#################################################################### # DELTA # # Database for Extended Ligand-Target Analyses # # 2025 # #################################################################### @MOLECULE TACR2_min 4874 4952 302 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.4 @ATOM 1 N 106.7630 127.7420 64.0200 N.4 1 GLY1 -0.0668 2 CA 107.7640 127.9270 62.8990 C.3 1 GLY1 0.1826 3 C 108.7390 129.0610 63.0760 C.2 1 GLY1 0.2284 4 O 109.9280 128.8520 62.9150 O.2 1 GLY1 -0.2776 5 H1 106.1870 126.8934 63.8437 H 1 GLY1 0.2747 6 H2 106.1395 128.5726 64.0814 H 1 GLY1 0.2747 7 H3 107.2701 127.6367 64.9253 H 1 GLY1 0.2747 8 HA1 107.2235 128.0798 61.9632 H 1 GLY1 0.0654 9 HA2 108.3408 127.0058 62.7945 H 1 GLY1 0.0654 10 N 108.2600 130.2760 63.4490 N.am 2 ILE2 -0.2452 11 CA 109.0960 131.4070 63.8750 C.3 2 ILE2 0.0903 12 C 109.9110 131.0420 65.0970 C.2 2 ILE2 0.2190 13 O 111.1100 131.2780 65.1720 O.2 2 ILE2 -0.2778 14 CB 108.2239 132.6617 64.1266 C.3 2 ILE2 -0.0201 15 CG1 107.4198 133.0443 62.8653 C.3 2 ILE2 -0.0514 16 CG2 109.0735 133.8555 64.6105 C.3 2 ILE2 -0.0605 17 CD1 106.3969 134.1627 63.1016 C.3 2 ILE2 -0.0650 18 H 107.2490 130.4130 63.4320 H 2 ILE2 0.1312 19 HA 109.7964 131.6025 63.0603 H 2 ILE2 0.0560 20 HB 107.5096 132.4243 64.9164 H 2 ILE2 0.0318 21 HG11 106.8749 132.1810 62.4857 H 2 ILE2 0.0266 22 HG12 108.1040 133.3418 62.0695 H 2 ILE2 0.0266 23 HG21 108.4585 134.7281 64.8266 H 2 ILE2 0.0233 24 HG22 109.8092 134.1458 63.8597 H 2 ILE2 0.0233 25 HG23 109.6137 133.6286 65.5300 H 2 ILE2 0.0233 26 HD11 105.7933 134.3279 62.2088 H 2 ILE2 0.0230 27 HD12 106.8804 135.1095 63.3407 H 2 ILE2 0.0230 28 HD13 105.7194 133.9137 63.9186 H 2 ILE2 0.0230 29 N 109.2650 130.3940 66.0770 N.am 3 THR3 -0.2434 30 CA 109.9340 129.9480 67.2730 C.3 3 THR3 0.1135 31 C 109.2590 128.6290 67.6090 C.2 3 THR3 0.2212 32 O 108.0730 128.4390 67.3220 O.2 3 THR3 -0.2777 33 CB 109.8426 130.9839 68.4099 C.3 3 THR3 0.0763 34 OG1 110.5211 130.4381 69.5285 O.3 3 THR3 -0.3900 35 CG2 108.3965 131.3646 68.7779 C.3 3 THR3 -0.0370 36 H 108.2670 130.2110 65.9730 H 3 THR3 0.1313 37 HA 110.9810 129.7413 67.0401 H 3 THR3 0.0583 38 HB 110.3733 131.8819 68.0697 H 3 THR3 0.0611 39 HG1 110.5172 131.0518 70.2586 H 3 THR3 0.2098 40 HG21 108.3705 132.1580 69.5258 H 3 THR3 0.0255 41 HG22 107.8537 130.5113 69.1847 H 3 THR3 0.0255 42 HG23 107.8487 131.7306 67.9100 H 3 THR3 0.0255 43 N 110.0420 127.6410 68.1100 N.am 4 ALA4 -0.2458 44 CA 109.5680 126.4020 68.6980 C.3 4 ALA4 0.0850 45 C 109.5550 126.5690 70.2100 C.2 4 ALA4 0.2184 46 O 109.7180 127.6650 70.7270 O.2 4 ALA4 -0.2778 47 CB 110.5105 125.2667 68.2734 C.3 4 ALA4 -0.0411 48 H 111.0520 127.7810 68.0700 H 4 ALA4 0.1312 49 HA 108.5508 126.2166 68.3530 H 4 ALA4 0.0554 50 HB1 110.1828 124.3004 68.6578 H 4 ALA4 0.0249 51 HB2 111.5270 125.4404 68.6305 H 4 ALA4 0.0249 52 HB3 110.5555 125.1880 67.1871 H 4 ALA4 0.0249 53 N 109.2660 125.4780 70.9480 N.am 5 PHE5 -0.2453 54 CA 109.1220 125.4710 72.4000 C.3 5 PHE5 0.0917 55 C 107.8530 126.1370 72.9120 C.2 5 PHE5 0.2191 56 O 107.6070 126.2100 74.1090 O.2 5 PHE5 -0.2778 57 CB 110.3870 126.0005 73.1085 C.3 5 PHE5 -0.0036 58 CG 111.6282 125.2956 72.6192 C.ar 5 PHE5 -0.0454 59 CD1 111.8918 123.9840 73.0027 C.ar 5 PHE5 -0.0585 60 CD2 112.5137 125.9311 71.7529 C.ar 5 PHE5 -0.0585 61 CE1 113.0148 123.3170 72.5310 C.ar 5 PHE5 -0.0615 62 CE2 113.6371 125.2664 71.2768 C.ar 5 PHE5 -0.0615 63 CZ 113.8885 123.9577 71.6647 C.ar 5 PHE5 -0.0617 64 H 109.1390 124.5940 70.4560 H 5 PHE5 0.1312 65 HA 109.0288 124.4189 72.6536 H 5 PHE5 0.0560 66 HB1 110.3059 125.8465 74.1854 H 5 PHE5 0.0333 67 HB2 110.4967 127.0770 72.9714 H 5 PHE5 0.0333 68 HD1 111.2161 123.4732 73.6687 H 5 PHE5 0.0620 69 HD2 112.3259 126.9477 71.4377 H 5 PHE5 0.0620 70 HE1 113.2129 122.3003 72.8374 H 5 PHE5 0.0618 71 HE2 114.3184 125.7668 70.6038 H 5 PHE5 0.0618 72 HZ 114.7645 123.4408 71.2967 H 5 PHE5 0.0618 73 N 106.9390 126.5100 71.9940 N.am 6 SER6 -0.2436 74 CA 105.6390 127.0430 72.3530 C.3 6 SER6 0.1109 75 C 104.7470 125.8350 72.5640 C.2 6 SER6 0.2209 76 O 104.3200 125.1570 71.6210 O.2 6 SER6 -0.2777 77 CB 105.1096 127.9721 71.2541 C.3 6 SER6 0.0681 78 OG 103.7668 128.3351 71.5442 O.3 6 SER6 -0.3930 79 H 107.1720 126.4130 71.0050 H 6 SER6 0.1312 80 HA 105.7282 127.5985 73.2892 H 6 SER6 0.0580 81 HB1 105.1495 127.4703 70.2832 H 6 SER6 0.0577 82 HB2 105.7539 128.8583 71.2058 H 6 SER6 0.0577 83 HG 103.4548 129.0346 70.9744 H 6 SER6 0.2095 84 N 104.5720 125.4370 73.8430 N.am 7 MET7 -0.2456 85 CA 103.6730 124.3610 74.2200 C.3 7 MET7 0.0888 86 C 102.2030 124.7570 74.1200 C.2 7 MET7 0.2214 87 O 101.8590 125.8930 74.4500 O.2 7 MET7 -0.2776 88 CB 104.0201 123.8605 75.6320 C.3 7 MET7 -0.0199 89 CG 105.4979 123.4606 75.7735 C.3 7 MET7 -0.0047 90 SD 105.7668 122.3842 77.1937 S.3 7 MET7 -0.1641 91 CE 106.3400 123.6095 78.3847 C.3 7 MET7 -0.0181 92 H 105.0950 125.9140 74.5770 H 7 MET7 0.1312 93 HA 103.8631 123.5659 73.5127 H 7 MET7 0.0557 94 HB1 103.3930 122.9989 75.8655 H 7 MET7 0.0293 95 HB2 103.7789 124.6210 76.3754 H 7 MET7 0.0293 96 HG1 106.1459 124.3365 75.8418 H 7 MET7 0.0377 97 HG2 105.8288 122.9136 74.8922 H 7 MET7 0.0377 98 HE1 106.1979 123.2450 79.4023 H 7 MET7 0.0340 99 HE2 105.7643 124.5265 78.2814 H 7 MET7 0.0340 100 HE3 107.3908 123.8488 78.2235 H 7 MET7 0.0340 101 N 101.2780 123.8860 73.7080 N.am 8 PRO8 -0.2316 102 CA 99.8560 124.1000 73.9450 C.3 8 PRO8 0.0907 103 C 99.4940 124.2320 75.4240 C.2 8 PRO8 0.2190 104 O 100.2180 123.7710 76.3080 O.2 8 PRO8 -0.2778 105 CB 99.1830 122.9102 73.2563 C.3 8 PRO8 -0.0276 106 CG 100.2611 121.8350 73.1951 C.3 8 PRO8 -0.0379 107 CD 101.5698 122.6130 73.0565 C.3 8 PRO8 0.0071 108 HA 99.5842 125.0319 73.4458 H 8 PRO8 0.0559 109 HB1 98.9100 123.1951 72.2396 H 8 PRO8 0.0285 110 HB2 98.2710 122.5799 73.7493 H 8 PRO8 0.0285 111 HG1 100.1019 121.1193 72.3886 H 8 PRO8 0.0278 112 HG2 100.2657 121.2820 74.1343 H 8 PRO8 0.0278 113 HD1 102.3873 122.1022 73.5559 H 8 PRO8 0.0431 114 HD2 101.8174 122.8304 72.0169 H 8 PRO8 0.0431 115 N 98.3450 124.8750 75.7000 N.am 9 SER9 -0.2436 116 CA 97.9020 125.3090 77.0170 C.3 9 SER9 0.1109 117 C 97.7020 124.2000 78.0420 C.2 9 SER9 0.2209 118 O 97.9970 124.3760 79.2210 O.2 9 SER9 -0.2777 119 CB 96.5960 126.0984 76.8549 C.3 9 SER9 0.0681 120 OG 95.6092 125.2788 76.2374 O.3 9 SER9 -0.3930 121 H 97.7270 125.0770 74.9140 H 9 SER9 0.1312 122 HA 98.6807 125.9652 77.4008 H 9 SER9 0.0580 123 HB1 96.7903 126.9790 76.2331 H 9 SER9 0.0577 124 HB2 96.2483 126.4529 77.8325 H 9 SER9 0.0577 125 HG 94.7811 125.7448 76.1419 H 9 SER9 0.2095 126 N 97.2080 123.0170 77.6210 N.am 10 TRP10 -0.2453 127 CA 97.0070 121.8530 78.4720 C.3 10 TRP10 0.0918 128 C 98.2960 121.3290 79.0970 C.2 10 TRP10 0.2190 129 O 98.3370 121.0260 80.2860 O.2 10 TRP10 -0.2778 130 CB 96.2046 120.7626 77.7389 C.3 10 TRP10 -0.0021 131 CG 96.9204 120.2519 76.5045 C.ar 10 TRP10 -0.0260 132 CD1 96.8330 120.7933 75.2197 C.ar 10 TRP10 -0.0136 133 CD2 97.7632 119.0865 76.3982 C.ar 10 TRP10 -0.0028 134 NE1 97.5975 120.0618 74.3716 N.ar 10 TRP10 -0.2641 135 CE2 98.1760 118.9967 75.0487 C.ar 10 TRP10 0.0269 136 CE3 98.1752 118.1482 77.3047 C.ar 10 TRP10 -0.0528 137 CZ2 98.9943 117.9746 74.6501 C.ar 10 TRP10 -0.0430 138 CZ3 99.0051 117.1019 76.9025 C.ar 10 TRP10 -0.0611 139 CH2 99.4180 117.0164 75.5723 C.ar 10 TRP10 -0.0602 140 H 96.9570 122.9320 76.6360 H 10 TRP10 0.1312 141 HA 96.3967 122.2114 79.3025 H 10 TRP10 0.0560 142 HB1 95.2383 121.1648 77.4338 H 10 TRP10 0.0334 143 HB2 95.9915 119.9297 78.4106 H 10 TRP10 0.0334 144 HD1 96.2512 121.6636 74.9507 H 10 TRP10 0.0748 145 HE1 97.7020 120.2373 73.4132 H 10 TRP10 0.1331 146 HE3 97.8478 118.2194 78.3306 H 10 TRP10 0.0624 147 HZ2 99.3028 117.9065 73.6177 H 10 TRP10 0.0633 148 HZ3 99.3254 116.3598 77.6195 H 10 TRP10 0.0618 149 HH2 100.0577 116.2052 75.2562 H 10 TRP10 0.0618 150 N 99.4070 121.2690 78.3300 N.am 11 GLN11 -0.2456 151 CA 100.7140 120.9050 78.8510 C.3 11 GLN11 0.0882 152 C 101.1980 121.8910 79.8990 C.2 11 GLN11 0.2187 153 O 101.6770 121.5080 80.9640 O.2 11 GLN11 -0.2778 154 CB 101.7726 120.8663 77.7316 C.3 11 GLN11 -0.0210 155 CG 101.5064 119.8019 76.6620 C.3 11 GLN11 0.0225 156 CD 102.7570 119.5819 75.7903 C.2 11 GLN11 0.1981 157 OE1 103.1471 120.4118 74.9772 O.2 11 GLN11 -0.2798 158 NE2 103.3630 118.4085 76.0202 N.am 11 GLN11 -0.2724 159 H 99.3240 121.4900 77.3380 H 11 GLN11 0.1312 160 HA 100.6124 119.9263 79.3229 H 11 GLN11 0.0557 161 HB1 102.7468 120.6688 78.1854 H 11 GLN11 0.0289 162 HB2 101.8521 121.8447 77.2548 H 11 GLN11 0.0289 163 HG1 100.6749 120.0963 76.0252 H 11 GLN11 0.0356 164 HG2 101.2377 118.8582 77.1355 H 11 GLN11 0.0356 165 HE21 104.2057 118.1640 75.5424 H 11 GLN11 0.1266 166 HE22 102.9941 117.7566 76.6823 H 11 GLN11 0.1266 167 N 101.0150 123.2010 79.6320 N.am 12 LEU12 -0.2456 168 CA 101.3040 124.2570 80.5830 C.3 12 LEU12 0.0880 169 C 100.5040 124.1440 81.8680 C.2 12 LEU12 0.2187 170 O 101.0600 124.2750 82.9520 O.2 12 LEU12 -0.2778 171 CB 101.0824 125.6249 79.9141 C.3 12 LEU12 -0.0266 172 CG 101.9406 125.8488 78.6544 C.3 12 LEU12 -0.0449 173 CD1 101.5352 127.1425 77.9424 C.3 12 LEU12 -0.0626 174 CD2 103.4375 125.8764 78.9891 C.3 12 LEU12 -0.0626 175 H 100.6550 123.4620 78.7140 H 12 LEU12 0.1312 176 HA 102.3527 124.1415 80.8584 H 12 LEU12 0.0557 177 HB1 101.2903 126.4218 80.6298 H 12 LEU12 0.0287 178 HB2 100.0306 125.7278 79.6488 H 12 LEU12 0.0287 179 HG 101.7637 125.0344 77.9518 H 12 LEU12 0.0296 180 HD11 102.0504 127.2272 76.9870 H 12 LEU12 0.0232 181 HD12 101.7805 128.0181 78.5438 H 12 LEU12 0.0232 182 HD13 100.4671 127.1703 77.7364 H 12 LEU12 0.0232 183 HD21 104.0325 126.1446 78.1159 H 12 LEU12 0.0232 184 HD22 103.7841 124.9052 79.3401 H 12 LEU12 0.0232 185 HD23 103.6484 126.6066 79.7695 H 12 LEU12 0.0232 186 N 99.1920 123.8450 81.7820 N.am 13 ALA13 -0.2459 187 CA 98.3560 123.5750 82.9350 C.3 13 ALA13 0.0850 188 C 98.7930 122.3600 83.7600 C.2 13 ALA13 0.2184 189 O 98.8920 122.4310 84.9840 O.2 13 ALA13 -0.2778 190 CB 96.9133 123.3924 82.4501 C.3 13 ALA13 -0.0411 191 H 98.7650 123.8070 80.8560 H 13 ALA13 0.1312 192 HA 98.4208 124.4545 83.5772 H 13 ALA13 0.0554 193 HB1 96.2272 123.2576 83.2869 H 13 ALA13 0.0249 194 HB2 96.8197 122.5257 81.7953 H 13 ALA13 0.0249 195 HB3 96.5820 124.2654 81.8877 H 13 ALA13 0.0249 196 N 99.1120 121.2180 83.1100 N.am 14 LEU14 -0.2457 197 CA 99.6020 120.0240 83.7880 C.3 14 LEU14 0.0880 198 C 100.9370 120.2100 84.4830 C.2 14 LEU14 0.2187 199 O 101.1030 119.8470 85.6500 O.2 14 LEU14 -0.2778 200 CB 99.7163 118.8812 82.7637 C.3 14 LEU14 -0.0266 201 CG 98.3672 118.4016 82.1985 C.3 14 LEU14 -0.0449 202 CD1 98.5957 117.5056 80.9757 C.3 14 LEU14 -0.0626 203 CD2 97.5317 117.6652 83.2546 C.3 14 LEU14 -0.0626 204 H 99.0050 121.1900 82.0960 H 14 LEU14 0.1312 205 HA 98.8721 119.7795 84.5596 H 14 LEU14 0.0557 206 HB1 100.2284 118.0250 83.2064 H 14 LEU14 0.0287 207 HB2 100.3509 119.2178 81.9417 H 14 LEU14 0.0287 208 HG 97.7924 119.2653 81.8669 H 14 LEU14 0.0296 209 HD11 97.6492 117.2001 80.5293 H 14 LEU14 0.0232 210 HD12 99.1455 116.6035 81.2451 H 14 LEU14 0.0232 211 HD13 99.1716 118.0299 80.2131 H 14 LEU14 0.0232 212 HD21 96.5946 117.3064 82.8284 H 14 LEU14 0.0232 213 HD22 97.2778 118.3149 84.0916 H 14 LEU14 0.0232 214 HD23 98.0684 116.8026 83.6504 H 14 LEU14 0.0232 215 N 101.9130 120.8320 83.7940 N.am 15 TRP15 -0.2453 216 CA 103.1790 121.2000 84.3880 C.3 15 TRP15 0.0918 217 C 103.0230 122.2350 85.4960 C.2 15 TRP15 0.2190 218 O 103.6320 122.0950 86.5530 O.2 15 TRP15 -0.2778 219 CB 104.1557 121.7412 83.3241 C.3 15 TRP15 -0.0021 220 CG 104.7431 120.6314 82.4734 C.ar 15 TRP15 -0.0260 221 CD1 104.6211 120.5018 81.0861 C.ar 15 TRP15 -0.0136 222 CD2 105.6315 119.5762 82.9018 C.ar 15 TRP15 -0.0028 223 NE1 105.3302 119.4239 80.6689 N.ar 15 TRP15 -0.2641 224 CE2 105.9738 118.8321 81.7475 C.ar 15 TRP15 0.0269 225 CE3 106.1527 119.2261 84.1203 C.ar 15 TRP15 -0.0528 226 CZ2 106.8145 117.7569 81.8493 C.ar 15 TRP15 -0.0430 227 CZ3 107.0132 118.1327 84.2271 C.ar 15 TRP15 -0.0611 228 CH2 107.3410 117.3943 83.0895 C.ar 15 TRP15 -0.0602 229 H 101.7520 121.0530 82.8110 H 15 TRP15 0.1312 230 HA 103.5804 120.2983 84.8513 H 15 TRP15 0.0560 231 HB1 104.9955 122.2475 83.8015 H 15 TRP15 0.0334 232 HB2 103.6629 122.4783 82.6882 H 15 TRP15 0.0334 233 HD1 104.0609 121.1655 80.4446 H 15 TRP15 0.0748 234 HE1 105.3971 119.1127 79.7421 H 15 TRP15 0.1331 235 HE3 105.9022 119.8003 85.0000 H 15 TRP15 0.0624 236 HZ2 107.0788 117.1974 80.9643 H 15 TRP15 0.0633 237 HZ3 107.4323 117.8643 85.1862 H 15 TRP15 0.0618 238 HH2 108.0120 116.5516 83.1647 H 15 TRP15 0.0618 239 N 102.1510 123.2580 85.3330 N.am 16 ALA16 -0.2459 240 CA 101.8740 124.2280 86.3760 C.3 16 ALA16 0.0850 241 C 101.3490 123.5840 87.6540 C.2 16 ALA16 0.2185 242 O 101.8750 123.8440 88.7290 O.2 16 ALA16 -0.2778 243 CB 100.8830 125.2723 85.8514 C.3 16 ALA16 -0.0411 244 H 101.6680 123.3510 84.4390 H 16 ALA16 0.1312 245 HA 102.8238 124.7028 86.6197 H 16 ALA16 0.0554 246 HB1 100.6609 126.0246 86.6088 H 16 ALA16 0.0249 247 HB2 99.9427 124.8109 85.5485 H 16 ALA16 0.0249 248 HB3 101.2918 125.7922 84.9854 H 16 ALA16 0.0249 249 N 100.3710 122.6570 87.5570 N.am 17 THR17 -0.2434 250 CA 99.8640 121.8740 88.6920 C.3 17 THR17 0.1135 251 C 100.9140 121.0170 89.3600 C.2 17 THR17 0.2212 252 O 101.0390 121.0110 90.5860 O.2 17 THR17 -0.2777 253 CB 98.6831 121.0156 88.1968 C.3 17 THR17 0.0763 254 OG1 97.7101 121.9022 87.6655 O.3 17 THR17 -0.3900 255 CG2 98.0437 120.1687 89.3128 C.3 17 THR17 -0.0370 256 H 99.9590 122.4900 86.6390 H 17 THR17 0.1313 257 HA 99.5067 122.5972 89.4257 H 17 THR17 0.0583 258 HB 99.0583 120.3591 87.4014 H 17 THR17 0.0611 259 HG1 97.0037 121.4235 87.2435 H 17 THR17 0.2098 260 HG21 97.2092 119.5737 88.9415 H 17 THR17 0.0255 261 HG22 97.6696 120.8045 90.1153 H 17 THR17 0.0255 262 HG23 98.7595 119.4710 89.7472 H 17 THR17 0.0255 263 N 101.7210 120.2810 88.5670 N.am 18 ALA18 -0.2458 264 CA 102.7750 119.4320 89.0790 C.3 18 ALA18 0.0850 265 C 103.8440 120.2280 89.8300 C.2 18 ALA18 0.2184 266 O 104.2400 119.8770 90.9380 O.2 18 ALA18 -0.2778 267 CB 103.4005 118.6797 87.8977 C.3 18 ALA18 -0.0411 268 H 101.5810 120.3250 87.5580 H 18 ALA18 0.1312 269 HA 102.3123 118.7318 89.7758 H 18 ALA18 0.0554 270 HB1 104.1630 117.9758 88.2305 H 18 ALA18 0.0249 271 HB2 103.8622 119.3664 87.1868 H 18 ALA18 0.0249 272 HB3 102.6425 118.1122 87.3576 H 18 ALA18 0.0249 273 N 104.3010 121.3590 89.2560 N.am 19 TYR19 -0.2453 274 CA 105.2310 122.2730 89.8860 C.3 19 TYR19 0.0917 275 C 104.6760 122.9840 91.0980 C.2 19 TYR19 0.2190 276 O 105.3210 123.0330 92.1450 O.2 19 TYR19 -0.2778 277 CB 105.7962 123.2801 88.8654 C.3 19 TYR19 -0.0036 278 CG 106.9386 122.6998 88.0699 C.ar 19 TYR19 -0.0453 279 CD1 106.8164 122.4686 86.7038 C.ar 19 TYR19 -0.0561 280 CD2 108.1542 122.4200 88.6916 C.ar 19 TYR19 -0.0561 281 CE1 107.8828 121.9633 85.9740 C.ar 19 TYR19 -0.0317 282 CE2 109.2216 121.9088 87.9642 C.ar 19 TYR19 -0.0317 283 CZ 109.0857 121.6875 86.6022 C.ar 19 TYR19 0.0726 284 OH 110.1468 121.2124 85.8641 O.3 19 TYR19 -0.3598 285 H 103.9710 121.5850 88.3180 H 19 TYR19 0.1312 286 HA 106.0409 121.6492 90.2678 H 19 TYR19 0.0560 287 HB1 106.1864 124.1651 89.3710 H 19 TYR19 0.0333 288 HB2 105.0069 123.6365 88.2016 H 19 TYR19 0.0333 289 HD1 105.8992 122.7069 86.1899 H 19 TYR19 0.0621 290 HD2 108.2733 122.6036 89.7498 H 19 TYR19 0.0621 291 HE1 107.7812 121.7886 84.9144 H 19 TYR19 0.0643 292 HE2 110.1618 121.6982 88.4525 H 19 TYR19 0.0643 293 HH 110.7629 120.7719 86.4346 H 19 TYR19 0.2173 294 N 103.4430 123.5160 90.9910 N.am 20 LEU20 -0.2456 295 CA 102.7940 124.2780 92.0380 C.3 20 LEU20 0.0880 296 C 102.6220 123.4830 93.3160 C.2 20 LEU20 0.2187 297 O 102.8890 123.9850 94.4070 O.2 20 LEU20 -0.2778 298 CB 101.4348 124.7740 91.5155 C.3 20 LEU20 -0.0266 299 CG 100.6336 125.6384 92.5069 C.3 20 LEU20 -0.0449 300 CD1 101.4146 126.8874 92.9412 C.3 20 LEU20 -0.0626 301 CD2 99.2808 126.0314 91.9016 C.3 20 LEU20 -0.0626 302 H 102.9350 123.3730 90.1180 H 20 LEU20 0.1312 303 HA 103.4293 125.1389 92.2230 H 20 LEU20 0.0557 304 HB1 100.8317 123.9164 91.2122 H 20 LEU20 0.0287 305 HB2 101.6024 125.3601 90.6121 H 20 LEU20 0.0287 306 HG 100.4249 125.0422 93.3945 H 20 LEU20 0.0296 307 HD11 100.8133 127.5188 93.5953 H 20 LEU20 0.0232 308 HD12 101.7078 127.4873 92.0795 H 20 LEU20 0.0232 309 HD13 102.3181 126.6239 93.4905 H 20 LEU20 0.0232 310 HD21 98.6856 126.6065 92.6113 H 20 LEU20 0.0232 311 HD22 98.7039 125.1485 91.6249 H 20 LEU20 0.0232 312 HD23 99.4117 126.6383 91.0052 H 20 LEU20 0.0232 313 N 102.2420 122.1910 93.2080 N.am 21 ALA21 -0.2459 314 CA 102.1550 121.3100 94.3510 C.3 21 ALA21 0.0850 315 C 103.4750 121.1770 95.1090 C.2 21 ALA21 0.2184 316 O 103.5400 121.3650 96.3210 O.2 21 ALA21 -0.2778 317 CB 101.6866 119.9356 93.8586 C.3 21 ALA21 -0.0411 318 H 102.0080 121.8240 92.2860 H 21 ALA21 0.1312 319 HA 101.4162 121.7432 95.0267 H 21 ALA21 0.0554 320 HB1 101.5640 119.2361 94.6860 H 21 ALA21 0.0249 321 HB2 102.3975 119.5033 93.1525 H 21 ALA21 0.0249 322 HB3 100.7272 120.0161 93.3473 H 21 ALA21 0.0249 323 N 104.5840 120.9180 94.4000 N.am 22 LEU22 -0.2457 324 CA 105.8850 120.7690 95.0120 C.3 22 LEU22 0.0880 325 C 106.4600 122.0240 95.6190 C.2 22 LEU22 0.2187 326 O 107.0110 121.9840 96.7180 O.2 22 LEU22 -0.2778 327 CB 106.8699 120.2782 93.9249 C.3 22 LEU22 -0.0266 328 CG 107.0080 118.7529 93.8308 C.3 22 LEU22 -0.0449 329 CD1 105.6775 118.0451 93.5464 C.3 22 LEU22 -0.0626 330 CD2 108.0616 118.3847 92.7806 C.3 22 LEU22 -0.0626 331 H 104.5060 120.8220 93.3870 H 22 LEU22 0.1312 332 HA 105.7903 120.0320 95.8107 H 22 LEU22 0.0557 333 HB1 107.8756 120.6629 94.1103 H 22 LEU22 0.0287 334 HB2 106.5827 120.6882 92.9549 H 22 LEU22 0.0287 335 HG 107.3745 118.4007 94.7919 H 22 LEU22 0.0296 336 HD11 105.8150 116.9646 93.5201 H 22 LEU22 0.0232 337 HD12 105.2637 118.3520 92.5872 H 22 LEU22 0.0232 338 HD13 104.9366 118.2535 94.3177 H 22 LEU22 0.0232 339 HD21 108.1587 117.3042 92.6844 H 22 LEU22 0.0232 340 HD22 109.0398 118.7899 93.0381 H 22 LEU22 0.0232 341 HD23 107.7950 118.7889 91.8059 H 22 LEU22 0.0232 342 N 106.3320 123.1810 94.9420 N.am 23 VAL23 -0.2454 343 CA 106.7820 124.4440 95.5090 C.3 23 VAL23 0.0901 344 C 106.0090 124.8370 96.7660 C.2 23 VAL23 0.2189 345 O 106.6200 125.2120 97.7630 O.2 23 VAL23 -0.2778 346 CB 106.8517 125.5744 94.4643 C.3 23 VAL23 -0.0227 347 CG1 107.8026 125.2050 93.3166 C.3 23 VAL23 -0.0608 348 CG2 105.4744 125.9622 93.9259 C.3 23 VAL23 -0.0608 349 H 105.9110 123.1720 94.0130 H 23 VAL23 0.1312 350 HA 107.8047 124.2575 95.8430 H 23 VAL23 0.0560 351 HB 107.2727 126.4553 94.9519 H 23 VAL23 0.0315 352 HG11 107.9273 126.0405 92.6274 H 23 VAL23 0.0233 353 HG12 107.4322 124.3565 92.7418 H 23 VAL23 0.0233 354 HG13 108.7885 124.9408 93.6996 H 23 VAL23 0.0233 355 HG21 105.5487 126.6936 93.1212 H 23 VAL23 0.0233 356 HG22 104.8347 126.3849 94.7001 H 23 VAL23 0.0233 357 HG23 104.9887 125.0759 93.5367 H 23 VAL23 0.0233 358 N 104.6590 124.6960 96.7940 N.am 24 LEU24 -0.2456 359 CA 103.8590 124.9710 97.9820 C.3 24 LEU24 0.0880 360 C 104.1770 124.0480 99.1490 C.2 24 LEU24 0.2187 361 O 104.3520 124.5010 100.2790 O.2 24 LEU24 -0.2778 362 CB 102.3670 124.8526 97.6266 C.3 24 LEU24 -0.0266 363 CG 101.8575 125.9301 96.6519 C.3 24 LEU24 -0.0449 364 CD1 100.4444 125.5753 96.1727 C.3 24 LEU24 -0.0626 365 CD2 101.8728 127.3312 97.2781 C.3 24 LEU24 -0.0626 366 H 104.1830 124.3840 95.9470 H 24 LEU24 0.1312 367 HA 104.0951 125.9861 98.2964 H 24 LEU24 0.0557 368 HB1 101.7614 124.8966 98.5335 H 24 LEU24 0.0287 369 HB2 102.1911 123.8658 97.1942 H 24 LEU24 0.0287 370 HG 102.5069 125.9542 95.7778 H 24 LEU24 0.0296 371 HD11 100.0688 126.3130 95.4644 H 24 LEU24 0.0232 372 HD12 99.7455 125.5320 97.0082 H 24 LEU24 0.0232 373 HD13 100.4328 124.6032 95.6789 H 24 LEU24 0.0232 374 HD21 101.4667 128.0695 96.5863 H 24 LEU24 0.0232 375 HD22 102.8837 127.6493 97.5305 H 24 LEU24 0.0232 376 HD23 101.2733 127.3630 98.1883 H 24 LEU24 0.0232 377 N 104.3090 122.7260 98.8980 N.am 25 VAL25 -0.2454 378 CA 104.7170 121.7570 99.9120 C.3 25 VAL25 0.0901 379 C 106.1050 122.0500 100.4540 C.2 25 VAL25 0.2189 380 O 106.3250 122.0610 101.6670 O.2 25 VAL25 -0.2778 381 CB 104.6018 120.3264 99.3399 C.3 25 VAL25 -0.0227 382 CG1 105.2193 119.2572 100.2606 C.3 25 VAL25 -0.0608 383 CG2 103.1335 119.9644 99.0645 C.3 25 VAL25 -0.0608 384 H 104.1140 122.3890 97.9550 H 25 VAL25 0.1312 385 HA 104.0212 121.8718 100.7444 H 25 VAL25 0.0560 386 HB 105.1401 120.3006 98.3906 H 25 VAL25 0.0315 387 HG11 105.0867 118.2587 99.8437 H 25 VAL25 0.0233 388 HG12 104.7523 119.2704 101.2456 H 25 VAL25 0.0233 389 HG13 106.2898 119.4064 100.3986 H 25 VAL25 0.0233 390 HG21 103.0590 119.0082 98.5462 H 25 VAL25 0.0233 391 HG22 102.6310 120.7104 98.4512 H 25 VAL25 0.0233 392 HG23 102.5716 119.8827 99.9952 H 25 VAL25 0.0233 393 N 107.0790 122.3420 99.5650 N.am 26 ALA26 -0.2459 394 CA 108.4150 122.7000 99.9720 C.3 26 ALA26 0.0850 395 C 108.5050 123.9730 100.8050 C.2 26 ALA26 0.2184 396 O 109.0470 123.9520 101.9070 O.2 26 ALA26 -0.2778 397 CB 109.2950 122.8232 98.7212 C.3 26 ALA26 -0.0411 398 H 106.8610 122.3080 98.5690 H 26 ALA26 0.1312 399 HA 108.7823 121.8769 100.5879 H 26 ALA26 0.0554 400 HB1 110.3294 123.0498 98.9823 H 26 ALA26 0.0249 401 HB2 108.9348 123.6092 98.0563 H 26 ALA26 0.0249 402 HB3 109.2970 121.8902 98.1571 H 26 ALA26 0.0249 403 N 107.9550 125.1160 100.3470 N.am 27 VAL27 -0.2454 404 CA 108.0820 126.3710 101.0790 C.3 27 VAL27 0.0901 405 C 107.3570 126.3640 102.4190 C.2 27 VAL27 0.2190 406 O 107.9030 126.8060 103.4310 O.2 27 VAL27 -0.2778 407 CB 107.7031 127.5860 100.2070 C.3 27 VAL27 -0.0227 408 CG1 108.5725 127.6551 98.9403 C.3 27 VAL27 -0.0608 409 CG2 106.2045 127.6450 99.8707 C.3 27 VAL27 -0.0608 410 H 107.4380 125.1020 99.4680 H 27 VAL27 0.1312 411 HA 109.1428 126.4539 101.3140 H 27 VAL27 0.0560 412 HB 107.9324 128.4847 100.7821 H 27 VAL27 0.0315 413 HG11 108.3504 128.5528 98.3634 H 27 VAL27 0.0233 414 HG12 108.4138 126.7988 98.2867 H 27 VAL27 0.0233 415 HG13 109.6329 127.6809 99.1939 H 27 VAL27 0.0233 416 HG21 105.9910 128.4374 99.1535 H 27 VAL27 0.0233 417 HG22 105.6048 127.8438 100.7588 H 27 VAL27 0.0233 418 HG23 105.8532 126.7076 99.4491 H 27 VAL27 0.0233 419 N 106.1310 125.7920 102.4650 N.am 28 THR28 -0.2434 420 CA 105.3430 125.6250 103.6870 C.3 28 THR28 0.1135 421 C 106.0240 124.7270 104.6910 C.2 28 THR28 0.2210 422 O 106.1450 125.0720 105.8630 O.2 28 THR28 -0.2777 423 CB 103.9454 125.0981 103.3111 C.3 28 THR28 0.0763 424 OG1 103.3547 126.0645 102.4546 O.3 28 THR28 -0.3900 425 CG2 103.0330 124.8748 104.5307 C.3 28 THR28 -0.0370 426 H 105.7300 125.4550 101.5900 H 28 THR28 0.1313 427 HA 105.2512 126.6160 104.1327 H 28 THR28 0.0583 428 HB 104.0791 124.1495 102.7753 H 28 THR28 0.0611 429 HG1 102.5531 125.7299 102.0642 H 28 THR28 0.2098 430 HG21 102.0392 124.5374 104.2367 H 28 THR28 0.0255 431 HG22 102.9173 125.7943 105.1047 H 28 THR28 0.0255 432 HG23 103.4394 124.1137 105.1956 H 28 THR28 0.0255 433 N 106.5680 123.5690 104.2610 N.am 29 GLY29 -0.2484 434 CA 107.2610 122.6730 105.1780 C.3 29 GLY29 0.0765 435 C 108.5640 123.2290 105.7000 C.2 29 GLY29 0.2155 436 O 108.8630 123.1070 106.8840 O.2 29 GLY29 -0.2781 437 H 106.4930 123.3160 103.2760 H 29 GLY29 0.1309 438 HA1 107.4592 121.7517 104.6309 H 29 GLY29 0.0521 439 HA2 106.5929 122.4489 106.0107 H 29 GLY29 0.0521 440 N 109.3680 123.8890 104.8420 N.am 30 ASN30 -0.2454 441 CA 110.6050 124.5250 105.2740 C.3 30 ASN30 0.0957 442 C 110.4220 125.6880 106.2440 C.2 30 ASN30 0.2191 443 O 111.0940 125.7480 107.2720 O.2 30 ASN30 -0.2778 444 CB 111.4447 124.9225 104.0562 C.3 30 ASN30 0.0446 445 CG 111.8422 123.6702 103.2639 C.2 30 ASN30 0.2000 446 OD1 111.6571 122.5404 103.6961 O.2 30 ASN30 -0.2797 447 ND2 112.4014 123.9434 102.0830 N.am 30 ASN30 -0.2723 448 H 109.1010 123.9450 103.8590 H 30 ASN30 0.1312 449 HA 111.1492 123.7631 105.8376 H 30 ASN30 0.0562 450 HB1 112.3616 125.4235 104.3669 H 30 ASN30 0.0375 451 HB2 110.8920 125.5990 103.4042 H 30 ASN30 0.0375 452 HD21 112.7286 123.1756 101.5348 H 30 ASN30 0.1266 453 HD22 112.5143 124.8745 101.7438 H 30 ASN30 0.1266 454 N 109.4840 126.6250 105.9780 N.am 31 ALA31 -0.2459 455 CA 109.2260 127.7410 106.8700 C.3 31 ALA31 0.0850 456 C 108.6040 127.3240 108.1970 C.2 31 ALA31 0.2184 457 O 108.9300 127.8880 109.2400 O.2 31 ALA31 -0.2778 458 CB 108.2678 128.7051 106.1604 C.3 31 ALA31 -0.0411 459 H 108.9380 126.5450 105.1200 H 31 ALA31 0.1312 460 HA 110.1793 128.2310 107.0683 H 31 ALA31 0.0554 461 HB1 108.0686 129.5891 106.7673 H 31 ALA31 0.0249 462 HB2 107.3130 128.2244 105.9409 H 31 ALA31 0.0249 463 HB3 108.6821 129.0444 105.2136 H 31 ALA31 0.0249 464 N 107.7280 126.2920 108.2040 N.am 32 ILE32 -0.2454 465 CA 107.2360 125.6820 109.4380 C.3 32 ILE32 0.0903 466 C 108.3680 125.0770 110.2670 C.2 32 ILE32 0.2189 467 O 108.4580 125.3400 111.4640 O.2 32 ILE32 -0.2778 468 CB 106.0349 124.7488 109.2084 C.3 32 ILE32 -0.0201 469 CG1 104.8535 125.5422 108.6150 C.3 32 ILE32 -0.0514 470 CG2 105.6075 124.0845 110.5311 C.3 32 ILE32 -0.0605 471 CD1 103.7254 124.6467 108.1010 C.3 32 ILE32 -0.0650 472 H 107.3980 125.9250 107.3110 H 32 ILE32 0.1312 473 HA 106.8708 126.5206 110.0340 H 32 ILE32 0.0560 474 HB 106.3308 123.9741 108.4993 H 32 ILE32 0.0318 475 HG11 105.1890 126.1689 107.7903 H 32 ILE32 0.0266 476 HG12 104.4584 126.2317 109.3623 H 32 ILE32 0.0266 477 HG21 104.6746 123.5358 110.4327 H 32 ILE32 0.0233 478 HG22 105.4602 124.8272 111.3161 H 32 ILE32 0.0233 479 HG23 106.3622 123.3801 110.8772 H 32 ILE32 0.0233 480 HD11 102.9716 125.2390 107.5828 H 32 ILE32 0.0230 481 HD12 103.2288 124.1284 108.9199 H 32 ILE32 0.0230 482 HD13 104.1036 123.8985 107.4046 H 32 ILE32 0.0230 483 N 109.3100 124.3200 109.6520 N.am 33 VAL33 -0.2454 484 CA 110.4970 123.8020 110.3430 C.3 33 VAL33 0.0901 485 C 111.3880 124.9090 110.9000 C.2 33 VAL33 0.2189 486 O 111.8050 124.8500 112.0560 O.2 33 VAL33 -0.2778 487 CB 111.2658 122.8527 109.3922 C.3 33 VAL33 -0.0227 488 CG1 112.6808 122.4938 109.8858 C.3 33 VAL33 -0.0608 489 CG2 110.4683 121.5616 109.1472 C.3 33 VAL33 -0.0608 490 H 109.1880 124.1000 108.6630 H 33 VAL33 0.1312 491 HA 110.1276 123.2370 111.1999 H 33 VAL33 0.0560 492 HB 111.3780 123.3612 108.4330 H 33 VAL33 0.0315 493 HG11 113.1565 121.7768 109.2160 H 33 VAL33 0.0233 494 HG12 112.6543 122.0514 110.8813 H 33 VAL33 0.0233 495 HG13 113.3303 123.3687 109.9256 H 33 VAL33 0.0233 496 HG21 110.9464 120.9447 108.3858 H 33 VAL33 0.0233 497 HG22 109.4540 121.7692 108.8115 H 33 VAL33 0.0233 498 HG23 110.3926 120.9674 110.0582 H 33 VAL33 0.0233 499 N 111.6550 125.9810 110.1170 N.am 34 ILE34 -0.2454 500 CA 112.3910 127.1570 110.5820 C.3 34 ILE34 0.0903 501 C 111.7100 127.8220 111.7650 C.2 34 ILE34 0.2189 502 O 112.3460 128.0820 112.7860 O.2 34 ILE34 -0.2778 503 CB 112.6240 128.1120 109.3873 C.3 34 ILE34 -0.0201 504 CG1 113.5161 127.4481 108.3149 C.3 34 ILE34 -0.0514 505 CG2 113.2456 129.4515 109.8188 C.3 34 ILE34 -0.0605 506 CD1 113.4510 128.1419 106.9485 C.3 34 ILE34 -0.0650 507 H 111.3260 125.9680 109.1520 H 34 ILE34 0.1312 508 HA 113.3539 126.7889 110.9398 H 34 ILE34 0.0560 509 HB 111.6497 128.3198 108.9429 H 34 ILE34 0.0318 510 HG11 113.2299 126.4084 108.1731 H 34 ILE34 0.0266 511 HG12 114.5502 127.4151 108.6605 H 34 ILE34 0.0266 512 HG21 113.3854 130.1183 108.9689 H 34 ILE34 0.0233 513 HG22 114.2208 129.2914 110.2782 H 34 ILE34 0.0233 514 HG23 112.6174 129.9817 110.5345 H 34 ILE34 0.0233 515 HD11 114.0226 127.5863 106.2071 H 34 ILE34 0.0230 516 HD12 113.8582 129.1516 106.9872 H 34 ILE34 0.0230 517 HD13 112.4255 128.2031 106.5866 H 34 ILE34 0.0230 518 N 110.3820 128.0530 111.6770 N.am 35 TRP35 -0.2453 519 CA 109.5970 128.6170 112.7590 C.3 35 TRP35 0.0918 520 C 109.6300 127.7460 114.0130 C.2 35 TRP35 0.2190 521 O 109.9190 128.2470 115.0910 O.2 35 TRP35 -0.2778 522 CB 108.1552 128.8052 112.2598 C.3 35 TRP35 -0.0021 523 CG 107.2925 129.4470 113.3284 C.ar 35 TRP35 -0.0260 524 CD1 107.2448 130.8085 113.6393 C.ar 35 TRP35 -0.0136 525 CD2 106.3693 128.7903 114.2217 C.ar 35 TRP35 -0.0028 526 NE1 106.3630 131.0060 114.6509 N.ar 35 TRP35 -0.2641 527 CE2 105.7962 129.7965 115.0334 C.ar 35 TRP35 0.0269 528 CE3 105.9954 127.4834 114.3843 C.ar 35 TRP35 -0.0528 529 CZ2 104.8584 129.4645 115.9736 C.ar 35 TRP35 -0.0430 530 CZ3 105.0460 127.1401 115.3468 C.ar 35 TRP35 -0.0611 531 CH2 104.4685 128.1342 116.1362 C.ar 35 TRP35 -0.0602 532 H 109.9070 127.8190 110.8050 H 35 TRP35 0.1312 533 HA 110.0454 129.5815 113.0014 H 35 TRP35 0.0560 534 HB1 107.7234 127.8507 111.9558 H 35 TRP35 0.0334 535 HB2 108.1492 129.4423 111.3753 H 35 TRP35 0.0334 536 HD1 107.8213 131.5775 113.1453 H 35 TRP35 0.0748 537 HE1 106.1406 131.8763 115.0413 H 35 TRP35 0.1331 538 HE3 106.4315 126.7213 113.7571 H 35 TRP35 0.0624 539 HZ2 104.4154 130.2379 116.5826 H 35 TRP35 0.0633 540 HZ3 104.7503 126.1078 115.4697 H 35 TRP35 0.0618 541 HH2 103.7229 127.8725 116.8721 H 35 TRP35 0.0618 542 N 109.4410 126.4130 113.9030 N.am 36 ILE36 -0.2454 543 CA 109.5210 125.4880 115.0330 C.3 36 ILE36 0.0903 544 C 110.8570 125.5460 115.7550 C.2 36 ILE36 0.2189 545 O 110.9440 125.5670 116.9810 O.2 36 ILE36 -0.2778 546 CB 109.2050 124.0495 114.5314 C.3 36 ILE36 -0.0201 547 CG1 107.7171 123.9080 114.1459 C.3 36 ILE36 -0.0514 548 CG2 109.5868 122.9419 115.5373 C.3 36 ILE36 -0.0605 549 CD1 107.3991 122.6196 113.3736 C.3 36 ILE36 -0.0650 550 H 109.2310 126.0310 112.9810 H 36 ILE36 0.1312 551 HA 108.7576 125.8093 115.7419 H 36 ILE36 0.0560 552 HB 109.8017 123.8854 113.6324 H 36 ILE36 0.0318 553 HG11 107.4108 124.7486 113.5285 H 36 ILE36 0.0266 554 HG12 107.0961 123.9632 115.0405 H 36 ILE36 0.0266 555 HG21 109.3912 121.9506 115.1320 H 36 ILE36 0.0233 556 HG22 109.0148 123.0329 116.4589 H 36 ILE36 0.0233 557 HG23 110.6467 122.9603 115.7907 H 36 ILE36 0.0233 558 HD11 106.3626 122.6196 113.0382 H 36 ILE36 0.0230 559 HD12 107.5366 121.7294 113.9865 H 36 ILE36 0.0230 560 HD13 108.0313 122.5246 112.4902 H 36 ILE36 0.0230 561 N 111.9720 125.5850 115.0140 N.am 37 ILE37 -0.2454 562 CA 113.2690 125.6650 115.6560 C.3 37 ILE37 0.0903 563 C 113.5690 127.0290 116.2730 C.2 37 ILE37 0.2189 564 O 114.0320 127.1330 117.4110 O.2 37 ILE37 -0.2778 565 CB 114.3658 125.2197 114.6590 C.3 37 ILE37 -0.0201 566 CG1 114.1078 123.7840 114.1426 C.3 37 ILE37 -0.0514 567 CG2 115.7639 125.3004 115.3014 C.3 37 ILE37 -0.0605 568 CD1 114.9480 123.4080 112.9151 C.3 37 ILE37 -0.0650 569 H 111.9080 125.5580 113.9960 H 37 ILE37 0.1312 570 HA 113.2563 124.9414 116.4685 H 37 ILE37 0.0560 571 HB 114.3355 125.8990 113.8051 H 37 ILE37 0.0318 572 HG11 113.0622 123.6539 113.8667 H 37 ILE37 0.0266 573 HG12 114.2887 123.0677 114.9447 H 37 ILE37 0.0266 574 HG21 116.5440 124.9720 114.6213 H 37 ILE37 0.0233 575 HG22 115.8167 124.6663 116.1847 H 37 ILE37 0.0233 576 HG23 116.0197 126.3159 115.6019 H 37 ILE37 0.0233 577 HD11 114.6842 122.4132 112.5583 H 37 ILE37 0.0230 578 HD12 116.0149 123.4020 113.1353 H 37 ILE37 0.0230 579 HD13 114.7714 124.1021 112.0935 H 37 ILE37 0.0230 580 N 113.2910 128.1270 115.5450 N.am 38 LEU38 -0.2456 581 CA 113.7020 129.4540 115.9680 C.3 38 LEU38 0.0880 582 C 112.6900 130.1990 116.8380 C.2 38 LEU38 0.2187 583 O 113.0490 131.1800 117.4930 O.2 38 LEU38 -0.2778 584 CB 114.0353 130.2829 114.7155 C.3 38 LEU38 -0.0266 585 CG 115.1234 129.6628 113.8148 C.3 38 LEU38 -0.0449 586 CD1 115.3581 130.5463 112.5843 C.3 38 LEU38 -0.0626 587 CD2 116.4442 129.4363 114.5649 C.3 38 LEU38 -0.0626 588 H 112.7770 128.0240 114.6710 H 38 LEU38 0.1312 589 HA 114.6051 129.3498 116.5699 H 38 LEU38 0.0557 590 HB1 114.3547 131.2827 115.0130 H 38 LEU38 0.0287 591 HB2 113.1263 130.4172 114.1264 H 38 LEU38 0.0287 592 HG 114.7729 128.6952 113.4534 H 38 LEU38 0.0296 593 HD11 116.0470 130.0715 111.8849 H 38 LEU38 0.0232 594 HD12 115.7792 131.5115 112.8665 H 38 LEU38 0.0232 595 HD13 114.4242 130.7370 112.0566 H 38 LEU38 0.0232 596 HD21 117.2234 129.0875 113.8872 H 38 LEU38 0.0232 597 HD22 116.3375 128.6848 115.3465 H 38 LEU38 0.0232 598 HD23 116.7971 130.3584 115.0266 H 38 LEU38 0.0232 599 N 111.4200 129.7500 116.9350 N.am 39 ALA39 -0.2459 600 CA 110.4210 130.4700 117.6990 C.3 39 ALA39 0.0850 601 C 110.1120 129.8710 119.0600 C.2 39 ALA39 0.2184 602 O 109.7120 130.5950 119.9720 O.2 39 ALA39 -0.2778 603 CB 109.1260 130.5169 116.8758 C.3 39 ALA39 -0.0411 604 H 111.1580 128.8860 116.4610 H 39 ALA39 0.1312 605 HA 110.7594 131.4954 117.8531 H 39 ALA39 0.0554 606 HB1 108.3816 131.1661 117.3374 H 39 ALA39 0.0249 607 HB2 108.6765 129.5286 116.7710 H 39 ALA39 0.0249 608 HB3 109.3174 130.8992 115.8728 H 39 ALA39 0.0249 609 N 110.3420 128.5620 119.2740 N.am 40 HIS40 -0.2453 610 CA 109.9720 127.9120 120.5260 C.3 40 HIS40 0.0932 611 C 110.9760 128.0990 121.6520 C.2 40 HIS40 0.2190 612 O 110.6900 127.7700 122.8000 O.2 40 HIS40 -0.2778 613 CB 109.7795 126.4065 120.2706 C.3 40 HIS40 0.0146 614 CG 108.5654 126.1565 119.4040 C.ar 40 HIS40 0.0551 615 ND1 107.4384 126.9008 119.4341 N.ar 40 HIS40 -0.2469 616 CD2 108.3578 125.0849 118.5222 C.ar 40 HIS40 0.0047 617 CE1 106.5940 126.3267 118.5597 C.ar 40 HIS40 0.0737 618 NE2 107.1236 125.2299 117.9895 N.ar 40 HIS40 -0.2539 619 H 110.7870 128.0100 118.5410 H 40 HIS40 0.1312 620 HA 109.0286 128.3460 120.8629 H 40 HIS40 0.0561 621 HB1 109.6295 125.8643 121.2048 H 40 HIS40 0.0348 622 HB2 110.6599 125.9807 119.7868 H 40 HIS40 0.0348 623 HD2 109.0695 124.3030 118.3050 H 40 HIS40 0.0764 624 HE1 105.6022 126.6992 118.3496 H 40 HIS40 0.0963 625 HE2 106.6986 124.6512 117.3226 H 40 HIS40 0.1339 626 N 112.1900 128.6090 121.3590 N.am 41 ARG41 -0.2456 627 CA 113.2300 128.9520 122.3320 C.3 41 ARG41 0.0879 628 C 113.8940 127.7750 123.0560 C.2 41 ARG41 0.2187 629 O 114.9550 127.9420 123.6470 O.2 41 ARG41 -0.2778 630 CB 112.7426 129.9982 123.3668 C.3 41 ARG41 -0.0258 631 CG 112.6891 131.4546 122.8696 C.3 41 ARG41 -0.0154 632 CD 111.5519 131.7750 121.8921 C.3 41 ARG41 0.1045 633 NE 111.4034 133.2320 121.7978 N.pl3 41 ARG41 -0.4450 634 CZ 110.3711 133.8608 121.2364 C.cat 41 ARG41 0.5062 635 NH1 110.3372 135.1665 121.2403 N.pl3 41 ARG41 -0.4573 636 NH2 109.3877 133.2092 120.6814 N.pl3 41 ARG41 -0.4573 637 H 112.4020 128.7700 120.3740 H 41 ARG41 0.1312 638 HA 114.0240 129.3978 121.7328 H 41 ARG41 0.0557 639 HB1 113.4306 130.0016 124.2145 H 41 ARG41 0.0286 640 HB2 111.7810 129.7123 123.7917 H 41 ARG41 0.0286 641 HG1 113.6465 131.7347 122.4294 H 41 ARG41 0.0299 642 HG2 112.5671 132.0923 123.7463 H 41 ARG41 0.0299 643 HD1 110.6094 131.3464 122.2432 H 41 ARG41 0.0711 644 HD2 111.7805 131.3887 120.8965 H 41 ARG41 0.0711 645 HE 112.1164 133.8148 122.1813 H 41 ARG41 0.3153 646 HH11 109.5707 135.6438 120.8171 H 41 ARG41 0.3114 647 HH12 111.0719 135.6902 121.6638 H 41 ARG41 0.3114 648 HH21 108.6109 133.6891 120.2834 H 41 ARG41 0.3114 649 HH22 109.4176 132.2107 120.6534 H 41 ARG41 0.3114 650 N 113.3320 126.5500 122.9730 N.am 42 ARG42 -0.2457 651 CA 113.9390 125.3450 123.5150 C.3 42 ARG42 0.0879 652 C 114.5770 124.4870 122.4310 C.2 42 ARG42 0.2187 653 O 115.3700 123.5960 122.7140 O.2 42 ARG42 -0.2778 654 CB 112.8675 124.5844 124.3130 C.3 42 ARG42 -0.0258 655 CG 112.4281 125.3733 125.5602 C.3 42 ARG42 -0.0154 656 CD 111.3078 124.6940 126.3562 C.3 42 ARG42 0.1045 657 NE 111.0839 125.4394 127.5980 N.pl3 42 ARG42 -0.4450 658 CZ 110.0239 125.3007 128.3911 C.cat 42 ARG42 0.5062 659 NH1 109.9453 126.0096 129.4853 N.pl3 42 ARG42 -0.4573 660 NH2 109.0584 124.4698 128.0996 N.pl3 42 ARG42 -0.4573 661 H 112.4300 126.4650 122.5030 H 42 ARG42 0.1312 662 HA 114.7467 125.6311 124.1914 H 42 ARG42 0.0557 663 HB1 113.2571 123.6145 124.6261 H 42 ARG42 0.0286 664 HB2 112.0070 124.3836 123.6732 H 42 ARG42 0.0286 665 HG1 112.0935 126.3713 125.2745 H 42 ARG42 0.0299 666 HG2 113.2949 125.5168 126.2067 H 42 ARG42 0.0299 667 HD1 111.5817 123.6707 126.6250 H 42 ARG42 0.0711 668 HD2 110.3849 124.6763 125.7707 H 42 ARG42 0.0711 669 HE 111.7783 126.1008 127.8796 H 42 ARG42 0.3153 670 HH11 109.1543 125.9205 130.0866 H 42 ARG42 0.3114 671 HH12 110.6763 126.6439 129.7266 H 42 ARG42 0.3114 672 HH21 108.2735 124.3724 128.7075 H 42 ARG42 0.3114 673 HH22 109.1092 123.9325 127.2629 H 42 ARG42 0.3114 674 N 114.2600 124.7650 121.1470 N.am 43 MET43 -0.2456 675 CA 114.8670 124.1010 120.0100 C.3 43 MET43 0.0885 676 C 115.9910 124.9350 119.4270 C.2 43 MET43 0.2187 677 O 116.6730 124.5290 118.4880 O.2 43 MET43 -0.2778 678 CB 113.7847 123.9373 118.9265 C.3 43 MET43 -0.0199 679 CG 112.6364 122.9939 119.3069 C.3 43 MET43 -0.0047 680 SD 113.1436 121.2620 119.2865 S.3 43 MET43 -0.1641 681 CE 112.9510 120.9475 117.5190 C.3 43 MET43 -0.0181 682 H 113.5560 125.4810 120.9680 H 43 MET43 0.1312 683 HA 115.2674 123.1329 120.3153 H 43 MET43 0.0557 684 HB1 114.2325 123.5823 117.9974 H 43 MET43 0.0293 685 HB2 113.3613 124.9184 118.7062 H 43 MET43 0.0293 686 HG1 111.8152 123.1205 118.5994 H 43 MET43 0.0377 687 HG2 112.2181 123.2385 120.2831 H 43 MET43 0.0377 688 HE1 113.1922 119.9111 117.2843 H 43 MET43 0.0340 689 HE2 113.6029 121.6038 116.9422 H 43 MET43 0.0340 690 HE3 111.9258 121.1506 117.2077 H 43 MET43 0.0340 691 N 116.2530 126.1190 120.0050 N.am 44 ARG44 -0.2457 692 CA 117.3750 126.9400 119.6200 C.3 44 ARG44 0.0879 693 C 118.6560 126.4210 120.2550 C.2 44 ARG44 0.2187 694 O 119.0860 126.8620 121.3180 O.2 44 ARG44 -0.2778 695 CB 117.0039 128.3777 120.0446 C.3 44 ARG44 -0.0258 696 CG 118.0571 129.4837 119.8203 C.3 44 ARG44 -0.0154 697 CD 119.1231 129.5417 120.9273 C.3 44 ARG44 0.1045 698 NE 119.5584 130.9132 121.1965 N.pl3 44 ARG44 -0.4450 699 CZ 120.2716 131.2273 122.2781 C.cat 44 ARG44 0.5062 700 NH1 120.5868 132.4738 122.5068 N.pl3 44 ARG44 -0.4573 701 NH2 120.6615 130.3063 123.1213 N.pl3 44 ARG44 -0.4573 702 H 115.6340 126.4500 120.7450 H 44 ARG44 0.1312 703 HA 117.4734 126.8932 118.5330 H 44 ARG44 0.0557 704 HB1 116.6907 128.3814 121.0900 H 44 ARG44 0.0286 705 HB2 116.1093 128.6508 119.4821 H 44 ARG44 0.0286 706 HG1 117.5262 130.4364 119.8097 H 44 ARG44 0.0299 707 HG2 118.5199 129.3878 118.8375 H 44 ARG44 0.0299 708 HD1 120.0057 128.9570 120.6541 H 44 ARG44 0.0711 709 HD2 118.7031 129.1481 121.8571 H 44 ARG44 0.0711 710 HE 119.3095 131.6367 120.5555 H 44 ARG44 0.3153 711 HH11 121.1190 132.7126 123.3162 H 44 ARG44 0.3114 712 HH12 120.2935 133.1885 121.8772 H 44 ARG44 0.3114 713 HH21 121.1848 130.5421 123.9363 H 44 ARG44 0.3114 714 HH22 120.4279 129.3522 122.9428 H 44 ARG44 0.3114 715 N 119.2880 125.4510 119.5780 N.am 45 THR45 -0.2434 716 CA 120.3490 124.6340 120.1400 C.3 45 THR45 0.1135 717 C 121.4110 124.4900 119.0860 C.2 45 THR45 0.2212 718 O 121.1050 124.4620 117.8970 O.2 45 THR45 -0.2777 719 CB 119.7406 123.2717 120.5363 C.3 45 THR45 0.0763 720 OG1 118.7290 123.5408 121.4948 O.3 45 THR45 -0.3900 721 CG2 120.7709 122.2899 121.1243 C.3 45 THR45 -0.0370 722 H 119.0070 125.2770 118.6130 H 45 THR45 0.1313 723 HA 120.7740 125.1392 121.0083 H 45 THR45 0.0583 724 HB 119.2846 122.8312 119.6404 H 45 THR45 0.0611 725 HG1 118.2659 122.7459 121.7414 H 45 THR45 0.2098 726 HG21 120.3112 121.3442 121.4120 H 45 THR45 0.0255 727 HG22 121.2502 122.7103 122.0083 H 45 THR45 0.0255 728 HG23 121.5494 122.0464 120.4037 H 45 THR45 0.0255 729 N 122.6930 124.3350 119.4930 N.am 46 VAL46 -0.2453 730 CA 123.8680 124.2060 118.6280 C.3 46 VAL46 0.0901 731 C 123.7320 123.1040 117.5860 C.2 46 VAL46 0.2190 732 O 124.1730 123.2410 116.4470 O.2 46 VAL46 -0.2778 733 CB 125.1854 124.1066 119.4281 C.3 46 VAL46 -0.0227 734 CG1 126.3893 124.4347 118.5280 C.3 46 VAL46 -0.0608 735 CG2 125.2035 125.0462 120.6450 C.3 46 VAL46 -0.0608 736 H 122.8560 124.3050 120.5000 H 46 VAL46 0.1312 737 HA 123.8813 125.1385 118.0693 H 46 VAL46 0.0560 738 HB 125.2952 123.0859 119.7981 H 46 VAL46 0.0315 739 HG11 127.3335 124.2952 119.0557 H 46 VAL46 0.0233 740 HG12 126.3421 125.4697 118.1913 H 46 VAL46 0.0233 741 HG13 126.4158 123.8165 117.6340 H 46 VAL46 0.0233 742 HG21 126.1745 125.0200 121.1407 H 46 VAL46 0.0233 743 HG22 124.4602 124.7639 121.3905 H 46 VAL46 0.0233 744 HG23 125.0116 126.0779 120.3486 H 46 VAL46 0.0233 745 N 123.0420 122.0080 117.9620 N.am 47 THR47 -0.2434 746 CA 122.6350 120.8970 117.1000 C.3 47 THR47 0.1135 747 C 121.7900 121.3210 115.9180 C.2 47 THR47 0.2212 748 O 121.9580 120.8340 114.8050 O.2 47 THR47 -0.2777 749 CB 121.9084 119.8358 117.9466 C.3 47 THR47 0.0763 750 OG1 122.6364 119.6768 119.1571 O.3 47 THR47 -0.3900 751 CG2 121.7917 118.4975 117.1926 C.3 47 THR47 -0.0370 752 H 122.7770 121.9470 118.9450 H 47 THR47 0.1313 753 HA 123.5571 120.4685 116.7095 H 47 THR47 0.0583 754 HB 120.9068 120.2118 118.1871 H 47 THR47 0.0611 755 HG1 122.2597 118.9776 119.6828 H 47 THR47 0.2098 756 HG21 121.2357 117.7527 117.7620 H 47 THR47 0.0255 757 HG22 122.7781 118.0861 116.9742 H 47 THR47 0.0255 758 HG23 121.2718 118.6231 116.2429 H 47 THR47 0.0255 759 N 120.8580 122.2700 116.1080 N.am 48 ASN48 -0.2451 760 CA 119.8600 122.5600 115.1030 C.3 48 ASN48 0.0957 761 C 120.2620 123.7150 114.1890 C.2 48 ASN48 0.2191 762 O 119.5050 124.1130 113.3070 O.2 48 ASN48 -0.2778 763 CB 118.5172 122.8766 115.7849 C.3 48 ASN48 0.0446 764 CG 117.9643 121.6722 116.5643 C.2 48 ASN48 0.2000 765 OD1 118.5233 120.5839 116.5738 O.2 48 ASN48 -0.2797 766 ND2 116.8225 121.9355 117.2152 N.am 48 ASN48 -0.2723 767 H 120.8550 122.7980 116.9810 H 48 ASN48 0.1312 768 HA 119.7376 121.6817 114.4679 H 48 ASN48 0.0562 769 HB1 117.7692 123.1450 115.0396 H 48 ASN48 0.0375 770 HB2 118.6175 123.7202 116.4689 H 48 ASN48 0.0375 771 HD21 116.3749 121.2115 117.7372 H 48 ASN48 0.1266 772 HD22 116.4137 122.8478 117.1926 H 48 ASN48 0.1266 773 N 121.4850 124.2680 114.3350 N.am 49 TYR49 -0.2453 774 CA 121.9970 125.3190 113.4660 C.3 49 TYR49 0.0917 775 C 122.2000 124.8830 112.0170 C.2 49 TYR49 0.2190 776 O 121.8270 125.5810 111.0750 O.2 49 TYR49 -0.2778 777 CB 123.3154 125.8752 114.0415 C.3 49 TYR49 -0.0036 778 CG 123.2216 126.5990 115.3714 C.ar 49 TYR49 -0.0453 779 CD1 122.0116 126.8599 116.0193 C.ar 49 TYR49 -0.0561 780 CD2 124.3968 127.0534 115.9672 C.ar 49 TYR49 -0.0561 781 CE1 121.9851 127.5286 117.2373 C.ar 49 TYR49 -0.0317 782 CE2 124.3735 127.7229 117.1843 C.ar 49 TYR49 -0.0317 783 CZ 123.1655 127.9562 117.8245 C.ar 49 TYR49 0.0726 784 OH 123.1378 128.6020 119.0445 O.3 49 TYR49 -0.3598 785 H 122.0810 123.9330 115.0920 H 49 TYR49 0.1312 786 HA 121.2533 126.1127 113.4542 H 49 TYR49 0.0560 787 HB1 123.7544 126.5780 113.3327 H 49 TYR49 0.0333 788 HB2 124.0272 125.0565 114.1443 H 49 TYR49 0.0333 789 HD1 121.0684 126.5378 115.6053 H 49 TYR49 0.0621 790 HD2 125.3458 126.8803 115.4825 H 49 TYR49 0.0621 791 HE1 121.0437 127.6995 117.7378 H 49 TYR49 0.0643 792 HE2 125.2975 128.0487 117.6375 H 49 TYR49 0.0643 793 HH 124.0111 128.6091 119.4130 H 49 TYR49 0.2173 794 N 122.7560 123.6780 111.7890 N.am 50 PHE50 -0.2453 795 CA 122.8520 123.0930 110.4630 C.3 50 PHE50 0.0917 796 C 121.4860 122.7310 109.8810 C.2 50 PHE50 0.2190 797 O 121.2540 122.8750 108.6820 O.2 50 PHE50 -0.2778 798 CB 123.7338 121.8299 110.4783 C.3 50 PHE50 -0.0036 799 CG 125.1414 122.0289 110.9851 C.ar 50 PHE50 -0.0454 800 CD1 125.9362 123.0769 110.5238 C.ar 50 PHE50 -0.0585 801 CD2 125.7093 121.0837 111.8377 C.ar 50 PHE50 -0.0585 802 CE1 127.2667 123.1794 110.9107 C.ar 50 PHE50 -0.0615 803 CE2 127.0412 121.1797 112.2197 C.ar 50 PHE50 -0.0615 804 CZ 127.8233 122.2260 111.7519 C.ar 50 PHE50 -0.0617 805 H 123.1260 123.1530 112.5820 H 50 PHE50 0.1312 806 HA 123.2884 123.8518 109.8123 H 50 PHE50 0.0560 807 HB1 123.8232 121.4471 109.4623 H 50 PHE50 0.0333 808 HB2 123.2505 121.0487 111.0676 H 50 PHE50 0.0333 809 HD1 125.5366 123.8081 109.8372 H 50 PHE50 0.0620 810 HD2 125.1271 120.2414 112.1855 H 50 PHE50 0.0620 811 HE1 127.8747 123.9939 110.5450 H 50 PHE50 0.0618 812 HE2 127.4717 120.4240 112.8626 H 50 PHE50 0.0618 813 HZ 128.8620 122.2972 112.0406 H 50 PHE50 0.0618 814 N 120.5220 122.3120 110.7310 N.am 51 ILE51 -0.2454 815 CA 119.1360 122.0770 110.3350 C.3 51 ILE51 0.0903 816 C 118.4510 123.3280 109.7800 C.2 51 ILE51 0.2189 817 O 117.8790 123.2920 108.6910 O.2 51 ILE51 -0.2778 818 CB 118.3300 121.4380 111.4917 C.3 51 ILE51 -0.0201 819 CG1 119.0507 120.1916 112.0510 C.3 51 ILE51 -0.0514 820 CG2 116.8965 121.0873 111.0439 C.3 51 ILE51 -0.0605 821 CD1 118.2998 119.5034 113.1980 C.3 51 ILE51 -0.0650 822 H 120.7770 122.1510 111.7050 H 51 ILE51 0.1312 823 HA 119.1838 121.3630 109.5122 H 51 ILE51 0.0560 824 HB 118.2540 122.1663 112.2998 H 51 ILE51 0.0318 825 HG11 120.0370 120.4693 112.4239 H 51 ILE51 0.0266 826 HG12 119.2227 119.4727 111.2488 H 51 ILE51 0.0266 827 HG21 116.3013 120.6968 111.8684 H 51 ILE51 0.0233 828 HG22 116.9042 120.3381 110.2518 H 51 ILE51 0.0233 829 HG23 116.3634 121.9605 110.6674 H 51 ILE51 0.0233 830 HD11 118.9249 118.7440 113.6682 H 51 ILE51 0.0230 831 HD12 117.3947 119.0094 112.8452 H 51 ILE51 0.0230 832 HD13 118.0131 120.2191 113.9679 H 51 ILE51 0.0230 833 N 118.5320 124.4870 110.4730 N.am 52 VAL52 -0.2454 834 CA 117.9640 125.7390 109.9780 C.3 52 VAL52 0.0901 835 C 118.6790 126.3000 108.7560 C.2 52 VAL52 0.2189 836 O 118.0460 126.8540 107.8610 O.2 52 VAL52 -0.2778 837 CB 117.7998 126.7948 111.0888 C.3 52 VAL52 -0.0227 838 CG1 116.8100 126.3080 112.1521 C.3 52 VAL52 -0.0608 839 CG2 119.1315 127.1982 111.7279 C.3 52 VAL52 -0.0608 840 H 119.0080 124.4870 111.3750 H 52 VAL52 0.1312 841 HA 116.9621 125.4817 109.6290 H 52 VAL52 0.0560 842 HB 117.3658 127.6919 110.6434 H 52 VAL52 0.0315 843 HG11 116.6777 127.0434 112.9445 H 52 VAL52 0.0233 844 HG12 117.1629 125.3843 112.6067 H 52 VAL52 0.0233 845 HG13 115.8295 126.1170 111.7159 H 52 VAL52 0.0233 846 HG21 118.9848 127.9505 112.5029 H 52 VAL52 0.0233 847 HG22 119.8259 127.6093 110.9955 H 52 VAL52 0.0233 848 HG23 119.5989 126.3339 112.1874 H 52 VAL52 0.0233 849 N 120.0170 126.1260 108.6640 N.am 53 ASN53 -0.2452 850 CA 120.8060 126.4500 107.4890 C.3 53 ASN53 0.0957 851 C 120.3680 125.6360 106.2660 C.2 53 ASN53 0.2191 852 O 120.1390 126.1830 105.1890 O.2 53 ASN53 -0.2778 853 CB 122.3008 126.2569 107.7951 C.3 53 ASN53 0.0446 854 CG 123.1586 127.1248 106.8643 C.2 53 ASN53 0.2000 855 OD1 123.1001 128.3451 106.9113 O.2 53 ASN53 -0.2797 856 ND2 123.9515 126.4433 106.0257 N.am 53 ASN53 -0.2723 857 H 120.5040 125.7420 109.4740 H 53 ASN53 0.1312 858 HA 120.5903 127.5005 107.2819 H 53 ASN53 0.0562 859 HB1 122.5999 125.2099 107.7294 H 53 ASN53 0.0375 860 HB2 122.5161 126.5845 108.8113 H 53 ASN53 0.0375 861 HD21 124.5286 126.9508 105.3860 H 53 ASN53 0.1266 862 HD22 123.9812 125.4441 106.0138 H 53 ASN53 0.1266 863 N 120.1750 124.3090 106.4310 N.am 54 LEU54 -0.2456 864 CA 119.6200 123.4540 105.3970 C.3 54 LEU54 0.0880 865 C 118.2170 123.8810 104.9810 C.2 54 LEU54 0.2187 866 O 117.9790 124.1410 103.8090 O.2 54 LEU54 -0.2778 867 CB 119.6117 121.9848 105.8708 C.3 54 LEU54 -0.0266 868 CG 118.9880 120.9974 104.8586 C.3 54 LEU54 -0.0449 869 CD1 119.7507 120.9811 103.5295 C.3 54 LEU54 -0.0626 870 CD2 118.8841 119.5764 105.4235 C.3 54 LEU54 -0.0626 871 H 120.4310 123.8880 107.3240 H 54 LEU54 0.1312 872 HA 120.2677 123.5633 104.5264 H 54 LEU54 0.0557 873 HB1 119.0658 121.9185 106.8122 H 54 LEU54 0.0287 874 HB2 120.6301 121.6720 106.0957 H 54 LEU54 0.0287 875 HG 117.9666 121.3157 104.6492 H 54 LEU54 0.0296 876 HD11 119.2964 120.2811 102.8275 H 54 LEU54 0.0232 877 HD12 120.7842 120.6800 103.6857 H 54 LEU54 0.0232 878 HD13 119.7447 121.9578 103.0461 H 54 LEU54 0.0232 879 HD21 118.2800 118.9517 104.7660 H 54 LEU54 0.0232 880 HD22 118.4162 119.5722 106.4076 H 54 LEU54 0.0232 881 HD23 119.8626 119.1072 105.4976 H 54 LEU54 0.0232 882 N 117.2940 124.0830 105.9470 N.am 55 ALA55 -0.2459 883 CA 115.9290 124.5020 105.6840 C.3 55 ALA55 0.0850 884 C 115.8150 125.8490 104.9670 C.2 55 ALA55 0.2184 885 O 115.0140 126.0190 104.0480 O.2 55 ALA55 -0.2778 886 CB 115.1543 124.5306 107.0059 C.3 55 ALA55 -0.0411 887 H 117.5720 123.9330 106.9170 H 55 ALA55 0.1312 888 HA 115.5063 123.7402 105.0254 H 55 ALA55 0.0554 889 HB1 114.0977 124.7414 106.8371 H 55 ALA55 0.0249 890 HB2 115.5509 125.2883 107.6821 H 55 ALA55 0.0249 891 HB3 115.2203 123.5678 107.5129 H 55 ALA55 0.0249 892 N 116.6390 126.8460 105.3580 N.am 56 LEU56 -0.2457 893 CA 116.7140 128.1300 104.6810 C.3 56 LEU56 0.0880 894 C 117.2160 128.0220 103.2500 C.2 56 LEU56 0.2187 895 O 116.6340 128.5880 102.3240 O.2 56 LEU56 -0.2778 896 CB 117.6271 129.0446 105.5152 C.3 56 LEU56 -0.0266 897 CG 117.8152 130.4658 104.9501 C.3 56 LEU56 -0.0449 898 CD1 116.4805 131.2126 104.8197 C.3 56 LEU56 -0.0626 899 CD2 118.7994 131.2597 105.8179 C.3 56 LEU56 -0.0626 900 H 117.2380 126.6900 106.1690 H 56 LEU56 0.1312 901 HA 115.6976 128.5233 104.6550 H 56 LEU56 0.0557 902 HB1 118.6040 128.5686 105.6195 H 56 LEU56 0.0287 903 HB2 117.2241 129.1127 106.5263 H 56 LEU56 0.0287 904 HG 118.2560 130.3915 103.9552 H 56 LEU56 0.0296 905 HD11 116.6366 132.2296 104.4594 H 56 LEU56 0.0232 906 HD12 115.9673 131.2729 105.7797 H 56 LEU56 0.0232 907 HD13 115.8144 130.7190 104.1121 H 56 LEU56 0.0232 908 HD21 118.9722 132.2544 105.4065 H 56 LEU56 0.0232 909 HD22 119.7642 130.7547 105.8771 H 56 LEU56 0.0232 910 HD23 118.4220 131.3785 106.8339 H 56 LEU56 0.0232 911 N 118.2930 127.2410 103.0300 N.am 57 ALA57 -0.2459 912 CA 118.8210 126.9630 101.7130 C.3 57 ALA57 0.0850 913 C 117.8260 126.2440 100.8060 C.2 57 ALA57 0.2184 914 O 117.5880 126.6750 99.6800 O.2 57 ALA57 -0.2778 915 CB 120.0649 126.0877 101.8850 C.3 57 ALA57 -0.0411 916 H 118.7600 126.8240 103.8360 H 57 ALA57 0.1312 917 HA 119.0820 127.9196 101.2598 H 57 ALA57 0.0554 918 HB1 120.5374 125.8873 100.9235 H 57 ALA57 0.0249 919 HB2 119.8233 125.1266 102.3410 H 57 ALA57 0.0249 920 HB3 120.7893 126.5788 102.5338 H 57 ALA57 0.0249 921 N 117.1740 125.1810 101.3210 N.am 58 ASP58 -0.2451 922 CA 116.1290 124.4100 100.6670 C.3 58 ASP58 0.0974 923 C 114.9180 125.2420 100.2800 C.2 58 ASP58 0.2192 924 O 114.4080 125.1510 99.1620 O.2 58 ASP58 -0.2778 925 CB 115.6511 123.3117 101.6500 C.3 58 ASP58 0.0576 926 CG 116.6152 122.1320 101.8418 C.2 58 ASP58 0.1780 927 OD1 117.6432 122.0798 101.1739 O.co2 58 ASP58 -0.6478 928 OD2 116.3151 121.2658 102.6654 O.co2 58 ASP58 -0.6478 929 H 117.4400 124.8900 102.2610 H 58 ASP58 0.1312 930 HA 116.5602 123.9726 99.7661 H 58 ASP58 0.0563 931 HB1 114.7159 122.8672 101.3228 H 58 ASP58 0.0394 932 HB2 115.4578 123.7436 102.6308 H 58 ASP58 0.0394 933 N 114.4410 126.1280 101.1750 N.am 59 LEU59 -0.2456 934 CA 113.3680 127.0530 100.8600 C.3 59 LEU59 0.0880 935 C 113.7150 128.0330 99.7510 C.2 59 LEU59 0.2187 936 O 112.9630 128.1940 98.7870 O.2 59 LEU59 -0.2778 937 CB 113.0070 127.7881 102.1649 C.3 59 LEU59 -0.0266 938 CG 111.5854 128.3757 102.2342 C.3 59 LEU59 -0.0449 939 CD1 111.2772 128.8180 103.6693 C.3 59 LEU59 -0.0626 940 CD2 111.3515 129.5410 101.2627 C.3 59 LEU59 -0.0626 941 H 114.8490 126.1500 102.1100 H 59 LEU59 0.1312 942 HA 112.5266 126.4442 100.5257 H 59 LEU59 0.0557 943 HB1 113.7507 128.5524 102.3965 H 59 LEU59 0.0287 944 HB2 113.0841 127.0663 102.9759 H 59 LEU59 0.0287 945 HG 110.8809 127.5846 101.9831 H 59 LEU59 0.0296 946 HD11 110.2689 129.2224 103.7382 H 59 LEU59 0.0232 947 HD12 111.9708 129.5904 104.0026 H 59 LEU59 0.0232 948 HD13 111.3502 127.9818 104.3647 H 59 LEU59 0.0232 949 HD21 110.3939 130.0240 101.4584 H 59 LEU59 0.0232 950 HD22 111.3190 129.2041 100.2291 H 59 LEU59 0.0232 951 HD23 112.1317 130.2970 101.3539 H 59 LEU59 0.0232 952 N 114.9010 128.6730 99.8360 N.am 60 CYS60 -0.2449 953 CA 115.4130 129.5800 98.8220 C.3 60 CYS60 0.0965 954 C 115.6480 128.8780 97.4940 C.2 60 CYS60 0.2195 955 O 115.3400 129.4030 96.4250 O.2 60 CYS60 -0.2778 956 CB 116.7170 130.2186 99.3195 C.3 60 CYS60 0.0147 957 SG 116.4769 131.2893 100.7613 S.3 60 CYS60 -0.1762 958 H 115.4740 128.5100 100.6640 H 60 CYS60 0.1312 959 HA 114.6520 130.3461 98.6720 H 60 CYS60 0.0565 960 HB1 117.1632 130.8204 98.5267 H 60 CYS60 0.0394 961 HB2 117.4444 129.4455 99.5735 H 60 CYS60 0.0394 962 HG 116.2372 130.5356 101.8381 H 60 CYS60 0.1017 963 N 116.1620 127.6370 97.5220 N.am 61 MET61 -0.2456 964 CA 116.2530 126.7990 96.3480 C.3 61 MET61 0.0885 965 C 114.9040 126.5090 95.7040 C.2 61 MET61 0.2187 966 O 114.7180 126.7050 94.5090 O.2 61 MET61 -0.2778 967 CB 117.0240 125.5347 96.7662 C.3 61 MET61 -0.0199 968 CG 117.2811 124.5283 95.6385 C.3 61 MET61 -0.0047 969 SD 115.9784 123.2873 95.5335 S.3 61 MET61 -0.1641 970 CE 116.4532 122.2669 96.9477 C.3 61 MET61 -0.0181 971 H 116.5030 127.2700 98.4110 H 61 MET61 0.1312 972 HA 116.8479 127.3534 95.6208 H 61 MET61 0.0557 973 HB1 116.5216 125.0399 97.5976 H 61 MET61 0.0293 974 HB2 117.9901 125.8516 97.1625 H 61 MET61 0.0293 975 HG1 118.2199 124.0100 95.8348 H 61 MET61 0.0377 976 HG2 117.4055 125.0183 94.6727 H 61 MET61 0.0377 977 HE1 116.1642 121.2298 96.7769 H 61 MET61 0.0340 978 HE2 115.9758 122.6251 97.8592 H 61 MET61 0.0340 979 HE3 117.5333 122.2749 97.0938 H 61 MET61 0.0340 980 N 113.9030 126.0660 96.4840 N.am 62 ALA62 -0.2459 981 CA 112.5950 125.7780 95.9450 C.3 62 ALA62 0.0850 982 C 111.8360 126.9750 95.4080 C.2 62 ALA62 0.2184 983 O 111.2960 126.9350 94.3100 O.2 62 ALA62 -0.2778 984 CB 111.7269 125.0846 97.0000 C.3 62 ALA62 -0.0411 985 H 114.0720 125.9300 97.4810 H 62 ALA62 0.1312 986 HA 112.7471 125.0935 95.1079 H 62 ALA62 0.0554 987 HB1 110.6786 125.0305 96.7012 H 62 ALA62 0.0249 988 HB2 111.7786 125.5916 97.9646 H 62 ALA62 0.0249 989 HB3 112.0545 124.0594 97.1258 H 62 ALA62 0.0249 990 N 111.7680 128.0820 96.1650 N.am 63 ALA63 -0.2459 991 CA 111.0180 129.2310 95.7230 C.3 63 ALA63 0.0850 992 C 111.6200 129.9550 94.5360 C.2 63 ALA63 0.2184 993 O 110.9660 130.1260 93.5110 O.2 63 ALA63 -0.2778 994 CB 110.8930 130.1894 96.9150 C.3 63 ALA63 -0.0411 995 H 112.2520 128.1100 97.0620 H 63 ALA63 0.1312 996 HA 110.0256 128.8780 95.4357 H 63 ALA63 0.0554 997 HB1 110.2878 131.0614 96.6653 H 63 ALA63 0.0249 998 HB2 111.8704 130.5404 97.2497 H 63 ALA63 0.0249 999 HB3 110.4212 129.6918 97.7621 H 63 ALA63 0.0249 1000 N 112.9020 130.3710 94.6350 N.am 64 PHE64 -0.2453 1001 CA 113.5280 131.1280 93.5720 C.3 64 PHE64 0.0917 1002 C 113.8290 130.2350 92.3850 C.2 64 PHE64 0.2190 1003 O 113.3260 130.4600 91.2890 O.2 64 PHE64 -0.2778 1004 CB 114.8430 131.7693 94.0521 C.3 64 PHE64 -0.0036 1005 CG 114.6142 132.9302 94.9811 C.ar 64 PHE64 -0.0454 1006 CD1 114.4932 134.2197 94.4713 C.ar 64 PHE64 -0.0585 1007 CD2 114.5471 132.7392 96.3574 C.ar 64 PHE64 -0.0585 1008 CE1 114.3143 135.3012 95.3235 C.ar 64 PHE64 -0.0615 1009 CE2 114.3677 133.8180 97.2125 C.ar 64 PHE64 -0.0615 1010 CZ 114.2528 135.1009 96.6956 C.ar 64 PHE64 -0.0617 1011 H 113.4380 130.1480 95.4740 H 64 PHE64 0.1312 1012 HA 112.8262 131.8985 93.2468 H 64 PHE64 0.0560 1013 HB1 115.4175 132.1379 93.1996 H 64 PHE64 0.0333 1014 HB2 115.4777 131.0300 94.5407 H 64 PHE64 0.0333 1015 HD1 114.5428 134.3856 93.4047 H 64 PHE64 0.0620 1016 HD2 114.6378 131.7466 96.7694 H 64 PHE64 0.0620 1017 HE1 114.2247 136.2988 94.9189 H 64 PHE64 0.0618 1018 HE2 114.3202 133.6588 98.2800 H 64 PHE64 0.0618 1019 HZ 114.1144 135.9415 97.3599 H 64 PHE64 0.0618 1020 N 114.5850 129.1340 92.5710 N.am 65 ASN65 -0.2452 1021 CA 115.0320 128.3290 91.4510 C.3 65 ASN65 0.0957 1022 C 113.8620 127.6900 90.7140 C.2 65 ASN65 0.2191 1023 O 113.7580 127.7700 89.4930 O.2 65 ASN65 -0.2778 1024 CB 116.0237 127.2586 91.9514 C.3 65 ASN65 0.0446 1025 CG 116.9613 126.7600 90.8447 C.2 65 ASN65 0.2000 1026 OD1 116.5450 126.4512 89.7392 O.2 65 ASN65 -0.2797 1027 ND2 118.2508 126.6962 91.2070 N.am 65 ASN65 -0.2723 1028 H 114.8480 128.8620 93.5180 H 65 ASN65 0.1312 1029 HA 115.5317 129.0173 90.7652 H 65 ASN65 0.0562 1030 HB1 115.5054 126.3856 92.3443 H 65 ASN65 0.0375 1031 HB2 116.6304 127.6623 92.7623 H 65 ASN65 0.0375 1032 HD21 118.9249 126.3766 90.5420 H 65 ASN65 0.1266 1033 HD22 118.5631 126.9532 92.1209 H 65 ASN65 0.1266 1034 N 112.9020 127.0840 91.4520 N.am 66 ALA66 -0.2459 1035 CA 111.7740 126.4390 90.8150 C.3 66 ALA66 0.0850 1036 C 110.8010 127.3550 90.1110 C.2 66 ALA66 0.2184 1037 O 110.3810 127.0520 88.9960 O.2 66 ALA66 -0.2778 1038 CB 111.0302 125.5171 91.7852 C.3 66 ALA66 -0.0411 1039 H 112.9750 127.0820 92.4690 H 66 ALA66 0.1312 1040 HA 112.2099 125.8050 90.0602 H 66 ALA66 0.0554 1041 HB1 110.4369 124.7811 91.2416 H 66 ALA66 0.0249 1042 HB2 110.3391 126.0746 92.4123 H 66 ALA66 0.0249 1043 HB3 111.7237 124.9724 92.4267 H 66 ALA66 0.0249 1044 N 110.4290 128.5070 90.7050 N.am 67 ALA67 -0.2459 1045 CA 109.5560 129.4340 90.0250 C.3 67 ALA67 0.0850 1046 C 110.1970 130.0730 88.7890 C.2 67 ALA67 0.2184 1047 O 109.6300 130.0230 87.7000 O.2 67 ALA67 -0.2778 1048 CB 109.1362 130.5262 91.0152 C.3 67 ALA67 -0.0411 1049 H 110.7670 128.7250 91.6420 H 67 ALA67 0.1312 1050 HA 108.6775 128.8723 89.7027 H 67 ALA67 0.0554 1051 HB1 108.4148 131.2109 90.5684 H 67 ALA67 0.0249 1052 HB2 109.9936 131.1133 91.3471 H 67 ALA67 0.0249 1053 HB3 108.6734 130.0889 91.9000 H 67 ALA67 0.0249 1054 N 111.4300 130.6220 88.8980 N.am 68 PHE68 -0.2453 1055 CA 112.1030 131.2680 87.7760 C.3 68 PHE68 0.0917 1056 C 112.4260 130.3030 86.6300 C.2 68 PHE68 0.2190 1057 O 112.1780 130.6110 85.4630 O.2 68 PHE68 -0.2778 1058 CB 113.3871 131.9673 88.2607 C.3 68 PHE68 -0.0036 1059 CG 113.1119 133.3321 88.8406 C.ar 68 PHE68 -0.0454 1060 CD1 113.3590 134.4754 88.0848 C.ar 68 PHE68 -0.0585 1061 CD2 112.6300 133.4777 90.1384 C.ar 68 PHE68 -0.0585 1062 CE1 113.1540 135.7388 88.6232 C.ar 68 PHE68 -0.0615 1063 CE2 112.4149 134.7395 90.6770 C.ar 68 PHE68 -0.0615 1064 CZ 112.6809 135.8722 89.9207 C.ar 68 PHE68 -0.0617 1065 H 111.9070 130.5820 89.7990 H 68 PHE68 0.1312 1066 HA 111.4077 132.0081 87.3759 H 68 PHE68 0.0560 1067 HB1 114.0929 132.0946 87.4378 H 68 PHE68 0.0333 1068 HB2 113.9055 131.3510 88.9959 H 68 PHE68 0.0333 1069 HD1 113.7288 134.3857 87.0736 H 68 PHE68 0.0620 1070 HD2 112.4171 132.6077 90.7391 H 68 PHE68 0.0620 1071 HE1 113.3611 136.6176 88.0309 H 68 PHE68 0.0618 1072 HE2 112.0429 134.8372 91.6865 H 68 PHE68 0.0618 1073 HZ 112.5163 136.8545 90.3386 H 68 PHE68 0.0618 1074 N 112.9320 129.0850 86.9340 N.am 69 ASN69 -0.2452 1075 CA 113.1640 128.0470 85.9350 C.3 69 ASN69 0.0957 1076 C 111.9160 127.4990 85.2750 C.2 69 ASN69 0.2191 1077 O 111.9330 127.2550 84.0750 O.2 69 ASN69 -0.2778 1078 CB 114.0602 126.9431 86.4911 C.3 69 ASN69 0.0446 1079 CG 115.5056 127.4329 86.6717 C.2 69 ASN69 0.2000 1080 OD1 115.7952 128.6217 86.6756 O.2 69 ASN69 -0.2797 1081 ND2 116.3951 126.4407 86.8111 N.am 69 ASN69 -0.2723 1082 H 113.1620 128.8830 87.9070 H 69 ASN69 0.1312 1083 HA 113.7024 128.5448 85.1252 H 69 ASN69 0.0562 1084 HB1 114.0754 126.0712 85.8360 H 69 ASN69 0.0375 1085 HB2 113.6700 126.6366 87.4510 H 69 ASN69 0.0375 1086 HD21 117.3577 126.6745 86.9407 H 69 ASN69 0.1266 1087 HD22 116.1227 125.4795 86.7972 H 69 ASN69 0.1266 1088 N 110.8000 127.2900 86.0060 N.am 70 PHE70 -0.2453 1089 CA 109.5310 126.9170 85.3980 C.3 70 PHE70 0.0917 1090 C 109.0330 128.0040 84.4390 C.2 70 PHE70 0.2190 1091 O 108.6970 127.7180 83.2940 O.2 70 PHE70 -0.2778 1092 CB 108.4828 126.5888 86.4749 C.3 70 PHE70 -0.0036 1093 CG 107.1344 126.2494 85.8822 C.ar 70 PHE70 -0.0454 1094 CD1 107.0228 125.3347 84.8360 C.ar 70 PHE70 -0.0585 1095 CD2 105.9842 126.8883 86.3369 C.ar 70 PHE70 -0.0585 1096 CE1 105.7957 125.0875 84.2371 C.ar 70 PHE70 -0.0615 1097 CE2 104.7525 126.6329 85.7472 C.ar 70 PHE70 -0.0615 1098 CZ 104.6586 125.7377 84.6908 C.ar 70 PHE70 -0.0617 1099 H 110.8480 127.3970 87.0190 H 70 PHE70 0.1312 1100 HA 109.7415 126.0278 84.8027 H 70 PHE70 0.0560 1101 HB1 108.3819 127.4362 87.1549 H 70 PHE70 0.0333 1102 HB2 108.8212 125.7468 87.0793 H 70 PHE70 0.0333 1103 HD1 107.8961 124.8238 84.4586 H 70 PHE70 0.0620 1104 HD2 106.0470 127.6044 87.1432 H 70 PHE70 0.0620 1105 HE1 105.7308 124.4005 83.4066 H 70 PHE70 0.0618 1106 HE2 103.8669 127.1377 86.1044 H 70 PHE70 0.0618 1107 HZ 103.7040 125.5440 84.2231 H 70 PHE70 0.0618 1108 N 109.0740 129.2940 84.8490 N.am 71 VAL71 -0.2454 1109 CA 108.6790 130.4260 84.0100 C.3 71 VAL71 0.0901 1110 C 109.4980 130.5040 82.7300 C.2 71 VAL71 0.2189 1111 O 108.9570 130.6770 81.6370 O.2 71 VAL71 -0.2778 1112 CB 108.7274 131.7223 84.8456 C.3 71 VAL71 -0.0227 1113 CG1 108.5891 132.9829 83.9805 C.3 71 VAL71 -0.0608 1114 CG2 107.6325 131.7193 85.9239 C.3 71 VAL71 -0.0608 1115 H 109.3990 129.4870 85.7970 H 71 VAL71 0.1312 1116 HA 107.6494 130.2304 83.7067 H 71 VAL71 0.0560 1117 HB 109.6952 131.7677 85.3482 H 71 VAL71 0.0315 1118 HG11 108.5033 133.8791 84.5923 H 71 VAL71 0.0233 1119 HG12 107.7029 132.9316 83.3475 H 71 VAL71 0.0233 1120 HG13 109.4599 133.1066 83.3382 H 71 VAL71 0.0233 1121 HG21 107.7358 132.5784 86.5871 H 71 VAL71 0.0233 1122 HG22 107.6646 130.8226 86.5405 H 71 VAL71 0.0233 1123 HG23 106.6411 131.7649 85.4727 H 71 VAL71 0.0233 1124 N 110.8270 130.3100 82.8360 N.am 72 TYR72 -0.2453 1125 CA 111.7180 130.2680 81.6930 C.3 72 TYR72 0.0917 1126 C 111.5750 129.0020 80.8340 C.2 72 TYR72 0.2190 1127 O 111.8250 129.0330 79.6360 O.2 72 TYR72 -0.2778 1128 CB 113.1735 130.4761 82.1506 C.3 72 TYR72 -0.0036 1129 CG 114.1792 130.6907 81.0341 C.ar 72 TYR72 -0.0453 1130 CD1 113.8361 131.3019 79.8246 C.ar 72 TYR72 -0.0561 1131 CD2 115.5135 130.3461 81.2407 C.ar 72 TYR72 -0.0561 1132 CE1 114.7939 131.5483 78.8496 C.ar 72 TYR72 -0.0317 1133 CE2 116.4770 130.6044 80.2717 C.ar 72 TYR72 -0.0317 1134 CZ 116.1166 131.2053 79.0747 C.ar 72 TYR72 0.0726 1135 OH 117.0694 131.4808 78.1158 O.3 72 TYR72 -0.3598 1136 H 111.2260 130.1870 83.7670 H 72 TYR72 0.1312 1137 HA 111.4052 131.1113 81.0775 H 72 TYR72 0.0560 1138 HB1 113.4858 129.6266 82.7602 H 72 TYR72 0.0333 1139 HB2 113.2167 131.3468 82.8050 H 72 TYR72 0.0333 1140 HD1 112.8232 131.6061 79.6168 H 72 TYR72 0.0621 1141 HD2 115.8140 129.8933 82.1748 H 72 TYR72 0.0621 1142 HE1 114.5143 132.0194 77.9182 H 72 TYR72 0.0643 1143 HE2 117.5104 130.3471 80.4520 H 72 TYR72 0.0643 1144 HH 117.9247 131.2052 78.4267 H 72 TYR72 0.2173 1145 N 111.1140 127.8630 81.3920 N.am 73 ALA73 -0.2459 1146 CA 111.0280 126.6050 80.6720 C.3 73 ALA73 0.0850 1147 C 109.6690 126.3670 80.0280 C.2 73 ALA73 0.2185 1148 O 109.5130 125.4760 79.2010 O.2 73 ALA73 -0.2778 1149 CB 111.3363 125.4704 81.6551 C.3 73 ALA73 -0.0411 1150 H 110.8120 127.8870 82.3660 H 73 ALA73 0.1312 1151 HA 111.7804 126.6075 79.8817 H 73 ALA73 0.0554 1152 HB1 111.3223 124.4972 81.1630 H 73 ALA73 0.0249 1153 HB2 110.6156 125.4475 82.4738 H 73 ALA73 0.0249 1154 HB3 112.3257 125.6036 82.0904 H 73 ALA73 0.0249 1155 N 108.6440 127.1700 80.3670 N.am 74 SER74 -0.2436 1156 CA 107.3300 127.0690 79.7350 C.3 74 SER74 0.1109 1157 C 107.2560 127.4410 78.2690 C.2 74 SER74 0.2209 1158 O 106.5920 126.7700 77.4870 O.2 74 SER74 -0.2777 1159 CB 106.3396 127.9249 80.5394 C.3 74 SER74 0.0681 1160 OG 106.0994 127.2954 81.7912 O.3 74 SER74 -0.3930 1161 H 108.7890 127.8740 81.0910 H 74 SER74 0.1312 1162 HA 107.0281 126.0242 79.8173 H 74 SER74 0.0580 1163 HB1 105.3922 128.0262 80.0000 H 74 SER74 0.0577 1164 HB2 106.7567 128.9291 80.6809 H 74 SER74 0.0577 1165 HG 105.5672 127.8401 82.3657 H 74 SER74 0.2095 1166 N 107.9060 128.5610 77.8930 N.am 75 HIS75 -0.2452 1167 CA 107.9290 129.0330 76.5190 C.3 75 HIS75 0.0932 1168 C 109.3390 129.3210 76.0130 C.2 75 HIS75 0.2191 1169 O 109.5130 129.7390 74.8730 O.2 75 HIS75 -0.2778 1170 CB 107.0429 130.2789 76.3645 C.3 75 HIS75 0.0146 1171 CG 105.5950 129.8527 76.3274 C.ar 75 HIS75 0.0551 1172 ND1 105.0497 129.1668 75.2989 N.ar 75 HIS75 -0.2469 1173 CD2 104.6052 130.0559 77.3013 C.ar 75 HIS75 0.0047 1174 CE1 103.7625 128.9740 75.6271 C.ar 75 HIS75 0.0737 1175 NE2 103.4659 129.4976 76.8316 N.ar 75 HIS75 -0.2539 1176 H 108.4020 129.0990 78.6030 H 75 HIS75 0.1312 1177 HA 107.5566 128.2387 75.8690 H 75 HIS75 0.0561 1178 HB1 107.2494 130.8029 75.4301 H 75 HIS75 0.0348 1179 HB2 107.2102 130.9899 77.1741 H 75 HIS75 0.0348 1180 HD2 104.7349 130.5693 78.2426 H 75 HIS75 0.0764 1181 HE1 103.0536 128.4539 74.9970 H 75 HIS75 0.0963 1182 HE2 102.5935 129.4789 77.2769 H 75 HIS75 0.1339 1183 N 110.3950 129.1110 76.8340 N.am 76 ASN76 -0.2452 1184 CA 111.7770 129.4590 76.5030 C.3 76 ASN76 0.0957 1185 C 112.0060 130.9580 76.2210 C.2 76 ASN76 0.2191 1186 O 112.7480 131.3500 75.3190 O.2 76 ASN76 -0.2778 1187 CB 112.2462 128.5802 75.3223 C.3 76 ASN76 0.0446 1188 CG 113.7736 128.5584 75.1529 C.2 76 ASN76 0.2000 1189 OD1 114.5322 128.9397 76.0323 O.2 76 ASN76 -0.2797 1190 ND2 114.1755 128.0833 73.9644 N.am 76 ASN76 -0.2723 1191 H 110.2150 128.6820 77.7420 H 76 ASN76 0.1312 1192 HA 112.3596 129.2073 77.3859 H 76 ASN76 0.0562 1193 HB1 111.7958 128.9083 74.3854 H 76 ASN76 0.0375 1194 HB2 111.9258 127.5511 75.4820 H 76 ASN76 0.0375 1195 HD21 115.1545 128.0106 73.7792 H 76 ASN76 0.1266 1196 HD22 113.5178 127.7968 73.2693 H 76 ASN76 0.1266 1197 N 111.3630 131.8380 77.0210 N.am 77 ILE77 -0.2454 1198 CA 111.4040 133.2820 76.8510 C.3 77 ILE77 0.0903 1199 C 111.7190 133.8870 78.2050 C.2 77 ILE77 0.2189 1200 O 111.0890 133.5760 79.2130 O.2 77 ILE77 -0.2778 1201 CB 110.0882 133.8320 76.2562 C.3 77 ILE77 -0.0201 1202 CG1 109.7969 133.2172 74.8727 C.3 77 ILE77 -0.0514 1203 CG2 110.1210 135.3707 76.1593 C.3 77 ILE77 -0.0605 1204 CD1 108.4031 133.5538 74.3306 C.3 77 ILE77 -0.0650 1205 H 110.8130 131.4650 77.7950 H 77 ILE77 0.1312 1206 HA 112.2330 133.5243 76.1830 H 77 ILE77 0.0560 1207 HB 109.2757 133.5470 76.9242 H 77 ILE77 0.0318 1208 HG11 109.8681 132.1343 74.9273 H 77 ILE77 0.0266 1209 HG12 110.5576 133.5321 74.1573 H 77 ILE77 0.0266 1210 HG21 109.1771 135.7690 75.7897 H 77 ILE77 0.0233 1211 HG22 110.9112 135.7045 75.4858 H 77 ILE77 0.0233 1212 HG23 110.2955 135.8380 77.1282 H 77 ILE77 0.0233 1213 HD11 108.2102 133.0115 73.4048 H 77 ILE77 0.0230 1214 HD12 108.3002 134.6161 74.1121 H 77 ILE77 0.0230 1215 HD13 107.6273 133.2773 75.0452 H 77 ILE77 0.0230 1216 N 112.7390 134.7580 78.2710 N.am 78 TRP78 -0.2453 1217 CA 113.1610 135.4070 79.4850 C.3 78 TRP78 0.0918 1218 C 112.4590 136.7470 79.6870 C.2 78 TRP78 0.2190 1219 O 112.4720 137.6090 78.8100 O.2 78 TRP78 -0.2778 1220 CB 114.6858 135.5839 79.3685 C.3 78 TRP78 -0.0021 1221 CG 115.2928 136.0455 80.6748 C.ar 78 TRP78 -0.0260 1222 CD1 115.8141 137.3128 80.9454 C.ar 78 TRP78 -0.0136 1223 CD2 115.4816 135.2607 81.8677 C.ar 78 TRP78 -0.0028 1224 NE1 116.2705 137.3412 82.2226 N.ar 78 TRP78 -0.2641 1225 CE2 116.0985 136.0987 82.8214 C.ar 78 TRP78 0.0269 1226 CE3 115.1822 133.9660 82.1866 C.ar 78 TRP78 -0.0528 1227 CZ2 116.3814 135.6146 84.0708 C.ar 78 TRP78 -0.0430 1228 CZ3 115.4875 133.4622 83.4503 C.ar 78 TRP78 -0.0611 1229 CH2 116.0886 134.2902 84.3963 C.ar 78 TRP78 -0.0602 1230 H 113.2440 134.9720 77.4110 H 78 TRP78 0.1312 1231 HA 112.9242 134.7467 80.3217 H 78 TRP78 0.0560 1232 HB1 114.9354 136.2891 78.5770 H 78 TRP78 0.0334 1233 HB2 115.1499 134.6365 79.0901 H 78 TRP78 0.0334 1234 HD1 115.8362 138.1369 80.2467 H 78 TRP78 0.0748 1235 HE1 116.6721 138.1199 82.6631 H 78 TRP78 0.1331 1236 HE3 114.7064 133.3405 81.4510 H 78 TRP78 0.0624 1237 HZ2 116.8162 136.2661 84.8125 H 78 TRP78 0.0633 1238 HZ3 115.2543 132.4365 83.6981 H 78 TRP78 0.0618 1239 HH2 116.3207 133.9042 85.3777 H 78 TRP78 0.0618 1240 N 111.8440 136.9590 80.8720 N.am 79 TYR79 -0.2453 1241 CA 111.0150 138.1230 81.1520 C.3 79 TYR79 0.0917 1242 C 111.6420 139.0330 82.2070 C.2 79 TYR79 0.2190 1243 O 110.9870 139.9130 82.7580 O.2 79 TYR79 -0.2778 1244 CB 109.6399 137.6561 81.6652 C.3 79 TYR79 -0.0036 1245 CG 109.0387 136.5564 80.8288 C.ar 79 TYR79 -0.0453 1246 CD1 108.4548 136.8285 79.5951 C.ar 79 TYR79 -0.0561 1247 CD2 109.0480 135.2460 81.2948 C.ar 79 TYR79 -0.0561 1248 CE1 107.8851 135.8054 78.8452 C.ar 79 TYR79 -0.0317 1249 CE2 108.4745 134.2237 80.5509 C.ar 79 TYR79 -0.0317 1250 CZ 107.8939 134.5031 79.3235 C.ar 79 TYR79 0.0726 1251 OH 107.3399 133.4845 78.5755 O.3 79 TYR79 -0.3598 1252 H 111.9670 136.2660 81.6100 H 79 TYR79 0.1312 1253 HA 110.8882 138.7007 80.2351 H 79 TYR79 0.0560 1254 HB1 108.9444 138.4961 81.6927 H 79 TYR79 0.0333 1255 HB2 109.7223 137.2989 82.6937 H 79 TYR79 0.0333 1256 HD1 108.4425 137.8394 79.2146 H 79 TYR79 0.0621 1257 HD2 109.5094 135.0228 82.2442 H 79 TYR79 0.0621 1258 HE1 107.4391 136.0162 77.8848 H 79 TYR79 0.0643 1259 HE2 108.4967 133.2083 80.9171 H 79 TYR79 0.0643 1260 HH 107.4838 132.6601 79.0209 H 79 TYR79 0.2173 1261 N 112.9370 138.8260 82.5360 N.am 80 PHE80 -0.2453 1262 CA 113.5210 139.4110 83.7320 C.3 80 PHE80 0.0917 1263 C 114.7220 140.3240 83.4940 C.2 80 PHE80 0.2188 1264 O 115.1690 141.0290 84.3920 O.2 80 PHE80 -0.2778 1265 CB 113.8611 138.3187 84.7549 C.3 80 PHE80 -0.0036 1266 CG 112.6901 137.4224 85.0610 C.ar 80 PHE80 -0.0454 1267 CD1 111.6883 137.8546 85.9241 C.ar 80 PHE80 -0.0585 1268 CD2 112.6010 136.1470 84.5094 C.ar 80 PHE80 -0.0585 1269 CE1 110.6291 137.0189 86.2505 C.ar 80 PHE80 -0.0615 1270 CE2 111.5442 135.3072 84.8352 C.ar 80 PHE80 -0.0615 1271 CZ 110.5627 135.7408 85.7151 C.ar 80 PHE80 -0.0617 1272 H 113.5180 138.2460 81.9310 H 80 PHE80 0.1312 1273 HA 112.7773 140.0596 84.1982 H 80 PHE80 0.0560 1274 HB1 114.1765 138.7786 85.6909 H 80 PHE80 0.0333 1275 HB2 114.6992 137.7218 84.4124 H 80 PHE80 0.0333 1276 HD1 111.7385 138.8430 86.3578 H 80 PHE80 0.0620 1277 HD2 113.3626 135.7960 83.8313 H 80 PHE80 0.0620 1278 HE1 109.8639 137.3585 86.9332 H 80 PHE80 0.0618 1279 HE2 111.4933 134.3122 84.4167 H 80 PHE80 0.0618 1280 HZ 109.7508 135.0855 85.9918 H 80 PHE80 0.0618 1281 N 115.2770 140.3940 82.2670 N.am 81 GLY81 -0.2485 1282 CA 116.4000 141.2880 81.9770 C.3 81 GLY81 0.0765 1283 C 117.7550 140.8070 82.4470 C.2 81 GLY81 0.2155 1284 O 117.9100 139.7370 83.0340 O.2 81 GLY81 -0.2781 1285 H 114.9040 139.8080 81.5200 H 81 GLY81 0.1309 1286 HA1 116.1821 142.2625 82.4172 H 81 GLY81 0.0521 1287 HA2 116.4229 141.4068 80.8942 H 81 GLY81 0.0521 1288 N 118.8070 141.6010 82.1480 N.am 82 ARG82 -0.2459 1289 CA 120.1930 141.2400 82.4100 C.3 82 ARG82 0.0879 1290 C 120.5410 141.0750 83.8830 C.2 82 ARG82 0.2187 1291 O 121.0820 140.0540 84.2790 O.2 82 ARG82 -0.2778 1292 CB 121.1548 142.2509 81.7631 C.3 82 ARG82 -0.0258 1293 CG 121.0980 142.2380 80.2274 C.3 82 ARG82 -0.0154 1294 CD 122.2463 143.0243 79.5780 C.3 82 ARG82 0.1045 1295 NE 123.5114 142.3404 79.8513 N.pl3 82 ARG82 -0.4450 1296 CZ 124.0759 141.4143 79.0836 C.cat 82 ARG82 0.5062 1297 NH1 125.1590 140.8237 79.5026 N.pl3 82 ARG82 -0.4573 1298 NH2 123.5756 141.0713 77.9265 N.pl3 82 ARG82 -0.4573 1299 H 118.6190 142.5050 81.7140 H 82 ARG82 0.1312 1300 HA 120.3441 140.2638 81.9534 H 82 ARG82 0.0557 1301 HB1 122.1721 142.0135 82.0781 H 82 ARG82 0.0286 1302 HB2 120.9502 143.2560 82.1346 H 82 ARG82 0.0286 1303 HG1 120.1394 142.6338 79.8906 H 82 ARG82 0.0299 1304 HG2 121.1493 141.2071 79.8828 H 82 ARG82 0.0299 1305 HD1 122.3211 144.0298 79.9989 H 82 ARG82 0.0711 1306 HD2 122.1094 143.1368 78.5000 H 82 ARG82 0.0711 1307 HE 124.0220 142.5404 80.6893 H 82 ARG82 0.3153 1308 HH11 125.5949 140.1249 78.9357 H 82 ARG82 0.3114 1309 HH12 125.5496 141.0600 80.3937 H 82 ARG82 0.3114 1310 HH21 124.0174 140.3394 77.4050 H 82 ARG82 0.3114 1311 HH22 122.7655 141.5186 77.5582 H 82 ARG82 0.3114 1312 N 120.1840 142.0300 84.7640 N.am 83 ALA83 -0.2459 1313 CA 120.5580 141.9580 86.1670 C.3 83 ALA83 0.0850 1314 C 119.9840 140.7380 86.8900 C.2 83 ALA83 0.2184 1315 O 120.6870 140.0140 87.5940 O.2 83 ALA83 -0.2778 1316 CB 120.1026 143.2446 86.8651 C.3 83 ALA83 -0.0411 1317 H 119.6360 142.8260 84.4370 H 83 ALA83 0.1312 1318 HA 121.6465 141.8835 86.2002 H 83 ALA83 0.0554 1319 HB1 120.4087 143.2579 87.9120 H 83 ALA83 0.0249 1320 HB2 119.0177 143.3540 86.8322 H 83 ALA83 0.0249 1321 HB3 120.5381 144.1210 86.3851 H 83 ALA83 0.0249 1322 N 118.6940 140.4300 86.6540 N.am 84 PHE84 -0.2453 1323 CA 118.0660 139.2260 87.1570 C.3 84 PHE84 0.0917 1324 C 118.6010 137.9470 86.5310 C.2 84 PHE84 0.2190 1325 O 118.7380 136.9430 87.2150 O.2 84 PHE84 -0.2778 1326 CB 116.5509 139.2922 86.9342 C.3 84 PHE84 -0.0036 1327 CG 115.8919 140.2788 87.8593 C.ar 84 PHE84 -0.0454 1328 CD1 115.4140 139.8606 89.0980 C.ar 84 PHE84 -0.0585 1329 CD2 115.7544 141.6157 87.4988 C.ar 84 PHE84 -0.0585 1330 CE1 114.8057 140.7621 89.9610 C.ar 84 PHE84 -0.0615 1331 CE2 115.1459 142.5195 88.3595 C.ar 84 PHE84 -0.0615 1332 CZ 114.6706 142.0930 89.5916 C.ar 84 PHE84 -0.0617 1333 H 118.1340 141.0740 86.0960 H 84 PHE84 0.1312 1334 HA 118.2734 139.1847 88.2258 H 84 PHE84 0.0560 1335 HB1 116.0918 138.3165 87.1051 H 84 PHE84 0.0333 1336 HB2 116.3424 139.5504 85.8976 H 84 PHE84 0.0333 1337 HD1 115.5142 138.8269 89.3962 H 84 PHE84 0.0620 1338 HD2 116.1219 141.9602 86.5437 H 84 PHE84 0.0620 1339 HE1 114.4370 140.4283 90.9200 H 84 PHE84 0.0618 1340 HE2 115.0403 143.5546 88.0695 H 84 PHE84 0.0618 1341 HZ 114.1960 142.7954 90.2613 H 84 PHE84 0.0618 1342 N 118.9880 137.9480 85.2370 N.am 85 CYS85 -0.2449 1343 CA 119.6690 136.8350 84.5850 C.3 85 CYS85 0.0965 1344 C 120.9740 136.4910 85.2960 C.2 85 CYS85 0.2195 1345 O 121.3390 135.3350 85.4730 O.2 85 CYS85 -0.2778 1346 CB 119.8918 137.2121 83.1107 C.3 85 CYS85 0.0147 1347 SG 121.0221 136.1580 82.1730 S.3 85 CYS85 -0.1762 1348 H 118.7920 138.7800 84.6800 H 85 CYS85 0.1312 1349 HA 119.0302 135.9570 84.6605 H 85 CYS85 0.0565 1350 HB1 120.2719 138.2265 83.0440 H 85 CYS85 0.0394 1351 HB2 118.9300 137.2238 82.5995 H 85 CYS85 0.0394 1352 HG 120.9944 136.4673 80.8749 H 85 CYS85 0.1017 1353 N 121.7220 137.5090 85.7530 N.am 86 TYR86 -0.2453 1354 CA 122.9960 137.3250 86.4260 C.3 86 TYR86 0.0917 1355 C 122.7700 136.8860 87.8640 C.2 86 TYR86 0.2190 1356 O 123.4180 135.9670 88.3490 O.2 86 TYR86 -0.2778 1357 CB 123.7650 138.6614 86.5667 C.3 86 TYR86 -0.0036 1358 CG 124.1246 139.4456 85.3294 C.ar 86 TYR86 -0.0453 1359 CD1 123.8985 139.0036 84.0278 C.ar 86 TYR86 -0.0561 1360 CD2 124.7296 140.6854 85.5171 C.ar 86 TYR86 -0.0561 1361 CE1 124.2483 139.8053 82.9469 C.ar 86 TYR86 -0.0317 1362 CE2 125.1043 141.4721 84.4398 C.ar 86 TYR86 -0.0317 1363 CZ 124.8616 141.0340 83.1497 C.ar 86 TYR86 0.0726 1364 OH 125.2470 141.8234 82.0832 O.3 86 TYR86 -0.3598 1365 H 121.3780 138.4600 85.6210 H 86 TYR86 0.1312 1366 HA 123.5837 136.5727 85.9032 H 86 TYR86 0.0560 1367 HB1 124.7013 138.4755 87.0970 H 86 TYR86 0.0333 1368 HB2 123.1953 139.3460 87.1980 H 86 TYR86 0.0333 1369 HD1 123.4390 138.0454 83.8372 H 86 TYR86 0.0621 1370 HD2 124.9249 141.0392 86.5195 H 86 TYR86 0.0621 1371 HE1 124.0565 139.4590 81.9474 H 86 TYR86 0.0643 1372 HE2 125.5860 142.4232 84.6106 H 86 TYR86 0.0643 1373 HH 125.8790 142.4576 82.4082 H 86 TYR86 0.2173 1374 N 121.7780 137.4780 88.5620 N.am 87 PHE87 -0.2453 1375 CA 121.3360 137.0530 89.8820 C.3 87 PHE87 0.0917 1376 C 120.8210 135.5990 89.9210 C.2 87 PHE87 0.2190 1377 O 121.2180 134.8270 90.7920 O.2 87 PHE87 -0.2778 1378 CB 120.2399 138.0109 90.3746 C.3 87 PHE87 -0.0036 1379 CG 119.6915 137.6165 91.7231 C.ar 87 PHE87 -0.0454 1380 CD1 120.4101 137.8804 92.8849 C.ar 87 PHE87 -0.0585 1381 CD2 118.4787 136.9387 91.8189 C.ar 87 PHE87 -0.0585 1382 CE1 119.9230 137.4771 94.1218 C.ar 87 PHE87 -0.0615 1383 CE2 117.9918 136.5293 93.0533 C.ar 87 PHE87 -0.0615 1384 CZ 118.7134 136.8016 94.2068 C.ar 87 PHE87 -0.0617 1385 H 121.3070 138.2760 88.1360 H 87 PHE87 0.1312 1386 HA 122.2082 137.1147 90.5342 H 87 PHE87 0.0560 1387 HB1 119.4241 138.0339 89.6541 H 87 PHE87 0.0333 1388 HB2 120.6302 139.0275 90.4294 H 87 PHE87 0.0333 1389 HD1 121.3589 138.3936 92.8278 H 87 PHE87 0.0620 1390 HD2 117.9186 136.7105 90.9241 H 87 PHE87 0.0620 1391 HE1 120.4891 137.6820 95.0188 H 87 PHE87 0.0618 1392 HE2 117.0546 135.9956 93.1165 H 87 PHE87 0.0618 1393 HZ 118.3383 136.4817 95.1684 H 87 PHE87 0.0618 1394 N 119.9770 135.1720 88.9520 N.am 88 GLN88 -0.2456 1395 CA 119.4730 133.8050 88.8230 C.3 88 GLN88 0.0882 1396 C 120.5550 132.7740 88.5090 C.2 88 GLN88 0.2187 1397 O 120.4780 131.6280 88.9440 O.2 88 GLN88 -0.2778 1398 CB 118.3028 133.7585 87.8279 C.3 88 GLN88 -0.0210 1399 CG 117.0486 134.4869 88.3503 C.3 88 GLN88 0.0225 1400 CD 116.4827 133.8210 89.6171 C.2 88 GLN88 0.1981 1401 OE1 116.4935 132.6084 89.7687 O.2 88 GLN88 -0.2798 1402 NE2 115.9914 134.6847 90.5169 N.am 88 GLN88 -0.2724 1403 H 119.6700 135.8550 88.2600 H 88 GLN88 0.1312 1404 HA 119.1087 133.5355 89.8147 H 88 GLN88 0.0557 1405 HB1 118.0415 132.7221 87.6054 H 88 GLN88 0.0289 1406 HB2 118.6167 134.1994 86.8807 H 88 GLN88 0.0289 1407 HG1 116.2667 134.4791 87.5934 H 88 GLN88 0.0356 1408 HG2 117.2675 135.5310 88.5693 H 88 GLN88 0.0356 1409 HE21 115.5990 134.3244 91.3620 H 88 GLN88 0.1266 1410 HE22 116.0017 135.6706 90.3590 H 88 GLN88 0.1266 1411 N 121.6300 133.1770 87.8020 N.am 89 ASN89 -0.2452 1412 CA 122.7800 132.3190 87.5760 C.3 89 ASN89 0.0957 1413 C 123.8570 132.4650 88.6740 C.2 89 ASN89 0.2191 1414 O 124.8790 131.7890 88.6220 O.2 89 ASN89 -0.2778 1415 CB 123.3844 132.6295 86.1954 C.3 89 ASN89 0.0446 1416 CG 122.4333 132.2076 85.0638 C.2 89 ASN89 0.2000 1417 OD1 121.4294 131.5420 85.2748 O.2 89 ASN89 -0.2797 1418 ND2 122.8082 132.6310 83.8487 N.am 89 ASN89 -0.2723 1419 H 121.6360 134.1190 87.4110 H 89 ASN89 0.1312 1420 HA 122.4475 131.2795 87.6021 H 89 ASN89 0.0562 1421 HB1 124.3236 132.0950 86.0495 H 89 ASN89 0.0375 1422 HB2 123.5950 133.6948 86.1029 H 89 ASN89 0.0375 1423 HD21 122.2314 132.4115 83.0623 H 89 ASN89 0.1266 1424 HD22 123.6390 133.1658 83.7012 H 89 ASN89 0.1266 1425 N 123.6400 133.3080 89.7190 N.am 90 LEU90 -0.2456 1426 CA 124.4920 133.3920 90.9090 C.3 90 LEU90 0.0880 1427 C 123.8520 132.6960 92.0800 C.2 90 LEU90 0.2187 1428 O 124.3000 131.6620 92.5650 O.2 90 LEU90 -0.2778 1429 CB 124.7463 134.8655 91.3037 C.3 90 LEU90 -0.0266 1430 CG 125.5919 135.0573 92.5837 C.3 90 LEU90 -0.0449 1431 CD1 126.8896 134.2330 92.5687 C.3 90 LEU90 -0.0626 1432 CD2 125.8967 136.5437 92.8028 C.3 90 LEU90 -0.0626 1433 H 122.8290 133.9240 89.6720 H 90 LEU90 0.1312 1434 HA 125.4298 132.8757 90.7021 H 90 LEU90 0.0557 1435 HB1 123.7961 135.3882 91.4213 H 90 LEU90 0.0287 1436 HB2 125.2345 135.3893 90.4944 H 90 LEU90 0.0287 1437 HG 125.0075 134.7233 93.4418 H 90 LEU90 0.0296 1438 HD11 127.4933 134.4362 93.4536 H 90 LEU90 0.0232 1439 HD12 127.4950 134.4624 91.6942 H 90 LEU90 0.0232 1440 HD13 126.6902 133.1613 92.5620 H 90 LEU90 0.0232 1441 HD21 126.4476 136.6987 93.7309 H 90 LEU90 0.0232 1442 HD22 124.9778 137.1277 92.8611 H 90 LEU90 0.0232 1443 HD23 126.4977 136.9461 91.9867 H 90 LEU90 0.0232 1444 N 122.7800 133.3060 92.6110 N.am 91 PHE91 -0.2453 1445 CA 122.2770 133.0070 93.9260 C.3 91 PHE91 0.0920 1446 C 121.5460 131.6600 94.0660 C.2 91 PHE91 0.2217 1447 O 121.8630 130.9380 95.0120 O.2 91 PHE91 -0.2776 1448 CB 121.3789 134.1701 94.3937 C.3 91 PHE91 -0.0036 1449 CG 120.6704 133.8701 95.6920 C.ar 91 PHE91 -0.0454 1450 CD1 121.3709 133.8620 96.8945 C.ar 91 PHE91 -0.0585 1451 CD2 119.3210 133.5237 95.6941 C.ar 91 PHE91 -0.0585 1452 CE1 120.7347 133.5115 98.0788 C.ar 91 PHE91 -0.0615 1453 CE2 118.6819 133.1759 96.8768 C.ar 91 PHE91 -0.0615 1454 CZ 119.3896 133.1679 98.0707 C.ar 91 PHE91 -0.0617 1455 H 122.3000 134.0150 92.0560 H 91 PHE91 0.1312 1456 HA 123.1472 132.9580 94.5836 H 91 PHE91 0.0560 1457 HB1 120.6378 134.4137 93.6325 H 91 PHE91 0.0333 1458 HB2 121.9814 135.0702 94.5183 H 91 PHE91 0.0333 1459 HD1 122.4226 134.1087 96.9075 H 91 PHE91 0.0620 1460 HD2 118.7664 133.5043 94.7668 H 91 PHE91 0.0620 1461 HE1 121.2887 133.4997 99.0063 H 91 PHE91 0.0618 1462 HE2 117.6363 132.9041 96.8658 H 91 PHE91 0.0618 1463 HZ 118.8947 132.8926 98.9910 H 91 PHE91 0.0618 1464 N 120.6260 131.1850 93.2350 N.am 92 PRO92 -0.2316 1465 CA 119.8920 129.9670 93.5540 C.3 92 PRO92 0.0907 1466 C 120.7310 128.7290 93.3230 C.2 92 PRO92 0.2189 1467 O 120.4490 127.7020 93.9310 O.2 92 PRO92 -0.2778 1468 CB 118.7114 130.0003 92.5593 C.3 92 PRO92 -0.0276 1469 CG 118.7755 131.3510 91.8427 C.3 92 PRO92 -0.0379 1470 CD 120.2111 131.8408 92.0094 C.3 92 PRO92 0.0071 1471 HA 119.5505 130.0241 94.5880 H 92 PRO92 0.0559 1472 HB1 117.7541 129.8601 93.0623 H 92 PRO92 0.0285 1473 HB2 118.7892 129.2155 91.8064 H 92 PRO92 0.0285 1474 HG1 118.0968 132.0520 92.3302 H 92 PRO92 0.0278 1475 HG2 118.4808 131.2832 90.7952 H 92 PRO92 0.0278 1476 HD1 120.8876 131.4852 91.2345 H 92 PRO92 0.0431 1477 HD2 120.2598 132.9238 92.0960 H 92 PRO92 0.0431 1478 N 121.7480 128.8010 92.4410 N.am 93 ILE93 -0.2454 1479 CA 122.7540 127.7660 92.2160 C.3 93 ILE93 0.0903 1480 C 123.6200 127.6020 93.4510 C.2 93 ILE93 0.2190 1481 O 123.8640 126.4970 93.9280 O.2 93 ILE93 -0.2778 1482 CB 123.5660 128.1527 90.9567 C.3 93 ILE93 -0.0201 1483 CG1 122.6421 128.2963 89.7269 C.3 93 ILE93 -0.0514 1484 CG2 124.7033 127.1570 90.6857 C.3 93 ILE93 -0.0605 1485 CD1 123.3833 128.6145 88.4228 C.3 93 ILE93 -0.0650 1486 H 121.8210 129.6510 91.8830 H 93 ILE93 0.1312 1487 HA 122.2185 126.8296 92.0514 H 93 ILE93 0.0560 1488 HB 124.0234 129.1276 91.1354 H 93 ILE93 0.0318 1489 HG11 121.9172 129.0926 89.8998 H 93 ILE93 0.0266 1490 HG12 122.0627 127.3822 89.5924 H 93 ILE93 0.0266 1491 HG21 125.3220 127.4667 89.8444 H 93 ILE93 0.0233 1492 HG22 124.3190 126.1581 90.4788 H 93 ILE93 0.0233 1493 HG23 125.3665 127.0936 91.5436 H 93 ILE93 0.0233 1494 HD11 122.6803 128.8571 87.6258 H 93 ILE93 0.0230 1495 HD12 123.9739 127.7635 88.0863 H 93 ILE93 0.0230 1496 HD13 124.0557 129.4613 88.5471 H 93 ILE93 0.0230 1497 N 124.0240 128.7290 94.0710 N.am 94 THR94 -0.2434 1498 CA 124.6090 128.7420 95.4080 C.3 94 THR94 0.1135 1499 C 123.7070 128.1070 96.4340 C.2 94 THR94 0.2212 1500 O 124.1460 127.2590 97.2040 O.2 94 THR94 -0.2777 1501 CB 124.8242 130.1987 95.9031 C.3 94 THR94 0.0763 1502 OG1 125.6498 130.9512 95.0360 O.3 94 THR94 -0.3900 1503 CG2 125.4233 130.2818 97.3139 C.3 94 THR94 -0.0370 1504 H 123.9150 129.6170 93.5810 H 94 THR94 0.1313 1505 HA 125.5535 128.1980 95.3588 H 94 THR94 0.0583 1506 HB 123.8660 130.7123 95.9971 H 94 THR94 0.0611 1507 HG1 125.2323 131.0290 94.1819 H 94 THR94 0.2098 1508 HG21 125.5005 131.3176 97.6303 H 94 THR94 0.0255 1509 HG22 126.4090 129.8363 97.3503 H 94 THR94 0.0255 1510 HG23 124.8094 129.7814 98.0621 H 94 THR94 0.0255 1511 N 122.4050 128.4680 96.4260 N.am 95 ALA95 -0.2458 1512 CA 121.3870 127.9110 97.2990 C.3 95 ALA95 0.0850 1513 C 121.2300 126.3930 97.1750 C.2 95 ALA95 0.2184 1514 O 120.9820 125.7060 98.1610 O.2 95 ALA95 -0.2778 1515 CB 120.0396 128.6087 97.0719 C.3 95 ALA95 -0.0411 1516 H 122.1160 129.1830 95.7590 H 95 ALA95 0.1312 1517 HA 121.7198 128.1323 98.3119 H 95 ALA95 0.0554 1518 HB1 119.3217 128.3300 97.8449 H 95 ALA95 0.0249 1519 HB2 119.5988 128.3407 96.1140 H 95 ALA95 0.0249 1520 HB3 120.1511 129.6930 97.1000 H 95 ALA95 0.0249 1521 N 121.4100 125.8290 95.9660 N.am 96 MET96 -0.2456 1522 CA 121.5720 124.4000 95.7680 C.3 96 MET96 0.0885 1523 C 122.8560 123.7970 96.3290 C.2 96 MET96 0.2187 1524 O 122.8590 122.7180 96.9060 O.2 96 MET96 -0.2778 1525 CB 121.5258 124.1048 94.2584 C.3 96 MET96 -0.0199 1526 CG 120.1636 124.3798 93.6105 C.3 96 MET96 -0.0047 1527 SD 120.2984 124.4038 91.8125 S.3 96 MET96 -0.1641 1528 CE 120.4925 122.6412 91.4982 C.3 96 MET96 -0.0181 1529 H 121.4340 126.4370 95.1470 H 96 MET96 0.1312 1530 HA 120.7279 123.9154 96.2601 H 96 MET96 0.0557 1531 HB1 121.7918 123.0632 94.0744 H 96 MET96 0.0293 1532 HB2 122.2843 124.6978 93.7503 H 96 MET96 0.0293 1533 HG1 119.7396 125.3284 93.9365 H 96 MET96 0.0377 1534 HG2 119.4513 123.6084 93.9043 H 96 MET96 0.0377 1535 HE1 119.6086 122.2488 90.9954 H 96 MET96 0.0340 1536 HE2 120.6693 122.0868 92.4177 H 96 MET96 0.0340 1537 HE3 121.3489 122.4832 90.8437 H 96 MET96 0.0340 1538 N 124.0190 124.4430 96.1320 N.am 97 PHE97 -0.2453 1539 CA 125.2830 123.9200 96.6340 C.3 97 PHE97 0.0917 1540 C 125.4080 123.9540 98.1310 C.2 97 PHE97 0.2190 1541 O 125.8540 123.0000 98.7650 O.2 97 PHE97 -0.2778 1542 CB 126.4529 124.7016 96.0042 C.3 97 PHE97 -0.0036 1543 CG 126.5168 124.6798 94.4939 C.ar 97 PHE97 -0.0454 1544 CD1 125.9078 123.6859 93.7254 C.ar 97 PHE97 -0.0585 1545 CD2 127.2584 125.6604 93.8413 C.ar 97 PHE97 -0.0585 1546 CE1 126.0350 123.6793 92.3428 C.ar 97 PHE97 -0.0615 1547 CE2 127.4106 125.6384 92.4622 C.ar 97 PHE97 -0.0615 1548 CZ 126.7978 124.6485 91.7104 C.ar 97 PHE97 -0.0617 1549 H 124.0160 125.3230 95.6170 H 97 PHE97 0.1312 1550 HA 125.3370 122.8687 96.3475 H 97 PHE97 0.0560 1551 HB1 127.4016 124.3092 96.3722 H 97 PHE97 0.0333 1552 HB2 126.4044 125.7438 96.3227 H 97 PHE97 0.0333 1553 HD1 125.3318 122.8971 94.1835 H 97 PHE97 0.0620 1554 HD2 127.7421 126.4407 94.4106 H 97 PHE97 0.0620 1555 HE1 125.5576 122.9052 91.7606 H 97 PHE97 0.0618 1556 HE2 127.9974 126.3998 91.9701 H 97 PHE97 0.0618 1557 HZ 126.9052 124.6429 90.6356 H 97 PHE97 0.0618 1558 N 124.9670 125.0610 98.7420 N.am 98 VAL98 -0.2454 1559 CA 124.8990 125.1940 100.1730 C.3 98 VAL98 0.0901 1560 C 123.9590 124.1510 100.7830 C.2 98 VAL98 0.2190 1561 O 124.3000 123.5590 101.7970 O.2 98 VAL98 -0.2778 1562 CB 124.5962 126.6553 100.5400 C.3 98 VAL98 -0.0227 1563 CG1 123.1126 127.0013 100.4876 C.3 98 VAL98 -0.0608 1564 CG2 125.1753 126.9881 101.9076 C.3 98 VAL98 -0.0608 1565 H 124.6650 125.8470 98.1660 H 98 VAL98 0.1312 1566 HA 125.9039 124.9522 100.5233 H 98 VAL98 0.0560 1567 HB 125.1023 127.2956 99.8164 H 98 VAL98 0.0315 1568 HG11 122.9500 128.0765 100.5477 H 98 VAL98 0.0233 1569 HG12 122.5971 126.5365 101.3229 H 98 VAL98 0.0233 1570 HG13 122.6702 126.6385 99.5663 H 98 VAL98 0.0233 1571 HG21 124.8693 127.9751 102.2262 H 98 VAL98 0.0233 1572 HG22 126.2621 126.9796 101.8563 H 98 VAL98 0.0233 1573 HG23 124.8415 126.2792 102.6659 H 98 VAL98 0.0233 1574 N 122.7760 123.8490 100.1740 N.am 99 SER99 -0.2436 1575 CA 121.8140 122.8810 100.7080 C.3 99 SER99 0.1109 1576 C 122.4030 121.4920 100.8060 C.2 99 SER99 0.2209 1577 O 122.3670 120.8530 101.8560 O.2 99 SER99 -0.2777 1578 CB 120.5082 122.8774 99.8873 C.3 99 SER99 0.0681 1579 OG 120.7222 122.8601 98.4883 O.3 99 SER99 -0.3930 1580 H 122.5490 124.3230 99.3000 H 99 SER99 0.1312 1581 HA 121.5833 123.2018 101.7245 H 99 SER99 0.0580 1582 HB1 119.9307 123.7762 100.1074 H 99 SER99 0.0577 1583 HB2 119.8606 122.0423 100.1725 H 99 SER99 0.0577 1584 HG 121.3265 122.1604 98.2743 H 99 SER99 0.2095 1585 N 123.0690 121.0450 99.7240 N.am 100 ILE100 -0.2453 1586 CA 123.7640 119.7710 99.6510 C.3 100 ILE100 0.0903 1587 C 124.8830 119.6890 100.6820 C.2 100 ILE100 0.2189 1588 O 124.9730 118.7310 101.4460 O.2 100 ILE100 -0.2778 1589 CB 124.2676 119.5267 98.2055 C.3 100 ILE100 -0.0201 1590 CG1 123.0754 119.3158 97.2483 C.3 100 ILE100 -0.0514 1591 CG2 125.2409 118.3325 98.1099 C.3 100 ILE100 -0.0605 1592 CD1 123.4449 119.3817 95.7624 C.3 100 ILE100 -0.0650 1593 H 123.0870 121.6430 98.8980 H 100 ILE100 0.1312 1594 HA 123.0310 119.0071 99.9167 H 100 ILE100 0.0560 1595 HB 124.8056 120.4219 97.8879 H 100 ILE100 0.0318 1596 HG11 122.3126 120.0690 97.4261 H 100 ILE100 0.0266 1597 HG12 122.5968 118.3612 97.4655 H 100 ILE100 0.0266 1598 HG21 125.5708 118.1635 97.0854 H 100 ILE100 0.0233 1599 HG22 124.7718 117.4139 98.4637 H 100 ILE100 0.0233 1600 HG23 126.1431 118.4937 98.7001 H 100 ILE100 0.0233 1601 HD11 122.5528 119.2954 95.1413 H 100 ILE100 0.0230 1602 HD12 124.1176 118.5735 95.4774 H 100 ILE100 0.0230 1603 HD13 123.9235 120.3317 95.5230 H 100 ILE100 0.0230 1604 N 125.7230 120.7380 100.8060 N.am 101 TYR101 -0.2453 1605 CA 126.7380 120.8220 101.8460 C.3 101 TYR101 0.0917 1606 C 126.1920 120.8750 103.2750 C.2 101 TYR101 0.2191 1607 O 126.7370 120.2410 104.1770 O.2 101 TYR101 -0.2778 1608 CB 127.5926 122.0895 101.6371 C.3 101 TYR101 -0.0036 1609 CG 128.3103 122.2044 100.3120 C.ar 101 TYR101 -0.0453 1610 CD1 128.7077 121.0888 99.5741 C.ar 101 TYR101 -0.0561 1611 CD2 128.6097 123.4725 99.8157 C.ar 101 TYR101 -0.0561 1612 CE1 129.3707 121.2423 98.3621 C.ar 101 TYR101 -0.0317 1613 CE2 129.2556 123.6263 98.5969 C.ar 101 TYR101 -0.0317 1614 CZ 129.6456 122.5107 97.8742 C.ar 101 TYR101 0.0726 1615 OH 130.3134 122.6601 96.6770 O.3 101 TYR101 -0.3598 1616 H 125.6430 121.5070 100.1410 H 101 TYR101 0.1312 1617 HA 127.3504 119.9252 101.7715 H 101 TYR101 0.0560 1618 HB1 128.3446 122.1681 102.4226 H 101 TYR101 0.0333 1619 HB2 126.9433 122.9596 101.7397 H 101 TYR101 0.0333 1620 HD1 128.5053 120.0886 99.9245 H 101 TYR101 0.0621 1621 HD2 128.3188 124.3546 100.3677 H 101 TYR101 0.0621 1622 HE1 129.6743 120.3760 97.7925 H 101 TYR101 0.0643 1623 HE2 129.4611 124.6146 98.2139 H 101 TYR101 0.0643 1624 HH 130.3861 123.5808 96.4623 H 101 TYR101 0.2173 1625 N 125.0820 121.5920 103.5310 N.am 102 SER102 -0.2436 1626 CA 124.3820 121.5680 104.8130 C.3 102 SER102 0.1109 1627 C 123.8370 120.2040 105.1950 C.2 102 SER102 0.2209 1628 O 123.9480 119.7780 106.3420 O.2 102 SER102 -0.2777 1629 CB 123.2343 122.5897 104.7693 C.3 102 SER102 0.0681 1630 OG 123.7679 123.9012 104.6288 O.3 102 SER102 -0.3930 1631 H 124.7090 122.1850 102.7890 H 102 SER102 0.1312 1632 HA 125.1072 121.8664 105.5705 H 102 SER102 0.0580 1633 HB1 122.6577 122.5469 105.6980 H 102 SER102 0.0577 1634 HB2 122.5583 122.3421 103.9406 H 102 SER102 0.0577 1635 HG 123.0885 124.5261 104.3801 H 102 SER102 0.2095 1636 N 123.2540 119.4580 104.2360 N.am 103 MET103 -0.2456 1637 CA 122.8400 118.0780 104.4250 C.3 103 MET103 0.0886 1638 C 124.0110 117.1510 104.7590 C.2 103 MET103 0.2188 1639 O 123.9240 116.3210 105.6650 O.2 103 MET103 -0.2778 1640 CB 122.1477 117.6166 103.1303 C.3 103 MET103 -0.0199 1641 CG 121.5846 116.1876 103.1955 C.3 103 MET103 -0.0047 1642 SD 121.0631 115.6061 101.5712 S.3 103 MET103 -0.1641 1643 CE 122.6846 115.4260 100.7968 C.3 103 MET103 -0.0181 1644 H 123.0940 119.8870 103.3250 H 103 MET103 0.1312 1645 HA 122.1356 118.0669 105.2563 H 103 MET103 0.0557 1646 HB1 122.8524 117.6924 102.3025 H 103 MET103 0.0293 1647 HB2 121.3377 118.3060 102.8871 H 103 MET103 0.0293 1648 HG1 120.7454 116.1276 103.8883 H 103 MET103 0.0377 1649 HG2 122.3406 115.4940 103.5627 H 103 MET103 0.0377 1650 HE1 122.7211 114.4906 100.2394 H 103 MET103 0.0340 1651 HE2 123.4824 115.3971 101.5392 H 103 MET103 0.0340 1652 HE3 122.8651 116.2444 100.0995 H 103 MET103 0.0340 1653 N 125.1620 117.3220 104.0680 N.am 104 THR104 -0.2434 1654 CA 126.4310 116.6460 104.3750 C.3 104 THR104 0.1135 1655 C 126.9350 116.9410 105.7830 C.2 104 THR104 0.2212 1656 O 127.3710 116.0420 106.5000 O.2 104 THR104 -0.2777 1657 CB 127.4754 117.0318 103.3163 C.3 104 THR104 0.0763 1658 OG1 126.8798 116.8078 102.0489 O.3 104 THR104 -0.3900 1659 CG2 128.7575 116.1895 103.4025 C.3 104 THR104 -0.0370 1660 H 125.1480 117.9660 103.2770 H 104 THR104 0.1313 1661 HA 126.2228 115.5778 104.3071 H 104 THR104 0.0583 1662 HB 127.7203 118.0926 103.4551 H 104 THR104 0.0611 1663 HG1 127.3006 117.3262 101.3733 H 104 THR104 0.2098 1664 HG21 129.4727 116.4774 102.6320 H 104 THR104 0.0255 1665 HG22 128.5367 115.1301 103.2684 H 104 THR104 0.0255 1666 HG23 129.2501 116.3088 104.3674 H 104 THR104 0.0255 1667 N 126.8500 118.2120 106.2390 N.am 105 ALA105 -0.2458 1668 CA 127.1370 118.6110 107.6090 C.3 105 ALA105 0.0850 1669 C 126.2190 117.9410 108.6450 C.2 105 ALA105 0.2184 1670 O 126.6810 117.3860 109.6340 O.2 105 ALA105 -0.2778 1671 CB 127.0449 120.1389 107.7178 C.3 105 ALA105 -0.0411 1672 H 126.5670 118.9370 105.5800 H 105 ALA105 0.1312 1673 HA 128.1592 118.2897 107.8139 H 105 ALA105 0.0554 1674 HB1 127.3384 120.4841 108.7101 H 105 ALA105 0.0249 1675 HB2 126.0334 120.4967 107.5279 H 105 ALA105 0.0249 1676 HB3 127.7034 120.6184 106.9934 H 105 ALA105 0.0249 1677 N 124.8930 117.8860 108.4040 N.am 106 ILE106 -0.2454 1678 CA 123.9380 117.1640 109.2530 C.3 106 ILE106 0.0903 1679 C 124.2070 115.6690 109.3570 C.2 106 ILE106 0.2189 1680 O 124.0660 115.0510 110.4150 O.2 106 ILE106 -0.2778 1681 CB 122.5316 117.4918 108.7036 C.3 106 ILE106 -0.0201 1682 CG1 122.1771 118.9720 108.9404 C.3 106 ILE106 -0.0514 1683 CG2 121.4407 116.5862 109.2798 C.3 106 ILE106 -0.0605 1684 CD1 121.0555 119.4712 108.0289 C.3 106 ILE106 -0.0650 1685 H 124.5330 118.3740 107.5840 H 106 ILE106 0.1312 1686 HA 124.0477 117.5758 110.2580 H 106 ILE106 0.0560 1687 HB 122.5584 117.3231 107.6258 H 106 ILE106 0.0318 1688 HG11 123.0468 119.5946 108.7461 H 106 ILE106 0.0266 1689 HG12 121.9156 119.1368 109.9863 H 106 ILE106 0.0266 1690 HG21 120.4549 116.8570 108.9042 H 106 ILE106 0.0233 1691 HG22 121.4184 116.6409 110.3685 H 106 ILE106 0.0233 1692 HG23 121.6229 115.5541 108.9872 H 106 ILE106 0.0233 1693 HD11 120.8352 120.5178 108.2183 H 106 ILE106 0.0230 1694 HD12 120.1306 118.9122 108.1616 H 106 ILE106 0.0230 1695 HD13 121.3621 119.3940 106.9879 H 106 ILE106 0.0230 1696 N 124.6040 115.0300 108.2400 N.am 107 ALA107 -0.2459 1697 CA 125.0670 113.6580 108.2300 C.3 107 ALA107 0.0850 1698 C 126.3380 113.4460 109.0630 C.2 107 ALA107 0.2184 1699 O 126.4450 112.4700 109.8080 O.2 107 ALA107 -0.2778 1700 CB 125.2885 113.2172 106.7774 C.3 107 ALA107 -0.0411 1701 H 124.5770 115.5380 107.3560 H 107 ALA107 0.1312 1702 HA 124.2727 113.0722 108.6853 H 107 ALA107 0.0554 1703 HB1 125.5909 112.1709 106.7190 H 107 ALA107 0.0249 1704 HB2 126.0606 113.8151 106.2925 H 107 ALA107 0.0249 1705 HB3 124.3739 113.3302 106.1949 H 107 ALA107 0.0249 1706 N 127.3030 114.3930 108.9910 N.am 108 ALA108 -0.2459 1707 CA 128.4950 114.4410 109.8220 C.3 108 ALA108 0.0850 1708 C 128.1800 114.5630 111.3210 C.2 108 ALA108 0.2184 1709 O 128.7360 113.8130 112.1260 O.2 108 ALA108 -0.2778 1710 CB 129.4062 115.5808 109.3523 C.3 108 ALA108 -0.0411 1711 H 127.1840 115.1320 108.2980 H 108 ALA108 0.1312 1712 HA 129.0032 113.4877 109.6711 H 108 ALA108 0.0554 1713 HB1 130.3587 115.5652 109.8828 H 108 ALA108 0.0249 1714 HB2 128.9542 116.5576 109.5161 H 108 ALA108 0.0249 1715 HB3 129.6189 115.4912 108.2869 H 108 ALA108 0.0249 1716 N 127.2240 115.4470 111.7200 N.am 109 ASP109 -0.2451 1717 CA 126.7350 115.5730 113.0930 C.3 109 ASP109 0.0974 1718 C 126.1670 114.2570 113.6270 C.2 109 ASP109 0.2192 1719 O 126.4860 113.8210 114.7320 O.2 109 ASP109 -0.2778 1720 CB 125.6870 116.7095 113.1253 C.3 109 ASP109 0.0576 1721 CG 125.7475 117.5610 114.4041 C.2 109 ASP109 0.1780 1722 OD1 126.8342 117.8531 114.8799 O.co2 109 ASP109 -0.6478 1723 OD2 124.7167 117.9623 114.9350 O.co2 109 ASP109 -0.6478 1724 H 126.8220 116.0630 111.0130 H 109 ASP109 0.1312 1725 HA 127.6154 115.8255 113.6864 H 109 ASP109 0.0563 1726 HB1 124.6732 116.3374 112.9792 H 109 ASP109 0.0394 1727 HB2 125.8751 117.4025 112.3059 H 109 ASP109 0.0394 1728 N 125.3240 113.5710 112.8260 N.am 110 ARG110 -0.2456 1729 CA 124.7550 112.2740 113.1570 C.3 110 ARG110 0.0879 1730 C 125.8180 111.1950 113.3320 C.2 110 ARG110 0.2187 1731 O 125.7630 110.4030 114.2690 O.2 110 ARG110 -0.2778 1732 CB 123.7373 111.9099 112.0621 C.3 110 ARG110 -0.0258 1733 CG 122.5225 112.8519 112.0985 C.3 110 ARG110 -0.0154 1734 CD 121.6492 112.8080 110.8400 C.3 110 ARG110 0.1045 1735 NE 120.5781 113.7900 111.0133 N.pl3 110 ARG110 -0.4450 1736 CZ 119.6881 114.1333 110.0885 C.cat 110 ARG110 0.5062 1737 NH1 119.6811 113.5813 108.9039 N.pl3 110 ARG110 -0.4573 1738 NH2 118.8110 115.0570 110.3772 N.pl3 110 ARG110 -0.4573 1739 H 125.0700 113.9890 111.9310 H 110 ARG110 0.1312 1740 HA 124.2538 112.3897 114.1196 H 110 ARG110 0.0557 1741 HB1 123.3977 110.8796 112.1808 H 110 ARG110 0.0286 1742 HB2 124.2244 111.9655 111.0876 H 110 ARG110 0.0286 1743 HG1 122.8531 113.8810 112.2396 H 110 ARG110 0.0299 1744 HG2 121.9189 112.6171 112.9758 H 110 ARG110 0.0299 1745 HD1 121.2068 111.8206 110.6904 H 110 ARG110 0.0711 1746 HD2 122.2321 113.0802 109.9557 H 110 ARG110 0.0711 1747 HE 120.5295 114.2556 111.8967 H 110 ARG110 0.3153 1748 HH11 118.9992 113.8500 108.2277 H 110 ARG110 0.3114 1749 HH12 120.3701 112.8932 108.6715 H 110 ARG110 0.3114 1750 HH21 118.1414 115.3736 109.7039 H 110 ARG110 0.3114 1751 HH22 118.8112 115.4738 111.2826 H 110 ARG110 0.3114 1752 N 126.8440 111.1610 112.4580 N.am 111 TYR111 -0.2453 1753 CA 127.9650 110.2490 112.5830 C.3 111 TYR111 0.0917 1754 C 128.7870 110.4910 113.8410 C.2 111 TYR111 0.2190 1755 O 129.0580 109.5620 114.5960 O.2 111 TYR111 -0.2778 1756 CB 128.8426 110.4329 111.3352 C.3 111 TYR111 -0.0036 1757 CG 129.9868 109.4570 111.2792 C.ar 111 TYR111 -0.0453 1758 CD1 129.8212 108.2054 110.6991 C.ar 111 TYR111 -0.0561 1759 CD2 131.2254 109.7952 111.8136 C.ar 111 TYR111 -0.0561 1760 CE1 130.8835 107.3135 110.6410 C.ar 111 TYR111 -0.0317 1761 CE2 132.2793 108.8916 111.7885 C.ar 111 TYR111 -0.0317 1762 CZ 132.1074 107.6484 111.1983 C.ar 111 TYR111 0.0726 1763 OH 133.1467 106.7423 111.1628 O.3 111 TYR111 -0.3598 1764 H 126.8310 111.8090 111.6700 H 111 TYR111 0.1312 1765 HA 127.5630 109.2377 112.6382 H 111 TYR111 0.0560 1766 HB1 129.2357 111.4493 111.2914 H 111 TYR111 0.0333 1767 HB2 128.2340 110.3184 110.4412 H 111 TYR111 0.0333 1768 HD1 128.8639 107.9238 110.2865 H 111 TYR111 0.0621 1769 HD2 131.3585 110.7654 112.2671 H 111 TYR111 0.0621 1770 HE1 130.7606 106.3508 110.1732 H 111 TYR111 0.0643 1771 HE2 133.2312 109.1572 112.2232 H 111 TYR111 0.0643 1772 HH 133.9193 107.1249 111.5558 H 111 TYR111 0.2173 1773 N 129.1510 111.7540 114.1350 N.am 112 MET112 -0.2456 1774 CA 129.8630 112.0890 115.3540 C.3 112 MET112 0.0885 1775 C 129.0690 111.7830 116.6190 C.2 112 MET112 0.2187 1776 O 129.5780 111.1400 117.5320 O.2 112 MET112 -0.2778 1777 CB 130.1964 113.5908 115.3129 C.3 112 MET112 -0.0199 1778 CG 131.2708 113.9509 114.2787 C.3 112 MET112 -0.0047 1779 SD 132.9255 113.5226 114.8643 S.3 112 MET112 -0.1641 1780 CE 133.2718 112.1057 113.8092 C.3 112 MET112 -0.0181 1781 H 128.9180 112.5000 113.4790 H 112 MET112 0.1312 1782 HA 130.7732 111.4904 115.3810 H 112 MET112 0.0557 1783 HB1 130.5319 113.9380 116.2917 H 112 MET112 0.0293 1784 HB2 129.2852 114.1502 115.0919 H 112 MET112 0.0293 1785 HG1 131.2518 115.0292 114.1189 H 112 MET112 0.0377 1786 HG2 131.0742 113.5023 113.3049 H 112 MET112 0.0377 1787 HE1 134.3168 111.8107 113.9014 H 112 MET112 0.0340 1788 HE2 133.0771 112.3580 112.7669 H 112 MET112 0.0340 1789 HE3 132.6339 111.2670 114.0817 H 112 MET112 0.0340 1790 N 127.7740 112.1530 116.6620 N.am 113 ALA113 -0.2459 1791 CA 126.9030 111.9080 117.7920 C.3 113 ALA113 0.0850 1792 C 126.6010 110.4380 118.0960 C.2 113 ALA113 0.2184 1793 O 126.4790 110.0510 119.2540 O.2 113 ALA113 -0.2778 1794 CB 125.5909 112.6603 117.5417 C.3 113 ALA113 -0.0411 1795 H 127.3850 112.6340 115.8510 H 113 ALA113 0.1312 1796 HA 127.4061 112.3281 118.6646 H 113 ALA113 0.0554 1797 HB1 124.9113 112.5727 118.3899 H 113 ALA113 0.0249 1798 HB2 125.0801 112.2795 116.6562 H 113 ALA113 0.0249 1799 HB3 125.7802 113.7218 117.3793 H 113 ALA113 0.0249 1800 N 126.4330 109.5890 117.0610 N.am 114 ILE114 -0.2454 1801 CA 126.0870 108.1830 117.2400 C.3 114 ILE114 0.0903 1802 C 127.3010 107.2740 117.3780 C.2 114 ILE114 0.2189 1803 O 127.3550 106.4280 118.2680 O.2 114 ILE114 -0.2778 1804 CB 125.1818 107.7486 116.0605 C.3 114 ILE114 -0.0201 1805 CG1 123.9081 108.6230 115.9740 C.3 114 ILE114 -0.0514 1806 CG2 124.8066 106.2577 116.1596 C.3 114 ILE114 -0.0605 1807 CD1 123.1930 108.5355 114.6202 C.3 114 ILE114 -0.0650 1808 H 126.5530 109.9450 116.1130 H 114 ILE114 0.1312 1809 HA 125.5168 108.0990 118.1665 H 114 ILE114 0.0560 1810 HB 125.7472 107.8946 115.1381 H 114 ILE114 0.0318 1811 HG11 124.1477 109.6738 116.1334 H 114 ILE114 0.0266 1812 HG12 123.2208 108.3558 116.7769 H 114 ILE114 0.0266 1813 HG21 124.0898 105.9669 115.3957 H 114 ILE114 0.0233 1814 HG22 124.3628 106.0362 117.1296 H 114 ILE114 0.0233 1815 HG23 125.6784 105.6145 116.0377 H 114 ILE114 0.0233 1816 HD11 122.3632 109.2405 114.5751 H 114 ILE114 0.0230 1817 HD12 122.7885 107.5432 114.4427 H 114 ILE114 0.0230 1818 HD13 123.8712 108.7709 113.8001 H 114 ILE114 0.0230 1819 N 128.3110 107.4030 116.4890 N.am 115 VAL115 -0.2454 1820 CA 129.5090 106.5670 116.5050 C.3 115 VAL115 0.0901 1821 C 130.4130 106.8780 117.6870 C.2 115 VAL115 0.2189 1822 O 130.9320 105.9740 118.3400 O.2 115 VAL115 -0.2778 1823 CB 130.2257 106.6500 115.1399 C.3 115 VAL115 -0.0227 1824 CG1 131.4225 105.6891 115.0589 C.3 115 VAL115 -0.0608 1825 CG2 129.2555 106.3599 113.9804 C.3 115 VAL115 -0.0608 1826 H 128.2330 108.1220 115.7690 H 115 VAL115 0.1312 1827 HA 129.1577 105.5434 116.6435 H 115 VAL115 0.0560 1828 HB 130.6037 107.6631 115.0080 H 115 VAL115 0.0315 1829 HG11 131.9361 105.7863 114.1019 H 115 VAL115 0.0233 1830 HG12 131.1010 104.6526 115.1617 H 115 VAL115 0.0233 1831 HG13 132.1534 105.8872 115.8421 H 115 VAL115 0.0233 1832 HG21 129.7821 106.3492 113.0279 H 115 VAL115 0.0233 1833 HG22 128.4695 107.1112 113.9034 H 115 VAL115 0.0233 1834 HG23 128.7778 105.3871 114.0992 H 115 VAL115 0.0233 1835 N 130.5940 108.1750 118.0160 N.am 116 HIS116 -0.2453 1836 CA 131.4630 108.5980 119.1030 C.3 116 HIS116 0.0934 1837 C 130.7410 109.4450 120.1590 C.2 116 HIS116 0.2217 1838 O 131.0840 110.6160 120.3170 O.2 116 HIS116 -0.2776 1839 CB 132.5911 109.4523 118.4891 C.3 116 HIS116 0.0146 1840 CG 133.2814 108.7278 117.3562 C.ar 116 HIS116 0.0551 1841 ND1 134.3186 107.8793 117.5165 N.ar 116 HIS116 -0.2469 1842 CD2 133.0086 108.8364 115.9827 C.ar 116 HIS116 0.0047 1843 CE1 134.6480 107.4625 116.2819 C.ar 116 HIS116 0.0737 1844 NE2 133.8743 108.0242 115.3341 N.ar 116 HIS116 -0.2539 1845 H 130.1000 108.8890 117.4800 H 116 HIS116 0.1312 1846 HA 131.8942 107.7253 119.5947 H 116 HIS116 0.0561 1847 HB1 133.3323 109.7064 119.2443 H 116 HIS116 0.0348 1848 HB2 132.1978 110.3903 118.0934 H 116 HIS116 0.0348 1849 HD2 132.2289 109.4402 115.5416 H 116 HIS116 0.0764 1850 HE1 135.4383 106.7530 116.0813 H 116 HIS116 0.0963 1851 HE2 133.9197 107.8636 114.3691 H 116 HIS116 0.1339 1852 N 129.7780 108.9370 120.9340 N.am 117 PRO117 -0.2316 1853 CA 128.8690 109.7570 121.7330 C.3 117 PRO117 0.0907 1854 C 129.5180 110.3520 122.9670 C.2 117 PRO117 0.2189 1855 O 129.0350 111.3570 123.4780 O.2 117 PRO117 -0.2778 1856 CB 127.7744 108.7550 122.1220 C.3 117 PRO117 -0.0276 1857 CG 128.4737 107.3973 122.1247 C.3 117 PRO117 -0.0379 1858 CD 129.5124 107.5038 121.0090 C.3 117 PRO117 0.0071 1859 HA 128.4809 110.5617 121.1058 H 117 PRO117 0.0559 1860 HB1 127.0037 108.7518 121.3515 H 117 PRO117 0.0285 1861 HB2 127.2830 108.9817 123.0692 H 117 PRO117 0.0285 1862 HG1 127.7848 106.5658 121.9781 H 117 PRO117 0.0278 1863 HG2 128.9760 107.2524 123.0810 H 117 PRO117 0.0278 1864 HD1 130.4336 106.9602 121.2242 H 117 PRO117 0.0431 1865 HD2 129.0945 107.1946 120.0515 H 117 PRO117 0.0431 1866 N 130.5790 109.7100 123.4980 N.am 118 PHE118 -0.2453 1867 CA 131.3340 110.1900 124.6440 C.3 118 PHE118 0.0917 1868 C 132.2140 111.3810 124.3070 C.2 118 PHE118 0.2190 1869 O 132.5680 112.1740 125.1780 O.2 118 PHE118 -0.2778 1870 CB 132.2063 109.0453 125.1844 C.3 118 PHE118 -0.0036 1871 CG 131.4060 107.7940 125.4362 C.ar 118 PHE118 -0.0454 1872 CD1 130.5404 107.7184 126.5228 C.ar 118 PHE118 -0.0585 1873 CD2 131.5103 106.7021 124.5785 C.ar 118 PHE118 -0.0585 1874 CE1 129.7903 106.5717 126.7491 C.ar 118 PHE118 -0.0615 1875 CE2 130.7626 105.5537 124.8030 C.ar 118 PHE118 -0.0615 1876 CZ 129.9014 105.4878 125.8893 C.ar 118 PHE118 -0.0617 1877 H 130.8700 108.8320 123.0680 H 118 PHE118 0.1312 1878 HA 130.6093 110.5041 125.3967 H 118 PHE118 0.0560 1879 HB1 132.6886 109.3468 126.1152 H 118 PHE118 0.0333 1880 HB2 133.0092 108.8168 124.4814 H 118 PHE118 0.0333 1881 HD1 130.4445 108.5597 127.1939 H 118 PHE118 0.0620 1882 HD2 132.1716 106.7455 123.7251 H 118 PHE118 0.0620 1883 HE1 129.1209 106.5244 127.5955 H 118 PHE118 0.0618 1884 HE2 130.8515 104.7134 124.1302 H 118 PHE118 0.0618 1885 HZ 129.3209 104.5946 126.0665 H 118 PHE118 0.0618 1886 N 132.5970 111.5320 123.0250 N.am 119 GLN119 -0.2456 1887 CA 133.3320 112.6860 122.5570 C.3 119 GLN119 0.0885 1888 C 132.4610 113.9400 122.5820 C.2 119 GLN119 0.2214 1889 O 131.2800 113.8590 122.2450 O.2 119 GLN119 -0.2776 1890 CB 133.8351 112.4336 121.1251 C.3 119 GLN119 -0.0210 1891 CG 134.7849 111.2302 121.0076 C.3 119 GLN119 0.0225 1892 CD 136.0567 111.4278 121.8413 C.2 119 GLN119 0.1981 1893 OE1 136.2443 110.8171 122.8836 O.2 119 GLN119 -0.2798 1894 NE2 136.9150 112.3163 121.3192 N.am 119 GLN119 -0.2724 1895 H 132.3580 110.8010 122.3550 H 119 GLN119 0.1312 1896 HA 134.1705 112.8053 123.2425 H 119 GLN119 0.0557 1897 HB1 134.3360 113.3267 120.7476 H 119 GLN119 0.0289 1898 HB2 132.9818 112.2742 120.4650 H 119 GLN119 0.0289 1899 HG1 135.0760 111.0795 119.9682 H 119 GLN119 0.0356 1900 HG2 134.2958 110.3137 121.3372 H 119 GLN119 0.0356 1901 HE21 137.7713 112.5016 121.7995 H 119 GLN119 0.1266 1902 HE22 136.7142 112.7929 120.4645 H 119 GLN119 0.1266 1903 N 132.9470 115.1150 122.9660 N.am 120 PRO120 -0.2316 1904 CA 132.1340 116.3160 122.9810 C.3 120 PRO120 0.0907 1905 C 131.7800 116.7730 121.5810 C.2 120 PRO120 0.2189 1906 O 132.4800 116.4760 120.6140 O.2 120 PRO120 -0.2778 1907 CB 133.0337 117.3308 123.6980 C.3 120 PRO120 -0.0276 1908 CG 134.4572 116.8358 123.4495 C.3 120 PRO120 -0.0379 1909 CD 134.3300 115.3139 123.3861 C.3 120 PRO120 0.0071 1910 HA 131.2229 116.1106 123.5456 H 120 PRO120 0.0559 1911 HB1 132.8281 117.2930 124.7682 H 120 PRO120 0.0285 1912 HB2 132.8828 118.3621 123.3749 H 120 PRO120 0.0285 1913 HG1 135.1617 117.1692 124.2115 H 120 PRO120 0.0278 1914 HG2 134.8042 117.2099 122.4855 H 120 PRO120 0.0278 1915 HD1 135.0107 114.8654 122.6604 H 120 PRO120 0.0431 1916 HD2 134.4442 114.8464 124.3658 H 120 PRO120 0.0431 1917 N 130.6570 117.4970 121.4650 N.am 121 ARG121 -0.2456 1918 CA 130.1820 118.0530 120.2210 C.3 121 ARG121 0.0879 1919 C 131.0450 119.2210 119.7610 C.2 121 ARG121 0.2187 1920 O 131.7830 119.8210 120.5380 O.2 121 ARG121 -0.2778 1921 CB 128.6710 118.3809 120.2503 C.3 121 ARG121 -0.0258 1922 CG 128.1303 118.7472 118.8492 C.3 121 ARG121 -0.0154 1923 CD 126.6065 118.8136 118.6973 C.3 121 ARG121 0.1045 1924 NE 126.2766 119.1256 117.3072 N.pl3 121 ARG121 -0.4450 1925 CZ 126.4122 120.2962 116.6977 C.cat 121 ARG121 0.5062 1926 NH1 126.9474 121.3287 117.2879 N.pl3 121 ARG121 -0.4573 1927 NH2 126.0028 120.4094 115.4725 N.pl3 121 ARG121 -0.4573 1928 H 130.1060 117.6650 122.3070 H 121 ARG121 0.1312 1929 HA 130.3262 117.2591 119.4844 H 121 ARG121 0.0557 1930 HB1 128.4691 119.1860 120.9573 H 121 ARG121 0.0286 1931 HB2 128.1354 117.5048 120.6176 H 121 ARG121 0.0286 1932 HG1 128.5102 118.0312 118.1185 H 121 ARG121 0.0299 1933 HG2 128.5230 119.7182 118.5628 H 121 ARG121 0.0299 1934 HD1 126.1463 119.5618 119.3455 H 121 ARG121 0.0711 1935 HD2 126.1487 117.8464 118.9165 H 121 ARG121 0.0711 1936 HE 125.9290 118.4393 116.6460 H 121 ARG121 0.3153 1937 HH11 127.0233 122.1899 116.7930 H 121 ARG121 0.3114 1938 HH12 127.2837 121.2355 118.2188 H 121 ARG121 0.3114 1939 HH21 125.9968 121.2582 114.9614 H 121 ARG121 0.3114 1940 HH22 125.6913 119.5435 115.0513 H 121 ARG121 0.3114 1941 N 130.9460 119.6150 118.4750 N.am 122 LEU122 -0.2456 1942 CA 131.4750 120.8890 118.0280 C.3 122 LEU122 0.0880 1943 C 130.8550 122.0850 118.7480 C.2 122 LEU122 0.2187 1944 O 129.6440 122.1380 118.9800 O.2 122 LEU122 -0.2778 1945 CB 131.1404 121.0309 116.5278 C.3 122 LEU122 -0.0266 1946 CG 131.8150 119.9928 115.6144 C.3 122 LEU122 -0.0449 1947 CD1 131.2243 120.0674 114.1995 C.3 122 LEU122 -0.0626 1948 CD2 133.3377 120.1800 115.5697 C.3 122 LEU122 -0.0626 1949 H 130.4880 119.0020 117.8010 H 122 LEU122 0.1312 1950 HA 132.5510 120.8755 118.2051 H 122 LEU122 0.0557 1951 HB1 131.3946 122.0269 116.1651 H 122 LEU122 0.0287 1952 HB2 130.0585 120.9478 116.4073 H 122 LEU122 0.0287 1953 HG 131.6064 118.9928 115.9967 H 122 LEU122 0.0296 1954 HD11 131.6734 119.3187 113.5464 H 122 LEU122 0.0232 1955 HD12 131.3931 121.0470 113.7510 H 122 LEU122 0.0232 1956 HD13 130.1485 119.8874 114.2125 H 122 LEU122 0.0232 1957 HD21 133.7981 119.4582 114.8945 H 122 LEU122 0.0232 1958 HD22 133.7891 120.0370 116.5510 H 122 LEU122 0.0232 1959 HD23 133.6019 121.1781 115.2192 H 122 LEU122 0.0232 1960 N 131.7270 123.0530 119.1040 N.am 123 SER123 -0.2436 1961 CA 131.4460 124.3510 119.6920 C.3 123 SER123 0.1109 1962 C 130.4880 125.2160 118.8690 C.2 123 SER123 0.2209 1963 O 130.4000 125.1120 117.6530 O.2 123 SER123 -0.2777 1964 CB 132.7717 125.0993 119.9061 C.3 123 SER123 0.0681 1965 OG 133.7009 124.2406 120.5533 O.3 123 SER123 -0.3930 1966 H 132.7120 122.8450 118.9380 H 123 SER123 0.1312 1967 HA 130.9830 124.1398 120.6562 H 123 SER123 0.0580 1968 HB1 132.5976 125.9874 120.5218 H 123 SER123 0.0577 1969 HB2 133.1775 125.4286 118.9432 H 123 SER123 0.0577 1970 HG 134.5327 124.6792 120.7208 H 123 SER123 0.2095 1971 N 129.7330 126.1490 119.4860 N.am 124 ALA124 -0.2458 1972 CA 128.9610 127.1250 118.7180 C.3 124 ALA124 0.0852 1973 C 129.7210 128.0460 117.7170 C.2 124 ALA124 0.2211 1974 O 129.2180 128.2100 116.6010 O.2 124 ALA124 -0.2776 1975 CB 128.1287 127.9643 119.6930 C.3 124 ALA124 -0.0411 1976 H 129.7000 126.1740 120.5050 H 124 ALA124 0.1312 1977 HA 128.2789 126.5306 118.1103 H 124 ALA124 0.0554 1978 HB1 127.4611 128.6442 119.1630 H 124 ALA124 0.0249 1979 HB2 128.7633 128.5577 120.3513 H 124 ALA124 0.0249 1980 HB3 127.5109 127.3221 120.3215 H 124 ALA124 0.0249 1981 N 130.8910 128.6540 117.9830 N.am 125 PRO125 -0.2316 1982 CA 131.7040 129.3330 116.9720 C.3 125 PRO125 0.0907 1983 C 132.2310 128.4230 115.8730 C.2 125 PRO125 0.2190 1984 O 132.3380 128.8940 114.7460 O.2 125 PRO125 -0.2778 1985 CB 132.8404 129.9759 117.7769 C.3 125 PRO125 -0.0276 1986 CG 132.9195 129.1602 119.0613 C.3 125 PRO125 -0.0379 1987 CD 131.4835 128.7106 119.3204 C.3 125 PRO125 0.0071 1988 HA 131.0811 130.0986 116.5097 H 125 PRO125 0.0559 1989 HB1 132.5668 131.0017 118.0258 H 125 PRO125 0.0285 1990 HB2 133.7933 130.0173 117.2466 H 125 PRO125 0.0285 1991 HG1 133.3436 129.7208 119.8947 H 125 PRO125 0.0278 1992 HG2 133.5487 128.2847 118.8945 H 125 PRO125 0.0278 1993 HD1 131.4648 127.7516 119.8233 H 125 PRO125 0.0431 1994 HD2 130.9221 129.4487 119.8946 H 125 PRO125 0.0431 1995 N 132.5640 127.1410 116.1390 N.am 126 SER126 -0.2436 1996 CA 132.9740 126.1990 115.1010 C.3 126 SER126 0.1109 1997 C 131.8120 125.8570 114.1750 C.2 126 SER126 0.2210 1998 O 131.9640 125.8640 112.9580 O.2 126 SER126 -0.2777 1999 CB 133.6539 124.9578 115.6958 C.3 126 SER126 0.0681 2000 OG 132.8163 124.2989 116.6339 O.3 126 SER126 -0.3930 2001 H 132.5280 126.8170 117.1050 H 126 SER126 0.1312 2002 HA 133.7108 126.7234 114.4907 H 126 SER126 0.0580 2003 HB1 134.5798 125.2775 116.1867 H 126 SER126 0.0577 2004 HB2 133.9314 124.2722 114.8865 H 126 SER126 0.0577 2005 HG 133.2537 123.5380 117.0105 H 126 SER126 0.2095 2006 N 130.5900 125.6420 114.7180 N.am 127 THR127 -0.2433 2007 CA 129.3510 125.5020 113.9300 C.3 127 THR127 0.1135 2008 C 129.0680 126.7160 113.0430 C.2 127 THR127 0.2212 2009 O 128.7740 126.5760 111.8580 O.2 127 THR127 -0.2777 2010 CB 128.1879 125.2411 114.9193 C.3 127 THR127 0.0763 2011 OG1 128.4372 124.1270 115.7639 O.3 127 THR127 -0.3900 2012 CG2 126.8592 124.9356 114.2227 C.3 127 THR127 -0.0370 2013 H 130.5220 125.5730 115.7340 H 127 THR127 0.1313 2014 HA 129.4935 124.6347 113.2837 H 127 THR127 0.0583 2015 HB 128.0392 126.1259 115.5477 H 127 THR127 0.0611 2016 HG1 129.2903 124.2213 116.1829 H 127 THR127 0.2098 2017 HG21 126.0874 124.7240 114.9620 H 127 THR127 0.0255 2018 HG22 126.9437 124.0560 113.5901 H 127 THR127 0.0255 2019 HG23 126.5197 125.7662 113.6038 H 127 THR127 0.0255 2020 N 129.2080 127.9590 113.5640 N.am 128 LYS128 -0.2456 2021 CA 129.1300 129.1850 112.7700 C.3 128 LYS128 0.0878 2022 C 130.2010 129.2940 111.6860 C.2 128 LYS128 0.2187 2023 O 129.9150 129.6940 110.5580 O.2 128 LYS128 -0.2778 2024 CB 129.2687 130.4220 113.6786 C.3 128 LYS128 -0.0289 2025 CG 127.9661 130.8686 114.3548 C.3 128 LYS128 -0.0496 2026 CD 128.1092 132.2934 114.9175 C.3 128 LYS128 -0.0278 2027 CE 126.7789 132.9260 115.3419 C.3 128 LYS128 0.1103 2028 NZ 126.9209 134.3570 115.6318 N.4 128 LYS128 -0.0749 2029 H 129.3770 128.0450 114.5660 H 128 LYS128 0.1312 2030 HA 128.1625 129.1772 112.2657 H 128 LYS128 0.0557 2031 HB1 129.6183 131.2671 113.0814 H 128 LYS128 0.0285 2032 HB2 130.0456 130.2524 114.4244 H 128 LYS128 0.0285 2033 HG1 127.6830 130.1637 115.1378 H 128 LYS128 0.0266 2034 HG2 127.1637 130.8548 113.6158 H 128 LYS128 0.0266 2035 HD1 128.5559 132.9264 114.1492 H 128 LYS128 0.0282 2036 HD2 128.8113 132.2883 115.7526 H 128 LYS128 0.0282 2037 HE1 126.3802 132.4250 116.2265 H 128 LYS128 0.0559 2038 HE2 126.0390 132.8183 114.5452 H 128 LYS128 0.0559 2039 HZ1 126.0019 134.7603 115.9072 H 128 LYS128 0.2742 2040 HZ2 127.2657 134.8544 114.7843 H 128 LYS128 0.2742 2041 HZ3 127.6050 134.4976 116.4037 H 128 LYS128 0.2742 2042 N 131.4570 128.9090 111.9900 N.am 129 ALA129 -0.2459 2043 CA 132.5460 128.8440 111.0330 C.3 129 ALA129 0.0850 2044 C 132.3090 127.8670 109.8820 C.2 129 ALA129 0.2184 2045 O 132.5600 128.1850 108.7210 O.2 129 ALA129 -0.2778 2046 CB 133.8375 128.4861 111.7769 C.3 129 ALA129 -0.0411 2047 H 131.6550 128.6460 112.9560 H 129 ALA129 0.1312 2048 HA 132.6367 129.8426 110.6034 H 129 ALA129 0.0554 2049 HB1 134.6989 128.5109 111.1086 H 129 ALA129 0.0249 2050 HB2 133.7839 127.4898 112.2150 H 129 ALA129 0.0249 2051 HB3 134.0273 129.1922 112.5853 H 129 ALA129 0.0249 2052 N 131.7810 126.6580 110.1730 N.am 130 VAL130 -0.2454 2053 CA 131.3580 125.6880 109.1670 C.3 130 VAL130 0.0901 2054 C 130.2070 126.2080 108.3010 C.2 130 VAL130 0.2189 2055 O 130.2560 126.0770 107.0800 O.2 130 VAL130 -0.2778 2056 CB 130.9895 124.3647 109.8791 C.3 130 VAL130 -0.0227 2057 CG1 130.3059 123.3446 108.9513 C.3 130 VAL130 -0.0608 2058 CG2 132.2274 123.7170 110.5191 C.3 130 VAL130 -0.0608 2059 H 131.6710 126.4070 111.1560 H 130 VAL130 0.1312 2060 HA 132.2119 125.5281 108.5070 H 130 VAL130 0.0560 2061 HB 130.2874 124.6004 110.6806 H 130 VAL130 0.0315 2062 HG11 130.1262 122.4021 109.4691 H 130 VAL130 0.0233 2063 HG12 130.9202 123.1329 108.0758 H 130 VAL130 0.0233 2064 HG13 129.3382 123.7039 108.6036 H 130 VAL130 0.0233 2065 HG21 131.9506 122.8368 111.1000 H 130 VAL130 0.0233 2066 HG22 132.7500 124.3982 111.1880 H 130 VAL130 0.0233 2067 HG23 132.9395 123.4010 109.7564 H 130 VAL130 0.0233 2068 N 129.1750 126.8800 108.8860 N.am 131 ILE131 -0.2454 2069 CA 128.1140 127.5650 108.1250 C.3 131 ILE131 0.0903 2070 C 128.6830 128.6140 107.1860 C.2 131 ILE131 0.2189 2071 O 128.3580 128.6480 105.9970 O.2 131 ILE131 -0.2778 2072 CB 127.0361 128.0873 109.1009 C.3 131 ILE131 -0.0201 2073 CG1 126.3039 126.8958 109.7573 C.3 131 ILE131 -0.0514 2074 CG2 126.0297 129.0215 108.4057 C.3 131 ILE131 -0.0605 2075 CD1 125.4618 127.2698 110.9813 C.3 131 ILE131 -0.0650 2076 H 129.1350 126.9110 109.9050 H 131 ILE131 0.1312 2077 HA 127.6687 126.8011 107.4854 H 131 ILE131 0.0560 2078 HB 127.5409 128.6562 109.8826 H 131 ILE131 0.0318 2079 HG11 127.0245 126.1442 110.0754 H 131 ILE131 0.0266 2080 HG12 125.6723 126.4020 109.0175 H 131 ILE131 0.0266 2081 HG21 125.2375 129.3405 109.0815 H 131 ILE131 0.0233 2082 HG22 125.5640 128.5225 107.5571 H 131 ILE131 0.0233 2083 HG23 126.5108 129.9256 108.0325 H 131 ILE131 0.0233 2084 HD11 125.0204 126.3750 111.4206 H 131 ILE131 0.0230 2085 HD12 124.6460 127.9432 110.7208 H 131 ILE131 0.0230 2086 HD13 126.0728 127.7498 111.7458 H 131 ILE131 0.0230 2087 N 129.5970 129.4690 107.6920 N.am 132 ALA132 -0.2459 2088 CA 130.2540 130.4770 106.8920 C.3 132 ALA132 0.0850 2089 C 131.0710 129.8710 105.7630 C.2 132 ALA132 0.2182 2090 O 130.9310 130.2650 104.6080 O.2 132 ALA132 -0.2778 2091 CB 131.1456 131.3257 107.8052 C.3 132 ALA132 -0.0411 2092 H 129.8340 129.4000 108.6820 H 132 ALA132 0.1312 2093 HA 129.4689 131.0931 106.4511 H 132 ALA132 0.0554 2094 HB1 131.6343 132.1267 107.2493 H 132 ALA132 0.0249 2095 HB2 131.9209 130.7220 108.2781 H 132 ALA132 0.0249 2096 HB3 130.5572 131.7839 108.6000 H 132 ALA132 0.0249 2097 N 131.8800 128.8290 106.0500 N.am 133 GLY133 -0.2485 2098 CA 132.6790 128.1580 105.0340 C.3 133 GLY133 0.0765 2099 C 131.8640 127.5040 103.9420 C.2 133 GLY133 0.2155 2100 O 132.1830 127.6390 102.7650 O.2 133 GLY133 -0.2781 2101 H 131.9340 128.5000 107.0140 H 133 GLY133 0.1309 2102 HA1 133.2718 127.4006 105.5453 H 133 GLY133 0.0521 2103 HA2 133.3527 128.8960 104.5975 H 133 GLY133 0.0521 2104 N 130.7530 126.8340 104.3110 N.am 134 ILE134 -0.2456 2105 CA 129.7880 126.2380 103.3960 C.3 134 ILE134 0.0903 2106 C 129.1340 127.2660 102.4560 C.2 134 ILE134 0.2189 2107 O 129.1070 127.0670 101.2410 O.2 134 ILE134 -0.2778 2108 CB 128.7873 125.4281 104.2653 C.3 134 ILE134 -0.0201 2109 CG1 129.4267 124.1031 104.7299 C.3 134 ILE134 -0.0514 2110 CG2 127.4274 125.1958 103.5939 C.3 134 ILE134 -0.0605 2111 CD1 128.5962 123.3411 105.7723 C.3 134 ILE134 -0.0650 2112 H 130.5740 126.7370 105.3100 H 134 ILE134 0.1312 2113 HA 130.3481 125.5502 102.7624 H 134 ILE134 0.0560 2114 HB 128.5791 126.0169 105.1603 H 134 ILE134 0.0318 2115 HG11 130.4032 124.3122 105.1679 H 134 ILE134 0.0266 2116 HG12 129.6171 123.4600 103.8709 H 134 ILE134 0.0266 2117 HG21 126.8336 124.4239 104.0804 H 134 ILE134 0.0233 2118 HG22 127.5323 124.9305 102.5433 H 134 ILE134 0.0233 2119 HG23 126.8461 126.1102 103.6706 H 134 ILE134 0.0233 2120 HD11 129.1740 122.5220 106.2005 H 134 ILE134 0.0230 2121 HD12 127.6963 122.9054 105.3389 H 134 ILE134 0.0230 2122 HD13 128.2944 123.9988 106.5875 H 134 ILE134 0.0230 2123 N 128.6290 128.4140 102.9740 N.am 135 TRP135 -0.2453 2124 CA 128.0740 129.4890 102.1540 C.3 135 TRP135 0.0918 2125 C 129.1140 130.1670 101.2650 C.2 135 TRP135 0.2190 2126 O 128.8570 130.4180 100.0880 O.2 135 TRP135 -0.2778 2127 CB 127.4709 130.5707 103.0779 C.3 135 TRP135 -0.0021 2128 CG 126.0034 130.3134 103.3392 C.ar 135 TRP135 -0.0260 2129 CD1 125.4487 129.7643 104.4982 C.ar 135 TRP135 -0.0136 2130 CD2 124.9016 130.6137 102.4564 C.ar 135 TRP135 -0.0028 2131 NE1 124.0997 129.7151 104.3649 N.ar 135 TRP135 -0.2641 2132 CE2 123.7188 130.2268 103.1302 C.ar 135 TRP135 0.0269 2133 CE3 124.8326 131.1361 101.1916 C.ar 135 TRP135 -0.0528 2134 CZ2 122.5031 130.3775 102.5194 C.ar 135 TRP135 -0.0430 2135 CZ3 123.5949 131.2865 100.5645 C.ar 135 TRP135 -0.0611 2136 CH2 122.4278 130.9086 101.2302 C.ar 135 TRP135 -0.0602 2137 H 128.6370 128.5330 103.9870 H 135 TRP135 0.1312 2138 HA 127.3157 129.0523 101.5029 H 135 TRP135 0.0560 2139 HB1 127.5412 131.5674 102.6372 H 135 TRP135 0.0334 2140 HB2 128.0144 130.6196 104.0228 H 135 TRP135 0.0334 2141 HD1 126.0066 129.4338 105.3620 H 135 TRP135 0.0748 2142 HE1 123.4818 129.3656 105.0425 H 135 TRP135 0.1331 2143 HE3 125.7392 131.4181 100.6756 H 135 TRP135 0.0624 2144 HZ2 121.6046 130.0708 103.0347 H 135 TRP135 0.0633 2145 HZ3 123.5408 131.6909 99.5640 H 135 TRP135 0.0618 2146 HH2 121.4682 131.0188 100.7463 H 135 TRP135 0.0618 2147 N 130.3280 130.4560 101.7830 N.am 136 LEU136 -0.2456 2148 CA 131.4010 131.0520 100.9960 C.3 136 LEU136 0.0880 2149 C 131.8590 130.1880 99.8220 C.2 136 LEU136 0.2187 2150 O 131.9770 130.6740 98.6970 O.2 136 LEU136 -0.2778 2151 CB 132.5846 131.3579 101.9301 C.3 136 LEU136 -0.0266 2152 CG 132.3017 132.4913 102.9353 C.3 136 LEU136 -0.0449 2153 CD1 133.3353 132.4797 104.0690 C.3 136 LEU136 -0.0626 2154 CD2 132.2708 133.8650 102.2506 C.3 136 LEU136 -0.0626 2155 H 130.5010 130.2480 102.7660 H 136 LEU136 0.1312 2156 HA 131.0017 131.9731 100.5721 H 136 LEU136 0.0557 2157 HB1 133.4712 131.6201 101.3507 H 136 LEU136 0.0287 2158 HB2 132.8390 130.4451 102.4719 H 136 LEU136 0.0287 2159 HG 131.3237 132.3303 103.3881 H 136 LEU136 0.0296 2160 HD11 133.1181 133.2532 104.8059 H 136 LEU136 0.0232 2161 HD12 134.3414 132.6532 103.6868 H 136 LEU136 0.0232 2162 HD13 133.3368 131.5218 104.5898 H 136 LEU136 0.0232 2163 HD21 132.0874 134.6574 102.9766 H 136 LEU136 0.0232 2164 HD22 131.4819 133.9241 101.5014 H 136 LEU136 0.0232 2165 HD23 133.2186 134.0801 101.7566 H 136 LEU136 0.0232 2166 N 132.0800 128.8670 100.0270 N.am 137 VAL137 -0.2454 2167 CA 132.4150 127.9510 98.9390 C.3 137 VAL137 0.0901 2168 C 131.2720 127.7270 97.9750 C.2 137 VAL137 0.2189 2169 O 131.4900 127.5640 96.7760 O.2 137 VAL137 -0.2778 2170 CB 133.0042 126.6195 99.4514 C.3 137 VAL137 -0.0227 2171 CG1 134.2580 126.8519 100.3074 C.3 137 VAL137 -0.0608 2172 CG2 131.9792 125.7402 100.1799 C.3 137 VAL137 -0.0608 2173 H 132.0100 128.4990 100.9750 H 137 VAL137 0.1312 2174 HA 133.1976 128.4536 98.3698 H 137 VAL137 0.0560 2175 HB 133.3331 126.0531 98.5783 H 137 VAL137 0.0315 2176 HG11 134.7039 125.9050 100.6121 H 137 VAL137 0.0233 2177 HG12 134.0375 127.4175 101.2109 H 137 VAL137 0.0233 2178 HG13 135.0129 127.4063 99.7495 H 137 VAL137 0.0233 2179 HG21 132.4440 124.8437 100.5899 H 137 VAL137 0.0233 2180 HG22 131.1900 125.4174 99.5054 H 137 VAL137 0.0233 2181 HG23 131.5051 126.2755 100.9947 H 137 VAL137 0.0233 2182 N 130.0130 127.7390 98.4610 N.am 138 ALA138 -0.2459 2183 CA 128.8490 127.6780 97.6090 C.3 138 ALA138 0.0850 2184 C 128.7550 128.8830 96.6540 C.2 138 ALA138 0.2184 2185 O 128.6060 128.7060 95.4450 O.2 138 ALA138 -0.2778 2186 CB 127.5906 127.5590 98.4776 C.3 138 ALA138 -0.0411 2187 H 129.8780 127.7930 99.4700 H 138 ALA138 0.1312 2188 HA 128.9548 126.7802 96.9976 H 138 ALA138 0.0554 2189 HB1 126.6916 127.4863 97.8659 H 138 ALA138 0.0249 2190 HB2 127.4768 128.4186 99.1379 H 138 ALA138 0.0249 2191 HB3 127.6327 126.6663 99.1019 H 138 ALA138 0.0249 2192 N 128.9320 130.1300 97.1750 N.am 139 LEU139 -0.2457 2193 CA 128.9810 131.3700 96.3910 C.3 139 LEU139 0.0880 2194 C 130.1540 131.4080 95.4340 C.2 139 LEU139 0.2187 2195 O 130.0180 131.8050 94.2800 O.2 139 LEU139 -0.2778 2196 CB 129.1141 132.5525 97.3726 C.3 139 LEU139 -0.0266 2197 CG 127.8469 132.8327 98.1975 C.3 139 LEU139 -0.0449 2198 CD1 128.1775 133.6400 99.4594 C.3 139 LEU139 -0.0626 2199 CD2 126.7926 133.5665 97.3547 C.3 139 LEU139 -0.0626 2200 H 129.0390 130.2070 98.1870 H 139 LEU139 0.1312 2201 HA 128.0609 131.4268 95.8090 H 139 LEU139 0.0557 2202 HB1 129.3890 133.4658 96.8418 H 139 LEU139 0.0287 2203 HB2 129.9439 132.3421 98.0496 H 139 LEU139 0.0287 2204 HG 127.4327 131.8827 98.5325 H 139 LEU139 0.0296 2205 HD11 127.2832 133.8125 100.0586 H 139 LEU139 0.0232 2206 HD12 128.6053 134.6103 99.2066 H 139 LEU139 0.0232 2207 HD13 128.8954 133.1119 100.0874 H 139 LEU139 0.0232 2208 HD21 125.8738 133.7178 97.9219 H 139 LEU139 0.0232 2209 HD22 126.5370 133.0078 96.4546 H 139 LEU139 0.0232 2210 HD23 127.1537 134.5459 97.0398 H 139 LEU139 0.0232 2211 N 131.3440 130.9670 95.8840 N.am 140 ALA140 -0.2459 2212 CA 132.5230 130.8630 95.0530 C.3 140 ALA140 0.0850 2213 C 132.3460 129.8940 93.8830 C.2 140 ALA140 0.2184 2214 O 132.7140 130.2010 92.7510 O.2 140 ALA140 -0.2778 2215 CB 133.7022 130.4247 95.9276 C.3 140 ALA140 -0.0411 2216 H 131.4180 130.6920 96.8630 H 140 ALA140 0.1312 2217 HA 132.7078 131.8578 94.6453 H 140 ALA140 0.0554 2218 HB1 134.6313 130.3988 95.3576 H 140 ALA140 0.0249 2219 HB2 133.5363 129.4312 96.3441 H 140 ALA140 0.0249 2220 HB3 133.8438 131.1131 96.7609 H 140 ALA140 0.0249 2221 N 131.7300 128.7170 94.1240 N.am 141 LEU141 -0.2457 2222 CA 131.4430 127.7310 93.0950 C.3 141 LEU141 0.0880 2223 C 130.4370 128.1730 92.0310 C.2 141 LEU141 0.2187 2224 O 130.6370 127.9110 90.8510 O.2 141 LEU141 -0.2778 2225 CB 131.0474 126.4254 93.7994 C.3 141 LEU141 -0.0266 2226 CG 130.9590 125.1774 92.9005 C.3 141 LEU141 -0.0449 2227 CD1 132.2552 124.9052 92.1232 C.3 141 LEU141 -0.0626 2228 CD2 130.5947 123.9639 93.7630 C.3 141 LEU141 -0.0626 2229 H 131.4500 128.5080 95.0820 H 141 LEU141 0.1312 2230 HA 132.3924 127.5807 92.5810 H 141 LEU141 0.0557 2231 HB1 130.1012 126.5743 94.3205 H 141 LEU141 0.0287 2232 HB2 131.7820 126.2250 94.5801 H 141 LEU141 0.0287 2233 HG 130.1636 125.3287 92.1715 H 141 LEU141 0.0296 2234 HD11 132.1857 123.9732 91.5615 H 141 LEU141 0.0232 2235 HD12 133.1093 124.8233 92.7956 H 141 LEU141 0.0232 2236 HD13 132.4629 125.6968 91.4035 H 141 LEU141 0.0232 2237 HD21 130.4153 123.0734 93.1620 H 141 LEU141 0.0232 2238 HD22 129.6950 124.1675 94.3411 H 141 LEU141 0.0232 2239 HD23 131.3928 123.7295 94.4677 H 141 LEU141 0.0232 2240 N 129.3550 128.8920 92.4080 N.am 142 ALA142 -0.2459 2241 CA 128.3400 129.3680 91.4910 C.3 142 ALA142 0.0850 2242 C 128.6600 130.7090 90.8390 C.2 142 ALA142 0.2185 2243 O 127.9960 131.1470 89.8990 O.2 142 ALA142 -0.2778 2244 CB 127.0553 129.5139 92.3062 C.3 142 ALA142 -0.0411 2245 H 129.2470 129.1120 93.3980 H 142 ALA142 0.1312 2246 HA 128.2077 128.6208 90.7061 H 142 ALA142 0.0554 2247 HB1 126.2231 129.8762 91.7014 H 142 ALA142 0.0249 2248 HB2 127.2304 130.2165 93.1188 H 142 ALA142 0.0249 2249 HB3 126.7588 128.5655 92.7531 H 142 ALA142 0.0249 2250 N 129.7290 131.3830 91.3060 N.am 143 SER143 -0.2436 2251 CA 130.2040 132.6560 90.7650 C.3 143 SER143 0.1111 2252 C 130.5250 132.6320 89.2650 C.2 143 SER143 0.2236 2253 O 130.0630 133.5450 88.5770 O.2 143 SER143 -0.2775 2254 CB 131.4109 133.1539 91.5747 C.3 143 SER143 0.0681 2255 OG 131.7922 134.4562 91.1452 O.3 143 SER143 -0.3930 2256 H 130.2420 130.9780 92.0900 H 143 SER143 0.1312 2257 HA 129.3812 133.3569 90.9025 H 143 SER143 0.0580 2258 HB1 132.2493 132.4580 91.4722 H 143 SER143 0.0577 2259 HB2 131.1372 133.1822 92.6332 H 143 SER143 0.0577 2260 HG 132.5456 134.7773 91.6345 H 143 SER143 0.2095 2261 N 131.2110 131.6670 88.6310 N.am 144 PRO144 -0.2315 2262 CA 131.5580 131.7890 87.2170 C.3 144 PRO144 0.0907 2263 C 130.3670 131.7600 86.2720 C.2 144 PRO144 0.2189 2264 O 130.4230 132.3920 85.2200 O.2 144 PRO144 -0.2778 2265 CB 132.4652 130.5675 86.9739 C.3 144 PRO144 -0.0276 2266 CG 132.8952 130.0989 88.3629 C.3 144 PRO144 -0.0379 2267 CD 131.7207 130.4599 89.2662 C.3 144 PRO144 0.0071 2268 HA 132.1060 132.7248 87.0959 H 144 PRO144 0.0559 2269 HB1 133.3146 130.8040 86.3329 H 144 PRO144 0.0285 2270 HB2 131.9171 129.7523 86.4970 H 144 PRO144 0.0285 2271 HG1 133.7755 130.6596 88.6789 H 144 PRO144 0.0278 2272 HG2 133.1464 129.0397 88.3991 H 144 PRO144 0.0278 2273 HD1 130.9228 129.7180 89.2231 H 144 PRO144 0.0431 2274 HD2 132.0248 130.6400 90.2957 H 144 PRO144 0.0431 2275 N 129.2820 131.0340 86.6190 N.am 145 GLN145 -0.2456 2276 CA 128.0460 130.9980 85.8480 C.3 145 GLN145 0.0882 2277 C 127.3430 132.3370 85.8090 C.2 145 GLN145 0.2187 2278 O 126.8070 132.7390 84.7810 O.2 145 GLN145 -0.2778 2279 CB 127.0965 129.9342 86.4214 C.3 145 GLN145 -0.0210 2280 CG 127.6931 128.5210 86.3442 C.3 145 GLN145 0.0225 2281 CD 126.6700 127.4500 86.7456 C.2 145 GLN145 0.1981 2282 OE1 126.7962 126.7855 87.7634 O.2 145 GLN145 -0.2798 2283 NE2 125.6528 127.3188 85.8811 N.am 145 GLN145 -0.2724 2284 H 129.3310 130.4770 87.4720 H 145 GLN145 0.1312 2285 HA 128.3230 130.7412 84.8253 H 145 GLN145 0.0557 2286 HB1 126.1560 129.9660 85.8679 H 145 GLN145 0.0289 2287 HB2 126.8497 130.1720 87.4584 H 145 GLN145 0.0289 2288 HG1 128.5545 128.4391 87.0054 H 145 GLN145 0.0356 2289 HG2 128.0387 128.3021 85.3340 H 145 GLN145 0.0356 2290 HE21 124.9455 126.6389 86.0723 H 145 GLN145 0.1266 2291 HE22 125.5829 127.8836 85.0605 H 145 GLN145 0.1266 2292 N 127.3570 133.0620 86.9420 N.am 146 CYS146 -0.2449 2293 CA 126.7940 134.3880 87.0690 C.3 146 CYS146 0.0965 2294 C 127.4980 135.4570 86.2980 C.2 146 CYS146 0.2195 2295 O 126.9010 136.2740 85.6090 O.2 146 CYS146 -0.2778 2296 CB 126.6932 134.8189 88.5278 C.3 146 CYS146 0.0147 2297 SG 128.1633 135.5432 89.3060 S.3 146 CYS146 -0.1762 2298 H 127.7940 132.6490 87.7660 H 146 CYS146 0.1312 2299 HA 125.7839 134.3107 86.6658 H 146 CYS146 0.0565 2300 HB1 126.3743 133.9675 89.1207 H 146 CYS146 0.0394 2301 HB2 125.9054 135.5688 88.5732 H 146 CYS146 0.0394 2302 HG 127.8679 135.9434 90.5446 H 146 CYS146 0.1017 2303 N 128.8320 135.4130 86.4000 N.am 147 PHE147 -0.2453 2304 CA 129.7190 136.4410 85.9330 C.3 147 PHE147 0.0917 2305 C 129.6550 136.5290 84.4190 C.2 147 PHE147 0.2190 2306 O 129.5920 137.6010 83.8250 O.2 147 PHE147 -0.2778 2307 CB 131.1310 136.0757 86.4210 C.3 147 PHE147 -0.0036 2308 CG 132.1815 137.0523 85.9637 C.ar 147 PHE147 -0.0454 2309 CD1 133.0044 136.7467 84.8839 C.ar 147 PHE147 -0.0585 2310 CD2 132.3391 138.2744 86.6092 C.ar 147 PHE147 -0.0585 2311 CE1 133.9685 137.6477 84.4527 C.ar 147 PHE147 -0.0615 2312 CE2 133.3031 139.1781 86.1809 C.ar 147 PHE147 -0.0615 2313 CZ 134.1185 138.8652 85.1018 C.ar 147 PHE147 -0.0617 2314 H 129.2470 134.5920 86.8400 H 147 PHE147 0.1312 2315 HA 129.3848 137.3877 86.3594 H 147 PHE147 0.0560 2316 HB1 131.3982 135.0729 86.0831 H 147 PHE147 0.0333 2317 HB2 131.1403 136.0347 87.5110 H 147 PHE147 0.0333 2318 HD1 132.8891 135.8042 84.3699 H 147 PHE147 0.0620 2319 HD2 131.7058 138.5263 87.4473 H 147 PHE147 0.0620 2320 HE1 134.5987 137.4006 83.6109 H 147 PHE147 0.0618 2321 HE2 133.4168 140.1257 86.6865 H 147 PHE147 0.0618 2322 HZ 134.8668 139.5682 84.7666 H 147 PHE147 0.0618 2323 N 129.5970 135.3500 83.7790 N.am 148 TYR148 -0.2453 2324 CA 129.5310 135.2110 82.3430 C.3 148 TYR148 0.0917 2325 C 128.1150 135.0910 81.8460 C.2 148 TYR148 0.2191 2326 O 127.8640 134.8660 80.6660 O.2 148 TYR148 -0.2778 2327 CB 130.2914 133.9316 81.9303 C.3 148 TYR148 -0.0036 2328 CG 131.7879 134.0298 82.0750 C.ar 148 TYR148 -0.0453 2329 CD1 132.5021 135.0188 81.4039 C.ar 148 TYR148 -0.0561 2330 CD2 132.4890 133.0774 82.8102 C.ar 148 TYR148 -0.0561 2331 CE1 133.8874 135.0719 81.4898 C.ar 148 TYR148 -0.0317 2332 CE2 133.8736 133.1292 82.8990 C.ar 148 TYR148 -0.0317 2333 CZ 134.5736 134.1276 82.2382 C.ar 148 TYR148 0.0726 2334 OH 135.9507 134.1689 82.3029 O.3 148 TYR148 -0.3598 2335 H 129.6000 134.5000 84.3420 H 148 TYR148 0.1312 2336 HA 129.9688 136.0971 81.8820 H 148 TYR148 0.0560 2337 HB1 130.0907 133.6772 80.8901 H 148 TYR148 0.0333 2338 HB2 129.9313 133.0885 82.5202 H 148 TYR148 0.0333 2339 HD1 131.9821 135.7451 80.7964 H 148 TYR148 0.0621 2340 HD2 131.9599 132.2769 83.3052 H 148 TYR148 0.0621 2341 HE1 134.4357 135.8400 80.9655 H 148 TYR148 0.0643 2342 HE2 134.4057 132.3844 83.4709 H 148 TYR148 0.0643 2343 HH 136.2549 133.5859 82.9852 H 148 TYR148 0.2173 2344 N 127.1290 135.2530 82.7290 N.am 149 SER149 -0.2436 2345 CA 125.7350 135.3410 82.3510 C.3 149 SER149 0.1109 2346 C 125.4680 136.5470 81.4450 C.2 149 SER149 0.2210 2347 O 126.0940 137.5980 81.5580 O.2 149 SER149 -0.2777 2348 CB 124.8428 135.3988 83.5923 C.3 149 SER149 0.0681 2349 OG 123.4873 135.3392 83.1729 O.3 149 SER149 -0.3930 2350 H 127.3690 135.3180 83.7180 H 149 SER149 0.1312 2351 HA 125.5004 134.4350 81.7970 H 149 SER149 0.0580 2352 HB1 125.0212 136.3278 84.1377 H 149 SER149 0.0577 2353 HB2 125.0874 134.5609 84.2535 H 149 SER149 0.0577 2354 HG 122.8828 135.2163 83.9028 H 149 SER149 0.2095 2355 N 124.5660 136.4090 80.4590 N.am 150 THR150 -0.2433 2356 CA 124.2150 137.4900 79.5500 C.3 150 THR150 0.1135 2357 C 122.8490 137.1970 78.9610 C.2 150 THR150 0.2212 2358 O 122.3580 136.0700 79.0140 O.2 150 THR150 -0.2777 2359 CB 125.2783 137.5794 78.4283 C.3 150 THR150 0.0763 2360 OG1 125.0897 138.7738 77.6745 O.3 150 THR150 -0.3900 2361 CG2 125.2766 136.3357 77.5132 C.3 150 THR150 -0.0370 2362 H 124.1060 135.5060 80.3420 H 150 THR150 0.1313 2363 HA 124.1567 138.4083 80.1249 H 150 THR150 0.0583 2364 HB 126.2558 137.6340 78.9221 H 150 THR150 0.0611 2365 HG1 125.6897 138.7809 76.9303 H 150 THR150 0.2098 2366 HG21 126.0701 136.3846 76.7697 H 150 THR150 0.0255 2367 HG22 124.3374 136.2294 76.9697 H 150 THR150 0.0255 2368 HG23 125.4309 135.4217 78.0877 H 150 THR150 0.0255 2369 N 122.1840 138.2300 78.4060 N.am 151 VAL151 -0.2453 2370 CA 120.8700 138.1330 77.7860 C.3 151 VAL151 0.0901 2371 C 121.0250 138.5550 76.3420 C.2 151 VAL151 0.2190 2372 O 121.6800 139.5560 76.0500 O.2 151 VAL151 -0.2778 2373 CB 119.7877 138.9285 78.5415 C.3 151 VAL151 -0.0227 2374 CG1 118.4064 138.8081 77.8736 C.3 151 VAL151 -0.0608 2375 CG2 119.6860 138.4579 79.9985 C.3 151 VAL151 -0.0608 2376 H 122.6340 139.1460 78.4210 H 151 VAL151 0.1312 2377 HA 120.5983 137.0817 77.7918 H 151 VAL151 0.0560 2378 HB 120.0627 139.9809 78.5303 H 151 VAL151 0.0315 2379 HG11 117.6528 139.3691 78.4269 H 151 VAL151 0.0233 2380 HG12 118.0770 137.7695 77.8341 H 151 VAL151 0.0233 2381 HG13 118.4109 139.1926 76.8535 H 151 VAL151 0.0233 2382 HG21 118.9269 139.0201 80.5412 H 151 VAL151 0.0233 2383 HG22 120.6311 138.5736 80.5277 H 151 VAL151 0.0233 2384 HG23 119.4058 137.4050 80.0473 H 151 VAL151 0.0233 2385 N 120.4350 137.7900 75.4040 N.am 152 THR152 -0.2434 2386 CA 120.4500 138.0660 73.9770 C.3 152 THR152 0.1135 2387 C 119.0240 138.1620 73.4710 C.2 152 THR152 0.2212 2388 O 118.1100 137.5240 73.9950 O.2 152 THR152 -0.2777 2389 CB 121.1990 136.9304 73.2523 C.3 152 THR152 0.0763 2390 OG1 120.6156 135.6896 73.6205 O.3 152 THR152 -0.3900 2391 CG2 122.6933 136.9248 73.6130 C.3 152 THR152 -0.0370 2392 H 119.9410 136.9550 75.7180 H 152 THR152 0.1313 2393 HA 120.9395 139.0242 73.7998 H 152 THR152 0.0583 2394 HB 121.0929 137.0872 72.1712 H 152 THR152 0.0611 2395 HG1 120.9963 134.9707 73.1254 H 152 THR152 0.2098 2396 HG21 123.2443 136.1874 73.0289 H 152 THR152 0.0255 2397 HG22 122.8448 136.6919 74.6675 H 152 THR152 0.0255 2398 HG23 123.1442 137.8975 73.4177 H 152 THR152 0.0255 2399 N 118.7940 139.0130 72.4450 N.am 153 MET153 -0.2456 2400 CA 117.5020 139.1920 71.8140 C.3 153 MET153 0.0886 2401 C 117.5440 138.6030 70.4150 C.2 153 MET153 0.2187 2402 O 118.1790 139.1370 69.5070 O.2 153 MET153 -0.2778 2403 CB 117.1346 140.6812 71.7812 C.3 153 MET153 -0.0199 2404 CG 115.6978 140.9237 71.2986 C.3 153 MET153 -0.0047 2405 SD 115.3185 142.6849 71.2392 S.3 153 MET153 -0.1641 2406 CE 115.8322 143.0087 69.5428 C.3 153 MET153 -0.0181 2407 H 119.5780 139.5630 72.0940 H 153 MET153 0.1312 2408 HA 116.7502 138.6520 72.3936 H 153 MET153 0.0557 2409 HB1 117.8372 141.2272 71.1505 H 153 MET153 0.0293 2410 HB2 117.2400 141.0958 72.7838 H 153 MET153 0.0293 2411 HG1 114.9824 140.4315 71.9587 H 153 MET153 0.0377 2412 HG2 115.5333 140.4892 70.3116 H 153 MET153 0.0377 2413 HE1 115.8050 144.0775 69.3319 H 153 MET153 0.0340 2414 HE2 115.1822 142.4809 68.8447 H 153 MET153 0.0340 2415 HE3 116.8488 142.6479 69.3850 H 153 MET153 0.0340 2416 N 116.8380 137.4790 70.2350 N.am 154 ASP154 -0.2451 2417 CA 116.6120 136.8080 68.9820 C.3 154 ASP154 0.0974 2418 C 115.2490 137.2750 68.4750 C.2 154 ASP154 0.2192 2419 O 114.4710 137.9140 69.1840 O.2 154 ASP154 -0.2778 2420 CB 117.0583 135.3388 68.8768 C.3 154 ASP154 0.0576 2421 CG 116.4140 134.3106 69.8025 C.2 154 ASP154 0.1780 2422 OD1 115.8664 133.3279 69.3084 O.co2 154 ASP154 -0.6478 2423 OD2 116.4616 134.4497 71.0213 O.co2 154 ASP154 -0.6478 2424 H 116.4210 137.0580 71.0650 H 154 ASP154 0.1312 2425 HA 117.2875 137.2995 68.2808 H 154 ASP154 0.0563 2426 HB1 118.1283 135.2902 69.0737 H 154 ASP154 0.0394 2427 HB2 116.9307 134.9965 67.8499 H 154 ASP154 0.0394 2428 N 114.9090 136.9500 67.2130 N.am 155 GLN155 -0.2456 2429 CA 113.6100 137.2370 66.6110 C.3 155 GLN155 0.0882 2430 C 112.4330 136.6390 67.3930 C.2 155 GLN155 0.2185 2431 O 112.1970 135.4350 67.3680 O.2 155 GLN155 -0.2778 2432 CB 113.6278 136.7056 65.1650 C.3 155 GLN155 -0.0210 2433 CG 112.3142 136.8909 64.3827 C.3 155 GLN155 0.0225 2434 CD 111.9148 138.3689 64.2822 C.2 155 GLN155 0.1981 2435 OE1 112.4434 139.1233 63.4789 O.2 155 GLN155 -0.2798 2436 NE2 110.9514 138.7345 65.1414 N.am 155 GLN155 -0.2724 2437 H 115.6050 136.4720 66.6400 H 155 GLN155 0.1312 2438 HA 113.5115 138.3235 66.6125 H 155 GLN155 0.0557 2439 HB1 113.8752 135.6431 65.1801 H 155 GLN155 0.0289 2440 HB2 114.4404 137.1896 64.6216 H 155 GLN155 0.0289 2441 HG1 111.5014 136.3244 64.8379 H 155 GLN155 0.0356 2442 HG2 112.4307 136.5075 63.3695 H 155 GLN155 0.0356 2443 HE21 110.6289 139.6803 65.1322 H 155 GLN155 0.1266 2444 HE22 110.5554 138.0822 65.7864 H 155 GLN155 0.1266 2445 N 111.6620 137.4810 68.1280 N.am 156 GLY156 -0.2485 2446 CA 110.5880 137.0300 69.0200 C.3 156 GLY156 0.0765 2447 C 111.0250 136.2200 70.2180 C.2 156 GLY156 0.2155 2448 O 110.2510 135.4330 70.7560 O.2 156 GLY156 -0.2781 2449 H 111.8390 138.4830 68.0560 H 156 GLY156 0.1309 2450 HA1 109.8905 136.4406 68.4246 H 156 GLY156 0.0521 2451 HA2 110.0714 137.9230 69.3690 H 156 GLY156 0.0521 2452 N 112.2770 136.3890 70.6760 N.am 157 ALA157 -0.2462 2453 CA 112.7720 135.6380 71.7990 C.3 157 ALA157 0.0850 2454 C 113.8190 136.4080 72.5770 C.2 157 ALA157 0.2185 2455 O 114.6820 137.0750 72.0200 O.2 157 ALA157 -0.2778 2456 CB 113.2265 134.2549 71.3488 C.3 157 ALA157 -0.0411 2457 H 112.8890 137.0640 70.2180 H 157 ALA157 0.1311 2458 HA 111.9356 135.5144 72.4905 H 157 ALA157 0.0554 2459 HB1 113.6777 133.7054 72.1734 H 157 ALA157 0.0249 2460 HB2 113.9319 134.3413 70.5302 H 157 ALA157 0.0249 2461 HB3 112.3821 133.6719 70.9813 H 157 ALA157 0.0249 2462 N 113.7990 136.2720 73.9090 N.am 158 THR158 -0.2434 2463 CA 114.7730 136.8870 74.7930 C.3 158 THR158 0.1135 2464 C 115.3220 135.7230 75.5720 C.2 158 THR158 0.2212 2465 O 114.5510 134.9780 76.1730 O.2 158 THR158 -0.2777 2466 CB 114.0939 137.9087 75.7248 C.3 158 THR158 0.0763 2467 OG1 113.4447 138.8778 74.9178 O.3 158 THR158 -0.3900 2468 CG2 115.1103 138.6036 76.6484 C.3 158 THR158 -0.0370 2469 H 113.0600 135.7060 74.3250 H 158 THR158 0.1313 2470 HA 115.5683 137.3500 74.2071 H 158 THR158 0.0583 2471 HB 113.3454 137.3773 76.3261 H 158 THR158 0.0611 2472 HG1 112.9685 139.5044 75.4534 H 158 THR158 0.2098 2473 HG21 114.6201 139.2654 77.3625 H 158 THR158 0.0255 2474 HG22 115.8168 139.1968 76.0672 H 158 THR158 0.0255 2475 HG23 115.6870 137.8819 77.2241 H 158 THR158 0.0255 2476 N 116.6470 135.4920 75.5440 N.am 159 LYS159 -0.2456 2477 CA 117.2670 134.3370 76.1690 C.3 159 LYS159 0.0878 2478 C 118.3300 134.7460 77.1630 C.2 159 LYS159 0.2187 2479 O 119.1350 135.6250 76.8910 O.2 159 LYS159 -0.2778 2480 CB 117.8023 133.3812 75.0978 C.3 159 LYS159 -0.0289 2481 CG 116.6577 132.8432 74.2288 C.3 159 LYS159 -0.0496 2482 CD 117.0830 131.6883 73.3178 C.3 159 LYS159 -0.0278 2483 CE 115.9141 131.1967 72.4598 C.3 159 LYS159 0.1103 2484 NZ 115.5382 132.1943 71.4697 N.4 159 LYS159 -0.0749 2485 H 117.2460 136.1610 75.0600 H 159 LYS159 0.1312 2486 HA 116.5051 133.8073 76.7448 H 159 LYS159 0.0557 2487 HB1 118.3092 132.5443 75.5808 H 159 LYS159 0.0285 2488 HB2 118.5440 133.8833 74.4746 H 159 LYS159 0.0285 2489 HG1 116.2492 133.6562 73.6269 H 159 LYS159 0.0266 2490 HG2 115.8457 132.5015 74.8731 H 159 LYS159 0.0266 2491 HD1 117.4539 130.8663 73.9310 H 159 LYS159 0.0282 2492 HD2 117.9107 132.0011 72.6794 H 159 LYS159 0.0282 2493 HE1 115.0424 130.9809 73.0814 H 159 LYS159 0.0559 2494 HE2 116.1798 130.2813 71.9291 H 159 LYS159 0.0559 2495 HZ1 114.7037 131.9449 70.9103 H 159 LYS159 0.2742 2496 HZ2 116.3045 132.3819 70.7846 H 159 LYS159 0.2742 2497 HZ3 115.4184 133.1446 71.8820 H 159 LYS159 0.2742 2498 N 118.3690 134.0830 78.3300 N.am 160 CYS160 -0.2449 2499 CA 119.3900 134.2150 79.3510 C.3 160 CYS160 0.0965 2500 C 120.3020 132.9980 79.2020 C.2 160 CYS160 0.2195 2501 O 119.8120 131.8690 79.1290 O.2 160 CYS160 -0.2778 2502 CB 118.6918 134.1658 80.7213 C.3 160 CYS160 0.0147 2503 SG 119.7153 133.5957 82.1071 S.3 160 CYS160 -0.1762 2504 H 117.6110 133.4260 78.5150 H 160 CYS160 0.1312 2505 HA 119.9581 135.1340 79.2044 H 160 CYS160 0.0565 2506 HB1 117.8340 133.4944 80.6631 H 160 CYS160 0.0394 2507 HB2 118.2908 135.1503 80.9595 H 160 CYS160 0.0394 2508 HG 118.9666 133.4760 83.2064 H 160 CYS160 0.1017 2509 N 121.6390 133.1910 79.1220 N.am 161 VAL161 -0.2454 2510 CA 122.5930 132.1000 78.9530 C.3 161 VAL161 0.0901 2511 C 123.9390 132.5070 79.5350 C.2 161 VAL161 0.2189 2512 O 124.2390 133.6880 79.6890 O.2 161 VAL161 -0.2778 2513 CB 122.6943 131.7675 77.4456 C.3 161 VAL161 -0.0227 2514 CG1 123.1930 132.9577 76.6050 C.3 161 VAL161 -0.0608 2515 CG2 123.5370 130.5130 77.1704 C.3 161 VAL161 -0.0608 2516 H 121.9970 134.1440 79.1830 H 161 VAL161 0.1312 2517 HA 122.2223 131.2446 79.5206 H 161 VAL161 0.0560 2518 HB 121.6826 131.5402 77.1066 H 161 VAL161 0.0315 2519 HG11 123.1894 132.7106 75.5433 H 161 VAL161 0.0233 2520 HG12 124.2122 133.2377 76.8733 H 161 VAL161 0.0233 2521 HG13 122.5614 133.8372 76.7347 H 161 VAL161 0.0233 2522 HG21 123.4571 130.2151 76.1248 H 161 VAL161 0.0233 2523 HG22 123.2035 129.6728 77.7796 H 161 VAL161 0.0233 2524 HG23 124.5931 130.6828 77.3778 H 161 VAL161 0.0233 2525 N 124.7910 131.5280 79.9020 N.am 162 VAL162 -0.2454 2526 CA 126.1740 131.7430 80.2830 C.3 162 VAL162 0.0901 2527 C 127.0290 131.8190 79.0230 C.2 162 VAL162 0.2189 2528 O 127.1170 130.8610 78.2550 O.2 162 VAL162 -0.2778 2529 CB 126.6646 130.6818 81.2876 C.3 162 VAL162 -0.0227 2530 CG1 128.0287 131.0821 81.8700 C.3 162 VAL162 -0.0608 2531 CG2 125.6636 130.4791 82.4378 C.3 162 VAL162 -0.0608 2532 H 124.4390 130.5710 79.9120 H 162 VAL162 0.1312 2533 HA 126.2203 132.7145 80.7722 H 162 VAL162 0.0560 2534 HB 126.7748 129.7289 80.7678 H 162 VAL162 0.0315 2535 HG11 128.4051 130.3173 82.5479 H 162 VAL162 0.0233 2536 HG12 127.9480 132.0115 82.4342 H 162 VAL162 0.0233 2537 HG13 128.7765 131.2310 81.0908 H 162 VAL162 0.0233 2538 HG21 126.0540 129.7803 83.1783 H 162 VAL162 0.0233 2539 HG22 124.7137 130.0782 82.0842 H 162 VAL162 0.0233 2540 HG23 125.4580 131.4201 82.9493 H 162 VAL162 0.0233 2541 N 127.6750 132.9700 78.7630 N.am 163 ALA163 -0.2459 2542 CA 128.5400 133.1700 77.6270 C.3 163 ALA163 0.0850 2543 C 129.9830 132.9200 78.0110 C.2 163 ALA163 0.2184 2544 O 130.7000 133.7890 78.5030 O.2 163 ALA163 -0.2778 2545 CB 128.3577 134.5925 77.0981 C.3 163 ALA163 -0.0411 2546 H 127.5450 133.7490 79.4090 H 163 ALA163 0.1312 2547 HA 128.2622 132.4619 76.8439 H 163 ALA163 0.0554 2548 HB1 129.0641 134.8168 76.2980 H 163 ALA163 0.0249 2549 HB2 128.4877 135.3350 77.8867 H 163 ALA163 0.0249 2550 HB3 127.3572 134.6984 76.6864 H 163 ALA163 0.0249 2551 N 130.4540 131.6860 77.8070 N.am 164 TRP164 -0.2453 2552 CA 131.8220 131.3230 78.0910 C.3 164 TRP164 0.0920 2553 C 132.8320 131.9640 77.1570 C.2 164 TRP164 0.2217 2554 O 132.5070 132.1970 75.9920 O.2 164 TRP164 -0.2776 2555 CB 131.9527 129.7917 78.1141 C.3 164 TRP164 -0.0021 2556 CG 131.1786 129.2563 79.3038 C.ar 164 TRP164 -0.0260 2557 CD1 129.8121 128.9608 79.3328 C.ar 164 TRP164 -0.0136 2558 CD2 131.6726 129.0340 80.6425 C.ar 164 TRP164 -0.0028 2559 NE1 129.4613 128.5889 80.5884 N.ar 164 TRP164 -0.2641 2560 CE2 130.5682 128.6246 81.4262 C.ar 164 TRP164 0.0269 2561 CE3 132.9085 129.1630 81.2192 C.ar 164 TRP164 -0.0528 2562 CZ2 130.7321 128.3595 82.7589 C.ar 164 TRP164 -0.0430 2563 CZ3 133.0782 128.8974 82.5787 C.ar 164 TRP164 -0.0611 2564 CH2 131.9875 128.4982 83.3506 C.ar 164 TRP164 -0.0602 2565 H 129.8240 130.9750 77.4370 H 164 TRP164 0.1312 2566 HA 132.0048 131.6932 79.0995 H 164 TRP164 0.0561 2567 HB1 132.9971 129.4872 78.2002 H 164 TRP164 0.0334 2568 HB2 131.5679 129.3548 77.1920 H 164 TRP164 0.0334 2569 HD1 129.1357 129.0473 78.4940 H 164 TRP164 0.0748 2570 HE1 128.5543 128.3456 80.8678 H 164 TRP164 0.1331 2571 HE3 133.7526 129.4719 80.6215 H 164 TRP164 0.0624 2572 HZ2 129.8851 128.0506 83.3531 H 164 TRP164 0.0633 2573 HZ3 134.0510 129.0034 83.0358 H 164 TRP164 0.0618 2574 HH2 132.1143 128.2972 84.4044 H 164 TRP164 0.0618 2575 N 134.0600 132.2770 77.5890 N.am 165 PRO165 -0.2316 2576 CA 135.1590 132.5820 76.6780 C.3 165 PRO165 0.0907 2577 C 135.3030 131.5850 75.5410 C.2 165 PRO165 0.2189 2578 O 135.2290 130.3790 75.7790 O.2 165 PRO165 -0.2778 2579 CB 136.3851 132.5793 77.6011 C.3 165 PRO165 -0.0276 2580 CG 135.8303 132.9215 78.9824 C.3 165 PRO165 -0.0379 2581 CD 134.4312 132.3070 78.9993 C.3 165 PRO165 0.0071 2582 HA 134.9618 133.5784 76.2808 H 165 PRO165 0.0559 2583 HB1 137.1568 133.2752 77.2716 H 165 PRO165 0.0285 2584 HB2 136.8351 131.5855 77.6427 H 165 PRO165 0.0285 2585 HG1 135.7508 134.0045 79.0825 H 165 PRO165 0.0278 2586 HG2 136.4594 132.5583 79.7953 H 165 PRO165 0.0278 2587 HD1 134.4375 131.2782 79.3592 H 165 PRO165 0.0431 2588 HD2 133.7176 132.9129 79.5583 H 165 PRO165 0.0431 2589 N 135.4660 132.0850 74.3050 N.am 166 GLU166 -0.2456 2590 CA 135.6060 131.2650 73.1210 C.3 166 GLU166 0.0883 2591 C 136.9110 130.4820 73.1250 C.2 166 GLU166 0.2187 2592 O 137.9700 131.0070 73.4680 O.2 166 GLU166 -0.2778 2593 CB 135.4841 132.1547 71.8702 C.3 166 GLU166 -0.0193 2594 CG 135.3550 131.3835 70.5386 C.3 166 GLU166 0.0356 2595 CD 136.7074 131.0329 69.9002 C.2 166 GLU166 0.1760 2596 OE1 137.4367 131.9538 69.5400 O.co2 166 GLU166 -0.6478 2597 OE2 137.0126 129.8499 69.7623 O.co2 166 GLU166 -0.6478 2598 H 135.4930 133.0990 74.1950 H 166 GLU166 0.1312 2599 HA 134.7783 130.5544 73.1393 H 166 GLU166 0.0557 2600 HB1 136.3093 132.8674 71.8229 H 166 GLU166 0.0290 2601 HB2 134.5845 132.7588 71.9861 H 166 GLU166 0.0290 2602 HG1 134.8250 131.9974 69.8118 H 166 GLU166 0.0374 2603 HG2 134.7675 130.4747 70.6663 H 166 GLU166 0.0374 2604 N 136.8350 129.1810 72.8020 N.am 167 ASP167 -0.2451 2605 CA 137.9710 128.3030 72.7780 C.3 167 ASP167 0.0974 2606 C 137.6640 127.3090 71.6880 C.2 167 ASP167 0.2193 2607 O 136.5100 126.9350 71.4780 O.2 167 ASP167 -0.2778 2608 CB 138.1817 127.6819 74.1670 C.3 167 ASP167 0.0576 2609 CG 139.3372 126.6676 74.1884 C.2 167 ASP167 0.1780 2610 OD1 139.0865 125.4747 74.2645 O.co2 167 ASP167 -0.6478 2611 OD2 140.5017 127.0419 74.1236 O.co2 167 ASP167 -0.6478 2612 H 135.9220 128.7960 72.5610 H 167 ASP167 0.1312 2613 HA 138.8408 128.8865 72.4678 H 167 ASP167 0.0563 2614 HB1 137.2708 127.1892 74.5038 H 167 ASP167 0.0394 2615 HB2 138.4034 128.4644 74.8915 H 167 ASP167 0.0394 2616 N 138.7220 126.8160 71.0230 N.am 168 SER168 -0.2436 2617 CA 138.6670 125.9280 69.8710 C.3 168 SER168 0.1109 2618 C 138.2320 124.5270 70.2610 C.2 168 SER168 0.2207 2619 O 137.7970 123.7360 69.4260 O.2 168 SER168 -0.2777 2620 CB 140.0680 125.8840 69.2466 C.3 168 SER168 0.0681 2621 OG 141.0370 125.3197 70.1403 O.3 168 SER168 -0.3930 2622 H 139.6470 127.0880 71.3550 H 168 SER168 0.1312 2623 HA 137.9379 126.3507 69.1771 H 168 SER168 0.0580 2624 HB1 140.3428 126.9119 68.9779 H 168 SER168 0.0577 2625 HB2 140.0282 125.3030 68.3189 H 168 SER168 0.0577 2626 HG 141.9086 125.3867 69.7568 H 168 SER168 0.2095 2627 N 138.3290 124.2070 71.5710 N.am 169 GLY169 -0.2484 2628 CA 137.9230 122.9240 72.1290 C.3 169 GLY169 0.0765 2629 C 137.0150 123.0320 73.3190 C.2 169 GLY169 0.2153 2630 O 136.6500 122.0220 73.9120 O.2 169 GLY169 -0.2781 2631 H 138.7100 124.9070 72.2080 H 169 GLY169 0.1309 2632 HA1 138.8311 122.4006 72.4223 H 169 GLY169 0.0521 2633 HA2 137.4159 122.3344 71.3639 H 169 GLY169 0.0521 2634 N 136.6350 124.2610 73.7210 N.am 170 GLY170 -0.2487 2635 CA 135.7680 124.5050 74.8750 C.3 170 GLY170 0.0765 2636 C 136.2730 124.0300 76.2230 C.2 170 GLY170 0.2155 2637 O 135.4950 123.5760 77.0620 O.2 170 GLY170 -0.2781 2638 H 136.9700 125.0660 73.1920 H 170 GLY170 0.1309 2639 HA1 134.8099 124.0294 74.6636 H 170 GLY170 0.0521 2640 HA2 135.6070 125.5814 74.9175 H 170 GLY170 0.0521 2641 N 137.5930 124.1140 76.4800 N.am 171 LYS171 -0.2459 2642 CA 138.2240 123.5320 77.6520 C.3 171 LYS171 0.0878 2643 C 137.7270 124.0760 78.9840 C.2 171 LYS171 0.2187 2644 O 137.4700 123.3180 79.9170 O.2 171 LYS171 -0.2778 2645 CB 139.7377 123.8002 77.4745 C.3 171 LYS171 -0.0289 2646 CG 140.3349 123.2726 76.1417 C.3 171 LYS171 -0.0496 2647 CD 141.5945 124.0464 75.6981 C.3 171 LYS171 -0.0278 2648 CE 141.9874 123.8366 74.2187 C.3 171 LYS171 0.1103 2649 NZ 141.2889 124.7315 73.2947 N.4 171 LYS171 -0.0749 2650 H 138.1820 124.6140 75.8140 H 171 LYS171 0.1312 2651 HA 138.0192 122.4610 77.6204 H 171 LYS171 0.0557 2652 HB1 140.2996 123.3867 78.3130 H 171 LYS171 0.0285 2653 HB2 139.8895 124.8804 77.5164 H 171 LYS171 0.0285 2654 HG1 139.6066 123.3269 75.3356 H 171 LYS171 0.0266 2655 HG2 140.5611 122.2105 76.2382 H 171 LYS171 0.0266 2656 HD1 142.4222 123.7473 76.3416 H 171 LYS171 0.0282 2657 HD2 141.4560 125.1148 75.8724 H 171 LYS171 0.0282 2658 HE1 141.8056 122.8061 73.9100 H 171 LYS171 0.0559 2659 HE2 143.0543 124.0299 74.0983 H 171 LYS171 0.0559 2660 HZ1 141.5678 124.6140 72.3042 H 171 LYS171 0.2742 2661 HZ2 141.4257 125.7236 73.5840 H 171 LYS171 0.2742 2662 HZ3 140.2601 124.6103 73.3867 H 171 LYS171 0.2742 2663 N 137.5550 125.4090 79.0930 N.am 172 THR172 -0.2434 2664 CA 137.1600 126.1030 80.3250 C.3 172 THR172 0.1135 2665 C 135.8330 125.6670 80.8740 C.2 172 THR172 0.2212 2666 O 135.6830 125.3750 82.0600 O.2 172 THR172 -0.2777 2667 CB 137.1648 127.6200 80.0418 C.3 172 THR172 0.0763 2668 OG1 138.4528 127.9499 79.5470 O.3 172 THR172 -0.3900 2669 CG2 136.8634 128.4688 81.2897 C.3 172 THR172 -0.0370 2670 H 137.7100 125.9760 78.2590 H 172 THR172 0.1313 2671 HA 137.9245 125.8645 81.0653 H 172 THR172 0.0583 2672 HB 136.4124 127.8224 79.2688 H 172 THR172 0.0611 2673 HG1 138.4874 128.8535 79.2451 H 172 THR172 0.2098 2674 HG21 136.8456 129.5341 81.0582 H 172 THR172 0.0255 2675 HG22 137.6164 128.3055 82.0608 H 172 THR172 0.0255 2676 HG23 135.8928 128.2197 81.7160 H 172 THR172 0.0255 2677 N 134.8340 125.5860 79.9830 N.am 173 LEU173 -0.2456 2678 CA 133.5240 125.0930 80.2900 C.3 173 LEU173 0.0880 2679 C 133.5380 123.6310 80.6890 C.2 173 LEU173 0.2187 2680 O 132.9900 123.2530 81.7210 O.2 173 LEU173 -0.2778 2681 CB 132.6804 125.2973 79.0135 C.3 173 LEU173 -0.0266 2682 CG 131.2869 124.6404 79.0102 C.3 173 LEU173 -0.0449 2683 CD1 130.4018 125.1785 80.1343 C.3 173 LEU173 -0.0626 2684 CD2 130.6027 124.8359 77.6517 C.3 173 LEU173 -0.0626 2685 H 135.0180 125.8940 79.0280 H 173 LEU173 0.1312 2686 HA 133.1330 125.6825 81.1208 H 173 LEU173 0.0557 2687 HB1 133.2391 124.9056 78.1613 H 173 LEU173 0.0287 2688 HB2 132.5753 126.3671 78.8286 H 173 LEU173 0.0287 2689 HG 131.4011 123.5658 79.1576 H 173 LEU173 0.0296 2690 HD11 129.4453 124.6573 80.1547 H 173 LEU173 0.0232 2691 HD12 130.1971 126.2340 79.9864 H 173 LEU173 0.0232 2692 HD13 130.8732 125.0611 81.1093 H 173 LEU173 0.0232 2693 HD21 129.6294 124.3453 77.6281 H 173 LEU173 0.0232 2694 HD22 131.2040 124.4149 76.8452 H 173 LEU173 0.0232 2695 HD23 130.4494 125.8940 77.4367 H 173 LEU173 0.0232 2696 N 134.2450 122.7850 79.9190 N.am 174 LEU174 -0.2456 2697 CA 134.3360 121.3710 80.1930 C.3 174 LEU174 0.0880 2698 C 134.9430 121.0570 81.5540 C.2 174 LEU174 0.2187 2699 O 134.4010 120.2610 82.3220 O.2 174 LEU174 -0.2778 2700 CB 135.1358 120.7147 79.0549 C.3 174 LEU174 -0.0266 2701 CG 135.2555 119.1814 79.1505 C.3 174 LEU174 -0.0449 2702 CD1 133.8819 118.4954 79.1767 C.3 174 LEU174 -0.0626 2703 CD2 136.1042 118.6396 77.9940 C.3 174 LEU174 -0.0626 2704 H 134.7370 123.1580 79.1070 H 174 LEU174 0.1312 2705 HA 133.3100 121.0017 80.1927 H 174 LEU174 0.0557 2706 HB1 136.1346 121.1526 79.0206 H 174 LEU174 0.0287 2707 HB2 134.6691 120.9750 78.1039 H 174 LEU174 0.0287 2708 HG 135.7752 118.9314 80.0752 H 174 LEU174 0.0296 2709 HD11 133.9833 117.4100 79.1666 H 174 LEU174 0.0232 2710 HD12 133.2882 118.7811 78.3088 H 174 LEU174 0.0232 2711 HD13 133.3196 118.7572 80.0729 H 174 LEU174 0.0232 2712 HD21 136.2327 117.5599 78.0738 H 174 LEU174 0.0232 2713 HD22 137.0959 119.0924 77.9893 H 174 LEU174 0.0232 2714 HD23 135.6368 118.8497 77.0313 H 174 LEU174 0.0232 2715 N 136.0560 121.7340 81.9090 N.am 175 LEU175 -0.2456 2716 CA 136.6660 121.6270 83.2210 C.3 175 LEU175 0.0880 2717 C 135.7620 122.1030 84.3450 C.2 175 LEU175 0.2187 2718 O 135.6100 121.4080 85.3460 O.2 175 LEU175 -0.2778 2719 CB 137.9742 122.4370 83.2086 C.3 175 LEU175 -0.0266 2720 CG 139.0482 121.8653 82.2623 C.3 175 LEU175 -0.0449 2721 CD1 140.1338 122.9115 81.9798 C.3 175 LEU175 -0.0626 2722 CD2 139.6694 120.5783 82.8221 C.3 175 LEU175 -0.0626 2723 H 136.4890 122.3510 81.2210 H 175 LEU175 0.1312 2724 HA 136.8669 120.5689 83.3909 H 175 LEU175 0.0557 2725 HB1 138.3906 122.5043 84.2149 H 175 LEU175 0.0287 2726 HB2 137.7406 123.4608 82.9099 H 175 LEU175 0.0287 2727 HG 138.5888 121.6178 81.3058 H 175 LEU175 0.0296 2728 HD11 140.8812 122.5244 81.2870 H 175 LEU175 0.0232 2729 HD12 140.6459 123.2060 82.8961 H 175 LEU175 0.0232 2730 HD13 139.7052 123.8090 81.5322 H 175 LEU175 0.0232 2731 HD21 140.4346 120.1904 82.1494 H 175 LEU175 0.0232 2732 HD22 138.9223 119.7955 82.9498 H 175 LEU175 0.0232 2733 HD23 140.1373 120.7558 83.7907 H 175 LEU175 0.0232 2734 N 135.0860 123.2630 84.1890 N.am 176 TYR176 -0.2453 2735 CA 134.1120 123.7510 85.1510 C.3 176 TYR176 0.0917 2736 C 132.9530 122.7680 85.3630 C.2 176 TYR176 0.2190 2737 O 132.6710 122.3950 86.5000 O.2 176 TYR176 -0.2778 2738 CB 133.5686 125.1233 84.7106 C.3 176 TYR176 -0.0036 2739 CG 132.5083 125.6270 85.6606 C.ar 176 TYR176 -0.0453 2740 CD1 132.8613 126.1461 86.9030 C.ar 176 TYR176 -0.0561 2741 CD2 131.1579 125.4798 85.3511 C.ar 176 TYR176 -0.0561 2742 CE1 131.8822 126.4913 87.8266 C.ar 176 TYR176 -0.0317 2743 CE2 130.1784 125.8198 86.2752 C.ar 176 TYR176 -0.0317 2744 CZ 130.5425 126.3204 87.5161 C.ar 176 TYR176 0.0726 2745 OH 129.5802 126.6418 88.4490 O.3 176 TYR176 -0.3598 2746 H 135.2680 123.8230 83.3560 H 176 TYR176 0.1312 2747 HA 134.6400 123.8465 86.1009 H 176 TYR176 0.0560 2748 HB1 133.1551 125.0611 83.7027 H 176 TYR176 0.0333 2749 HB2 134.3818 125.8477 84.6624 H 176 TYR176 0.0333 2750 HD1 133.9027 126.2464 87.1712 H 176 TYR176 0.0621 2751 HD2 130.8679 125.0547 84.4014 H 176 TYR176 0.0621 2752 HE1 132.1544 126.8717 88.8003 H 176 TYR176 0.0643 2753 HE2 129.1347 125.6759 86.0392 H 176 TYR176 0.0643 2754 HH 128.7318 126.3174 88.1746 H 176 TYR176 0.2173 2755 N 132.2960 122.2720 84.2820 N.am 177 HIS177 -0.2453 2756 CA 131.2120 121.2990 84.4250 C.3 177 HIS177 0.0932 2757 C 131.6360 119.9880 85.0570 C.2 177 HIS177 0.2190 2758 O 130.9780 119.5050 85.9720 O.2 177 HIS177 -0.2778 2759 CB 130.5278 121.0752 83.0669 C.3 177 HIS177 0.0146 2760 CG 129.4318 122.1051 82.9081 C.ar 177 HIS177 0.0551 2761 ND1 129.6481 123.4180 82.6854 N.ar 177 HIS177 -0.2469 2762 CD2 128.0598 121.9240 83.1456 C.ar 177 HIS177 0.0047 2763 CE1 128.4424 124.0088 82.7418 C.ar 177 HIS177 0.0737 2764 NE2 127.4616 123.1299 83.0129 N.ar 177 HIS177 -0.2539 2765 H 132.5640 122.5850 83.3490 H 177 HIS177 0.1312 2766 HA 130.4941 121.7610 85.0983 H 177 HIS177 0.0561 2767 HB1 130.0668 120.0882 83.0026 H 177 HIS177 0.0348 2768 HB2 131.2420 121.1522 82.2462 H 177 HIS177 0.0348 2769 HD2 127.5830 120.9909 83.4056 H 177 HIS177 0.0764 2770 HE1 128.2887 125.0674 82.5877 H 177 HIS177 0.0963 2771 HE2 126.5066 123.3248 83.1124 H 177 HIS177 0.1339 2772 N 132.7610 119.3790 84.6420 N.am 178 LEU178 -0.2456 2773 CA 133.2400 118.1550 85.2660 C.3 178 LEU178 0.0880 2774 C 133.6170 118.3160 86.7380 C.2 178 LEU178 0.2187 2775 O 133.2650 117.4810 87.5720 O.2 178 LEU178 -0.2778 2776 CB 134.4446 117.6352 84.4627 C.3 178 LEU178 -0.0266 2777 CG 134.1058 117.2200 83.0170 C.3 178 LEU178 -0.0449 2778 CD1 135.3915 117.0020 82.2100 C.3 178 LEU178 -0.0626 2779 CD2 133.2209 115.9683 82.9673 C.3 178 LEU178 -0.0626 2780 H 133.2910 119.7850 83.8710 H 178 LEU178 0.1312 2781 HA 132.4205 117.4375 85.2253 H 178 LEU178 0.0557 2782 HB1 134.8982 116.7843 84.9733 H 178 LEU178 0.0287 2783 HB2 135.2071 118.4162 84.4409 H 178 LEU178 0.0287 2784 HG 133.5529 118.0231 82.5320 H 178 LEU178 0.0296 2785 HD11 135.1681 116.7383 81.1764 H 178 LEU178 0.0232 2786 HD12 135.9933 116.1995 82.6368 H 178 LEU178 0.0232 2787 HD13 136.0014 117.9059 82.1967 H 178 LEU178 0.0232 2788 HD21 133.0240 115.6766 81.9353 H 178 LEU178 0.0232 2789 HD22 132.2565 116.1404 83.4443 H 178 LEU178 0.0232 2790 HD23 133.6984 115.1252 83.4669 H 178 LEU178 0.0232 2791 N 134.3110 119.4230 87.0960 N.am 179 VAL179 -0.2454 2792 CA 134.6420 119.7730 88.4760 C.3 179 VAL179 0.0901 2793 C 133.4040 119.9850 89.3340 C.2 179 VAL179 0.2189 2794 O 133.2770 119.3880 90.4030 O.2 179 VAL179 -0.2778 2795 CB 135.5878 120.9949 88.4833 C.3 179 VAL179 -0.0227 2796 CG1 135.7619 121.6238 89.8766 C.3 179 VAL179 -0.0608 2797 CG2 136.9676 120.6149 87.9212 C.3 179 VAL179 -0.0608 2798 H 134.6220 120.0520 86.3560 H 179 VAL179 0.1312 2799 HA 135.1639 118.9101 88.8923 H 179 VAL179 0.0560 2800 HB 135.1537 121.7584 87.8357 H 179 VAL179 0.0315 2801 HG11 136.4959 122.4294 89.8532 H 179 VAL179 0.0233 2802 HG12 136.0999 120.8846 90.6034 H 179 VAL179 0.0233 2803 HG13 134.8294 122.0543 90.2413 H 179 VAL179 0.0233 2804 HG21 137.5967 121.4971 87.8015 H 179 VAL179 0.0233 2805 HG22 136.8975 120.1271 86.9498 H 179 VAL179 0.0233 2806 HG23 137.4841 119.9264 88.5904 H 179 VAL179 0.0233 2807 N 132.4170 120.7870 88.8660 N.am 180 VAL180 -0.2454 2808 CA 131.1740 121.0210 89.5960 C.3 180 VAL180 0.0901 2809 C 130.3380 119.7580 89.7580 C.2 180 VAL180 0.2189 2810 O 129.7980 119.4920 90.8280 O.2 180 VAL180 -0.2778 2811 CB 130.3922 122.2368 89.0502 C.3 180 VAL180 -0.0227 2812 CG1 129.5940 121.9215 87.7863 C.3 180 VAL180 -0.0608 2813 CG2 129.4670 122.8484 90.1104 C.3 180 VAL180 -0.0608 2814 H 132.5480 121.2470 87.9650 H 180 VAL180 0.1312 2815 HA 131.5052 121.2836 90.6028 H 180 VAL180 0.0560 2816 HB 131.1282 123.0003 88.7926 H 180 VAL180 0.0315 2817 HG11 129.2211 122.8301 87.3128 H 180 VAL180 0.0233 2818 HG12 128.7429 121.2725 87.9935 H 180 VAL180 0.0233 2819 HG13 130.2348 121.4110 87.0834 H 180 VAL180 0.0233 2820 HG21 128.9757 123.7432 89.7274 H 180 VAL180 0.0233 2821 HG22 130.0266 123.1393 90.9962 H 180 VAL180 0.0233 2822 HG23 128.6932 122.1452 90.4193 H 180 VAL180 0.0233 2823 N 130.2650 118.8880 88.7250 N.am 181 ILE181 -0.2454 2824 CA 129.6440 117.5680 88.8220 C.3 181 ILE181 0.0903 2825 C 130.2940 116.7040 89.8880 C.2 181 ILE181 0.2189 2826 O 129.6180 116.1190 90.7340 O.2 181 ILE181 -0.2778 2827 CB 129.6410 116.8939 87.4318 C.3 181 ILE181 -0.0201 2828 CG1 128.7000 117.6395 86.4638 C.3 181 ILE181 -0.0514 2829 CG2 129.2581 115.4020 87.5000 C.3 181 ILE181 -0.0605 2830 CD1 128.9893 117.3227 84.9957 C.3 181 ILE181 -0.0650 2831 H 130.6650 119.1680 87.8290 H 181 ILE181 0.1312 2832 HA 128.6173 117.7400 89.1457 H 181 ILE181 0.0560 2833 HB 130.6565 116.9592 87.0374 H 181 ILE181 0.0318 2834 HG11 128.7719 118.7175 86.6041 H 181 ILE181 0.0266 2835 HG12 127.6646 117.3836 86.6849 H 181 ILE181 0.0266 2836 HG21 129.2127 114.9490 86.5107 H 181 ILE181 0.0233 2837 HG22 128.2858 115.2663 87.9743 H 181 ILE181 0.0233 2838 HG23 129.9903 114.8294 88.0684 H 181 ILE181 0.0233 2839 HD11 128.3242 117.8830 84.3380 H 181 ILE181 0.0230 2840 HD12 128.8454 116.2627 84.8039 H 181 ILE181 0.0230 2841 HD13 130.0143 117.5681 84.7211 H 181 ILE181 0.0230 2842 N 131.6370 116.6490 89.9230 N.am 182 ALA182 -0.2459 2843 CA 132.3520 115.9000 90.9310 C.3 182 ALA182 0.0850 2844 C 132.2190 116.3860 92.3690 C.2 182 ALA182 0.2184 2845 O 132.0130 115.5980 93.2920 O.2 182 ALA182 -0.2778 2846 CB 133.8330 115.8949 90.5332 C.3 182 ALA182 -0.0411 2847 H 132.1690 117.1530 89.2140 H 182 ALA182 0.1312 2848 HA 131.9770 114.8798 90.8911 H 182 ALA182 0.0554 2849 HB1 134.4278 115.2819 91.2114 H 182 ALA182 0.0249 2850 HB2 134.2496 116.9031 90.5360 H 182 ALA182 0.0249 2851 HB3 133.9607 115.4926 89.5280 H 182 ALA182 0.0249 2852 N 132.3170 117.7080 92.5890 N.am 183 LEU183 -0.2457 2853 CA 132.1810 118.3000 93.9040 C.3 183 LEU183 0.0880 2854 C 130.7540 118.2470 94.4550 C.2 183 LEU183 0.2187 2855 O 130.5500 118.1510 95.6620 O.2 183 LEU183 -0.2778 2856 CB 132.5735 119.7884 93.8104 C.3 183 LEU183 -0.0266 2857 CG 134.0427 120.0588 93.4405 C.3 183 LEU183 -0.0449 2858 CD1 134.2286 121.5394 93.0820 C.3 183 LEU183 -0.0626 2859 CD2 135.0000 119.6504 94.5658 C.3 183 LEU183 -0.0626 2860 H 132.4950 118.3220 91.7940 H 183 LEU183 0.1312 2861 HA 132.8345 117.7565 94.5847 H 183 LEU183 0.0557 2862 HB1 132.3584 120.2949 94.7535 H 183 LEU183 0.0287 2863 HB2 131.9321 120.2651 93.0660 H 183 LEU183 0.0287 2864 HG 134.3068 119.4745 92.5607 H 183 LEU183 0.0296 2865 HD11 135.2585 121.7494 92.7936 H 183 LEU183 0.0232 2866 HD12 133.9788 122.1841 93.9251 H 183 LEU183 0.0232 2867 HD13 133.5860 121.8224 92.2475 H 183 LEU183 0.0232 2868 HD21 136.0305 119.8991 94.3112 H 183 LEU183 0.0232 2869 HD22 134.9612 118.5774 94.7424 H 183 LEU183 0.0232 2870 HD23 134.7543 120.1573 95.4992 H 183 LEU183 0.0232 2871 N 129.7260 118.2770 93.5790 N.am 184 ILE184 -0.2454 2872 CA 128.3370 118.3830 94.0120 C.3 184 ILE184 0.0903 2873 C 127.5900 117.0580 93.9850 C.2 184 ILE184 0.2189 2874 O 126.6840 116.8440 94.7890 O.2 184 ILE184 -0.2778 2875 CB 127.6248 119.4496 93.1478 C.3 184 ILE184 -0.0201 2876 CG1 128.2803 120.8356 93.3083 C.3 184 ILE184 -0.0514 2877 CG2 126.1110 119.5430 93.4137 C.3 184 ILE184 -0.0605 2878 CD1 128.2107 121.3818 94.7412 C.3 184 ILE184 -0.0650 2879 H 129.9280 118.2240 92.5810 H 184 ILE184 0.1312 2880 HA 128.3194 118.7044 95.0537 H 184 ILE184 0.0560 2881 HB 127.7344 119.1561 92.1035 H 184 ILE184 0.0318 2882 HG11 127.7950 121.5373 92.6320 H 184 ILE184 0.0266 2883 HG12 129.3227 120.8056 92.9903 H 184 ILE184 0.0266 2884 HG21 125.6640 120.3706 92.8624 H 184 ILE184 0.0233 2885 HG22 125.9104 119.6984 94.4724 H 184 ILE184 0.0233 2886 HG23 125.5898 118.6356 93.1085 H 184 ILE184 0.0233 2887 HD11 128.5604 122.4090 94.7799 H 184 ILE184 0.0230 2888 HD12 128.8373 120.8019 95.4174 H 184 ILE184 0.0230 2889 HD13 127.1956 121.3795 95.1354 H 184 ILE184 0.0230 2890 N 127.9610 116.0940 93.1170 N.am 185 TYR185 -0.2453 2891 CA 127.3340 114.7850 93.1580 C.3 185 TYR185 0.0917 2892 C 128.1910 113.7680 93.9040 C.2 185 TYR185 0.2190 2893 O 127.7740 113.2020 94.9130 O.2 185 TYR185 -0.2778 2894 CB 127.0176 114.3177 91.7262 C.3 185 TYR185 -0.0036 2895 CG 126.1414 113.0885 91.7138 C.ar 185 TYR185 -0.0453 2896 CD1 124.7651 113.2006 91.8959 C.ar 185 TYR185 -0.0561 2897 CD2 126.6947 111.8217 91.5508 C.ar 185 TYR185 -0.0561 2898 CE1 123.9604 112.0677 91.9212 C.ar 185 TYR185 -0.0317 2899 CE2 125.8897 110.6899 91.5573 C.ar 185 TYR185 -0.0317 2900 CZ 124.5208 110.8127 91.7449 C.ar 185 TYR185 0.0726 2901 OH 123.7196 109.6901 91.7784 O.3 185 TYR185 -0.3598 2902 H 128.6870 116.2860 92.4270 H 185 TYR185 0.1312 2903 HA 126.3874 114.8564 93.6966 H 185 TYR185 0.0560 2904 HB1 127.9313 114.1300 91.1620 H 185 TYR185 0.0333 2905 HB2 126.4974 115.1136 91.1933 H 185 TYR185 0.0333 2906 HD1 124.3157 114.1733 92.0318 H 185 TYR185 0.0621 2907 HD2 127.7606 111.7091 91.4301 H 185 TYR185 0.0621 2908 HE1 122.8965 112.1530 92.0818 H 185 TYR185 0.0643 2909 HE2 126.3307 109.7124 91.4351 H 185 TYR185 0.0643 2910 HH 124.2433 108.9177 91.6155 H 185 TYR185 0.2173 2911 N 129.4240 113.5060 93.4200 N.am 186 PHE186 -0.2453 2912 CA 130.1960 112.3440 93.8390 C.3 186 PHE186 0.0917 2913 C 130.7260 112.4120 95.2640 C.2 186 PHE186 0.2190 2914 O 130.5600 111.4740 96.0440 O.2 186 PHE186 -0.2778 2915 CB 131.3354 112.1176 92.8320 C.3 186 PHE186 -0.0036 2916 CG 130.8136 111.5884 91.5198 C.ar 186 PHE186 -0.0454 2917 CD1 130.7700 110.2161 91.2899 C.ar 186 PHE186 -0.0585 2918 CD2 130.3383 112.4492 90.5335 C.ar 186 PHE186 -0.0585 2919 CE1 130.2671 109.7132 90.0970 C.ar 186 PHE186 -0.0615 2920 CE2 129.8329 111.9493 89.3405 C.ar 186 PHE186 -0.0615 2921 CZ 129.7984 110.5801 89.1205 C.ar 186 PHE186 -0.0617 2922 H 129.8300 114.1450 92.7360 H 186 PHE186 0.1312 2923 HA 129.5144 111.4915 93.8062 H 186 PHE186 0.0560 2924 HB1 132.0577 111.4002 93.2251 H 186 PHE186 0.0333 2925 HB2 131.8858 113.0438 92.6624 H 186 PHE186 0.0333 2926 HD1 131.1234 109.5305 92.0464 H 186 PHE186 0.0620 2927 HD2 130.3256 113.5148 90.7009 H 186 PHE186 0.0620 2928 HE1 130.2375 108.6463 89.9306 H 186 PHE186 0.0618 2929 HE2 129.4532 112.6243 88.5883 H 186 PHE186 0.0618 2930 HZ 129.4019 110.1903 88.1944 H 186 PHE186 0.0618 2931 N 131.3430 113.5430 95.6620 N.am 187 LEU187 -0.2456 2932 CA 131.8480 113.7100 97.0200 C.3 187 LEU187 0.0883 2933 C 130.8120 113.6660 98.1470 C.2 187 LEU187 0.2214 2934 O 131.0420 112.9140 99.0980 O.2 187 LEU187 -0.2776 2935 CB 132.7084 114.9823 97.1331 C.3 187 LEU187 -0.0266 2936 CG 133.9019 115.0489 96.1623 C.3 187 LEU187 -0.0449 2937 CD1 134.7158 116.3229 96.4191 C.3 187 LEU187 -0.0626 2938 CD2 134.8103 113.8143 96.2505 C.3 187 LEU187 -0.0626 2939 H 131.4600 114.3040 94.9930 H 187 LEU187 0.1312 2940 HA 132.4902 112.8462 97.1945 H 187 LEU187 0.0557 2941 HB1 133.0894 115.0633 98.1525 H 187 LEU187 0.0287 2942 HB2 132.0872 115.8635 96.9745 H 187 LEU187 0.0287 2943 HG 133.5173 115.1055 95.1452 H 187 LEU187 0.0296 2944 HD11 135.5012 116.4441 95.6729 H 187 LEU187 0.0232 2945 HD12 135.1899 116.2945 97.4005 H 187 LEU187 0.0232 2946 HD13 134.0820 117.2087 96.3879 H 187 LEU187 0.0232 2947 HD21 135.6855 113.9293 95.6107 H 187 LEU187 0.0232 2948 HD22 134.2942 112.9117 95.9245 H 187 LEU187 0.0232 2949 HD23 135.1615 113.6549 97.2703 H 187 LEU187 0.0232 2950 N 129.6640 114.3480 98.1410 N.am 188 PRO188 -0.2316 2951 CA 128.7760 114.3270 99.2900 C.3 188 PRO188 0.0907 2952 C 127.9790 113.0480 99.3010 C.2 188 PRO188 0.2189 2953 O 127.6380 112.5910 100.3890 O.2 188 PRO188 -0.2778 2954 CB 127.8802 115.5416 99.0205 C.3 188 PRO188 -0.0276 2955 CG 127.8387 115.6809 97.5022 C.3 188 PRO188 -0.0379 2956 CD 129.2278 115.2294 97.0589 C.3 188 PRO188 0.0071 2957 HA 129.3479 114.4291 100.2134 H 188 PRO188 0.0559 2958 HB1 128.3810 116.4253 99.4117 H 188 PRO188 0.0285 2959 HB2 126.8897 115.4773 99.4736 H 188 PRO188 0.0285 2960 HG1 127.6082 116.6964 97.1807 H 188 PRO188 0.0278 2961 HG2 127.0805 115.0168 97.0850 H 188 PRO188 0.0278 2962 HD1 129.2095 114.7028 96.1140 H 188 PRO188 0.0431 2963 HD2 129.9209 116.0681 97.0109 H 188 PRO188 0.0431 2964 N 127.6980 112.4320 98.1250 N.am 189 LEU189 -0.2456 2965 CA 127.0660 111.1230 98.0520 C.3 189 LEU189 0.0880 2966 C 127.9070 110.0660 98.7260 C.2 189 LEU189 0.2187 2967 O 127.4140 109.3310 99.5760 O.2 189 LEU189 -0.2778 2968 CB 126.8114 110.7774 96.5726 C.3 189 LEU189 -0.0266 2969 CG 126.1736 109.3957 96.3187 C.3 189 LEU189 -0.0449 2970 CD1 124.8018 109.2483 96.9911 C.3 189 LEU189 -0.0626 2971 CD2 126.0488 109.1373 94.8126 C.3 189 LEU189 -0.0626 2972 H 127.9400 112.9070 97.2550 H 189 LEU189 0.1312 2973 HA 126.1229 111.2062 98.5934 H 189 LEU189 0.0557 2974 HB1 127.7575 110.8331 96.0315 H 189 LEU189 0.0287 2975 HB2 126.1760 111.5467 96.1335 H 189 LEU189 0.0287 2976 HG 126.8325 108.6284 96.7267 H 189 LEU189 0.0296 2977 HD11 124.3974 108.2482 96.8336 H 189 LEU189 0.0232 2978 HD12 124.0882 109.9577 96.5737 H 189 LEU189 0.0232 2979 HD13 124.8564 109.4085 98.0676 H 189 LEU189 0.0232 2980 HD21 125.6502 108.1422 94.6144 H 189 LEU189 0.0232 2981 HD22 127.0163 109.2151 94.3159 H 189 LEU189 0.0232 2982 HD23 125.3769 109.8616 94.3525 H 189 LEU189 0.0232 2983 N 129.2230 110.0140 98.4130 N.am 190 ALA190 -0.2459 2984 CA 130.1300 109.0980 99.0630 C.3 190 ALA190 0.0850 2985 C 130.2420 109.3460 100.5660 C.2 190 ALA190 0.2184 2986 O 130.0740 108.4230 101.3550 O.2 190 ALA190 -0.2778 2987 CB 131.5045 109.2347 98.3982 C.3 190 ALA190 -0.0411 2988 H 129.5850 110.6420 97.6950 H 190 ALA190 0.1312 2989 HA 129.7337 108.0931 98.9091 H 190 ALA190 0.0554 2990 HB1 132.2262 108.5394 98.8280 H 190 ALA190 0.0249 2991 HB2 131.9001 110.2455 98.5087 H 190 ALA190 0.0249 2992 HB3 131.4381 109.0255 97.3304 H 190 ALA190 0.0249 2993 N 130.4380 110.6080 101.0100 N.am 191 VAL191 -0.2454 2994 CA 130.5390 110.9470 102.4300 C.3 191 VAL191 0.0901 2995 C 129.2940 110.6030 103.2310 C.2 191 VAL191 0.2189 2996 O 129.3670 109.9540 104.2760 O.2 191 VAL191 -0.2778 2997 CB 130.8973 112.4480 102.5460 C.3 191 VAL191 -0.0227 2998 CG1 130.7830 113.0029 103.9780 C.3 191 VAL191 -0.0608 2999 CG2 132.3120 112.7162 102.0084 C.3 191 VAL191 -0.0608 3000 H 130.5190 111.3580 100.3240 H 191 VAL191 0.1312 3001 HA 131.3527 110.3430 102.8343 H 191 VAL191 0.0560 3002 HB 130.1938 113.0058 101.9257 H 191 VAL191 0.0315 3003 HG11 131.0978 114.0460 104.0175 H 191 VAL191 0.0233 3004 HG12 131.4095 112.4388 104.6694 H 191 VAL191 0.0233 3005 HG13 129.7579 112.9676 104.3477 H 191 VAL191 0.0233 3006 HG21 132.5250 113.7851 101.9856 H 191 VAL191 0.0233 3007 HG22 132.4487 112.3342 100.9979 H 191 VAL191 0.0233 3008 HG23 133.0644 112.2409 102.6382 H 191 VAL191 0.0233 3009 N 128.1050 110.9920 102.7330 N.am 192 MET192 -0.2456 3010 CA 126.8390 110.6900 103.3630 C.3 192 MET192 0.0885 3011 C 126.5230 109.1990 103.3850 C.2 192 MET192 0.2187 3012 O 126.0910 108.6710 104.4080 O.2 192 MET192 -0.2778 3013 CB 125.7086 111.4906 102.6954 C.3 192 MET192 -0.0199 3014 CG 124.3571 111.3189 103.4100 C.3 192 MET192 -0.0047 3015 SD 123.1260 112.5049 102.8367 S.3 192 MET192 -0.1641 3016 CE 122.5064 111.6070 101.4013 C.3 192 MET192 -0.0181 3017 H 128.0970 111.5280 101.8650 H 192 MET192 0.1312 3018 HA 126.9370 111.0137 104.4006 H 192 MET192 0.0557 3019 HB1 125.6149 111.2090 101.6455 H 192 MET192 0.0293 3020 HB2 125.9806 112.5468 102.7012 H 192 MET192 0.0293 3021 HG1 124.4722 111.4446 104.4867 H 192 MET192 0.0377 3022 HG2 123.9714 110.3083 103.2714 H 192 MET192 0.0377 3023 HE1 121.7664 112.2032 100.8668 H 192 MET192 0.0340 3024 HE2 122.0514 110.6680 101.7136 H 192 MET192 0.0340 3025 HE3 123.3253 111.3700 100.7219 H 192 MET192 0.0340 3026 N 126.7790 108.4740 102.2680 N.am 193 PHE193 -0.2453 3027 CA 126.6530 107.0260 102.1870 C.3 193 PHE193 0.0917 3028 C 127.5410 106.3160 103.1910 C.2 193 PHE193 0.2190 3029 O 127.0590 105.4840 103.9490 O.2 193 PHE193 -0.2778 3030 CB 126.9948 106.5812 100.7538 C.3 193 PHE193 -0.0036 3031 CG 127.0701 105.0825 100.5978 C.ar 193 PHE193 -0.0454 3032 CD1 128.2867 104.4646 100.3212 C.ar 193 PHE193 -0.0585 3033 CD2 125.9376 104.2926 100.7685 C.ar 193 PHE193 -0.0585 3034 CE1 128.3680 103.0829 100.2084 C.ar 193 PHE193 -0.0615 3035 CE2 126.0142 102.9112 100.6510 C.ar 193 PHE193 -0.0615 3036 CZ 127.2305 102.3048 100.3710 C.ar 193 PHE193 -0.0617 3037 H 127.0790 108.9750 101.4310 H 193 PHE193 0.1312 3038 HA 125.6157 106.7860 102.4246 H 193 PHE193 0.0560 3039 HB1 127.9493 107.0154 100.4537 H 193 PHE193 0.0333 3040 HB2 126.2507 106.9714 100.0588 H 193 PHE193 0.0333 3041 HD1 129.1808 105.0599 100.2046 H 193 PHE193 0.0620 3042 HD2 124.9924 104.7495 101.0156 H 193 PHE193 0.0620 3043 HE1 129.3177 102.6137 99.9970 H 193 PHE193 0.0618 3044 HE2 125.1290 102.3084 100.7924 H 193 PHE193 0.0618 3045 HZ 127.2922 101.2298 100.2860 H 193 PHE193 0.0618 3046 N 128.8450 106.6600 103.2670 N.am 194 VAL194 -0.2454 3047 CA 129.7750 106.0310 104.1990 C.3 194 VAL194 0.0901 3048 C 129.3550 106.2370 105.6420 C.2 194 VAL194 0.2189 3049 O 129.2680 105.2860 106.4190 O.2 194 VAL194 -0.2778 3050 CB 131.2050 106.5380 103.9101 C.3 194 VAL194 -0.0227 3051 CG1 132.2168 106.1539 105.0046 C.3 194 VAL194 -0.0608 3052 CG2 131.7013 106.0138 102.5526 C.3 194 VAL194 -0.0608 3053 H 129.1940 107.3900 102.6470 H 194 VAL194 0.1312 3054 HA 129.7240 104.9581 104.0065 H 194 VAL194 0.0560 3055 HB 131.1706 107.6279 103.8591 H 194 VAL194 0.0315 3056 HG11 133.2225 106.4782 104.7369 H 194 VAL194 0.0233 3057 HG12 132.2435 105.0740 105.1536 H 194 VAL194 0.0233 3058 HG13 131.9754 106.6178 105.9612 H 194 VAL194 0.0233 3059 HG21 132.6601 106.4601 102.2883 H 194 VAL194 0.0233 3060 HG22 131.0040 106.2319 101.7453 H 194 VAL194 0.0233 3061 HG23 131.8341 104.9320 102.5784 H 194 VAL194 0.0233 3062 N 129.0110 107.4860 106.0160 N.am 195 ALA195 -0.2459 3063 CA 128.5610 107.8100 107.3490 C.3 195 ALA195 0.0850 3064 C 127.2570 107.1160 107.7400 C.2 195 ALA195 0.2184 3065 O 127.1680 106.4830 108.7890 O.2 195 ALA195 -0.2778 3066 CB 128.3792 109.3310 107.4190 C.3 195 ALA195 -0.0411 3067 H 129.0710 108.2350 105.3260 H 195 ALA195 0.1312 3068 HA 129.3458 107.4811 108.0292 H 195 ALA195 0.0554 3069 HB1 128.0146 109.6467 108.3946 H 195 ALA195 0.0249 3070 HB2 127.6662 109.6788 106.6697 H 195 ALA195 0.0249 3071 HB3 129.3238 109.8425 107.2335 H 195 ALA195 0.0249 3072 N 126.2280 107.1620 106.8710 N.am 196 TYR196 -0.2453 3073 CA 124.9530 106.4970 107.0750 C.3 196 TYR196 0.0917 3074 C 125.0280 104.9880 107.0650 C.2 196 TYR196 0.2191 3075 O 124.3680 104.3380 107.8700 O.2 196 TYR196 -0.2778 3076 CB 123.9111 107.0273 106.0676 C.3 196 TYR196 -0.0036 3077 CG 123.3182 108.3843 106.4036 C.ar 196 TYR196 -0.0453 3078 CD1 123.8624 109.2402 107.3627 C.ar 196 TYR196 -0.0561 3079 CD2 122.1535 108.7871 105.7573 C.ar 196 TYR196 -0.0561 3080 CE1 123.2330 110.4321 107.6945 C.ar 196 TYR196 -0.0317 3081 CE2 121.5477 110.0020 106.0501 C.ar 196 TYR196 -0.0317 3082 CZ 122.0789 110.8226 107.0336 C.ar 196 TYR196 0.0726 3083 OH 121.4667 112.0236 107.3400 O.3 196 TYR196 -0.3598 3084 H 126.3530 107.6990 106.0130 H 196 TYR196 0.1312 3085 HA 124.6315 106.7460 108.0862 H 196 TYR196 0.0560 3086 HB1 123.0774 106.3265 106.0064 H 196 TYR196 0.0333 3087 HB2 124.3397 107.0574 105.0657 H 196 TYR196 0.0333 3088 HD1 124.7696 108.9914 107.8882 H 196 TYR196 0.0621 3089 HD2 121.6948 108.1299 105.0361 H 196 TYR196 0.0621 3090 HE1 123.6545 111.0513 108.4686 H 196 TYR196 0.0643 3091 HE2 120.6454 110.2872 105.5311 H 196 TYR196 0.0643 3092 HH 121.1618 112.4021 106.5220 H 196 TYR196 0.2173 3093 N 125.8590 104.3760 106.2010 N.am 197 SER197 -0.2436 3094 CA 126.1190 102.9430 106.2680 C.3 197 SER197 0.1109 3095 C 126.7420 102.5200 107.5880 C.2 197 SER197 0.2209 3096 O 126.2590 101.5910 108.2240 O.2 197 SER197 -0.2777 3097 CB 127.0353 102.5540 105.0992 C.3 197 SER197 0.0681 3098 OG 126.3234 102.7055 103.8770 O.3 197 SER197 -0.3930 3099 H 126.3200 104.9300 105.4790 H 197 SER197 0.1312 3100 HA 125.1574 102.4383 106.1671 H 197 SER197 0.0580 3101 HB1 127.3521 101.5108 105.1963 H 197 SER197 0.0577 3102 HB2 127.9325 103.1861 105.1188 H 197 SER197 0.0577 3103 HG 126.9077 102.6675 103.1229 H 197 SER197 0.2095 3104 N 127.7810 103.2260 108.0900 N.am 198 VAL198 -0.2453 3105 CA 128.3810 102.9180 109.3900 C.3 198 VAL198 0.0901 3106 C 127.4100 103.1030 110.5470 C.2 198 VAL198 0.2189 3107 O 127.2640 102.2280 111.4000 O.2 198 VAL198 -0.2778 3108 CB 129.6526 103.7744 109.5719 C.3 198 VAL198 -0.0227 3109 CG1 130.2376 103.6936 110.9954 C.3 198 VAL198 -0.0608 3110 CG2 130.7341 103.3817 108.5532 C.3 198 VAL198 -0.0608 3111 H 128.1600 104.0000 107.5440 H 198 VAL198 0.1312 3112 HA 128.6539 101.8622 109.3657 H 198 VAL198 0.0560 3113 HB 129.3762 104.8119 109.3794 H 198 VAL198 0.0315 3114 HG11 131.1819 104.2341 111.0655 H 198 VAL198 0.0233 3115 HG12 130.4285 102.6596 111.2828 H 198 VAL198 0.0233 3116 HG13 129.5660 104.1296 111.7354 H 198 VAL198 0.0233 3117 HG21 131.5902 104.0540 108.6162 H 198 VAL198 0.0233 3118 HG22 130.3676 103.4163 107.5285 H 198 VAL198 0.0233 3119 HG23 131.0928 102.3686 108.7359 H 198 VAL198 0.0233 3120 N 126.6590 104.2260 110.5700 N.am 199 ILE199 -0.2454 3121 CA 125.6160 104.4720 111.5620 C.3 199 ILE199 0.0903 3122 C 124.5300 103.4250 111.5210 C.2 199 ILE199 0.2187 3123 O 124.1140 102.8960 112.5510 O.2 199 ILE199 -0.2778 3124 CB 125.0092 105.8751 111.3229 C.3 199 ILE199 -0.0201 3125 CG1 126.0351 107.0009 111.5557 C.3 199 ILE199 -0.0514 3126 CG2 123.7524 106.1308 112.1732 C.3 199 ILE199 -0.0605 3127 CD1 125.6004 108.3134 110.8900 C.3 199 ILE199 -0.0650 3128 H 126.8290 104.9370 109.8590 H 199 ILE199 0.1312 3129 HA 126.0927 104.4286 112.5421 H 199 ILE199 0.0560 3130 HB 124.7070 105.9129 110.2749 H 199 ILE199 0.0318 3131 HG11 127.0068 106.7157 111.1575 H 199 ILE199 0.0266 3132 HG12 126.1974 107.1560 112.6232 H 199 ILE199 0.0266 3133 HG21 123.4011 107.1548 112.0697 H 199 ILE199 0.0233 3134 HG22 123.9599 105.9528 113.2258 H 199 ILE199 0.0233 3135 HG23 122.9258 105.4837 111.8804 H 199 ILE199 0.0233 3136 HD11 126.4392 108.9910 110.7597 H 199 ILE199 0.0230 3137 HD12 124.8412 108.8277 111.4781 H 199 ILE199 0.0230 3138 HD13 125.1932 108.1297 109.8981 H 199 ILE199 0.0230 3139 N 124.0730 103.0570 110.3110 N.am 200 GLY200 -0.2485 3140 CA 123.0410 102.0550 110.1480 C.3 200 GLY200 0.0765 3141 C 123.4600 100.6670 110.5460 C.2 200 GLY200 0.2155 3142 O 122.6870 99.9520 111.1720 O.2 200 GLY200 -0.2781 3143 H 124.4670 103.4990 109.4800 H 200 GLY200 0.1309 3144 HA1 122.7560 102.0609 109.0963 H 200 GLY200 0.0521 3145 HA2 122.1874 102.3676 110.7424 H 200 GLY200 0.0521 3146 N 124.7100 100.2570 110.2630 N.am 201 LEU201 -0.2459 3147 CA 125.2660 99.0060 110.7560 C.3 201 LEU201 0.0880 3148 C 125.3690 98.9490 112.2780 C.2 201 LEU201 0.2187 3149 O 125.0190 97.9460 112.9050 O.2 201 LEU201 -0.2778 3150 CB 126.6540 98.8088 110.1202 C.3 201 LEU201 -0.0266 3151 CG 126.6041 98.5028 108.6112 C.3 201 LEU201 -0.0449 3152 CD1 127.9720 98.7480 107.9613 C.3 201 LEU201 -0.0626 3153 CD2 126.1281 97.0695 108.3373 C.3 201 LEU201 -0.0626 3154 H 125.2950 100.8510 109.6750 H 201 LEU201 0.1312 3155 HA 124.5826 98.2155 110.4449 H 201 LEU201 0.0557 3156 HB1 127.1970 98.0051 110.6190 H 201 LEU201 0.0287 3157 HB2 127.2392 99.7152 110.2866 H 201 LEU201 0.0287 3158 HG 125.8956 99.1796 108.1339 H 201 LEU201 0.0296 3159 HD11 127.9340 98.5641 106.8873 H 201 LEU201 0.0232 3160 HD12 128.7352 98.0956 108.3860 H 201 LEU201 0.0232 3161 HD13 128.2959 99.7793 108.1044 H 201 LEU201 0.0232 3162 HD21 126.1012 96.8679 107.2659 H 201 LEU201 0.0232 3163 HD22 125.1237 96.8984 108.7233 H 201 LEU201 0.0232 3164 HD23 126.7937 96.3376 108.7950 H 201 LEU201 0.0232 3165 N 125.8310 100.0510 112.9110 N.am 202 THR202 -0.2434 3166 CA 125.8930 100.1970 114.3710 C.3 202 THR202 0.1135 3167 C 124.5360 100.1620 115.0480 C.2 202 THR202 0.2212 3168 O 124.3440 99.4490 116.0320 O.2 202 THR202 -0.2777 3169 CB 126.6754 101.4907 114.6715 C.3 202 THR202 0.0763 3170 OG1 128.0152 101.2277 114.2809 O.3 202 THR202 -0.3900 3171 CG2 126.6528 101.9178 116.1504 C.3 202 THR202 -0.0370 3172 H 126.1570 100.8300 112.3390 H 202 THR202 0.1313 3173 HA 126.4573 99.3451 114.7462 H 202 THR202 0.0583 3174 HB 126.2476 102.2936 114.0560 H 202 THR202 0.0611 3175 HG1 128.5305 102.0315 114.2714 H 202 THR202 0.2098 3176 HG21 127.2464 102.8177 116.3161 H 202 THR202 0.0255 3177 HG22 127.0530 101.1318 116.7904 H 202 THR202 0.0255 3178 HG23 125.6406 102.1443 116.4854 H 202 THR202 0.0255 3179 N 123.5430 100.9160 114.5330 N.am 203 LEU203 -0.2456 3180 CA 122.2130 100.9780 115.1170 C.3 203 LEU203 0.0880 3181 C 121.3070 99.8000 114.8190 C.2 203 LEU203 0.2187 3182 O 120.4110 99.5090 115.6070 O.2 203 LEU203 -0.2778 3183 CB 121.5068 102.2556 114.6284 C.3 203 LEU203 -0.0266 3184 CG 122.1413 103.5724 115.1067 C.3 203 LEU203 -0.0449 3185 CD1 121.3262 104.7546 114.5681 C.3 203 LEU203 -0.0626 3186 CD2 122.2443 103.6431 116.6362 C.3 203 LEU203 -0.0626 3187 H 123.7340 101.4670 113.6960 H 203 LEU203 0.1312 3188 HA 122.3341 101.0060 116.1990 H 203 LEU203 0.0557 3189 HB1 120.4654 102.2492 114.9551 H 203 LEU203 0.0287 3190 HB2 121.4755 102.2506 113.5370 H 203 LEU203 0.0287 3191 HG 123.1500 103.6535 114.7014 H 203 LEU203 0.0296 3192 HD11 121.7447 105.7024 114.8997 H 203 LEU203 0.0232 3193 HD12 120.2925 104.7118 114.9127 H 203 LEU203 0.0232 3194 HD13 121.3131 104.7575 113.4778 H 203 LEU203 0.0232 3195 HD21 122.5435 104.6384 116.9625 H 203 LEU203 0.0232 3196 HD22 122.9858 102.9419 117.0183 H 203 LEU203 0.0232 3197 HD23 121.2867 103.4151 117.1007 H 203 LEU203 0.0232 3198 N 121.4880 99.1020 113.6810 N.am 204 TRP204 -0.2453 3199 CA 120.6660 97.9470 113.3490 C.3 204 TRP204 0.0918 3200 C 120.9310 96.6960 114.1950 C.2 204 TRP204 0.2190 3201 O 120.0140 96.0670 114.7120 O.2 204 TRP204 -0.2778 3202 CB 120.7404 97.6311 111.8449 C.3 204 TRP204 -0.0021 3203 CG 119.4907 96.8871 111.4167 C.ar 204 TRP204 -0.0260 3204 CD1 118.3367 97.4791 110.8958 C.ar 204 TRP204 -0.0136 3205 CD2 119.2298 95.4691 111.4805 C.ar 204 TRP204 -0.0028 3206 NE1 117.4017 96.5223 110.6739 N.ar 204 TRP204 -0.2641 3207 CE2 117.9094 95.2740 111.0098 C.ar 204 TRP204 0.0269 3208 CE3 119.9780 94.3952 111.8839 C.ar 204 TRP204 -0.0528 3209 CZ2 117.3820 94.0121 110.9538 C.ar 204 TRP204 -0.0430 3210 CZ3 119.4411 93.1088 111.8337 C.ar 204 TRP204 -0.0611 3211 CH2 118.1413 92.9164 111.3660 C.ar 204 TRP204 -0.0602 3212 H 122.2210 99.3910 113.0340 H 204 TRP204 0.1312 3213 HA 119.6428 98.2592 113.5694 H 204 TRP204 0.0560 3214 HB1 121.6393 97.0700 111.5862 H 204 TRP204 0.0334 3215 HB2 120.7701 98.5542 111.2696 H 204 TRP204 0.0334 3216 HD1 118.2126 98.5383 110.7173 H 204 TRP204 0.0748 3217 HE1 116.5114 96.6848 110.3006 H 204 TRP204 0.1331 3218 HE3 120.9886 94.5441 112.2336 H 204 TRP204 0.0624 3219 HZ2 116.3829 93.8639 110.5727 H 204 TRP204 0.0633 3220 HZ3 120.0370 92.2608 112.1397 H 204 TRP204 0.0618 3221 HH2 117.7329 91.9177 111.3044 H 204 TRP204 0.0618 3222 N 122.2220 96.3230 114.3390 N.am 205 ARG205 -0.2456 3223 CA 122.6570 95.1060 115.0010 C.3 205 ARG205 0.0879 3224 C 122.4480 95.1150 116.5130 C.2 205 ARG205 0.2187 3225 O 122.2160 94.0950 117.1450 O.2 205 ARG205 -0.2778 3226 CB 124.1383 95.0140 114.6063 C.3 205 ARG205 -0.0258 3227 CG 124.9939 93.9445 115.2998 C.3 205 ARG205 -0.0154 3228 CD 126.3491 93.7601 114.5896 C.3 205 ARG205 0.1045 3229 NE 126.8805 95.0482 114.1227 N.pl3 205 ARG205 -0.4450 3230 CZ 127.6073 95.8984 114.8406 C.cat 205 ARG205 0.5062 3231 NH1 127.9596 97.0394 114.3095 N.pl3 205 ARG205 -0.4573 3232 NH2 127.9725 95.6162 116.0625 N.pl3 205 ARG205 -0.4573 3233 H 122.9400 96.9390 113.9560 H 205 ARG205 0.1312 3234 HA 122.0882 94.2752 114.5801 H 205 ARG205 0.0557 3235 HB1 124.5953 95.9886 114.7883 H 205 ARG205 0.0286 3236 HB2 124.1804 94.8616 113.5266 H 205 ARG205 0.0286 3237 HG1 124.4629 92.9920 115.3240 H 205 ARG205 0.0299 3238 HG2 125.1561 94.2330 116.3387 H 205 ARG205 0.0299 3239 HD1 126.2147 93.1491 113.6936 H 205 ARG205 0.0711 3240 HD2 127.0848 93.2470 115.2133 H 205 ARG205 0.0711 3241 HE 126.6724 95.3322 113.1870 H 205 ARG205 0.3153 3242 HH11 128.5371 97.6801 114.8107 H 205 ARG205 0.3114 3243 HH12 127.6470 97.2793 113.3923 H 205 ARG205 0.3114 3244 HH21 128.5243 96.2588 116.5884 H 205 ARG205 0.3114 3245 HH22 127.6941 94.7481 116.4651 H 205 ARG205 0.3114 3246 N 122.6640 96.3080 117.1010 N.am 206 ARG206 -0.2457 3247 CA 122.5080 96.7100 118.4910 C.3 206 ARG206 0.0879 3248 C 121.3970 96.0400 119.2730 C.2 206 ARG206 0.2187 3249 O 120.2670 95.9420 118.8310 O.2 206 ARG206 -0.2778 3250 CB 122.2271 98.2244 118.4376 C.3 206 ARG206 -0.0258 3251 CG 122.2521 98.9604 119.7850 C.3 206 ARG206 -0.0154 3252 CD 122.0168 100.4663 119.5938 C.3 206 ARG206 0.1045 3253 NE 122.2351 101.1748 120.8558 N.pl3 206 ARG206 -0.4450 3254 CZ 122.2088 102.5013 120.9733 C.cat 206 ARG206 0.5062 3255 NH1 122.4665 103.0483 122.1311 N.pl3 206 ARG206 -0.4573 3256 NH2 121.9320 103.2711 119.9538 N.pl3 206 ARG206 -0.4573 3257 H 122.9870 97.0450 116.4740 H 206 ARG206 0.1312 3258 HA 123.4635 96.5041 118.9741 H 206 ARG206 0.0557 3259 HB1 121.2689 98.3992 117.9441 H 206 ARG206 0.0286 3260 HB2 122.9722 98.6863 117.7948 H 206 ARG206 0.0286 3261 HG1 123.2176 98.7965 120.2646 H 206 ARG206 0.0299 3262 HG2 121.4951 98.5536 120.4568 H 206 ARG206 0.0299 3263 HD1 120.9953 100.6601 119.2551 H 206 ARG206 0.0711 3264 HD2 122.7138 100.8674 118.8523 H 206 ARG206 0.0711 3265 HE 122.4207 100.6419 121.6807 H 206 ARG206 0.3153 3266 HH11 122.4537 104.0410 122.2309 H 206 ARG206 0.3114 3267 HH12 122.6791 102.4763 122.9200 H 206 ARG206 0.3114 3268 HH21 121.9363 104.2636 120.0518 H 206 ARG206 0.3114 3269 HH22 121.7137 102.8631 119.0713 H 206 ARG206 0.3114 3270 N 121.6940 95.6010 120.5020 N.am 207 ALA207 -0.2459 3271 CA 120.7950 94.8160 121.2810 C.3 207 ALA207 0.0850 3272 C 120.5490 95.5030 122.6100 C.2 207 ALA207 0.2184 3273 O 121.4330 96.1000 123.2240 O.2 207 ALA207 -0.2778 3274 CB 121.4121 93.4310 121.5061 C.3 207 ALA207 -0.0411 3275 H 122.6030 95.8390 120.8990 H 207 ALA207 0.1312 3276 HA 119.8398 94.7105 120.7630 H 207 ALA207 0.0554 3277 HB1 120.7532 92.7937 122.0973 H 207 ALA207 0.0249 3278 HB2 122.3679 93.4989 122.0273 H 207 ALA207 0.0249 3279 HB3 121.5893 92.9286 120.5548 H 207 ALA207 0.0249 3280 N 119.2820 95.4720 123.0470 N.am 208 VAL208 -0.2454 3281 CA 118.8430 95.9610 124.3340 C.3 208 VAL208 0.0903 3282 C 118.8300 94.7470 125.2600 C.2 208 VAL208 0.2216 3283 O 118.2170 93.7450 124.8800 O.2 208 VAL208 -0.2776 3284 CB 117.4446 96.6014 124.2346 C.3 208 VAL208 -0.0227 3285 CG1 116.8602 96.9676 125.6095 C.3 208 VAL208 -0.0608 3286 CG2 117.4540 97.8413 123.3311 C.3 208 VAL208 -0.0608 3287 H 118.5770 95.0750 122.4260 H 208 VAL208 0.1312 3288 HA 119.5522 96.7157 124.6676 H 208 VAL208 0.0560 3289 HB 116.7855 95.8651 123.7868 H 208 VAL208 0.0315 3290 HG11 115.8816 97.4363 125.5051 H 208 VAL208 0.0233 3291 HG12 117.5099 97.6643 126.1396 H 208 VAL208 0.0233 3292 HG13 116.7293 96.0880 126.2407 H 208 VAL208 0.0233 3293 HG21 116.4459 98.2318 123.1910 H 208 VAL208 0.0233 3294 HG22 117.8558 97.6130 122.3480 H 208 VAL208 0.0233 3295 HG23 118.0655 98.6352 123.7602 H 208 VAL208 0.0233 3296 N 119.4770 94.7420 126.4260 N.am 209 PRO209 -0.2316 3297 CA 119.4280 93.6490 127.3950 C.3 209 PRO209 0.0907 3298 C 118.0440 93.1290 127.7340 C.2 209 PRO209 0.2187 3299 O 117.1390 93.9230 127.9980 O.2 209 PRO209 -0.2778 3300 CB 120.1140 94.2395 128.6338 C.3 209 PRO209 -0.0276 3301 CG 121.0483 95.3099 128.0832 C.3 209 PRO209 -0.0379 3302 CD 120.3295 95.8521 126.8488 C.3 209 PRO209 0.0071 3303 HA 120.0269 92.8444 126.9662 H 209 PRO209 0.0559 3304 HB1 120.6390 93.4862 129.2215 H 209 PRO209 0.0285 3305 HB2 119.3858 94.7209 129.2893 H 209 PRO209 0.0285 3306 HG1 121.9885 94.8469 127.7812 H 209 PRO209 0.0278 3307 HG2 121.2790 96.0867 128.8126 H 209 PRO209 0.0278 3308 HD1 119.6812 96.6975 127.0838 H 209 PRO209 0.0431 3309 HD2 121.0368 96.1063 126.0573 H 209 PRO209 0.0431 3310 N 117.8500 91.7900 127.7550 N.am 210 GLY210 -0.2485 3311 CA 116.5150 91.2450 127.9450 C.3 210 GLY210 0.0765 3312 C 115.6730 91.3850 126.7080 C.2 210 GLY210 0.2155 3313 O 114.5700 91.9270 126.7160 O.2 210 GLY210 -0.2781 3314 H 118.6430 91.1600 127.6370 H 210 GLY210 0.1309 3315 HA1 116.0389 91.7510 128.7863 H 210 GLY210 0.0521 3316 HA2 116.6283 90.1895 128.1910 H 210 GLY210 0.0521 3317 N 116.1620 90.8580 125.5730 N.am 211 HIS211 -0.2455 3318 CA 115.4030 90.8110 124.3390 C.3 211 HIS211 0.0932 3319 C 114.2420 89.8150 124.3960 C.2 211 HIS211 0.2190 3320 O 113.3630 89.8260 123.5410 O.2 211 HIS211 -0.2778 3321 CB 116.3498 90.5180 123.1627 C.3 211 HIS211 0.0146 3322 CG 116.9697 89.1412 123.2760 C.ar 211 HIS211 0.0551 3323 ND1 117.7508 88.7423 124.3035 N.ar 211 HIS211 -0.2469 3324 CD2 116.8565 88.0734 122.3702 C.ar 211 HIS211 0.0047 3325 CE1 118.0936 87.4703 124.0376 C.ar 211 HIS211 0.0737 3326 NE2 117.5652 87.0395 122.8779 N.ar 211 HIS211 -0.2539 3327 H 117.1070 90.4750 125.5800 H 211 HIS211 0.1312 3328 HA 114.9723 91.8026 124.2030 H 211 HIS211 0.0561 3329 HB1 117.1498 91.2583 123.1353 H 211 HIS211 0.0348 3330 HB2 115.8161 90.5923 122.2151 H 211 HIS211 0.0348 3331 HD2 116.2956 88.0743 121.4476 H 211 HIS211 0.0764 3332 HE1 118.7036 86.8581 124.6875 H 211 HIS211 0.0963 3333 HE2 117.6713 86.1462 122.4883 H 211 HIS211 0.1339 3334 N 114.2370 88.9750 125.4540 N.am 212 GLN212 -0.2456 3335 CA 113.2480 87.9860 125.8460 C.3 212 GLN212 0.0882 3336 C 112.4870 88.4410 127.0990 C.2 212 GLN212 0.2187 3337 O 111.9880 87.6260 127.8670 O.2 212 GLN212 -0.2778 3338 CB 113.9520 86.6405 126.0884 C.3 212 GLN212 -0.0210 3339 CG 114.6160 86.0894 124.8174 C.3 212 GLN212 0.0225 3340 CD 115.3991 84.8058 125.1131 C.2 212 GLN212 0.1981 3341 OE1 116.6133 84.8140 125.2570 O.2 212 GLN212 -0.2798 3342 NE2 114.6340 83.7073 125.1926 N.am 212 GLN212 -0.2724 3343 H 115.0480 89.0460 126.0690 H 212 GLN212 0.1312 3344 HA 112.5251 87.8951 125.0339 H 212 GLN212 0.0557 3345 HB1 113.2327 85.9075 126.4577 H 212 GLN212 0.0289 3346 HB2 114.7001 86.7620 126.8738 H 212 GLN212 0.0289 3347 HG1 115.3142 86.8130 124.4047 H 212 GLN212 0.0356 3348 HG2 113.8725 85.8854 124.0469 H 212 GLN212 0.0356 3349 HE21 115.0697 82.8275 125.3793 H 212 GLN212 0.1266 3350 HE22 113.6434 83.7489 125.0711 H 212 GLN212 0.1266 3351 N 112.4130 89.7720 127.3520 N.am 213 ALA213 -0.2459 3352 CA 111.7300 90.3400 128.5030 C.3 213 ALA213 0.0850 3353 C 110.3450 90.8840 128.1480 C.2 213 ALA213 0.2184 3354 O 109.3660 90.1550 128.0570 O.2 213 ALA213 -0.2778 3355 CB 112.6495 91.3766 129.1655 C.3 213 ALA213 -0.0411 3356 H 112.8630 90.4110 126.6970 H 213 ALA213 0.1312 3357 HA 111.5643 89.5365 129.2231 H 213 ALA213 0.0554 3358 HB1 112.2144 91.7537 130.0908 H 213 ALA213 0.0249 3359 HB2 112.8555 92.2239 128.5125 H 213 ALA213 0.0249 3360 HB3 113.6086 90.9248 129.4199 H 213 ALA213 0.0249 3361 N 110.2490 92.2140 127.9380 N.am 214 HIS214 -0.2453 3362 CA 109.0240 92.8990 127.5440 C.3 214 HIS214 0.0932 3363 C 108.8670 92.9180 126.0450 C.2 214 HIS214 0.2188 3364 O 107.7820 92.7940 125.4910 O.2 214 HIS214 -0.2778 3365 CB 109.0831 94.3649 128.0171 C.3 214 HIS214 0.0146 3366 CG 109.1720 94.4740 129.5237 C.ar 214 HIS214 0.0551 3367 ND1 108.1816 94.9753 130.2909 N.ar 214 HIS214 -0.2469 3368 CD2 110.2793 94.2246 130.3533 C.ar 214 HIS214 0.0047 3369 CE1 108.6301 94.9319 131.5566 C.ar 214 HIS214 0.0737 3370 NE2 109.9060 94.5105 131.6214 N.ar 214 HIS214 -0.2539 3371 H 111.0900 92.7780 128.0630 H 214 HIS214 0.1312 3372 HA 108.1725 92.3769 127.9860 H 214 HIS214 0.0561 3373 HB1 108.1942 94.9056 127.6872 H 214 HIS214 0.0348 3374 HB2 109.9442 94.8751 127.5849 H 214 HIS214 0.0348 3375 HD2 111.2434 93.8530 130.0409 H 214 HIS214 0.0764 3376 HE1 108.0337 95.2066 132.4163 H 214 HIS214 0.0963 3377 HE2 110.4411 94.3936 132.4349 H 214 HIS214 0.1339 3378 N 110.0000 93.0870 125.3430 N.am 215 GLY215 -0.2485 3379 CA 110.0070 93.1050 123.8960 C.3 215 GLY215 0.0765 3380 C 110.8550 94.2240 123.4220 C.2 215 GLY215 0.2155 3381 O 110.3580 95.2420 122.9630 O.2 215 GLY215 -0.2781 3382 H 110.8800 93.2060 125.8440 H 215 GLY215 0.1309 3383 HA1 108.9964 93.2297 123.5022 H 215 GLY215 0.0521 3384 HA2 110.4072 92.1493 123.5565 H 215 GLY215 0.0521 3385 N 112.1910 94.0590 123.4810 N.am 216 ALA216 -0.2462 3386 CA 113.1530 95.0690 123.0750 C.3 216 ALA216 0.0850 3387 C 112.8970 95.6410 121.6770 C.2 216 ALA216 0.2184 3388 O 113.0960 96.8320 121.4330 O.2 216 ALA216 -0.2778 3389 CB 114.5395 94.4161 123.0807 C.3 216 ALA216 -0.0411 3390 H 112.5490 93.1710 123.8320 H 216 ALA216 0.1311 3391 HA 113.1044 95.8775 123.8033 H 216 ALA216 0.0554 3392 HB1 115.2824 95.0658 122.6219 H 216 ALA216 0.0249 3393 HB2 114.5397 93.4839 122.5143 H 216 ALA216 0.0249 3394 HB3 114.8650 94.1884 124.0964 H 216 ALA216 0.0249 3395 N 112.4060 94.7770 120.7480 N.am 217 ASN217 -0.2452 3396 CA 112.0630 95.1500 119.3930 C.3 217 ASN217 0.0957 3397 C 110.9870 96.2400 119.3320 C.2 217 ASN217 0.2191 3398 O 111.2670 97.3420 118.8840 O.2 217 ASN217 -0.2778 3399 CB 111.7464 93.9285 118.5171 C.3 217 ASN217 0.0446 3400 CG 112.0152 94.2629 117.0348 C.2 217 ASN217 0.2000 3401 OD1 113.1560 94.3348 116.5823 O.2 217 ASN217 -0.2797 3402 ND2 110.9007 94.4652 116.3165 N.am 217 ASN217 -0.2723 3403 H 112.2710 93.8040 121.0240 H 217 ASN217 0.1312 3404 HA 112.9669 95.5977 119.0098 H 217 ASN217 0.0562 3405 HB1 110.7203 93.5840 118.6536 H 217 ASN217 0.0375 3406 HB2 112.3992 93.0983 118.7851 H 217 ASN217 0.0375 3407 HD21 110.9538 94.6900 115.3446 H 217 ASN217 0.1266 3408 HD22 109.9950 94.3965 116.7363 H 217 ASN217 0.1266 3409 N 109.7930 95.9770 119.9020 N.am 218 LEU218 -0.2456 3410 CA 108.6440 96.8620 120.0350 C.3 218 LEU218 0.0880 3411 C 108.8430 98.0080 121.0380 C.2 218 LEU218 0.2187 3412 O 108.0580 98.9480 121.0980 O.2 218 LEU218 -0.2778 3413 CB 107.4115 96.0270 120.4239 C.3 218 LEU218 -0.0266 3414 CG 107.1278 94.8361 119.4865 C.3 218 LEU218 -0.0449 3415 CD1 105.9114 94.0446 119.9831 C.3 218 LEU218 -0.0626 3416 CD2 106.9217 95.2800 118.0310 C.3 218 LEU218 -0.0626 3417 H 109.6810 95.0400 120.2890 H 218 LEU218 0.1312 3418 HA 108.4924 97.3232 119.0589 H 218 LEU218 0.0557 3419 HB1 106.5321 96.6725 120.4545 H 218 LEU218 0.0287 3420 HB2 107.5433 95.6484 121.4390 H 218 LEU218 0.0287 3421 HG 107.9790 94.1554 119.5114 H 218 LEU218 0.0296 3422 HD11 105.7225 93.1754 119.3525 H 218 LEU218 0.0232 3423 HD12 105.0118 94.6608 119.9787 H 218 LEU218 0.0232 3424 HD13 106.0642 93.6862 121.0016 H 218 LEU218 0.0232 3425 HD21 106.6682 94.4303 117.3966 H 218 LEU218 0.0232 3426 HD22 107.8217 95.7341 117.6171 H 218 LEU218 0.0232 3427 HD23 106.1114 96.0055 117.9528 H 218 LEU218 0.0232 3428 N 109.9230 97.9330 121.8380 N.am 219 ARG219 -0.2457 3429 CA 110.4200 98.9620 122.7290 C.3 219 ARG219 0.0879 3430 C 111.3310 99.9730 121.9930 C.2 219 ARG219 0.2187 3431 O 110.8490 100.9260 121.3890 O.2 219 ARG219 -0.2778 3432 CB 111.0298 98.3172 123.9815 C.3 219 ARG219 -0.0258 3433 CG 111.2564 99.3349 125.1079 C.3 219 ARG219 -0.0154 3434 CD 111.4010 98.6892 126.4883 C.3 219 ARG219 0.1045 3435 NE 111.5826 99.7471 127.4856 N.pl3 219 ARG219 -0.4450 3436 CZ 111.2556 99.6504 128.7734 C.cat 219 ARG219 0.5062 3437 NH1 111.4617 100.6707 129.5624 N.pl3 219 ARG219 -0.4573 3438 NH2 110.7315 98.5593 129.2690 N.pl3 219 ARG219 -0.4573 3439 H 110.4480 97.0590 121.8150 H 219 ARG219 0.1312 3440 HA 109.5377 99.5266 123.0367 H 219 ARG219 0.0557 3441 HB1 111.9551 97.7963 123.7401 H 219 ARG219 0.0286 3442 HB2 110.3356 97.5527 124.3330 H 219 ARG219 0.0286 3443 HG1 110.4185 100.0328 125.1404 H 219 ARG219 0.0299 3444 HG2 112.1395 99.9276 124.8839 H 219 ARG219 0.0299 3445 HD1 112.2704 98.0286 126.5302 H 219 ARG219 0.0711 3446 HD2 110.5032 98.1108 126.7203 H 219 ARG219 0.0711 3447 HE 111.9800 100.6095 127.1703 H 219 ARG219 0.3153 3448 HH11 111.2238 100.6151 130.5296 H 219 ARG219 0.3114 3449 HH12 111.8571 101.5115 129.2002 H 219 ARG219 0.3114 3450 HH21 110.4936 98.5017 130.2362 H 219 ARG219 0.3114 3451 HH22 110.5653 97.7783 128.6738 H 219 ARG219 0.3114 3452 N 112.6800 99.8030 122.0170 N.am 220 HIS220 -0.2453 3453 CA 113.6210 100.8330 121.5570 C.3 220 HIS220 0.0932 3454 C 114.4310 100.4570 120.3220 C.2 220 HIS220 0.2190 3455 O 115.0280 101.3140 119.6720 O.2 220 HIS220 -0.2778 3456 CB 114.6147 101.1524 122.6906 C.3 220 HIS220 0.0146 3457 CG 113.9239 101.7474 123.8993 C.ar 220 HIS220 0.0551 3458 ND1 112.7510 102.4144 123.8616 N.ar 220 HIS220 -0.2469 3459 CD2 114.4072 101.7980 125.2181 C.ar 220 HIS220 0.0047 3460 CE1 112.5372 102.8761 125.1036 C.ar 220 HIS220 0.0737 3461 NE2 113.5088 102.4949 125.9545 N.ar 220 HIS220 -0.2539 3462 H 113.0550 98.9220 122.3700 H 220 HIS220 0.1312 3463 HA 113.0636 101.7362 121.3017 H 220 HIS220 0.0561 3464 HB1 115.3624 101.8725 122.3554 H 220 HIS220 0.0348 3465 HB2 115.1496 100.2530 122.9960 H 220 HIS220 0.0348 3466 HD2 115.3468 101.3916 125.5632 H 220 HIS220 0.0764 3467 HE1 111.6968 103.5055 125.3645 H 220 HIS220 0.0963 3468 HE2 113.6014 102.7604 126.8929 H 220 HIS220 0.1339 3469 N 114.4670 99.1690 119.9250 N.am 221 LEU221 -0.2456 3470 CA 115.1280 98.7350 118.7120 C.3 221 LEU221 0.0880 3471 C 114.3550 99.1640 117.4620 C.2 221 LEU221 0.2187 3472 O 114.9470 99.4740 116.4330 O.2 221 LEU221 -0.2778 3473 CB 115.4806 97.2473 118.7426 C.3 221 LEU221 -0.0266 3474 CG 116.4624 96.8612 119.8627 C.3 221 LEU221 -0.0449 3475 CD1 116.6095 95.3374 119.9545 C.3 221 LEU221 -0.0626 3476 CD2 117.8334 97.5229 119.6556 C.3 221 LEU221 -0.0626 3477 H 114.0070 98.4680 120.5060 H 221 LEU221 0.1312 3478 HA 116.0622 99.2953 118.6622 H 221 LEU221 0.0557 3479 HB1 115.9006 96.9470 117.7826 H 221 LEU221 0.0287 3480 HB2 114.5673 96.6896 118.8639 H 221 LEU221 0.0287 3481 HG 116.0562 97.1993 120.8168 H 221 LEU221 0.0296 3482 HD11 117.2602 95.0579 120.7838 H 221 LEU221 0.0232 3483 HD12 117.0405 94.9267 119.0413 H 221 LEU221 0.0232 3484 HD13 115.6436 94.8585 120.1184 H 221 LEU221 0.0232 3485 HD21 118.5781 97.1163 120.3397 H 221 LEU221 0.0232 3486 HD22 117.7911 98.5980 119.8272 H 221 LEU221 0.0232 3487 HD23 118.1975 97.3614 118.6408 H 221 LEU221 0.0232 3488 N 112.9980 99.1840 117.5200 N.am 222 GLN222 -0.2456 3489 CA 112.1210 99.6100 116.4310 C.3 222 GLN222 0.0882 3490 C 112.3690 101.0440 116.0100 C.2 222 GLN222 0.2187 3491 O 112.3800 101.3540 114.8200 O.2 222 GLN222 -0.2778 3492 CB 110.6340 99.4117 116.7859 C.3 222 GLN222 -0.0210 3493 CG 109.6513 99.7592 115.6510 C.3 222 GLN222 0.0225 3494 CD 109.7902 98.7774 114.4747 C.2 222 GLN222 0.1981 3495 OE1 110.6456 98.9133 113.6087 O.2 222 GLN222 -0.2798 3496 NE2 108.8937 97.7796 114.5017 N.am 222 GLN222 -0.2724 3497 H 112.5580 98.8790 118.3880 H 222 GLN222 0.1312 3498 HA 112.3807 98.9750 115.5837 H 222 GLN222 0.0557 3499 HB1 110.3896 99.9971 117.6737 H 222 GLN222 0.0289 3500 HB2 110.4571 98.3729 117.0489 H 222 GLN222 0.0289 3501 HG1 109.8006 100.7733 115.2825 H 222 GLN222 0.0356 3502 HG2 108.6274 99.7147 116.0240 H 222 GLN222 0.0356 3503 HE21 108.8922 97.0848 113.7845 H 222 GLN222 0.1266 3504 HE22 108.2145 97.7204 115.2336 H 222 GLN222 0.1266 3505 N 112.6060 101.9550 116.9820 N.am 223 ALA223 -0.2459 3506 CA 113.0060 103.3220 116.7170 C.3 223 ALA223 0.0850 3507 C 114.3420 103.3880 115.9780 C.2 223 ALA223 0.2184 3508 O 114.4610 104.0690 114.9620 O.2 223 ALA223 -0.2778 3509 CB 113.1004 104.0695 118.0524 C.3 223 ALA223 -0.0411 3510 H 112.4970 101.6640 117.9530 H 223 ALA223 0.1312 3511 HA 112.2321 103.7595 116.0858 H 223 ALA223 0.0554 3512 HB1 113.3733 105.1151 117.9082 H 223 ALA223 0.0249 3513 HB2 113.8438 103.6163 118.7101 H 223 ALA223 0.0249 3514 HB3 112.1447 104.0452 118.5768 H 223 ALA223 0.0249 3515 N 115.3550 102.6100 116.4240 N.am 224 MET224 -0.2456 3516 CA 116.6500 102.5030 115.7670 C.3 224 MET224 0.0885 3517 C 116.5490 101.9530 114.3550 C.2 224 MET224 0.2187 3518 O 117.0880 102.5270 113.4160 O.2 224 MET224 -0.2778 3519 CB 117.5898 101.6058 116.5954 C.3 224 MET224 -0.0199 3520 CG 117.8553 102.1180 118.0168 C.3 224 MET224 -0.0047 3521 SD 118.7450 103.6869 118.0306 S.3 224 MET224 -0.1641 3522 CE 117.3974 104.7728 118.5376 C.3 224 MET224 -0.0181 3523 H 115.2020 102.0650 117.2730 H 224 MET224 0.1312 3524 HA 117.0623 103.5088 115.7019 H 224 MET224 0.0557 3525 HB1 118.5461 101.5000 116.0812 H 224 MET224 0.0293 3526 HB2 117.1746 100.5999 116.6605 H 224 MET224 0.0293 3527 HG1 118.4621 101.3837 118.5468 H 224 MET224 0.0377 3528 HG2 116.9360 102.2119 118.5899 H 224 MET224 0.0377 3529 HE1 117.6880 105.8178 118.4301 H 224 MET224 0.0340 3530 HE2 117.1178 104.5732 119.5723 H 224 MET224 0.0340 3531 HE3 116.5179 104.5981 117.9193 H 224 MET224 0.0340 3532 N 115.7700 100.8760 114.1450 N.am 225 LYS225 -0.2457 3533 CA 115.4790 100.3500 112.8240 C.3 225 LYS225 0.0878 3534 C 114.7670 101.3410 111.9210 C.2 225 LYS225 0.2187 3535 O 115.0610 101.4300 110.7320 O.2 225 LYS225 -0.2778 3536 CB 114.7877 98.9891 113.0044 C.3 225 LYS225 -0.0289 3537 CG 115.7573 97.9926 113.6753 C.3 225 LYS225 -0.0496 3538 CD 115.1404 96.6512 114.0822 C.3 225 LYS225 -0.0278 3539 CE 116.1854 95.7663 114.7818 C.3 225 LYS225 0.1103 3540 NZ 115.6490 94.4915 115.2608 N.4 225 LYS225 -0.0749 3541 H 115.3640 100.4060 114.9540 H 225 LYS225 0.1312 3542 HA 116.4519 100.1796 112.3578 H 225 LYS225 0.0557 3543 HB1 114.4698 98.5931 112.0395 H 225 LYS225 0.0285 3544 HB2 113.8888 99.1119 113.6106 H 225 LYS225 0.0285 3545 HG1 116.1963 98.4375 114.5676 H 225 LYS225 0.0266 3546 HG2 116.5968 97.8127 113.0056 H 225 LYS225 0.0266 3547 HD1 114.7442 96.1446 113.2015 H 225 LYS225 0.0282 3548 HD2 114.2984 96.8310 114.7527 H 225 LYS225 0.0282 3549 HE1 116.6085 96.2944 115.6391 H 225 LYS225 0.0559 3550 HE2 117.0174 95.5534 114.1053 H 225 LYS225 0.0559 3551 HZ1 116.3908 93.9692 115.7707 H 225 LYS225 0.2742 3552 HZ2 115.3250 93.9203 114.4552 H 225 LYS225 0.2742 3553 HZ3 114.8432 94.6596 115.9006 H 225 LYS225 0.2742 3554 N 113.8260 102.1360 112.4650 N.am 226 LYS226 -0.2457 3555 CA 113.1840 103.2220 111.7500 C.3 226 LYS226 0.0878 3556 C 114.1630 104.3070 111.2970 C.2 226 LYS226 0.2187 3557 O 114.1230 104.7460 110.1530 O.2 226 LYS226 -0.2778 3558 CB 111.9848 103.6873 112.5967 C.3 226 LYS226 -0.0289 3559 CG 111.2842 104.9771 112.1244 C.3 226 LYS226 -0.0496 3560 CD 111.3601 106.0935 113.1744 C.3 226 LYS226 -0.0278 3561 CE 112.8113 106.4676 113.4903 C.3 226 LYS226 0.1103 3562 NZ 112.9651 107.4531 114.5526 N.4 226 LYS226 -0.0749 3563 H 113.5500 101.9650 113.4320 H 226 LYS226 0.1312 3564 HA 112.7927 102.7806 110.8322 H 226 LYS226 0.0557 3565 HB1 112.2815 103.7678 113.6412 H 226 LYS226 0.0285 3566 HB2 111.2530 102.8782 112.6029 H 226 LYS226 0.0285 3567 HG1 110.2344 104.7592 111.9230 H 226 LYS226 0.0266 3568 HG2 111.6923 105.3259 111.1750 H 226 LYS226 0.0266 3569 HD1 110.8587 105.7625 114.0849 H 226 LYS226 0.0282 3570 HD2 110.8097 106.9653 112.8201 H 226 LYS226 0.0282 3571 HE1 113.3325 106.8111 112.5970 H 226 LYS226 0.0559 3572 HE2 113.3498 105.5930 113.8161 H 226 LYS226 0.0559 3573 HZ1 113.9799 107.6112 114.7253 H 226 LYS226 0.2742 3574 HZ2 112.5284 107.0966 115.4266 H 226 LYS226 0.2742 3575 HZ3 112.5180 108.3479 114.2732 H 226 LYS226 0.2742 3576 N 115.1110 104.7120 112.1720 N.am 227 PHE227 -0.2453 3577 CA 116.2180 105.6030 111.8420 C.3 227 PHE227 0.0917 3578 C 117.1270 105.0610 110.7470 C.2 227 PHE227 0.2190 3579 O 117.5150 105.7980 109.8420 O.2 227 PHE227 -0.2778 3580 CB 117.0597 105.9193 113.0953 C.3 227 PHE227 -0.0036 3581 CG 116.4278 106.9302 114.0216 C.ar 227 PHE227 -0.0454 3582 CD1 116.2176 108.2393 113.5963 C.ar 227 PHE227 -0.0585 3583 CD2 116.1778 106.6135 115.3537 C.ar 227 PHE227 -0.0585 3584 CE1 115.7638 109.2095 114.4820 C.ar 227 PHE227 -0.0615 3585 CE2 115.7223 107.5784 116.2427 C.ar 227 PHE227 -0.0615 3586 CZ 115.5187 108.8808 115.8082 C.ar 227 PHE227 -0.0617 3587 H 115.0480 104.3700 113.1310 H 227 PHE227 0.1312 3588 HA 115.7683 106.5109 111.4389 H 227 PHE227 0.0560 3589 HB1 118.0283 106.3311 112.8052 H 227 PHE227 0.0333 3590 HB2 117.2829 105.0014 113.6392 H 227 PHE227 0.0333 3591 HD1 116.4498 108.5169 112.5774 H 227 PHE227 0.0620 3592 HD2 116.3827 105.6185 115.7182 H 227 PHE227 0.0620 3593 HE1 115.6354 110.2284 114.1447 H 227 PHE227 0.0618 3594 HE2 115.5677 107.3220 117.2819 H 227 PHE227 0.0618 3595 HZ 115.2023 109.6419 116.5078 H 227 PHE227 0.0618 3596 N 117.4560 103.7520 110.7760 N.am 228 VAL228 -0.2454 3597 CA 118.1770 103.0810 109.6970 C.3 228 VAL228 0.0901 3598 C 117.4180 103.1250 108.3800 C.2 228 VAL228 0.2189 3599 O 117.9680 103.5170 107.3530 O.2 228 VAL228 -0.2778 3600 CB 118.5929 101.6422 110.0872 C.3 228 VAL228 -0.0227 3601 CG1 119.3700 100.9474 108.9539 C.3 228 VAL228 -0.0608 3602 CG2 119.4527 101.6294 111.3613 C.3 228 VAL228 -0.0608 3603 H 117.1880 103.2030 111.5930 H 228 VAL228 0.1312 3604 HA 119.0847 103.6684 109.5451 H 228 VAL228 0.0560 3605 HB 117.6945 101.0555 110.2820 H 228 VAL228 0.0315 3606 HG11 119.6941 99.9499 109.2518 H 228 VAL228 0.0233 3607 HG12 120.2608 101.5160 108.6846 H 228 VAL228 0.0233 3608 HG13 118.7641 100.8328 108.0550 H 228 VAL228 0.0233 3609 HG21 119.9827 100.6854 111.4829 H 228 VAL228 0.0233 3610 HG22 118.8602 101.7649 112.2564 H 228 VAL228 0.0233 3611 HG23 120.1884 102.4300 111.3458 H 228 VAL228 0.0233 3612 N 116.1020 102.8090 108.3860 N.am 229 LYS229 -0.2456 3613 CA 115.2520 102.9090 107.2090 C.3 229 LYS229 0.0878 3614 C 115.1930 104.3180 106.6450 C.2 229 LYS229 0.2187 3615 O 115.3340 104.5160 105.4420 O.2 229 LYS229 -0.2778 3616 CB 113.8222 102.4464 107.5357 C.3 229 LYS229 -0.0289 3617 CG 113.6791 100.9261 107.6754 C.3 229 LYS229 -0.0496 3618 CD 112.2067 100.5208 107.8336 C.3 229 LYS229 -0.0278 3619 CE 111.9953 99.0029 107.8062 C.3 229 LYS229 0.1103 3620 NZ 110.5747 98.6420 107.8056 N.4 229 LYS229 -0.0749 3621 H 115.6850 102.4850 109.2590 H 229 LYS229 0.1312 3622 HA 115.6976 102.2715 106.4437 H 229 LYS229 0.0557 3623 HB1 113.1503 102.7681 106.7372 H 229 LYS229 0.0285 3624 HB2 113.4706 102.9396 108.4423 H 229 LYS229 0.0285 3625 HG1 114.2664 100.5658 108.5199 H 229 LYS229 0.0266 3626 HG2 114.0936 100.4495 106.7859 H 229 LYS229 0.0266 3627 HD1 111.6302 100.9734 107.0253 H 229 LYS229 0.0282 3628 HD2 111.8140 100.9374 108.7624 H 229 LYS229 0.0282 3629 HE1 112.4736 98.5353 108.6696 H 229 LYS229 0.0559 3630 HE2 112.4521 98.5751 106.9107 H 229 LYS229 0.0559 3631 HZ1 110.4687 97.6072 107.7721 H 229 LYS229 0.2742 3632 HZ2 110.1077 99.0574 106.9730 H 229 LYS229 0.2742 3633 HZ3 110.1159 99.0071 108.6655 H 229 LYS229 0.2742 3634 N 115.0620 105.3350 107.5200 N.am 230 THR230 -0.2434 3635 CA 115.1150 106.7510 107.1540 C.3 230 THR230 0.1135 3636 C 116.3990 107.1280 106.4410 C.2 230 THR230 0.2212 3637 O 116.3750 107.7880 105.4060 O.2 230 THR230 -0.2777 3638 CB 114.9184 107.6341 108.4055 C.3 230 THR230 0.0763 3639 OG1 113.7563 107.2928 109.1392 O.3 230 THR230 -0.3900 3640 CG2 114.8833 109.1341 108.0736 C.3 230 THR230 -0.0370 3641 H 114.9160 105.1020 108.5020 H 230 THR230 0.1313 3642 HA 114.3031 106.9105 106.4440 H 230 THR230 0.0583 3643 HB 115.7579 107.4576 109.0799 H 230 THR230 0.0611 3644 HG1 112.9990 107.3435 108.5658 H 230 THR230 0.2098 3645 HG21 114.7164 109.7161 108.9763 H 230 THR230 0.0255 3646 HG22 114.0910 109.3724 107.3632 H 230 THR230 0.0255 3647 HG23 115.8243 109.4730 107.6405 H 230 THR230 0.0255 3648 N 117.5670 106.6930 106.9490 N.am 231 MET231 -0.2456 3649 CA 118.8480 106.9300 106.3070 C.3 231 MET231 0.0886 3650 C 119.0010 106.2470 104.9530 C.2 231 MET231 0.2187 3651 O 119.4930 106.8580 104.0040 O.2 231 MET231 -0.2778 3652 CB 119.9645 106.4861 107.2671 C.3 231 MET231 -0.0199 3653 CG 120.1064 107.4304 108.4673 C.3 231 MET231 -0.0047 3654 SD 121.5355 107.0068 109.4815 S.3 231 MET231 -0.1641 3655 CE 121.7228 108.5498 110.3964 C.3 231 MET231 -0.0181 3656 H 117.5520 106.1720 107.8260 H 231 MET231 0.1312 3657 HA 118.9183 108.0037 106.1281 H 231 MET231 0.0557 3658 HB1 120.9175 106.4518 106.7411 H 231 MET231 0.0293 3659 HB2 119.7782 105.4690 107.6148 H 231 MET231 0.0293 3660 HG1 119.2118 107.4356 109.0881 H 231 MET231 0.0377 3661 HG2 120.2331 108.4480 108.1010 H 231 MET231 0.0377 3662 HE1 122.7673 108.8582 110.3736 H 231 MET231 0.0340 3663 HE2 121.4422 108.4058 111.4396 H 231 MET231 0.0340 3664 HE3 121.1278 109.3515 109.9608 H 231 MET231 0.0340 3665 N 118.5350 104.9830 104.8190 N.am 232 VAL232 -0.2454 3666 CA 118.4720 104.2620 103.5470 C.3 232 VAL232 0.0901 3667 C 117.6100 105.0000 102.5360 C.2 232 VAL232 0.2189 3668 O 118.0230 105.2280 101.3990 O.2 232 VAL232 -0.2778 3669 CB 117.9863 102.8196 103.8124 C.3 232 VAL232 -0.0227 3670 CG1 117.6591 102.0487 102.5231 C.3 232 VAL232 -0.0608 3671 CG2 119.0232 102.0334 104.6309 C.3 232 VAL232 -0.0608 3672 H 118.2070 104.5030 105.6570 H 232 VAL232 0.1312 3673 HA 119.4882 104.2438 103.1502 H 232 VAL232 0.0560 3674 HB 117.0709 102.8755 104.4025 H 232 VAL232 0.0315 3675 HG11 117.3962 101.0135 102.7409 H 232 VAL232 0.0233 3676 HG12 118.5111 102.0407 101.8427 H 232 VAL232 0.0233 3677 HG13 116.8121 102.4897 101.9988 H 232 VAL232 0.0233 3678 HG21 118.6466 101.0450 104.8945 H 232 VAL232 0.0233 3679 HG22 119.2861 102.5395 105.5582 H 232 VAL232 0.0233 3680 HG23 119.9445 101.8970 104.0640 H 232 VAL232 0.0233 3681 N 116.4130 105.4670 102.9530 N.am 233 LEU233 -0.2456 3682 CA 115.5460 106.2790 102.1180 C.3 233 LEU233 0.0880 3683 C 116.1880 107.5860 101.6610 C.2 233 LEU233 0.2187 3684 O 116.1560 107.8920 100.4740 O.2 233 LEU233 -0.2778 3685 CB 114.2346 106.5503 102.8753 C.3 233 LEU233 -0.0266 3686 CG 113.3631 105.2935 103.0655 C.3 233 LEU233 -0.0449 3687 CD1 112.3096 105.5212 104.1568 C.3 233 LEU233 -0.0626 3688 CD2 112.6923 104.8668 101.7522 C.3 233 LEU233 -0.0626 3689 H 116.1040 105.2390 103.8980 H 233 LEU233 0.1312 3690 HA 115.3521 105.6952 101.2181 H 233 LEU233 0.0557 3691 HB1 113.6458 107.3093 102.3575 H 233 LEU233 0.0287 3692 HB2 114.4796 106.9750 103.8493 H 233 LEU233 0.0287 3693 HG 113.9950 104.4689 103.3938 H 233 LEU233 0.0296 3694 HD11 111.6999 104.6301 104.3056 H 233 LEU233 0.0232 3695 HD12 111.6435 106.3438 103.8949 H 233 LEU233 0.0232 3696 HD13 112.7793 105.7608 105.1105 H 233 LEU233 0.0232 3697 HD21 112.0689 103.9849 101.9005 H 233 LEU233 0.0232 3698 HD22 113.4273 104.6186 100.9870 H 233 LEU233 0.0232 3699 HD23 112.0567 105.6605 101.3588 H 233 LEU233 0.0232 3700 N 116.8410 108.3490 102.5710 N.am 234 VAL234 -0.2454 3701 CA 117.5360 109.6040 102.2600 C.3 234 VAL234 0.0901 3702 C 118.6330 109.4420 101.2280 C.2 234 VAL234 0.2189 3703 O 118.7460 110.2240 100.2860 O.2 234 VAL234 -0.2778 3704 CB 118.0518 110.2383 103.5736 C.3 234 VAL234 -0.0227 3705 CG1 119.0648 111.3773 103.3509 C.3 234 VAL234 -0.0608 3706 CG2 116.8795 110.7673 104.4140 C.3 234 VAL234 -0.0608 3707 H 116.8500 108.0290 103.5400 H 234 VAL234 0.1312 3708 HA 116.7897 110.2602 101.8129 H 234 VAL234 0.0560 3709 HB 118.5550 109.4572 104.1456 H 234 VAL234 0.0315 3710 HG11 119.3310 111.8578 104.2922 H 234 VAL234 0.0233 3711 HG12 118.6557 112.1443 102.6923 H 234 VAL234 0.0233 3712 HG13 119.9904 111.0128 102.9054 H 234 VAL234 0.0233 3713 HG21 117.2152 111.0914 105.3989 H 234 VAL234 0.0233 3714 HG22 116.1031 110.0182 104.5591 H 234 VAL234 0.0233 3715 HG23 116.4127 111.6217 103.9232 H 234 VAL234 0.0233 3716 N 119.4810 108.4080 101.3650 N.am 235 VAL235 -0.2454 3717 CA 120.5370 108.1610 100.3970 C.3 235 VAL235 0.0901 3718 C 120.0160 107.7570 99.0290 C.2 235 VAL235 0.2189 3719 O 120.4470 108.2900 98.0030 O.2 235 VAL235 -0.2778 3720 CB 121.5348 107.1225 100.9552 C.3 235 VAL235 -0.0227 3721 CG1 122.6099 106.7183 99.9307 C.3 235 VAL235 -0.0608 3722 CG2 122.2224 107.6491 102.2218 C.3 235 VAL235 -0.0608 3723 H 119.3820 107.7830 102.1650 H 235 VAL235 0.1312 3724 HA 121.0607 109.1083 100.2593 H 235 VAL235 0.0560 3725 HB 120.9722 106.2272 101.2264 H 235 VAL235 0.0315 3726 HG11 123.3277 106.0321 100.3754 H 235 VAL235 0.0233 3727 HG12 123.1613 107.5887 99.5729 H 235 VAL235 0.0233 3728 HG13 122.1801 106.2138 99.0653 H 235 VAL235 0.0233 3729 HG21 122.8193 106.8725 102.7011 H 235 VAL235 0.0233 3730 HG22 121.4908 108.0006 102.9436 H 235 VAL235 0.0233 3731 HG23 122.8866 108.4827 101.9931 H 235 VAL235 0.0233 3732 N 119.0570 106.8040 98.9780 N.am 236 LEU236 -0.2456 3733 CA 118.4900 106.3280 97.7290 C.3 236 LEU236 0.0880 3734 C 117.7810 107.4320 96.9780 C.2 236 LEU236 0.2187 3735 O 117.9800 107.6180 95.7780 O.2 236 LEU236 -0.2778 3736 CB 117.5120 105.1772 98.0202 C.3 236 LEU236 -0.0266 3737 CG 118.1880 103.8981 98.5465 C.3 236 LEU236 -0.0449 3738 CD1 117.1347 102.9326 99.1030 C.3 236 LEU236 -0.0626 3739 CD2 119.0296 103.2075 97.4645 C.3 236 LEU236 -0.0626 3740 H 118.7180 106.4030 99.8530 H 236 LEU236 0.1312 3741 HA 119.3198 105.9913 97.1077 H 236 LEU236 0.0557 3742 HB1 116.9459 104.9264 97.1213 H 236 LEU236 0.0287 3743 HB2 116.7789 105.5234 98.7514 H 236 LEU236 0.0287 3744 HG 118.8562 104.1607 99.3664 H 236 LEU236 0.0296 3745 HD11 117.6009 102.0420 99.5244 H 236 LEU236 0.0232 3746 HD12 116.4436 102.6118 98.3233 H 236 LEU236 0.0232 3747 HD13 116.5496 103.4070 99.8912 H 236 LEU236 0.0232 3748 HD21 119.4738 102.2877 97.8457 H 236 LEU236 0.0232 3749 HD22 119.8462 103.8428 97.1232 H 236 LEU236 0.0232 3750 HD23 118.4212 102.9485 96.5976 H 236 LEU236 0.0232 3751 N 116.9710 108.2380 97.6910 N.am 237 THR237 -0.2434 3752 CA 116.2900 109.3790 97.1000 C.3 237 THR237 0.1135 3753 C 117.2240 110.4590 96.6120 C.2 237 THR237 0.2212 3754 O 117.0280 110.9930 95.5240 O.2 237 THR237 -0.2777 3755 CB 115.2052 109.9462 98.0310 C.3 237 THR237 0.0763 3756 OG1 115.7890 110.4063 99.2386 O.3 237 THR237 -0.3900 3757 CG2 114.0837 108.9214 98.2800 C.3 237 THR237 -0.0370 3758 H 116.8300 108.0410 98.6820 H 237 THR237 0.1313 3759 HA 115.7952 108.9915 96.2080 H 237 THR237 0.0583 3760 HB 114.7624 110.7973 97.5089 H 237 THR237 0.0611 3761 HG1 115.1179 110.7201 99.8346 H 237 THR237 0.2098 3762 HG21 113.2698 109.3425 98.8706 H 237 THR237 0.0255 3763 HG22 114.4477 108.0353 98.7966 H 237 THR237 0.0255 3764 HG23 113.6531 108.5899 97.3353 H 237 THR237 0.0255 3765 N 118.2960 110.7870 97.3630 N.am 238 PHE238 -0.2453 3766 CA 119.3110 111.7220 96.9110 C.3 238 PHE238 0.0917 3767 C 119.9940 111.2760 95.6110 C.2 238 PHE238 0.2190 3768 O 120.0720 112.0420 94.6530 O.2 238 PHE238 -0.2778 3769 CB 120.3269 111.8949 98.0578 C.3 238 PHE238 -0.0036 3770 CG 121.4277 112.8806 97.7524 C.ar 238 PHE238 -0.0454 3771 CD1 121.1402 114.2301 97.5747 C.ar 238 PHE238 -0.0585 3772 CD2 122.7524 112.4611 97.6699 C.ar 238 PHE238 -0.0585 3773 CE1 122.1500 115.1364 97.2768 C.ar 238 PHE238 -0.0615 3774 CE2 123.7675 113.3669 97.3862 C.ar 238 PHE238 -0.0615 3775 CZ 123.4658 114.7056 97.1801 C.ar 238 PHE238 -0.0617 3776 H 118.3970 110.3610 98.2840 H 238 PHE238 0.1312 3777 HA 118.7977 112.6645 96.7158 H 238 PHE238 0.0560 3778 HB1 120.7621 110.9291 98.3186 H 238 PHE238 0.0333 3779 HB2 119.8064 112.2385 98.9520 H 238 PHE238 0.0333 3780 HD1 120.1213 114.5806 97.6543 H 238 PHE238 0.0620 3781 HD2 122.9961 111.4227 97.8333 H 238 PHE238 0.0620 3782 HE1 121.9073 116.1776 97.1231 H 238 PHE238 0.0618 3783 HE2 124.7921 113.0318 97.3239 H 238 PHE238 0.0618 3784 HZ 124.2524 115.4109 96.9527 H 238 PHE238 0.0618 3785 N 120.4450 110.0070 95.5180 N.am 239 ALA239 -0.2459 3786 CA 121.0650 109.4890 94.3120 C.3 239 ALA239 0.0850 3787 C 120.1260 109.4600 93.1060 C.2 239 ALA239 0.2184 3788 O 120.4650 109.9050 92.0140 O.2 239 ALA239 -0.2778 3789 CB 121.5965 108.0835 94.6120 C.3 239 ALA239 -0.0411 3790 H 120.3470 109.3900 96.3240 H 239 ALA239 0.1312 3791 HA 121.8966 110.1546 94.0730 H 239 ALA239 0.0554 3792 HB1 122.1213 107.6660 93.7521 H 239 ALA239 0.0249 3793 HB2 120.7876 107.4028 94.8815 H 239 ALA239 0.0249 3794 HB3 122.2970 108.1080 95.4469 H 239 ALA239 0.0249 3795 N 118.8790 108.9850 93.2850 N.am 240 ILE240 -0.2454 3796 CA 117.8770 108.9750 92.2240 C.3 240 ILE240 0.0903 3797 C 117.4900 110.3730 91.7410 C.2 240 ILE240 0.2190 3798 O 117.4290 110.6320 90.5400 O.2 240 ILE240 -0.2778 3799 CB 116.6412 108.1879 92.7268 C.3 240 ILE240 -0.0201 3800 CG1 116.9956 106.7099 93.0009 C.3 240 ILE240 -0.0514 3801 CG2 115.4471 108.2747 91.7548 C.3 240 ILE240 -0.0605 3802 CD1 115.9539 105.9837 93.8621 C.3 240 ILE240 -0.0650 3803 H 118.6240 108.6170 94.2010 H 240 ILE240 0.1312 3804 HA 118.3241 108.4528 91.3767 H 240 ILE240 0.0560 3805 HB 116.3335 108.6400 93.6717 H 240 ILE240 0.0318 3806 HG11 117.9553 106.6335 93.5103 H 240 ILE240 0.0266 3807 HG12 117.1261 106.1815 92.0561 H 240 ILE240 0.0266 3808 HG21 114.5937 107.7031 92.1166 H 240 ILE240 0.0233 3809 HG22 115.7140 107.8879 90.7711 H 240 ILE240 0.0233 3810 HG23 115.0994 109.3000 91.6265 H 240 ILE240 0.0233 3811 HD11 116.2869 104.9730 94.0985 H 240 ILE240 0.0230 3812 HD12 114.9946 105.9017 93.3527 H 240 ILE240 0.0230 3813 HD13 115.7903 106.5059 94.8051 H 240 ILE240 0.0230 3814 N 117.2530 111.3290 92.6630 N.am 241 CYS241 -0.2449 3815 CA 116.8240 112.6760 92.3180 C.3 241 CYS241 0.0965 3816 C 117.9100 113.5540 91.7010 C.2 241 CYS241 0.2195 3817 O 117.6180 114.4550 90.9150 O.2 241 CYS241 -0.2778 3818 CB 116.2554 113.3855 93.5591 C.3 241 CYS241 0.0147 3819 SG 114.6514 112.7399 94.1044 S.3 241 CYS241 -0.1762 3820 H 117.3810 111.0970 93.6480 H 241 CYS241 0.1312 3821 HA 116.0354 112.5741 91.5740 H 241 CYS241 0.0565 3822 HB1 116.1232 114.4518 93.3647 H 241 CYS241 0.0394 3823 HB2 116.9666 113.3138 94.3831 H 241 CYS241 0.0394 3824 HG 113.6851 113.4920 93.5653 H 241 CYS241 0.1017 3825 N 119.1990 113.3000 92.0070 N.am 242 TRP242 -0.2453 3826 CA 120.2820 114.1200 91.4980 C.3 242 TRP242 0.0918 3827 C 121.0680 113.4670 90.3810 C.2 242 TRP242 0.2190 3828 O 121.8400 114.1370 89.7030 O.2 242 TRP242 -0.2778 3829 CB 121.1644 114.5939 92.6602 C.3 242 TRP242 -0.0021 3830 CG 120.3817 115.6091 93.4697 C.ar 242 TRP242 -0.0260 3831 CD1 119.6915 115.3686 94.6603 C.ar 242 TRP242 -0.0136 3832 CD2 120.1216 116.9851 93.1210 C.ar 242 TRP242 -0.0028 3833 NE1 119.0864 116.5108 95.0691 N.ar 242 TRP242 -0.2641 3834 CE2 119.3074 117.5238 94.1454 C.ar 242 TRP242 0.0269 3835 CE3 120.4870 117.7630 92.0541 C.ar 242 TRP242 -0.0528 3836 CZ2 118.8941 118.8269 94.0765 C.ar 242 TRP242 -0.0430 3837 CZ3 120.0570 119.0877 91.9760 C.ar 242 TRP242 -0.0611 3838 CH2 119.2582 119.6192 92.9890 C.ar 242 TRP242 -0.0602 3839 H 119.4180 112.5090 92.6130 H 242 TRP242 0.1312 3840 HA 119.8561 115.0095 91.0313 H 242 TRP242 0.0560 3841 HB1 122.0740 115.0704 92.2927 H 242 TRP242 0.0334 3842 HB2 121.4684 113.7599 93.2933 H 242 TRP242 0.0334 3843 HD1 119.6491 114.4195 95.1718 H 242 TRP242 0.0748 3844 HE1 118.5543 116.6080 95.8866 H 242 TRP242 0.1331 3845 HE3 121.0976 117.3450 91.2672 H 242 TRP242 0.0624 3846 HZ2 118.2754 119.2441 94.8575 H 242 TRP242 0.0633 3847 HZ3 120.3360 119.6991 91.1308 H 242 TRP242 0.0618 3848 HH2 118.9125 120.6405 92.9352 H 242 TRP242 0.0618 3849 N 120.8400 112.1770 90.0520 N.am 243 LEU243 -0.2456 3850 CA 121.5050 111.5980 88.8960 C.3 243 LEU243 0.0883 3851 C 121.1690 112.2630 87.5560 C.2 243 LEU243 0.2214 3852 O 122.1070 112.6190 86.8370 O.2 243 LEU243 -0.2776 3853 CB 121.2404 110.0824 88.8777 C.3 243 LEU243 -0.0266 3854 CG 121.8845 109.3257 87.7005 C.3 243 LEU243 -0.0449 3855 CD1 123.4083 109.5112 87.6577 C.3 243 LEU243 -0.0626 3856 CD2 121.5253 107.8364 87.7595 C.3 243 LEU243 -0.0626 3857 H 120.2030 111.6110 90.6130 H 243 LEU243 0.1312 3858 HA 122.5713 111.7554 89.0673 H 243 LEU243 0.0557 3859 HB1 120.1661 109.8988 88.8788 H 243 LEU243 0.0287 3860 HB2 121.6123 109.6565 89.8099 H 243 LEU243 0.0287 3861 HG 121.4694 109.7178 86.7727 H 243 LEU243 0.0296 3862 HD11 123.8499 108.9318 86.8468 H 243 LEU243 0.0232 3863 HD12 123.8700 109.1874 88.5910 H 243 LEU243 0.0232 3864 HD13 123.6819 110.5530 87.4927 H 243 LEU243 0.0232 3865 HD21 121.9391 107.2988 86.9061 H 243 LEU243 0.0232 3866 HD22 120.4445 107.6932 87.7488 H 243 LEU243 0.0232 3867 HD23 121.9141 107.3742 88.6674 H 243 LEU243 0.0232 3868 N 119.9320 112.5510 87.1390 N.am 244 PRO244 -0.2316 3869 CA 119.7160 112.9100 85.7510 C.3 244 PRO244 0.0907 3870 C 119.9130 114.3930 85.5490 C.2 244 PRO244 0.2189 3871 O 120.1030 114.8060 84.4080 O.2 244 PRO244 -0.2778 3872 CB 118.2675 112.4686 85.5559 C.3 244 PRO244 -0.0276 3873 CG 117.6052 112.6949 86.9161 C.3 244 PRO244 -0.0379 3874 CD 118.7166 112.4461 87.9422 C.3 244 PRO244 0.0071 3875 HA 120.3862 112.3455 85.1093 H 244 PRO244 0.0559 3876 HB1 118.2583 111.3994 85.3410 H 244 PRO244 0.0285 3877 HB2 117.7670 112.9551 84.7222 H 244 PRO244 0.0285 3878 HG1 116.7485 112.0383 87.0622 H 244 PRO244 0.0278 3879 HG2 117.2580 113.7253 86.9975 H 244 PRO244 0.0278 3880 HD1 118.7358 113.1950 88.7348 H 244 PRO244 0.0431 3881 HD2 118.6653 111.4422 88.3631 H 244 PRO244 0.0431 3882 N 119.9250 115.2010 86.6350 N.am 245 TYR245 -0.2453 3883 CA 120.3230 116.6010 86.6120 C.3 245 TYR245 0.0917 3884 C 121.7530 116.7280 86.0980 C.2 245 TYR245 0.2190 3885 O 122.0250 117.4070 85.1090 O.2 245 TYR245 -0.2778 3886 CB 120.1695 117.1497 88.0408 C.3 245 TYR245 -0.0036 3887 CG 120.3102 118.6463 88.1002 C.ar 245 TYR245 -0.0453 3888 CD1 121.5535 119.2315 88.3213 C.ar 245 TYR245 -0.0561 3889 CD2 119.1939 119.4631 87.9420 C.ar 245 TYR245 -0.0561 3890 CE1 121.6794 120.6133 88.3753 C.ar 245 TYR245 -0.0317 3891 CE2 119.3171 120.8449 88.0053 C.ar 245 TYR245 -0.0317 3892 CZ 120.5620 121.4192 88.2165 C.ar 245 TYR245 0.0726 3893 OH 120.6936 122.7903 88.2767 O.3 245 TYR245 -0.3598 3894 H 119.6360 114.8030 87.5280 H 245 TYR245 0.1312 3895 HA 119.6503 117.1092 85.9194 H 245 TYR245 0.0560 3896 HB1 120.8895 116.6847 88.7168 H 245 TYR245 0.0333 3897 HB2 119.1857 116.8820 88.4291 H 245 TYR245 0.0333 3898 HD1 122.4293 118.6108 88.4480 H 245 TYR245 0.0621 3899 HD2 118.2211 119.0240 87.7717 H 245 TYR245 0.0621 3900 HE1 122.6448 121.0675 88.5416 H 245 TYR245 0.0643 3901 HE2 118.4477 121.4740 87.8848 H 245 TYR245 0.0643 3902 HH 119.8487 123.2025 88.1519 H 245 TYR245 0.2173 3903 N 122.7020 116.0030 86.7240 N.am 246 HIS246 -0.2453 3904 CA 124.0910 116.0370 86.3090 C.3 246 HIS246 0.0932 3905 C 124.3280 115.3540 84.9740 C.2 246 HIS246 0.2190 3906 O 125.1770 115.7940 84.2070 O.2 246 HIS246 -0.2778 3907 CB 124.9686 115.4273 87.4133 C.3 246 HIS246 0.0146 3908 CG 124.8690 116.2604 88.6760 C.ar 246 HIS246 0.0551 3909 ND1 124.0260 115.9923 89.6957 N.ar 246 HIS246 -0.2469 3910 CD2 125.6015 117.4117 89.0137 C.ar 246 HIS246 0.0047 3911 CE1 124.2459 116.9355 90.6265 C.ar 246 HIS246 0.0737 3912 NE2 125.1962 117.8063 90.2431 N.ar 246 HIS246 -0.2539 3913 H 122.4350 115.4140 87.5120 H 246 HIS246 0.1312 3914 HA 124.3569 117.0880 86.1798 H 246 HIS246 0.0561 3915 HB1 126.0134 115.3934 87.1029 H 246 HIS246 0.0348 3916 HB2 124.6607 114.4035 87.6315 H 246 HIS246 0.0348 3917 HD2 126.3546 117.8930 88.4096 H 246 HIS246 0.0764 3918 HE1 123.7274 116.9771 91.5745 H 246 HIS246 0.0963 3919 HE2 125.5315 118.5709 90.7570 H 246 HIS246 0.1339 3920 N 123.5460 114.3010 84.6370 N.am 247 LEU247 -0.2456 3921 CA 123.5490 113.6980 83.3080 C.3 247 LEU247 0.0880 3922 C 123.1490 114.6690 82.1990 C.2 247 LEU247 0.2187 3923 O 123.7980 114.7330 81.1620 O.2 247 LEU247 -0.2778 3924 CB 122.6955 112.4221 83.2379 C.3 247 LEU247 -0.0266 3925 CG 123.2187 111.2522 84.0959 C.3 247 LEU247 -0.0449 3926 CD1 122.2167 110.0902 84.0912 C.3 247 LEU247 -0.0626 3927 CD2 124.5941 110.7558 83.6263 C.3 247 LEU247 -0.0626 3928 H 122.9250 113.9110 85.3460 H 247 LEU247 0.1312 3929 HA 124.5843 113.4281 83.1150 H 247 LEU247 0.0557 3930 HB1 122.6425 112.0781 82.2035 H 247 LEU247 0.0287 3931 HB2 121.6738 112.6723 83.5113 H 247 LEU247 0.0287 3932 HG 123.3323 111.5880 85.1239 H 247 LEU247 0.0296 3933 HD11 122.5727 109.2628 84.7052 H 247 LEU247 0.0232 3934 HD12 122.0614 109.7098 83.0814 H 247 LEU247 0.0232 3935 HD13 121.2478 110.3962 84.4833 H 247 LEU247 0.0232 3936 HD21 124.9110 109.8876 84.2048 H 247 LEU247 0.0232 3937 HD22 125.3642 111.5165 83.7487 H 247 LEU247 0.0232 3938 HD23 124.5713 110.4646 82.5759 H 247 LEU247 0.0232 3939 N 122.0890 115.4780 82.3990 N.am 248 TYR248 -0.2453 3940 CA 121.6930 116.5310 81.4780 C.3 248 TYR248 0.0917 3941 C 122.7480 117.6330 81.3270 C.2 248 TYR248 0.2190 3942 O 123.1040 118.0360 80.2230 O.2 248 TYR248 -0.2778 3943 CB 120.3682 117.1082 81.9913 C.3 248 TYR248 -0.0036 3944 CG 119.6653 118.0100 81.0090 C.ar 248 TYR248 -0.0453 3945 CD1 119.9891 119.3615 80.9215 C.ar 248 TYR248 -0.0561 3946 CD2 118.6350 117.5121 80.2163 C.ar 248 TYR248 -0.0561 3947 CE1 119.2951 120.1979 80.0559 C.ar 248 TYR248 -0.0317 3948 CE2 117.9193 118.3531 79.3745 C.ar 248 TYR248 -0.0317 3949 CZ 118.2496 119.6969 79.2943 C.ar 248 TYR248 0.0726 3950 OH 117.5204 120.5397 78.4815 O.3 248 TYR248 -0.3598 3951 H 121.5340 115.3440 83.2440 H 248 TYR248 0.1312 3952 HA 121.5477 116.0589 80.5052 H 248 TYR248 0.0560 3953 HB1 120.5115 117.6360 82.9353 H 248 TYR248 0.0333 3954 HB2 119.7114 116.2708 82.2093 H 248 TYR248 0.0333 3955 HD1 120.7817 119.7696 81.5326 H 248 TYR248 0.0621 3956 HD2 118.3676 116.4674 80.2747 H 248 TYR248 0.0621 3957 HE1 119.5474 121.2458 79.9927 H 248 TYR248 0.0643 3958 HE2 117.0977 117.9672 78.7906 H 248 TYR248 0.0643 3959 HH 116.7874 120.0651 78.1113 H 248 TYR248 0.2173 3960 N 123.3280 118.1150 82.4410 N.am 249 PHE249 -0.2453 3961 CA 124.3140 119.1870 82.4060 C.3 249 PHE249 0.0917 3962 C 125.7070 118.7580 81.9270 C.2 249 PHE249 0.2190 3963 O 126.5330 119.6040 81.5900 O.2 249 PHE249 -0.2778 3964 CB 124.3574 119.9086 83.7652 C.3 249 PHE249 -0.0036 3965 CG 123.2531 120.9314 83.8660 C.ar 249 PHE249 -0.0454 3966 CD1 123.3700 122.1458 83.1947 C.ar 249 PHE249 -0.0585 3967 CD2 122.0929 120.6763 84.5906 C.ar 249 PHE249 -0.0585 3968 CE1 122.3422 123.0794 83.2327 C.ar 249 PHE249 -0.0615 3969 CE2 121.0601 121.6040 84.6247 C.ar 249 PHE249 -0.0615 3970 CZ 121.1831 122.8068 83.9449 C.ar 249 PHE249 -0.0617 3971 H 123.0680 117.7160 83.3430 H 249 PHE249 0.1312 3972 HA 123.9693 119.8946 81.6494 H 249 PHE249 0.0560 3973 HB1 125.3022 120.4379 83.8943 H 249 PHE249 0.0333 3974 HB2 124.2918 119.1917 84.5849 H 249 PHE249 0.0333 3975 HD1 124.2610 122.3593 82.6219 H 249 PHE249 0.0620 3976 HD2 121.9815 119.7523 85.1327 H 249 PHE249 0.0620 3977 HE1 122.4406 124.0142 82.7005 H 249 PHE249 0.0618 3978 HE2 120.1597 121.3895 85.1806 H 249 PHE249 0.0618 3979 HZ 120.3792 123.5283 83.9719 H 249 PHE249 0.0618 3980 N 125.9880 117.4390 81.8270 N.am 250 ILE250 -0.2454 3981 CA 127.1750 116.9240 81.1530 C.3 250 ILE250 0.0903 3982 C 126.8710 116.4770 79.7240 C.2 250 ILE250 0.2189 3983 O 127.7620 116.2150 78.9230 O.2 250 ILE250 -0.2778 3984 CB 127.8077 115.7751 81.9701 C.3 250 ILE250 -0.0201 3985 CG1 129.2833 115.5480 81.5854 C.3 250 ILE250 -0.0514 3986 CG2 127.0020 114.4724 81.8894 C.3 250 ILE250 -0.0605 3987 CD1 130.0054 114.5162 82.4604 C.3 250 ILE250 -0.0650 3988 H 125.3380 116.7720 82.2430 H 250 ILE250 0.1312 3989 HA 127.8983 117.7378 81.0837 H 250 ILE250 0.0560 3990 HB 127.7770 116.0912 83.0072 H 250 ILE250 0.0318 3991 HG11 129.8233 116.4937 81.6430 H 250 ILE250 0.0266 3992 HG12 129.3428 115.2271 80.5466 H 250 ILE250 0.0266 3993 HG21 127.3277 113.7478 82.6348 H 250 ILE250 0.0233 3994 HG22 127.0780 114.0056 80.9071 H 250 ILE250 0.0233 3995 HG23 125.9572 114.6793 82.0801 H 250 ILE250 0.0233 3996 HD11 131.0414 114.4038 82.1437 H 250 ILE250 0.0230 3997 HD12 129.5423 113.5329 82.3867 H 250 ILE250 0.0230 3998 HD13 130.0073 114.8124 83.5087 H 250 ILE250 0.0230 3999 N 125.5850 116.4240 79.3250 N.am 251 LEU251 -0.2456 4000 CA 125.1590 115.8550 78.0540 C.3 251 LEU251 0.0880 4001 C 125.6630 116.5800 76.8150 C.2 251 LEU251 0.2185 4002 O 126.0870 115.9790 75.8270 O.2 251 LEU251 -0.2778 4003 CB 123.6206 115.7995 78.0241 C.3 251 LEU251 -0.0266 4004 CG 123.0106 115.1090 76.7894 C.3 251 LEU251 -0.0449 4005 CD1 123.5350 113.6783 76.6037 C.3 251 LEU251 -0.0626 4006 CD2 121.4819 115.1073 76.8927 C.3 251 LEU251 -0.0626 4007 H 124.8710 116.8030 79.9470 H 251 LEU251 0.1312 4008 HA 125.5699 114.8453 78.0351 H 251 LEU251 0.0557 4009 HB1 123.2228 116.8126 78.0887 H 251 LEU251 0.0287 4010 HB2 123.2671 115.2847 78.9144 H 251 LEU251 0.0287 4011 HG 123.2757 115.6788 75.8971 H 251 LEU251 0.0296 4012 HD11 123.0453 113.1906 75.7605 H 251 LEU251 0.0232 4013 HD12 123.3541 113.0733 77.4924 H 251 LEU251 0.0232 4014 HD13 124.6055 113.6679 76.3993 H 251 LEU251 0.0232 4015 HD21 121.0442 114.5897 76.0416 H 251 LEU251 0.0232 4016 HD22 121.0853 116.1231 76.9118 H 251 LEU251 0.0232 4017 HD23 121.1474 114.5991 77.7975 H 251 LEU251 0.0232 4018 N 125.6690 117.9260 76.8560 N.am 252 GLY252 -0.2485 4019 CA 125.9480 118.7530 75.6870 C.3 252 GLY252 0.0765 4020 C 127.3980 118.8400 75.2850 C.2 252 GLY252 0.2156 4021 O 127.7210 119.4860 74.2980 O.2 252 GLY252 -0.2781 4022 H 125.4700 118.3880 77.7430 H 252 GLY252 0.1309 4023 HA1 125.5822 119.7542 75.9096 H 252 GLY252 0.0521 4024 HA2 125.3714 118.3600 74.8476 H 252 GLY252 0.0521 4025 N 128.3140 118.2060 76.0430 N.am 253 SER253 -0.2439 4026 CA 129.7270 118.1510 75.7060 C.3 253 SER253 0.1109 4027 C 130.1190 116.8320 75.0390 C.2 253 SER253 0.2209 4028 O 131.2760 116.6580 74.6610 O.2 253 SER253 -0.2777 4029 CB 130.5682 118.3816 76.9696 C.3 253 SER253 0.0681 4030 OG 130.2531 117.4316 77.9818 O.3 253 SER253 -0.3930 4031 H 128.0010 117.7420 76.8950 H 253 SER253 0.1312 4032 HA 129.9462 118.9422 74.9871 H 253 SER253 0.0580 4033 HB1 130.3676 119.3922 77.3389 H 253 SER253 0.0577 4034 HB2 131.6315 118.3291 76.7092 H 253 SER253 0.0577 4035 HG 130.8008 117.5464 78.7528 H 253 SER253 0.2095 4036 N 129.1570 115.8940 74.8370 N.am 254 PHE254 -0.2453 4037 CA 129.3770 114.6630 74.0790 C.3 254 PHE254 0.0917 4038 C 128.3610 114.4690 72.9550 C.2 254 PHE254 0.2190 4039 O 128.5690 113.6570 72.0540 O.2 254 PHE254 -0.2778 4040 CB 129.3261 113.4713 75.0491 C.3 254 PHE254 -0.0036 4041 CG 130.4287 113.5352 76.0748 C.ar 254 PHE254 -0.0454 4042 CD1 131.6974 113.0520 75.7694 C.ar 254 PHE254 -0.0585 4043 CD2 130.2085 114.1070 77.3253 C.ar 254 PHE254 -0.0585 4044 CE1 132.7288 113.1365 76.6958 C.ar 254 PHE254 -0.0615 4045 CE2 131.2396 114.1971 78.2516 C.ar 254 PHE254 -0.0615 4046 CZ 132.5005 113.7102 77.9386 C.ar 254 PHE254 -0.0617 4047 H 128.2320 116.0570 75.2350 H 254 PHE254 0.1312 4048 HA 130.3563 114.7168 73.6005 H 254 PHE254 0.0560 4049 HB1 129.4193 112.5328 74.5009 H 254 PHE254 0.0333 4050 HB2 128.3611 113.4407 75.5570 H 254 PHE254 0.0333 4051 HD1 131.8885 112.6240 74.7960 H 254 PHE254 0.0620 4052 HD2 129.2378 114.5146 77.5692 H 254 PHE254 0.0620 4053 HE1 133.7116 112.7679 76.4420 H 254 PHE254 0.0618 4054 HE2 131.0647 114.6614 79.2097 H 254 PHE254 0.0618 4055 HZ 133.3040 113.7892 78.6556 H 254 PHE254 0.0618 4056 N 127.2370 115.2070 72.9860 N.am 255 GLN255 -0.2456 4057 CA 126.2420 115.2000 71.9330 C.3 255 GLN255 0.0882 4058 C 125.4450 116.4800 72.0860 C.2 255 GLN255 0.2187 4059 O 124.5290 116.5930 72.9020 O.2 255 GLN255 -0.2778 4060 CB 125.4035 113.9022 72.0143 C.3 255 GLN255 -0.0210 4061 CG 123.8997 113.9733 71.6637 C.3 255 GLN255 0.0225 4062 CD 123.5151 114.5213 70.2784 C.2 255 GLN255 0.1981 4063 OE1 122.3385 114.7060 70.0030 O.2 255 GLN255 -0.2798 4064 NE2 124.5236 114.7681 69.4284 N.am 255 GLN255 -0.2724 4065 H 127.0760 115.8050 73.7960 H 255 GLN255 0.1312 4066 HA 126.7818 115.2602 70.9840 H 255 GLN255 0.0557 4067 HB1 125.4655 113.5211 73.0342 H 255 GLN255 0.0289 4068 HB2 125.8862 113.1423 71.3990 H 255 GLN255 0.0289 4069 HG1 123.3624 114.5617 72.4059 H 255 GLN255 0.0356 4070 HG2 123.4769 112.9718 71.7309 H 255 GLN255 0.0356 4071 HE21 124.3068 115.1250 68.5191 H 255 GLN255 0.1266 4072 HE22 125.4851 114.6231 69.6585 H 255 GLN255 0.1266 4073 N 125.8130 117.5050 71.2970 N.am 256 GLU256 -0.2456 4074 CA 125.3050 118.8520 71.3890 C.3 256 GLU256 0.0883 4075 C 124.0610 119.0980 70.5330 C.2 256 GLU256 0.2187 4076 O 123.3490 120.0830 70.7350 O.2 256 GLU256 -0.2778 4077 CB 126.4285 119.8327 70.9945 C.3 256 GLU256 -0.0193 4078 CG 127.1088 119.5416 69.6376 C.3 256 GLU256 0.0356 4079 CD 128.2453 118.5111 69.7632 C.2 256 GLU256 0.1760 4080 OE1 129.2951 118.8631 70.2942 O.co2 256 GLU256 -0.6478 4081 OE2 128.0693 117.3719 69.3331 O.co2 256 GLU256 -0.6478 4082 H 126.5080 117.3140 70.5750 H 256 GLU256 0.1312 4083 HA 125.0277 119.0308 72.4282 H 256 GLU256 0.0557 4084 HB1 127.1862 119.8471 71.7789 H 256 GLU256 0.0290 4085 HB2 126.0234 120.8447 70.9742 H 256 GLU256 0.0290 4086 HG1 127.5552 120.4552 69.2474 H 256 GLU256 0.0374 4087 HG2 126.3897 119.2039 68.8915 H 256 GLU256 0.0374 4088 N 123.6950 118.1540 69.6320 N.am 257 ASP257 -0.2451 4089 CA 122.6060 118.3040 68.6740 C.3 257 ASP257 0.0974 4090 C 121.2400 117.9120 69.2330 C.2 257 ASP257 0.2192 4091 O 120.2130 117.9560 68.5550 O.2 257 ASP257 -0.2778 4092 CB 122.9376 117.5070 67.3966 C.3 257 ASP257 0.0576 4093 CG 122.0435 117.8823 66.1969 C.2 257 ASP257 0.1780 4094 OD1 121.8519 119.0725 65.9479 O.co2 257 ASP257 -0.6478 4095 OD2 121.5490 116.9800 65.5222 O.co2 257 ASP257 -0.6478 4096 H 124.2170 117.2780 69.6230 H 257 ASP257 0.1312 4097 HA 122.5590 119.3644 68.4191 H 257 ASP257 0.0563 4098 HB1 122.8628 116.4352 67.5788 H 257 ASP257 0.0394 4099 HB2 123.9654 117.7048 67.0960 H 257 ASP257 0.0394 4100 N 121.1560 117.5640 70.5330 N.am 258 ILE258 -0.2454 4101 CA 119.9040 117.1490 71.1480 C.3 258 ILE258 0.0903 4102 C 118.9390 118.3200 71.3930 C.2 258 ILE258 0.2189 4103 O 117.7330 118.1460 71.5670 O.2 258 ILE258 -0.2778 4104 CB 120.1738 116.3083 72.4130 C.3 258 ILE258 -0.0201 4105 CG1 118.9145 115.5137 72.8150 C.3 258 ILE258 -0.0514 4106 CG2 120.7428 117.1499 73.5659 C.3 258 ILE258 -0.0605 4107 CD1 119.1107 114.5957 74.0241 C.3 258 ILE258 -0.0650 4108 H 122.0000 117.5930 71.1060 H 258 ILE258 0.1312 4109 HA 119.4233 116.5002 70.4129 H 258 ILE258 0.0560 4110 HB 120.9378 115.5760 72.1469 H 258 ILE258 0.0318 4111 HG11 118.6015 114.9045 71.9663 H 258 ILE258 0.0266 4112 HG12 118.0866 116.1910 73.0146 H 258 ILE258 0.0266 4113 HG21 121.0424 116.5249 74.4060 H 258 ILE258 0.0233 4114 HG22 120.0153 117.8748 73.9318 H 258 ILE258 0.0233 4115 HG23 121.6317 117.6913 73.2424 H 258 ILE258 0.0233 4116 HD11 118.2362 113.9625 74.1741 H 258 ILE258 0.0230 4117 HD12 119.2490 115.1775 74.9340 H 258 ILE258 0.0230 4118 HD13 119.9774 113.9476 73.8921 H 258 ILE258 0.0230 4119 N 119.4460 119.5750 71.3380 N.am 259 TYR259 -0.2453 4120 CA 118.7180 120.7910 71.6890 C.3 259 TYR259 0.0917 4121 C 117.9340 121.4160 70.5350 C.2 259 TYR259 0.2190 4122 O 117.5620 122.5880 70.5740 O.2 259 TYR259 -0.2778 4123 CB 119.7036 121.7948 72.3145 C.3 259 TYR259 -0.0036 4124 CG 120.2922 121.2691 73.6012 C.ar 259 TYR259 -0.0453 4125 CD1 119.6048 121.4109 74.8034 C.ar 259 TYR259 -0.0561 4126 CD2 121.5191 120.6121 73.6056 C.ar 259 TYR259 -0.0561 4127 CE1 120.1188 120.8751 75.9786 C.ar 259 TYR259 -0.0317 4128 CE2 122.0377 120.0788 74.7787 C.ar 259 TYR259 -0.0317 4129 CZ 121.3296 120.1987 75.9650 C.ar 259 TYR259 0.0726 4130 OH 121.8189 119.6402 77.1277 O.3 259 TYR259 -0.3598 4131 H 120.4120 119.6790 71.0270 H 259 TYR259 0.1312 4132 HA 117.9902 120.5034 72.4433 H 259 TYR259 0.0560 4133 HB1 119.2043 122.7400 72.5310 H 259 TYR259 0.0333 4134 HB2 120.5061 122.0218 71.6107 H 259 TYR259 0.0333 4135 HD1 118.6488 121.9137 74.8233 H 259 TYR259 0.0621 4136 HD2 122.0635 120.4882 72.6833 H 259 TYR259 0.0621 4137 HE1 119.5717 120.9694 76.9044 H 259 TYR259 0.0643 4138 HE2 122.9791 119.5495 74.7592 H 259 TYR259 0.0643 4139 HH 122.6280 119.1797 76.9479 H 259 TYR259 0.2173 4140 N 117.6180 120.6230 69.4930 N.am 260 CYS260 -0.2449 4141 CA 116.9270 121.0920 68.3030 C.3 260 CYS260 0.0965 4142 C 115.4940 120.5720 68.2370 C.2 260 CYS260 0.2195 4143 O 114.8180 120.7120 67.2230 O.2 260 CYS260 -0.2778 4144 CB 117.7371 120.5986 67.0940 C.3 260 CYS260 0.0147 4145 SG 119.4351 121.2320 67.1024 S.3 260 CYS260 -0.1762 4146 H 117.8780 119.6380 69.5420 H 260 CYS260 0.1312 4147 HA 116.8988 122.1821 68.3027 H 260 CYS260 0.0565 4148 HB1 117.2631 120.8914 66.1567 H 260 CYS260 0.0394 4149 HB2 117.7844 119.5083 67.0938 H 260 CYS260 0.0394 4150 HG 120.2506 120.3376 66.5202 H 260 CYS260 0.1017 4151 N 114.9780 119.9850 69.3410 N.am 261 HIS261 -0.2453 4152 CA 113.6430 119.4130 69.3870 C.3 261 HIS261 0.0932 4153 C 112.9760 119.6730 70.7110 C.2 261 HIS261 0.2190 4154 O 113.6060 119.9010 71.7360 O.2 261 HIS261 -0.2778 4155 CB 113.7560 117.8860 69.2045 C.3 261 HIS261 0.0146 4156 CG 114.3191 117.5519 67.8435 C.ar 261 HIS261 0.0551 4157 ND1 113.5696 117.4773 66.7229 N.ar 261 HIS261 -0.2469 4158 CD2 115.6593 117.3011 67.5028 C.ar 261 HIS261 0.0047 4159 CE1 114.4333 117.2146 65.7252 C.ar 261 HIS261 0.0737 4160 NE2 115.6981 117.0972 66.1678 N.ar 261 HIS261 -0.2539 4161 H 115.5540 119.9420 70.1820 H 261 HIS261 0.1312 4162 HA 113.0355 119.8607 68.5983 H 261 HIS261 0.0561 4163 HB1 112.7825 117.4030 69.2949 H 261 HIS261 0.0348 4164 HB2 114.4038 117.4515 69.9675 H 261 HIS261 0.0348 4165 HD2 116.5084 117.3069 68.1720 H 261 HIS261 0.0764 4166 HE1 114.1493 117.1176 64.6872 H 261 HIS261 0.0963 4167 HE2 116.5009 116.9248 65.6298 H 261 HIS261 0.1339 4168 N 111.6340 119.5680 70.7460 N.am 262 LYS262 -0.2456 4169 CA 110.8490 119.8760 71.9240 C.3 262 LYS262 0.0878 4170 C 110.9000 118.7750 72.9660 C.2 262 LYS262 0.2187 4171 O 110.4870 118.9590 74.1060 O.2 262 LYS262 -0.2778 4172 CB 109.3743 120.1942 71.5766 C.3 262 LYS262 -0.0289 4173 CG 109.1416 121.6149 71.0240 C.3 262 LYS262 -0.0496 4174 CD 107.6487 121.9661 70.8205 C.3 262 LYS262 -0.0278 4175 CE 106.8694 122.2146 72.1292 C.3 262 LYS262 0.1103 4176 NZ 105.4271 122.4159 71.9625 N.4 262 LYS262 -0.0749 4177 H 111.1480 119.2570 69.9050 H 262 LYS262 0.1312 4178 HA 111.2984 120.7556 72.3891 H 262 LYS262 0.0557 4179 HB1 108.7684 120.0948 72.4780 H 262 LYS262 0.0285 4180 HB2 108.9921 119.4496 70.8772 H 262 LYS262 0.0285 4181 HG1 109.6653 121.7057 70.0714 H 262 LYS262 0.0266 4182 HG2 109.6014 122.3483 71.6873 H 262 LYS262 0.0266 4183 HD1 107.1726 121.1679 70.2497 H 262 LYS262 0.0282 4184 HD2 107.5819 122.8621 70.2021 H 262 LYS262 0.0282 4185 HE1 107.2528 123.1002 72.6347 H 262 LYS262 0.0559 4186 HE2 107.0008 121.3734 72.8122 H 262 LYS262 0.0559 4187 HZ1 104.9678 122.3907 72.8962 H 262 LYS262 0.2742 4188 HZ2 105.0240 121.6573 71.3764 H 262 LYS262 0.2742 4189 HZ3 105.2324 123.3433 71.5247 H 262 LYS262 0.2742 4190 N 111.4430 117.5980 72.6040 N.am 263 PHE263 -0.2453 4191 CA 111.7000 116.5050 73.5190 C.3 263 PHE263 0.0917 4192 C 112.6270 116.9590 74.6410 C.2 263 PHE263 0.2190 4193 O 112.4030 116.6560 75.8080 O.2 263 PHE263 -0.2778 4194 CB 112.3271 115.3512 72.7184 C.3 263 PHE263 -0.0036 4195 CG 112.7444 114.1908 73.5838 C.ar 263 PHE263 -0.0454 4196 CD1 111.7884 113.3988 74.2125 C.ar 263 PHE263 -0.0585 4197 CD2 114.0931 113.8995 73.7709 C.ar 263 PHE263 -0.0585 4198 CE1 112.1731 112.3322 75.0143 C.ar 263 PHE263 -0.0615 4199 CE2 114.4799 112.8276 74.5640 C.ar 263 PHE263 -0.0615 4200 CZ 113.5195 112.0441 75.1883 C.ar 263 PHE263 -0.0617 4201 H 111.6890 117.4670 71.6230 H 263 PHE263 0.1312 4202 HA 110.7446 116.2093 73.9548 H 263 PHE263 0.0560 4203 HB1 113.1922 115.7120 72.1593 H 263 PHE263 0.0333 4204 HB2 111.6161 114.9906 71.9747 H 263 PHE263 0.0333 4205 HD1 110.7376 113.6114 74.0812 H 263 PHE263 0.0620 4206 HD2 114.8516 114.5061 73.2970 H 263 PHE263 0.0620 4207 HE1 111.4244 111.7234 75.4999 H 263 PHE263 0.0618 4208 HE2 115.5287 112.6083 74.7016 H 263 PHE263 0.0618 4209 HZ 113.8194 111.2132 75.8101 H 263 PHE263 0.0618 4210 N 113.6520 117.7790 74.3210 N.am 264 ILE264 -0.2454 4211 CA 114.5880 118.2580 75.3170 C.3 264 ILE264 0.0903 4212 C 113.9990 119.1620 76.3990 C.2 264 ILE264 0.2189 4213 O 114.3890 119.0850 77.5610 O.2 264 ILE264 -0.2778 4214 CB 115.7785 118.9323 74.5932 C.3 264 ILE264 -0.0201 4215 CG1 117.0979 118.8717 75.3856 C.3 264 ILE264 -0.0514 4216 CG2 115.4750 120.3913 74.2004 C.3 264 ILE264 -0.0605 4217 CD1 117.5162 117.4680 75.8399 C.3 264 ILE264 -0.0650 4218 H 113.7700 118.0690 73.3500 H 264 ILE264 0.1312 4219 HA 114.9288 117.3524 75.8166 H 264 ILE264 0.0560 4220 HB 115.9482 118.3734 73.6709 H 264 ILE264 0.0318 4221 HG11 117.0466 119.5312 76.2500 H 264 ILE264 0.0266 4222 HG12 117.8880 119.2648 74.7469 H 264 ILE264 0.0266 4223 HG21 116.1632 120.7588 73.4439 H 264 ILE264 0.0233 4224 HG22 115.5536 121.0574 75.0602 H 264 ILE264 0.0233 4225 HG23 114.4688 120.5008 73.8063 H 264 ILE264 0.0233 4226 HD11 118.5468 117.4699 76.1966 H 264 ILE264 0.0230 4227 HD12 117.4458 116.7540 75.0226 H 264 ILE264 0.0230 4228 HD13 116.8932 117.1023 76.6551 H 264 ILE264 0.0230 4229 N 113.0080 120.0260 76.0670 N.am 265 GLN265 -0.2456 4230 CA 112.2970 120.8080 77.0680 C.3 265 GLN265 0.0882 4231 C 111.4400 119.9270 77.9800 C.2 265 GLN265 0.2187 4232 O 111.3650 120.1570 79.1820 O.2 265 GLN265 -0.2778 4233 CB 111.4732 121.9466 76.4184 C.3 265 GLN265 -0.0210 4234 CG 109.9740 121.6438 76.1965 C.3 265 GLN265 0.0225 4235 CD 109.2534 122.7437 75.4077 C.2 265 GLN265 0.1981 4236 OE1 108.8208 122.5373 74.2812 O.2 265 GLN265 -0.2798 4237 NE2 109.1452 123.9129 76.0574 N.am 265 GLN265 -0.2724 4238 H 112.7530 120.1310 75.0850 H 265 GLN265 0.1312 4239 HA 113.0731 121.2600 77.6888 H 265 GLN265 0.0557 4240 HB1 111.9478 122.2272 75.4781 H 265 GLN265 0.0289 4241 HB2 111.5479 122.8274 77.0581 H 265 GLN265 0.0289 4242 HG1 109.4570 121.5277 77.1497 H 265 GLN265 0.0356 4243 HG2 109.8485 120.7135 75.6478 H 265 GLN265 0.0356 4244 HE21 108.6902 124.6962 75.6328 H 265 GLN265 0.1266 4245 HE22 109.5093 124.0346 76.9819 H 265 GLN265 0.1266 4246 N 110.8100 118.8550 77.4300 N.am 266 GLN266 -0.2456 4247 CA 110.0710 117.8610 78.2060 C.3 266 GLN266 0.0882 4248 C 110.9840 117.1030 79.1690 C.2 266 GLN266 0.2187 4249 O 110.6600 116.9200 80.3410 O.2 266 GLN266 -0.2778 4250 CB 109.3203 116.9010 77.2679 C.3 266 GLN266 -0.0210 4251 CG 108.3540 117.5989 76.2928 C.3 266 GLN266 0.0225 4252 CD 107.1339 118.2239 76.9842 C.2 266 GLN266 0.1981 4253 OE1 106.0554 117.6508 77.0110 O.2 266 GLN266 -0.2798 4254 NE2 107.3588 119.4298 77.5259 N.am 266 GLN266 -0.2724 4255 H 110.8560 118.7380 76.4180 H 266 GLN266 0.1312 4256 HA 109.3643 118.4114 78.8272 H 266 GLN266 0.0557 4257 HB1 108.7710 116.1635 77.8557 H 266 GLN266 0.0289 4258 HB2 110.0465 116.3344 76.6844 H 266 GLN266 0.0289 4259 HG1 107.9817 116.8728 75.5706 H 266 GLN266 0.0356 4260 HG2 108.8571 118.3738 75.7213 H 266 GLN266 0.0356 4261 HE21 106.6077 119.9127 77.9768 H 266 GLN266 0.1266 4262 HE22 108.2612 119.8571 77.5010 H 266 GLN266 0.1266 4263 N 112.1880 116.6970 78.7000 N.am 267 VAL267 -0.2454 4264 CA 113.2510 116.1270 79.5280 C.3 267 VAL267 0.0901 4265 C 113.7330 117.0940 80.6100 C.2 267 VAL267 0.2189 4266 O 113.8550 116.7170 81.7750 O.2 267 VAL267 -0.2778 4267 CB 114.4205 115.6582 78.6327 C.3 267 VAL267 -0.0227 4268 CG1 115.6508 115.2060 79.4402 C.3 267 VAL267 -0.0608 4269 CG2 113.9891 114.5169 77.7010 C.3 267 VAL267 -0.0608 4270 H 112.3660 116.7960 77.7000 H 267 VAL267 0.1312 4271 HA 112.8137 115.2679 80.0388 H 267 VAL267 0.0560 4272 HB 114.7262 116.5008 78.0117 H 267 VAL267 0.0315 4273 HG11 116.4502 114.8695 78.7796 H 267 VAL267 0.0233 4274 HG12 115.4017 114.3824 80.1098 H 267 VAL267 0.0233 4275 HG13 116.0569 116.0138 80.0468 H 267 VAL267 0.0233 4276 HG21 114.7985 114.2519 77.0214 H 267 VAL267 0.0233 4277 HG22 113.1245 114.7776 77.0946 H 267 VAL267 0.0233 4278 HG23 113.7282 113.6242 78.2698 H 267 VAL267 0.0233 4279 N 113.9660 118.3830 80.2690 N.am 268 TYR268 -0.2453 4280 CA 114.3380 119.4280 81.2130 C.3 268 TYR268 0.0917 4281 C 113.2850 119.6440 82.3050 C.2 268 TYR268 0.2190 4282 O 113.6150 119.6610 83.4880 O.2 268 TYR268 -0.2778 4283 CB 114.6134 120.7585 80.4947 C.3 268 TYR268 -0.0036 4284 CG 115.0740 121.8112 81.4742 C.ar 268 TYR268 -0.0453 4285 CD1 116.3614 121.7609 82.0006 C.ar 268 TYR268 -0.0561 4286 CD2 114.1882 122.7744 81.9534 C.ar 268 TYR268 -0.0561 4287 CE1 116.7559 122.6482 82.9935 C.ar 268 TYR268 -0.0317 4288 CE2 114.5799 123.6607 82.9499 C.ar 268 TYR268 -0.0317 4289 CZ 115.8631 123.5944 83.4730 C.ar 268 TYR268 0.0726 4290 OH 116.2498 124.4546 84.4794 O.3 268 TYR268 -0.3598 4291 H 113.8750 118.6390 79.2860 H 268 TYR268 0.1312 4292 HA 115.2491 119.0761 81.6995 H 268 TYR268 0.0560 4293 HB1 113.7207 121.1049 79.9734 H 268 TYR268 0.0333 4294 HB2 115.3785 120.6185 79.7334 H 268 TYR268 0.0333 4295 HD1 117.0524 121.0039 81.6623 H 268 TYR268 0.0621 4296 HD2 113.1744 122.8091 81.5811 H 268 TYR268 0.0621 4297 HE1 117.7520 122.5949 83.4072 H 268 TYR268 0.0643 4298 HE2 113.8822 124.3885 83.3357 H 268 TYR268 0.0643 4299 HH 115.5923 125.1276 84.5937 H 268 TYR268 0.2173 4300 N 111.9860 119.7420 81.9440 N.am 269 LEU269 -0.2456 4301 CA 110.8800 119.8080 82.8910 C.3 269 LEU269 0.0880 4302 C 110.7860 118.5770 83.7850 C.2 269 LEU269 0.2187 4303 O 110.6740 118.6880 85.0040 O.2 269 LEU269 -0.2778 4304 CB 109.5788 120.0611 82.1108 C.3 269 LEU269 -0.0266 4305 CG 109.5369 121.4362 81.4093 C.3 269 LEU269 -0.0449 4306 CD1 108.5401 121.4318 80.2447 C.3 269 LEU269 -0.0626 4307 CD2 109.1962 122.5668 82.3898 C.3 269 LEU269 -0.0626 4308 H 111.7670 119.7720 80.9480 H 269 LEU269 0.1312 4309 HA 111.0883 120.6571 83.5424 H 269 LEU269 0.0557 4310 HB1 108.7204 119.9864 82.7774 H 269 LEU269 0.0287 4311 HB2 109.4627 119.2670 81.3716 H 269 LEU269 0.0287 4312 HG 110.5176 121.6525 80.9862 H 269 LEU269 0.0296 4313 HD11 108.5591 122.3842 79.7156 H 269 LEU269 0.0232 4314 HD12 107.5226 121.2609 80.5955 H 269 LEU269 0.0232 4315 HD13 108.7830 120.6507 79.5260 H 269 LEU269 0.0232 4316 HD21 109.2051 123.5345 81.8881 H 269 LEU269 0.0232 4317 HD22 109.9074 122.6137 83.2146 H 269 LEU269 0.0232 4318 HD23 108.2001 122.4303 82.8098 H 269 LEU269 0.0232 4319 N 110.9080 117.3540 83.2310 N.am 270 ALA270 -0.2459 4320 CA 110.9000 116.1460 84.0320 C.3 270 ALA270 0.0850 4321 C 112.0380 116.0630 85.0610 C.2 270 ALA270 0.2184 4322 O 111.8280 115.7560 86.2350 O.2 270 ALA270 -0.2778 4323 CB 110.9652 114.9474 83.0788 C.3 270 ALA270 -0.0411 4324 H 111.0090 117.2770 82.2190 H 270 ALA270 0.1312 4325 HA 109.9553 116.1369 84.5775 H 270 ALA270 0.0554 4326 HB1 110.9077 114.0031 83.6210 H 270 ALA270 0.0249 4327 HB2 111.8905 114.9497 82.5010 H 270 ALA270 0.0249 4328 HB3 110.1370 114.9737 82.3704 H 270 ALA270 0.0249 4329 N 113.2740 116.3880 84.6430 N.am 271 LEU271 -0.2457 4330 CA 114.4570 116.4070 85.4870 C.3 271 LEU271 0.0880 4331 C 114.4780 117.4960 86.5200 C.2 271 LEU271 0.2187 4332 O 114.9030 117.2940 87.6540 O.2 271 LEU271 -0.2778 4333 CB 115.6776 116.5403 84.5640 C.3 271 LEU271 -0.0266 4334 CG 116.2440 115.1908 84.1054 C.3 271 LEU271 -0.0449 4335 CD1 115.2171 114.2419 83.4693 C.3 271 LEU271 -0.0626 4336 CD2 117.4130 115.4309 83.1540 C.3 271 LEU271 -0.0626 4337 H 113.3900 116.6400 83.6610 H 271 LEU271 0.1312 4338 HA 114.4845 115.4591 86.0269 H 271 LEU271 0.0557 4339 HB1 116.4886 117.0655 85.0736 H 271 LEU271 0.0287 4340 HB2 115.4283 117.1652 83.7052 H 271 LEU271 0.0287 4341 HG 116.6273 114.7085 85.0018 H 271 LEU271 0.0296 4342 HD11 115.6888 113.3000 83.1891 H 271 LEU271 0.0232 4343 HD12 114.7819 114.6655 82.5669 H 271 LEU271 0.0232 4344 HD13 114.4063 114.0003 84.1558 H 271 LEU271 0.0232 4345 HD21 117.9231 114.5025 82.8969 H 271 LEU271 0.0232 4346 HD22 118.1334 116.1006 83.6214 H 271 LEU271 0.0232 4347 HD23 117.0739 115.8980 82.2299 H 271 LEU271 0.0232 4348 N 114.0180 118.6940 86.1570 N.am 272 PHE272 -0.2453 4349 CA 113.9050 119.7900 87.0740 C.3 272 PHE272 0.0917 4350 C 112.8290 119.5350 88.1460 C.2 272 PHE272 0.2190 4351 O 113.0530 119.8210 89.3190 O.2 272 PHE272 -0.2778 4352 CB 113.6888 121.0434 86.2269 C.3 272 PHE272 -0.0036 4353 CG 113.8651 122.2715 87.0555 C.ar 272 PHE272 -0.0454 4354 CD1 112.7937 123.1235 87.2640 C.ar 272 PHE272 -0.0585 4355 CD2 115.0906 122.5371 87.6599 C.ar 272 PHE272 -0.0585 4356 CE1 112.9325 124.2076 88.1058 C.ar 272 PHE272 -0.0615 4357 CE2 115.2291 123.6156 88.5157 C.ar 272 PHE272 -0.0615 4358 CZ 114.1436 124.4410 88.7491 C.ar 272 PHE272 -0.0617 4359 H 113.7350 118.8360 85.1870 H 272 PHE272 0.1312 4360 HA 114.8652 119.8448 87.5889 H 272 PHE272 0.0560 4361 HB1 112.7096 121.0282 85.7474 H 272 PHE272 0.0333 4362 HB2 114.4253 121.0815 85.4235 H 272 PHE272 0.0333 4363 HD1 111.8449 122.9414 86.7820 H 272 PHE272 0.0620 4364 HD2 115.9351 121.8857 87.4905 H 272 PHE272 0.0620 4365 HE1 112.0901 124.8700 88.2299 H 272 PHE272 0.0618 4366 HE2 116.1730 123.8131 89.0034 H 272 PHE272 0.0618 4367 HZ 114.2634 125.2830 89.4113 H 272 PHE272 0.0618 4368 N 111.6710 118.9120 87.7980 N.am 273 TRP273 -0.2453 4369 CA 110.7020 118.4250 88.7820 C.3 273 TRP273 0.0918 4370 C 111.3080 117.3910 89.7230 C.2 273 TRP273 0.2190 4371 O 111.1710 117.4850 90.9380 O.2 273 TRP273 -0.2778 4372 CB 109.5255 117.8526 87.9696 C.3 273 TRP273 -0.0021 4373 CG 108.3100 117.5908 88.8318 C.ar 273 TRP273 -0.0260 4374 CD1 107.2353 118.4659 89.0168 C.ar 273 TRP273 -0.0136 4375 CD2 107.9967 116.3919 89.5704 C.ar 273 TRP273 -0.0028 4376 NE1 106.3164 117.8780 89.8212 N.ar 273 TRP273 -0.2641 4377 CE2 106.7365 116.6031 90.1765 C.ar 273 TRP273 0.0269 4378 CE3 108.6560 115.2057 89.7561 C.ar 273 TRP273 -0.0528 4379 CZ2 106.1790 115.6255 90.9542 C.ar 273 TRP273 -0.0430 4380 CZ3 108.0957 114.2113 90.5577 C.ar 273 TRP273 -0.0611 4381 CH2 106.8544 114.4217 91.1585 C.ar 273 TRP273 -0.0602 4382 H 111.4690 118.7780 86.8070 H 273 TRP273 0.1312 4383 HA 110.3853 119.2885 89.3686 H 273 TRP273 0.0560 4384 HB1 109.8150 116.9400 87.4469 H 273 TRP273 0.0334 4385 HB2 109.2355 118.5649 87.1962 H 273 TRP273 0.0334 4386 HD1 107.1498 119.4540 88.5874 H 273 TRP273 0.0748 4387 HE1 105.4787 118.2932 90.1173 H 273 TRP273 0.1331 4388 HE3 109.6144 115.0418 89.2867 H 273 TRP273 0.0624 4389 HZ2 105.2184 115.7955 91.4173 H 273 TRP273 0.0633 4390 HZ3 108.6217 113.2802 90.7100 H 273 TRP273 0.0618 4391 HH2 106.4160 113.6539 91.7790 H 273 TRP273 0.0618 4392 N 112.0450 116.4040 89.1740 N.am 274 LEU274 -0.2456 4393 CA 112.7260 115.3800 89.9460 C.3 274 LEU274 0.0880 4394 C 113.8220 115.9030 90.8790 C.2 274 LEU274 0.2187 4395 O 113.9340 115.4910 92.0300 O.2 274 LEU274 -0.2778 4396 CB 113.3102 114.3154 89.0041 C.3 274 LEU274 -0.0266 4397 CG 113.6913 113.0147 89.7417 C.3 274 LEU274 -0.0449 4398 CD1 112.4611 112.1389 90.0130 C.3 274 LEU274 -0.0626 4399 CD2 114.7629 112.2332 88.9773 C.3 274 LEU274 -0.0626 4400 H 112.1290 116.3750 88.1580 H 274 LEU274 0.1312 4401 HA 111.9542 114.9320 90.5717 H 274 LEU274 0.0557 4402 HB1 114.1814 114.7309 88.4945 H 274 LEU274 0.0287 4403 HB2 112.5945 114.0843 88.2145 H 274 LEU274 0.0287 4404 HG 114.1262 113.2706 90.7069 H 274 LEU274 0.0296 4405 HD11 112.7387 111.2359 90.5574 H 274 LEU274 0.0232 4406 HD12 111.9824 111.8335 89.0823 H 274 LEU274 0.0232 4407 HD13 111.7198 112.6674 90.6121 H 274 LEU274 0.0232 4408 HD21 115.0180 111.3064 89.4921 H 274 LEU274 0.0232 4409 HD22 115.6757 112.8236 88.8996 H 274 LEU274 0.0232 4410 HD23 114.4300 111.9807 87.9705 H 274 LEU274 0.0232 4411 N 114.6540 116.8540 90.4120 N.am 275 ALA275 -0.2459 4412 CA 115.6550 117.5230 91.2200 C.3 275 ALA275 0.0850 4413 C 115.0960 118.4190 92.3280 C.2 275 ALA275 0.2184 4414 O 115.6270 118.4480 93.4350 O.2 275 ALA275 -0.2778 4415 CB 116.5411 118.3502 90.2816 C.3 275 ALA275 -0.0411 4416 H 114.5750 117.1200 89.4300 H 275 ALA275 0.1312 4417 HA 116.2514 116.7402 91.6928 H 275 ALA275 0.0554 4418 HB1 117.3464 118.8446 90.8243 H 275 ALA275 0.0249 4419 HB2 115.9630 119.1172 89.7643 H 275 ALA275 0.0249 4420 HB3 116.9967 117.7123 89.5242 H 275 ALA275 0.0249 4421 N 113.9990 119.1670 92.0700 N.am 276 MET276 -0.2456 4422 CA 113.4350 120.1000 93.0350 C.3 276 MET276 0.0885 4423 C 112.3640 119.4500 93.9150 C.2 276 MET276 0.2188 4424 O 111.8240 120.0740 94.8270 O.2 276 MET276 -0.2778 4425 CB 112.7982 121.2703 92.2647 C.3 276 MET276 -0.0199 4426 CG 113.7836 122.0655 91.3978 C.3 276 MET276 -0.0047 4427 SD 114.9309 123.0505 92.3801 S.3 276 MET276 -0.1641 4428 CE 116.4145 122.0395 92.2110 C.3 276 MET276 -0.0181 4429 H 113.5470 119.0730 91.1600 H 276 MET276 0.1312 4430 HA 114.2319 120.4646 93.6860 H 276 MET276 0.0557 4431 HB1 112.3154 121.9587 92.9602 H 276 MET276 0.0293 4432 HB2 112.0062 120.8822 91.6220 H 276 MET276 0.0293 4433 HG1 113.2114 122.7543 90.7781 H 276 MET276 0.0377 4434 HG2 114.3328 121.4316 90.7024 H 276 MET276 0.0377 4435 HE1 117.2809 122.5724 92.6032 H 276 MET276 0.0340 4436 HE2 116.5985 121.8116 91.1611 H 276 MET276 0.0340 4437 HE3 116.2971 121.0961 92.7438 H 276 MET276 0.0340 4438 N 112.0530 118.1510 93.6980 N.am 277 SER277 -0.2436 4439 CA 111.1380 117.3810 94.5410 C.3 277 SER277 0.1109 4440 C 111.7670 116.9450 95.8460 C.2 277 SER277 0.2210 4441 O 111.0760 116.6900 96.8320 O.2 277 SER277 -0.2777 4442 CB 110.6207 116.1346 93.8032 C.3 277 SER277 0.0681 4443 OG 111.6524 115.1699 93.6281 O.3 277 SER277 -0.3930 4444 H 112.4810 117.6810 92.9000 H 277 SER277 0.1312 4445 HA 110.3002 118.0360 94.7807 H 277 SER277 0.0580 4446 HB1 110.2123 116.4288 92.8337 H 277 SER277 0.0577 4447 HB2 109.7988 115.6973 94.3812 H 277 SER277 0.0577 4448 HG 111.3310 114.3917 93.1805 H 277 SER277 0.2095 4449 N 113.1180 116.9350 95.9130 N.am 278 SER278 -0.2435 4450 CA 113.8790 116.4800 97.0670 C.3 278 SER278 0.1109 4451 C 113.7260 117.4230 98.2470 C.2 278 SER278 0.2210 4452 O 113.8550 117.0310 99.4050 O.2 278 SER278 -0.2777 4453 CB 115.3475 116.2906 96.6693 C.3 278 SER278 0.0681 4454 OG 115.8701 117.5058 96.1533 O.3 278 SER278 -0.3930 4455 H 113.6380 117.2680 95.1010 H 278 SER278 0.1312 4456 HA 113.4479 115.5324 97.3579 H 278 SER278 0.0580 4457 HB1 115.4026 115.5018 95.9102 H 278 SER278 0.0577 4458 HB2 115.9329 115.9668 97.5364 H 278 SER278 0.0577 4459 HG 116.7534 117.3917 95.8131 H 278 SER278 0.2095 4460 N 113.3290 118.6810 97.9560 N.am 279 THR279 -0.2433 4461 CA 113.0620 119.7470 98.9080 C.3 279 THR279 0.1135 4462 C 111.9690 119.4350 99.9200 C.2 279 THR279 0.2212 4463 O 111.9820 119.8670 101.0710 O.2 279 THR279 -0.2777 4464 CB 112.8002 121.0800 98.1871 C.3 279 THR279 0.0763 4465 OG1 113.5787 121.1225 97.0021 O.3 279 THR279 -0.3900 4466 CG2 113.1766 122.2319 99.1285 C.3 279 THR279 -0.0370 4467 H 113.2040 118.9060 96.9690 H 279 THR279 0.1313 4468 HA 113.9939 119.8351 99.4707 H 279 THR279 0.0583 4469 HB 111.7414 121.1345 97.9105 H 279 THR279 0.0611 4470 HG1 113.4968 121.9645 96.5673 H 279 THR279 0.2098 4471 HG21 112.9302 123.2111 98.7383 H 279 THR279 0.0255 4472 HG22 114.2475 122.2179 99.3260 H 279 THR279 0.0255 4473 HG23 112.6583 122.1319 100.0789 H 279 THR279 0.0255 4474 N 110.9510 118.6650 99.5070 N.am 280 MET280 -0.2456 4475 CA 109.8380 118.3130 100.3580 C.3 280 MET280 0.0886 4476 C 110.1570 117.2480 101.3980 C.2 280 MET280 0.2187 4477 O 109.4360 117.0840 102.3790 O.2 280 MET280 -0.2778 4478 CB 108.7041 117.7619 99.4766 C.3 280 MET280 -0.0199 4479 CG 108.2645 118.6968 98.3426 C.3 280 MET280 -0.0047 4480 SD 106.8457 118.0009 97.4724 S.3 280 MET280 -0.1641 4481 CE 107.6492 116.5985 96.6710 C.3 280 MET280 -0.0181 4482 H 110.9630 118.3130 98.5500 H 280 MET280 0.1312 4483 HA 109.5127 119.2193 100.8724 H 280 MET280 0.0557 4484 HB1 107.8366 117.5379 100.0994 H 280 MET280 0.0293 4485 HB2 109.0200 116.8129 99.0413 H 280 MET280 0.0293 4486 HG1 109.0773 118.8366 97.6287 H 280 MET280 0.0377 4487 HG2 108.0020 119.6862 98.7185 H 280 MET280 0.0377 4488 HE1 107.0386 116.2370 95.8436 H 280 MET280 0.0340 4489 HE2 107.8175 115.7893 97.3811 H 280 MET280 0.0340 4490 HE3 108.6117 116.9027 96.2619 H 280 MET280 0.0340 4491 N 111.2250 116.4580 101.1800 N.am 281 TYR281 -0.2453 4492 CA 111.4660 115.2280 101.9120 C.3 281 TYR281 0.0917 4493 C 111.7790 115.4290 103.3890 C.2 281 TYR281 0.2190 4494 O 111.2260 114.7550 104.2580 O.2 281 TYR281 -0.2778 4495 CB 112.5558 114.3891 101.2162 C.3 281 TYR281 -0.0036 4496 CG 112.2309 113.9353 99.8062 C.ar 281 TYR281 -0.0453 4497 CD1 110.9444 113.9962 99.2624 C.ar 281 TYR281 -0.0561 4498 CD2 113.2559 113.4208 99.0152 C.ar 281 TYR281 -0.0561 4499 CE1 110.7027 113.5895 97.9562 C.ar 281 TYR281 -0.0317 4500 CE2 113.0140 113.0144 97.7079 C.ar 281 TYR281 -0.0317 4501 CZ 111.7388 113.1069 97.1746 C.ar 281 TYR281 0.0726 4502 OH 111.5038 112.7412 95.8656 O.3 281 TYR281 -0.3598 4503 H 111.8970 116.7370 100.4660 H 281 TYR281 0.1312 4504 HA 110.5258 114.6760 101.9043 H 281 TYR281 0.0560 4505 HB1 112.7620 113.4943 101.8052 H 281 TYR281 0.0333 4506 HB2 113.4859 114.9594 101.1886 H 281 TYR281 0.0333 4507 HD1 110.1087 114.3797 99.8260 H 281 TYR281 0.0621 4508 HD2 114.2625 113.3717 99.4053 H 281 TYR281 0.0621 4509 HE1 109.7117 113.6690 97.5353 H 281 TYR281 0.0643 4510 HE2 113.8264 112.6784 97.0830 H 281 TYR281 0.0643 4511 HH 112.3282 112.6835 95.3991 H 281 TYR281 0.2173 4512 N 112.6470 116.3990 103.7210 N.am 282 ASN282 -0.2452 4513 CA 113.0970 116.6140 105.0900 C.3 282 ASN282 0.0959 4514 C 112.0340 117.0280 106.1100 C.2 282 ASN282 0.2218 4515 O 112.0300 116.4290 107.1890 O.2 282 ASN282 -0.2776 4516 CB 114.2742 117.6138 105.0976 C.3 282 ASN282 0.0446 4517 CG 115.5457 116.9784 104.5197 C.2 282 ASN282 0.2000 4518 OD1 115.9650 115.9044 104.9355 O.2 282 ASN282 -0.2797 4519 ND2 116.1285 117.6994 103.5487 N.am 282 ASN282 -0.2723 4520 H 113.0050 117.0090 102.9860 H 282 ASN282 0.1312 4521 HA 113.4588 115.6443 105.4338 H 282 ASN282 0.0562 4522 HB1 114.5131 117.9287 106.1120 H 282 ASN282 0.0375 4523 HB2 114.0465 118.5162 104.5322 H 282 ASN282 0.0375 4524 HD21 116.9449 117.3638 103.0807 H 282 ASN282 0.1266 4525 HD22 115.7860 118.5961 103.2558 H 282 ASN282 0.1266 4526 N 111.0930 117.9470 105.8930 N.am 283 PRO283 -0.2316 4527 CA 110.0370 118.2180 106.8630 C.3 283 PRO283 0.0907 4528 C 109.1480 117.0200 107.1490 C.2 283 PRO283 0.2189 4529 O 108.7270 116.8480 108.2930 O.2 283 PRO283 -0.2778 4530 CB 109.2385 119.3628 106.2117 C.3 283 PRO283 -0.0276 4531 CG 110.1865 119.9843 105.1900 C.3 283 PRO283 -0.0379 4532 CD 111.0655 118.8245 104.7276 C.3 283 PRO283 0.0071 4533 HA 110.5218 118.5486 107.7822 H 283 PRO283 0.0559 4534 HB1 108.8825 120.0929 106.9384 H 283 PRO283 0.0285 4535 HB2 108.3656 118.9821 105.6784 H 283 PRO283 0.0285 4536 HG1 110.8062 120.7369 105.6798 H 283 PRO283 0.0278 4537 HG2 109.6675 120.4727 104.3647 H 283 PRO283 0.0278 4538 HD1 110.6198 118.2714 103.9118 H 283 PRO283 0.0431 4539 HD2 112.0631 119.1607 104.4541 H 283 PRO283 0.0431 4540 N 108.8660 116.1850 106.1240 N.am 284 ILE284 -0.2454 4541 CA 108.1170 114.9380 106.2480 C.3 284 ILE284 0.0903 4542 C 108.8750 113.9260 107.1060 C.2 284 ILE284 0.2189 4543 O 108.3130 113.3250 108.0180 O.2 284 ILE284 -0.2778 4544 CB 107.8250 114.3768 104.8347 C.3 284 ILE284 -0.0201 4545 CG1 107.0819 115.4041 103.9517 C.3 284 ILE284 -0.0514 4546 CG2 107.0400 113.0530 104.9024 C.3 284 ILE284 -0.0605 4547 CD1 107.0267 115.0105 102.4696 C.3 284 ILE284 -0.0650 4548 H 109.2010 116.4450 105.1960 H 284 ILE284 0.1312 4549 HA 107.1830 115.1818 106.7560 H 284 ILE284 0.0560 4550 HB 108.7827 114.1706 104.3554 H 284 ILE284 0.0318 4551 HG11 107.5676 116.3776 104.0045 H 284 ILE284 0.0266 4552 HG12 106.0709 115.5555 104.3311 H 284 ILE284 0.0266 4553 HG21 106.8652 112.6393 103.9101 H 284 ILE284 0.0233 4554 HG22 106.0704 113.1965 105.3796 H 284 ILE284 0.0233 4555 HG23 107.5777 112.2910 105.4664 H 284 ILE284 0.0233 4556 HD11 106.5836 115.8103 101.8756 H 284 ILE284 0.0230 4557 HD12 106.4277 114.1147 102.3104 H 284 ILE284 0.0230 4558 HD13 108.0261 114.8239 102.0757 H 284 ILE284 0.0230 4559 N 110.2020 113.7700 106.8920 N.am 285 ILE285 -0.2454 4560 CA 111.0810 112.9550 107.7310 C.3 285 ILE285 0.0903 4561 C 111.0920 113.4070 109.1900 C.2 285 ILE285 0.2189 4562 O 110.9250 112.5990 110.1050 O.2 285 ILE285 -0.2778 4563 CB 112.4915 112.9415 107.0956 C.3 285 ILE285 -0.0201 4564 CG1 112.4781 112.1823 105.7516 C.3 285 ILE285 -0.0514 4565 CG2 113.5486 112.3450 108.0400 C.3 285 ILE285 -0.0605 4566 CD1 113.7119 112.4521 104.8814 C.3 285 ILE285 -0.0650 4567 H 110.6160 114.2520 106.0940 H 285 ILE285 0.1312 4568 HA 110.6645 111.9469 107.7149 H 285 ILE285 0.0560 4569 HB 112.7734 113.9754 106.8951 H 285 ILE285 0.0318 4570 HG11 111.5979 112.4552 105.1702 H 285 ILE285 0.0266 4571 HG12 112.3866 111.1114 105.9361 H 285 ILE285 0.0266 4572 HG21 114.5169 112.2338 107.5546 H 285 ILE285 0.0233 4573 HG22 113.2313 111.3645 108.3924 H 285 ILE285 0.0233 4574 HG23 113.7056 112.9826 108.9095 H 285 ILE285 0.0233 4575 HD11 113.6434 111.9137 103.9360 H 285 ILE285 0.0230 4576 HD12 114.6287 112.1338 105.3738 H 285 ILE285 0.0230 4577 HD13 113.8069 113.5124 104.6482 H 285 ILE285 0.0230 4578 N 111.2240 114.7250 109.4520 N.am 286 TYR286 -0.2453 4579 CA 111.1780 115.2770 110.8000 C.3 286 TYR286 0.0917 4580 C 109.8420 115.0690 111.5080 C.2 286 TYR286 0.2190 4581 O 109.8160 114.6850 112.6790 O.2 286 TYR286 -0.2778 4582 CB 111.6136 116.7557 110.7890 C.3 286 TYR286 -0.0036 4583 CG 113.0878 116.9146 110.4960 C.ar 286 TYR286 -0.0453 4584 CD1 114.0394 116.2794 111.2915 C.ar 286 TYR286 -0.0561 4585 CD2 113.5272 117.7070 109.4385 C.ar 286 TYR286 -0.0561 4586 CE1 115.3915 116.3644 110.9874 C.ar 286 TYR286 -0.0317 4587 CE2 114.8807 117.7978 109.1340 C.ar 286 TYR286 -0.0317 4588 CZ 115.8128 117.1043 109.8935 C.ar 286 TYR286 0.0726 4589 OH 117.1537 117.1429 109.5632 O.3 286 TYR286 -0.3598 4590 H 111.3620 115.3650 108.6700 H 286 TYR286 0.1312 4591 HA 111.8900 114.6879 111.3766 H 286 TYR286 0.0560 4592 HB1 111.4233 117.2152 111.7572 H 286 TYR286 0.0333 4593 HB2 111.0219 117.3132 110.0608 H 286 TYR286 0.0333 4594 HD1 113.7281 115.6959 112.1449 H 286 TYR286 0.0621 4595 HD2 112.8121 118.2371 108.8255 H 286 TYR286 0.0621 4596 HE1 116.1150 115.8483 111.5987 H 286 TYR286 0.0643 4597 HE2 115.2045 118.3954 108.2947 H 286 TYR286 0.0643 4598 HH 117.2792 117.8053 108.8906 H 286 TYR286 0.2173 4599 N 108.7100 115.2590 110.7930 N.am 287 CYS287 -0.2449 4600 CA 107.3620 114.9520 111.2620 C.3 287 CYS287 0.0965 4601 C 107.1600 113.4600 111.5730 C.2 287 CYS287 0.2195 4602 O 106.5990 113.0780 112.6010 O.2 287 CYS287 -0.2778 4603 CB 106.3587 115.3818 110.1834 C.3 287 CYS287 0.0147 4604 SG 104.6275 115.2518 110.7080 S.3 287 CYS287 -0.1762 4605 H 108.8050 115.6460 109.8540 H 287 CYS287 0.1312 4606 HA 107.2072 115.5273 112.1757 H 287 CYS287 0.0565 4607 HB1 106.4980 114.7889 109.2781 H 287 CYS287 0.0394 4608 HB2 106.5515 116.4117 109.8894 H 287 CYS287 0.0394 4609 HG 103.8381 115.6598 109.7101 H 287 CYS287 0.1017 4610 N 107.6370 112.5490 110.7000 N.am 288 CYS288 -0.2448 4611 CA 107.5470 111.1120 110.9220 C.3 288 CYS288 0.0965 4612 C 108.3670 110.5830 112.0970 C.2 288 CYS288 0.2195 4613 O 107.9080 109.7310 112.8680 O.2 288 CYS288 -0.2778 4614 CB 107.9552 110.4004 109.6249 C.3 288 CYS288 0.0147 4615 SG 106.7903 110.7208 108.2759 S.3 288 CYS288 -0.1762 4616 H 108.0810 112.8820 109.8440 H 288 CYS288 0.1312 4617 HA 106.4978 110.8937 111.1264 H 288 CYS288 0.0565 4618 HB1 108.0068 109.3212 109.7746 H 288 CYS288 0.0394 4619 HB2 108.9492 110.7265 109.3143 H 288 CYS288 0.0394 4620 HG 107.2756 110.2366 107.1297 H 288 CYS288 0.1017 4621 N 109.6100 111.0690 112.2690 N.am 289 LEU289 -0.2456 4622 CA 110.4720 110.6230 113.3450 C.3 289 LEU289 0.0880 4623 C 110.1540 111.1950 114.7150 C.2 289 LEU289 0.2187 4624 O 109.8940 110.4350 115.6480 O.2 289 LEU289 -0.2778 4625 CB 111.8969 111.1453 113.0270 C.3 289 LEU289 -0.0266 4626 CG 112.5579 110.6532 111.7298 C.3 289 LEU289 -0.0449 4627 CD1 113.7671 111.5420 111.4056 C.3 289 LEU289 -0.0626 4628 CD2 112.9808 109.1976 111.8180 C.3 289 LEU289 -0.0626 4629 H 109.9570 111.7750 111.6200 H 289 LEU289 0.1312 4630 HA 110.4400 109.5338 113.3813 H 289 LEU289 0.0557 4631 HB1 112.5764 110.9318 113.8543 H 289 LEU289 0.0287 4632 HB2 111.8515 112.2349 112.9588 H 289 LEU289 0.0287 4633 HG 111.8569 110.7104 110.9020 H 289 LEU289 0.0296 4634 HD11 114.2735 111.2137 110.5008 H 289 LEU289 0.0232 4635 HD12 114.4976 111.5259 112.2145 H 289 LEU289 0.0232 4636 HD13 113.4615 112.5779 111.2533 H 289 LEU289 0.0232 4637 HD21 113.5189 108.8968 110.9216 H 289 LEU289 0.0232 4638 HD22 112.1071 108.5563 111.9107 H 289 LEU289 0.0232 4639 HD23 113.6427 109.0428 112.6646 H 289 LEU289 0.0232 4640 N 110.1370 112.5330 114.8710 N.am 290 ASN290 -0.2452 4641 CA 110.1140 113.1510 116.1840 C.3 290 ASN290 0.0957 4642 C 108.7120 113.6390 116.5230 C.2 290 ASN290 0.2191 4643 O 108.0670 114.3550 115.7590 O.2 290 ASN290 -0.2778 4644 CB 111.0924 114.3396 116.1393 C.3 290 ASN290 0.0446 4645 CG 111.3063 115.0175 117.5045 C.2 290 ASN290 0.2000 4646 OD1 110.7800 114.6088 118.5309 O.2 290 ASN290 -0.2797 4647 ND2 112.1179 116.0830 117.4466 N.am 290 ASN290 -0.2723 4648 H 110.1400 113.1290 114.0430 H 290 ASN290 0.1312 4649 HA 110.4382 112.4248 116.9327 H 290 ASN290 0.0562 4650 HB1 110.7470 115.0877 115.4259 H 290 ASN290 0.0375 4651 HB2 112.0654 113.9997 115.7854 H 290 ASN290 0.0375 4652 HD21 112.3235 116.6020 118.2742 H 290 ASN290 0.1266 4653 HD22 112.5285 116.3799 116.5847 H 290 ASN290 0.1266 4654 N 108.1960 113.3090 117.7230 N.am 291 HIS291 -0.2453 4655 CA 106.8690 113.7340 118.1130 C.3 291 HIS291 0.0932 4656 C 106.7830 115.2210 118.4370 C.2 291 HIS291 0.2190 4657 O 105.7190 115.8200 118.3120 O.2 291 HIS291 -0.2778 4658 CB 106.4023 112.9042 119.3208 C.3 291 HIS291 0.0146 4659 CG 107.3527 113.0568 120.4896 C.ar 291 HIS291 0.0551 4660 ND1 108.5318 112.4059 120.5885 N.ar 291 HIS291 -0.2469 4661 CD2 107.1773 113.8308 121.6485 C.ar 291 HIS291 0.0047 4662 CE1 109.0413 112.7436 121.7849 C.ar 291 HIS291 0.0737 4663 NE2 108.2559 113.6201 122.4386 N.ar 291 HIS291 -0.2539 4664 H 108.7520 112.7490 118.3690 H 291 HIS291 0.1312 4665 HA 106.2042 113.5505 117.2690 H 291 HIS291 0.0561 4666 HB1 106.3565 111.8488 119.0556 H 291 HIS291 0.0348 4667 HB2 105.3980 113.1949 119.6321 H 291 HIS291 0.0348 4668 HD2 106.3219 114.4511 121.8757 H 291 HIS291 0.0764 4669 HE1 109.9585 112.3301 122.1806 H 291 HIS291 0.0963 4670 HE2 108.3905 113.9764 123.3412 H 291 HIS291 0.1339 4671 N 107.9150 115.8520 118.8230 N.am 292 ARG292 -0.2456 4672 CA 108.0340 117.2940 119.0070 C.3 292 ARG292 0.0879 4673 C 107.8940 118.1030 117.7220 C.2 292 ARG292 0.2187 4674 O 107.3510 119.2030 117.7170 O.2 292 ARG292 -0.2778 4675 CB 109.4106 117.5861 119.6350 C.3 292 ARG292 -0.0258 4676 CG 109.7132 116.7642 120.9017 C.3 292 ARG292 -0.0154 4677 CD 111.1418 116.9890 121.4115 C.3 292 ARG292 0.1045 4678 NE 111.4025 116.1049 122.5497 N.pl3 292 ARG292 -0.4450 4679 CZ 112.5894 115.9794 123.1406 C.cat 292 ARG292 0.5062 4680 NH1 112.7224 115.1590 124.1483 N.pl3 292 ARG292 -0.4573 4681 NH2 113.6281 116.6611 122.7339 N.pl3 292 ARG292 -0.4573 4682 H 108.7420 115.2810 118.9970 H 292 ARG292 0.1312 4683 HA 107.2372 117.5868 119.6891 H 292 ARG292 0.0557 4684 HB1 109.4851 118.6493 119.8697 H 292 ARG292 0.0286 4685 HB2 110.1880 117.3860 118.8975 H 292 ARG292 0.0286 4686 HG1 109.5948 115.6994 120.7019 H 292 ARG292 0.0299 4687 HG2 108.9929 117.0122 121.6820 H 292 ARG292 0.0299 4688 HD1 111.2855 118.0241 121.7322 H 292 ARG292 0.0711 4689 HD2 111.8630 116.7572 120.6230 H 292 ARG292 0.0711 4690 HE 110.6483 115.5559 122.9076 H 292 ARG292 0.3153 4691 HH11 113.6076 115.0519 124.5959 H 292 ARG292 0.3114 4692 HH12 111.9408 114.6338 124.4768 H 292 ARG292 0.3114 4693 HH21 114.5123 116.5530 123.1831 H 292 ARG292 0.3114 4694 HH22 113.5340 117.2922 121.9686 H 292 ARG292 0.3114 4695 N 108.3850 117.5860 116.5770 N.am 293 PHE293 -0.2453 4696 CA 108.1020 118.1820 115.2820 C.3 293 PHE293 0.0917 4697 C 106.6310 118.0560 114.9160 C.2 293 PHE293 0.2190 4698 O 106.0160 119.0140 114.4620 O.2 293 PHE293 -0.2778 4699 CB 109.0104 117.6115 114.1773 C.3 293 PHE293 -0.0036 4700 CG 110.2207 118.4847 113.9736 C.ar 293 PHE293 -0.0454 4701 CD1 110.1007 119.6847 113.2768 C.ar 293 PHE293 -0.0585 4702 CD2 111.4614 118.1278 114.4905 C.ar 293 PHE293 -0.0585 4703 CE1 111.1966 120.5211 113.1133 C.ar 293 PHE293 -0.0615 4704 CE2 112.5630 118.9570 114.3193 C.ar 293 PHE293 -0.0615 4705 CZ 112.4296 120.1572 113.6349 C.ar 293 PHE293 -0.0617 4706 H 108.9720 116.7530 116.6210 H 293 PHE293 0.1312 4707 HA 108.2854 119.2539 115.3879 H 293 PHE293 0.0560 4708 HB1 108.4878 117.5635 113.2201 H 293 PHE293 0.0333 4709 HB2 109.3050 116.5881 114.4073 H 293 PHE293 0.0333 4710 HD1 109.1425 119.9840 112.8752 H 293 PHE293 0.0620 4711 HD2 111.5725 117.1993 115.0251 H 293 PHE293 0.0620 4712 HE1 111.0858 121.4591 112.5884 H 293 PHE293 0.0618 4713 HE2 113.5236 118.6745 114.7238 H 293 PHE293 0.0618 4714 HZ 113.2813 120.8092 113.5097 H 293 PHE293 0.0618 4715 N 106.0070 116.8830 115.1730 N.am 294 ARG294 -0.2456 4716 CA 104.5740 116.6800 114.9920 C.3 294 ARG294 0.0879 4717 C 103.7110 117.6180 115.8080 C.2 294 ARG294 0.2187 4718 O 102.7080 118.1370 115.3190 O.2 294 ARG294 -0.2778 4719 CB 104.1703 115.2285 115.3091 C.3 294 ARG294 -0.0258 4720 CG 104.8378 114.2279 114.3664 C.3 294 ARG294 -0.0154 4721 CD 104.1600 112.8478 114.3220 C.3 294 ARG294 0.1045 4722 NE 104.4526 112.0294 115.5039 N.pl3 294 ARG294 -0.4450 4723 CZ 105.5639 111.3079 115.6425 C.cat 294 ARG294 0.5062 4724 NH1 106.5334 111.3798 114.7758 N.pl3 294 ARG294 -0.4573 4725 NH2 105.6881 110.5065 116.6653 N.pl3 294 ARG294 -0.4573 4726 H 106.5670 116.1010 115.5110 H 294 ARG294 0.1312 4727 HA 104.3722 116.8976 113.9417 H 294 ARG294 0.0557 4728 HB1 103.0883 115.1339 115.2040 H 294 ARG294 0.0286 4729 HB2 104.4019 114.9770 116.3437 H 294 ARG294 0.0286 4730 HG1 105.8909 114.1358 114.6247 H 294 ARG294 0.0299 4731 HG2 104.8048 114.6432 113.3593 H 294 ARG294 0.0299 4732 HD1 104.4484 112.2862 113.4294 H 294 ARG294 0.0711 4733 HD2 103.0750 112.9551 114.2641 H 294 ARG294 0.0711 4734 HE 103.7848 111.9823 116.2433 H 294 ARG294 0.3153 4735 HH11 107.3417 110.8006 114.8378 H 294 ARG294 0.3114 4736 HH12 106.4596 112.0334 114.0226 H 294 ARG294 0.3114 4737 HH21 106.5242 109.9759 116.7772 H 294 ARG294 0.3114 4738 HH22 104.9491 110.4178 117.3286 H 294 ARG294 0.3114 4739 N 104.0790 117.8470 117.0850 N.am 295 SER295 -0.2436 4740 CA 103.4190 118.8340 117.9200 C.3 295 SER295 0.1109 4741 C 103.5830 120.2300 117.3430 C.2 295 SER295 0.2207 4742 O 102.5970 120.9340 117.1740 O.2 295 SER295 -0.2777 4743 CB 103.8792 118.7700 119.3845 C.3 295 SER295 0.0681 4744 OG 105.2428 119.1419 119.5328 O.3 295 SER295 -0.3930 4745 H 104.8490 117.3070 117.4790 H 295 SER295 0.1312 4746 HA 102.3560 118.5950 117.8824 H 295 SER295 0.0580 4747 HB1 103.7457 117.7507 119.7576 H 295 SER295 0.0577 4748 HB2 103.2274 119.4249 119.9774 H 295 SER295 0.0577 4749 HG 105.4596 119.3189 120.4450 H 295 SER295 0.2095 4750 N 104.8020 120.6270 116.9150 N.am 296 GLY296 -0.2484 4751 CA 105.0370 121.9120 116.2590 C.3 296 GLY296 0.0765 4752 C 104.2980 122.1430 114.9600 C.2 296 GLY296 0.2155 4753 O 103.8140 123.2450 114.7170 O.2 296 GLY296 -0.2781 4754 H 105.5950 120.0010 117.0560 H 296 GLY296 0.1309 4755 HA1 106.1079 121.9682 116.0672 H 296 GLY296 0.0521 4756 HA2 104.7795 122.6986 116.9675 H 296 GLY296 0.0521 4757 N 104.1550 121.1050 114.1060 N.am 297 PHE297 -0.2456 4758 CA 103.3080 121.1310 112.9210 C.3 297 PHE297 0.0917 4759 C 101.8450 121.3400 113.2910 C.2 297 PHE297 0.2190 4760 O 101.1740 122.2100 112.7480 O.2 297 PHE297 -0.2778 4761 CB 103.4847 119.8481 112.0791 C.3 297 PHE297 -0.0036 4762 CG 104.7461 119.8567 111.2487 C.ar 297 PHE297 -0.0454 4763 CD1 104.8811 120.7510 110.1907 C.ar 297 PHE297 -0.0585 4764 CD2 105.7730 118.9466 111.4833 C.ar 297 PHE297 -0.0585 4765 CE1 106.0423 120.7828 109.4281 C.ar 297 PHE297 -0.0615 4766 CE2 106.9433 118.9857 110.7360 C.ar 297 PHE297 -0.0615 4767 CZ 107.0802 119.9065 109.7088 C.ar 297 PHE297 -0.0617 4768 H 104.6730 120.2490 114.3040 H 297 PHE297 0.1312 4769 HA 103.6109 122.0076 112.3455 H 297 PHE297 0.0560 4770 HB1 102.6516 119.7378 111.3831 H 297 PHE297 0.0333 4771 HB2 103.4644 118.9690 112.7242 H 297 PHE297 0.0333 4772 HD1 104.0777 121.4357 109.9614 H 297 PHE297 0.0620 4773 HD2 105.6665 118.1960 112.2494 H 297 PHE297 0.0620 4774 HE1 106.1400 121.4950 108.6214 H 297 PHE297 0.0618 4775 HE2 107.7411 118.2860 110.9386 H 297 PHE297 0.0618 4776 HZ 107.9845 119.9262 109.1195 H 297 PHE297 0.0618 4777 N 101.3250 120.5940 114.2880 N.am 298 ARG298 -0.2456 4778 CA 99.9740 120.7930 114.7920 C.3 298 ARG298 0.0879 4779 C 99.7340 122.1670 115.4000 C.2 298 ARG298 0.2187 4780 O 98.6680 122.7370 115.2130 O.2 298 ARG298 -0.2778 4781 CB 99.5586 119.6674 115.7549 C.3 298 ARG298 -0.0258 4782 CG 99.0399 118.4311 115.0023 C.3 298 ARG298 -0.0154 4783 CD 98.2372 117.4771 115.8975 C.3 298 ARG298 0.1045 4784 NE 97.4752 116.5483 115.0570 N.pl3 298 ARG298 -0.4450 4785 CZ 96.4792 115.7777 115.4923 C.cat 298 ARG298 0.5062 4786 NH1 95.8381 115.0174 114.6451 N.pl3 298 ARG298 -0.4573 4787 NH2 96.1256 115.7662 116.7510 N.pl3 298 ARG298 -0.4573 4788 H 101.9010 119.8620 114.7050 H 298 ARG298 0.1312 4789 HA 99.3297 120.7678 113.9110 H 298 ARG298 0.0557 4790 HB1 98.7546 120.0264 116.4000 H 298 ARG298 0.0286 4791 HB2 100.3847 119.4066 116.4179 H 298 ARG298 0.0286 4792 HG1 99.8672 117.9071 114.5220 H 298 ARG298 0.0299 4793 HG2 98.3827 118.7659 114.1985 H 298 ARG298 0.0299 4794 HD1 97.5289 118.0460 116.5059 H 298 ARG298 0.0711 4795 HD2 98.8923 116.9039 116.5581 H 298 ARG298 0.0711 4796 HE 97.7064 116.4939 114.0860 H 298 ARG298 0.3153 4797 HH11 95.0919 114.4332 114.9576 H 298 ARG298 0.3114 4798 HH12 96.0878 115.0183 113.6792 H 298 ARG298 0.3114 4799 HH21 95.3747 115.1869 117.0617 H 298 ARG298 0.3114 4800 HH22 96.6091 116.3425 117.4042 H 298 ARG298 0.3114 4801 N 100.7040 122.7170 116.1520 N.am 299 LEU299 -0.2456 4802 CA 100.6560 124.0690 116.6840 C.3 299 LEU299 0.0880 4803 C 100.7020 125.1770 115.6350 C.2 299 LEU299 0.2187 4804 O 100.0120 126.1780 115.7790 O.2 299 LEU299 -0.2778 4805 CB 101.8235 124.2451 117.6717 C.3 299 LEU299 -0.0266 4806 CG 101.6715 123.4222 118.9650 C.3 299 LEU299 -0.0449 4807 CD1 103.0139 123.3133 119.6997 C.3 299 LEU299 -0.0626 4808 CD2 100.5990 124.0157 119.8894 C.3 299 LEU299 -0.0626 4809 H 101.5250 122.1500 116.3620 H 299 LEU299 0.1312 4810 HA 99.7000 124.1666 117.1978 H 299 LEU299 0.0557 4811 HB1 101.9455 125.2956 117.9407 H 299 LEU299 0.0287 4812 HB2 102.7463 123.9605 117.1637 H 299 LEU299 0.0287 4813 HG 101.3631 122.4092 118.7084 H 299 LEU299 0.0296 4814 HD11 102.9171 122.7206 120.6096 H 299 LEU299 0.0232 4815 HD12 103.3932 124.2967 119.9786 H 299 LEU299 0.0232 4816 HD13 103.7654 122.8306 119.0748 H 299 LEU299 0.0232 4817 HD21 100.5082 123.4304 120.8049 H 299 LEU299 0.0232 4818 HD22 99.6191 124.0273 119.4134 H 299 LEU299 0.0232 4819 HD23 100.8470 125.0386 120.1734 H 299 LEU299 0.0232 4820 N 101.5120 125.0370 114.5620 N.am 300 ALA300 -0.2459 4821 CA 101.6250 126.0300 113.5040 C.3 300 ALA300 0.0850 4822 C 100.4530 126.0690 112.5210 C.2 300 ALA300 0.2184 4823 O 100.2770 127.0440 111.7960 O.2 300 ALA300 -0.2778 4824 CB 102.8994 125.7088 112.7090 C.3 300 ALA300 -0.0411 4825 H 102.0750 124.1890 114.4900 H 300 ALA300 0.1312 4826 HA 101.7110 127.0092 113.9770 H 300 ALA300 0.0554 4827 HB1 103.1035 126.4683 111.9533 H 300 ALA300 0.0249 4828 HB2 102.8180 124.7455 112.2026 H 300 ALA300 0.0249 4829 HB3 103.7681 125.6519 113.3615 H 300 ALA300 0.0249 4830 N 99.6400 124.9950 112.4680 N.am 301 PHE301 -0.2453 4831 CA 98.4600 124.9080 111.6210 C.3 301 PHE301 0.0917 4832 C 97.1590 125.2240 112.3590 C.2 301 PHE301 0.2190 4833 O 96.0770 125.0540 111.7960 O.2 301 PHE301 -0.2778 4834 CB 98.3564 123.4912 111.0118 C.3 301 PHE301 -0.0036 4835 CG 99.3855 123.1791 109.9508 C.ar 301 PHE301 -0.0454 4836 CD1 99.5694 124.0262 108.8603 C.ar 301 PHE301 -0.0585 4837 CD2 100.0872 121.9764 109.9843 C.ar 301 PHE301 -0.0585 4838 CE1 100.4508 123.6898 107.8410 C.ar 301 PHE301 -0.0615 4839 CE2 100.9823 121.6436 108.9760 C.ar 301 PHE301 -0.0615 4840 CZ 101.1600 122.4985 107.8985 C.ar 301 PHE301 -0.0617 4841 H 99.8660 124.1940 113.0580 H 301 PHE301 0.1312 4842 HA 98.5448 125.6584 110.8353 H 301 PHE301 0.0560 4843 HB1 97.3834 123.3486 110.5399 H 301 PHE301 0.0333 4844 HB2 98.4173 122.7514 111.8111 H 301 PHE301 0.0333 4845 HD1 99.0114 124.9481 108.7867 H 301 PHE301 0.0620 4846 HD2 99.9335 121.2868 110.8002 H 301 PHE301 0.0620 4847 HE1 100.5858 124.3591 107.0041 H 301 PHE301 0.0618 4848 HE2 101.5307 120.7146 109.0246 H 301 PHE301 0.0618 4849 HZ 101.8526 122.2432 107.1100 H 301 PHE301 0.0618 4850 N 97.2290 125.6760 113.6230 N.am 302 ARG302 -0.2440 4851 CA 96.0720 126.0940 114.3940 C.3 302 ARG302 0.1007 4852 C 96.1310 127.6060 114.7260 C.2 302 ARG302 0.1943 4853 O 97.1260 128.2770 114.3490 O.co2 302 ARG302 -0.6467 4854 CB 96.1241 125.1749 115.6483 C.3 302 ARG302 -0.0241 4855 CG 95.2560 125.5344 116.8780 C.3 302 ARG302 -0.0153 4856 CD 96.0589 126.1806 118.0280 C.3 302 ARG302 0.1045 4857 NE 96.7555 127.3317 117.4868 N.pl3 302 ARG302 -0.4450 4858 CZ 98.0273 127.6657 117.5152 C.cat 302 ARG302 0.5062 4859 NH1 98.4351 128.5650 116.6716 N.pl3 302 ARG302 -0.4573 4860 NH2 98.8662 127.1130 118.3449 N.pl3 302 ARG302 -0.4573 4861 OXT 95.2154 128.1367 115.3532 O.co2 302 ARG302 -0.6467 4862 H 98.1470 125.7280 114.0650 H 302 ARG302 0.1312 4863 HA 95.1579 125.9240 113.8244 H 302 ARG302 0.0576 4864 HB1 97.1608 125.0726 115.9739 H 302 ARG302 0.0287 4865 HB2 95.8456 124.1752 115.3140 H 302 ARG302 0.0287 4866 HG1 94.7999 124.6230 117.2636 H 302 ARG302 0.0299 4867 HG2 94.4182 126.1655 116.5834 H 302 ARG302 0.0299 4868 HD1 96.7812 125.4758 118.4420 H 302 ARG302 0.0711 4869 HD2 95.4008 126.5336 118.8238 H 302 ARG302 0.0711 4870 HE 96.2166 127.9636 116.9185 H 302 ARG302 0.3153 4871 HH11 99.3354 128.9758 116.6820 H 302 ARG302 0.3114 4872 HH12 97.7790 128.8169 115.9415 H 302 ARG302 0.3114 4873 HH21 99.8289 127.3504 118.2763 H 302 ARG302 0.3114 4874 HH22 98.5210 126.4655 119.0130 H 302 ARG302 0.3114 @BOND 1 1 2 1 2 1 5 1 3 1 6 1 4 1 7 1 5 2 3 1 6 2 8 1 7 2 9 1 8 3 4 2 9 3 10 am 10 10 11 1 11 10 18 1 12 11 14 1 13 11 12 1 14 11 19 1 15 12 13 2 16 12 29 am 17 14 16 1 18 14 15 1 19 14 20 1 20 15 17 1 21 15 21 1 22 15 22 1 23 16 23 1 24 16 24 1 25 16 25 1 26 17 26 1 27 17 27 1 28 17 28 1 29 29 30 1 30 29 36 1 31 30 33 1 32 30 31 1 33 30 37 1 34 31 32 2 35 31 43 am 36 33 35 1 37 33 34 1 38 33 38 1 39 34 39 1 40 35 40 1 41 35 41 1 42 35 42 1 43 43 44 1 44 43 48 1 45 44 47 1 46 44 45 1 47 44 49 1 48 45 46 2 49 45 53 am 50 47 50 1 51 47 51 1 52 47 52 1 53 53 54 1 54 53 64 1 55 54 57 1 56 54 55 1 57 54 65 1 58 55 56 2 59 55 73 am 60 57 58 1 61 57 66 1 62 57 67 1 63 58 59 ar 64 58 60 ar 65 59 61 ar 66 59 68 1 67 60 62 ar 68 60 69 1 69 61 63 ar 70 61 70 1 71 62 63 ar 72 62 71 1 73 63 72 1 74 73 74 1 75 73 79 1 76 74 77 1 77 74 75 1 78 74 80 1 79 75 76 2 80 75 84 am 81 77 78 1 82 77 81 1 83 77 82 1 84 78 83 1 85 84 85 1 86 84 92 1 87 85 88 1 88 85 86 1 89 85 93 1 90 86 87 2 91 86 101 am 92 88 89 1 93 88 94 1 94 88 95 1 95 89 90 1 96 89 96 1 97 89 97 1 98 90 91 1 99 91 98 1 100 91 99 1 101 91 100 1 102 101 107 1 103 101 102 1 104 102 105 1 105 102 103 1 106 102 108 1 107 103 104 2 108 103 115 am 109 105 106 1 110 105 109 1 111 105 110 1 112 106 107 1 113 106 111 1 114 106 112 1 115 107 113 1 116 107 114 1 117 115 116 1 118 115 121 1 119 116 119 1 120 116 117 1 121 116 122 1 122 117 118 2 123 117 126 am 124 119 120 1 125 119 123 1 126 119 124 1 127 120 125 1 128 126 127 1 129 126 140 1 130 127 130 1 131 127 128 1 132 127 141 1 133 128 129 2 134 128 150 am 135 130 131 1 136 130 142 1 137 130 143 1 138 131 132 ar 139 131 133 ar 140 132 134 ar 141 132 144 1 142 133 135 ar 143 133 136 ar 144 134 135 ar 145 134 145 1 146 135 137 ar 147 136 138 ar 148 136 146 1 149 137 139 ar 150 137 147 1 151 138 139 ar 152 138 148 1 153 139 149 1 154 150 151 1 155 150 159 1 156 151 154 1 157 151 152 1 158 151 160 1 159 152 153 2 160 152 167 am 161 154 155 1 162 154 161 1 163 154 162 1 164 155 156 1 165 155 163 1 166 155 164 1 167 156 157 2 168 156 158 am 169 158 165 1 170 158 166 1 171 167 168 1 172 167 175 1 173 168 171 1 174 168 169 1 175 168 176 1 176 169 170 2 177 169 186 am 178 171 172 1 179 171 177 1 180 171 178 1 181 172 173 1 182 172 174 1 183 172 179 1 184 173 180 1 185 173 181 1 186 173 182 1 187 174 183 1 188 174 184 1 189 174 185 1 190 186 187 1 191 186 191 1 192 187 190 1 193 187 188 1 194 187 192 1 195 188 189 2 196 188 196 am 197 190 193 1 198 190 194 1 199 190 195 1 200 196 197 1 201 196 204 1 202 197 200 1 203 197 198 1 204 197 205 1 205 198 199 2 206 198 215 am 207 200 201 1 208 200 206 1 209 200 207 1 210 201 202 1 211 201 203 1 212 201 208 1 213 202 209 1 214 202 210 1 215 202 211 1 216 203 212 1 217 203 213 1 218 203 214 1 219 215 216 1 220 215 229 1 221 216 219 1 222 216 217 1 223 216 230 1 224 217 218 2 225 217 239 am 226 219 220 1 227 219 231 1 228 219 232 1 229 220 221 ar 230 220 222 ar 231 221 223 ar 232 221 233 1 233 222 224 ar 234 222 225 ar 235 223 224 ar 236 223 234 1 237 224 226 ar 238 225 227 ar 239 225 235 1 240 226 228 ar 241 226 236 1 242 227 228 ar 243 227 237 1 244 228 238 1 245 239 240 1 246 239 244 1 247 240 243 1 248 240 241 1 249 240 245 1 250 241 242 2 251 241 249 am 252 243 246 1 253 243 247 1 254 243 248 1 255 249 250 1 256 249 256 1 257 250 253 1 258 250 251 1 259 250 257 1 260 251 252 2 261 251 263 am 262 253 255 1 263 253 254 1 264 253 258 1 265 254 259 1 266 255 260 1 267 255 261 1 268 255 262 1 269 263 264 1 270 263 268 1 271 264 267 1 272 264 265 1 273 264 269 1 274 265 266 2 275 265 273 am 276 267 270 1 277 267 271 1 278 267 272 1 279 273 274 1 280 273 285 1 281 274 277 1 282 274 275 1 283 274 286 1 284 275 276 2 285 275 294 am 286 277 278 1 287 277 287 1 288 277 288 1 289 278 279 ar 290 278 280 ar 291 279 281 ar 292 279 289 1 293 280 282 ar 294 280 290 1 295 281 283 ar 296 281 291 1 297 282 283 ar 298 282 292 1 299 283 284 1 300 284 293 1 301 294 295 1 302 294 302 1 303 295 298 1 304 295 296 1 305 295 303 1 306 296 297 2 307 296 313 am 308 298 299 1 309 298 304 1 310 298 305 1 311 299 300 1 312 299 301 1 313 299 306 1 314 300 307 1 315 300 308 1 316 300 309 1 317 301 310 1 318 301 311 1 319 301 312 1 320 313 314 1 321 313 318 1 322 314 317 1 323 314 315 1 324 314 319 1 325 315 316 2 326 315 323 am 327 317 320 1 328 317 321 1 329 317 322 1 330 323 324 1 331 323 331 1 332 324 327 1 333 324 325 1 334 324 332 1 335 325 326 2 336 325 342 am 337 327 328 1 338 327 333 1 339 327 334 1 340 328 329 1 341 328 330 1 342 328 335 1 343 329 336 1 344 329 337 1 345 329 338 1 346 330 339 1 347 330 340 1 348 330 341 1 349 342 343 1 350 342 349 1 351 343 346 1 352 343 344 1 353 343 350 1 354 344 345 2 355 344 358 am 356 346 347 1 357 346 348 1 358 346 351 1 359 347 352 1 360 347 353 1 361 347 354 1 362 348 355 1 363 348 356 1 364 348 357 1 365 358 359 1 366 358 366 1 367 359 362 1 368 359 360 1 369 359 367 1 370 360 361 2 371 360 377 am 372 362 363 1 373 362 368 1 374 362 369 1 375 363 364 1 376 363 365 1 377 363 370 1 378 364 371 1 379 364 372 1 380 364 373 1 381 365 374 1 382 365 375 1 383 365 376 1 384 377 378 1 385 377 384 1 386 378 381 1 387 378 379 1 388 378 385 1 389 379 380 2 390 379 393 am 391 381 382 1 392 381 383 1 393 381 386 1 394 382 387 1 395 382 388 1 396 382 389 1 397 383 390 1 398 383 391 1 399 383 392 1 400 393 394 1 401 393 398 1 402 394 397 1 403 394 395 1 404 394 399 1 405 395 396 2 406 395 403 am 407 397 400 1 408 397 401 1 409 397 402 1 410 403 404 1 411 403 410 1 412 404 407 1 413 404 405 1 414 404 411 1 415 405 406 2 416 405 419 am 417 407 408 1 418 407 409 1 419 407 412 1 420 408 413 1 421 408 414 1 422 408 415 1 423 409 416 1 424 409 417 1 425 409 418 1 426 419 420 1 427 419 426 1 428 420 423 1 429 420 421 1 430 420 427 1 431 421 422 2 432 421 433 am 433 423 425 1 434 423 424 1 435 423 428 1 436 424 429 1 437 425 430 1 438 425 431 1 439 425 432 1 440 433 434 1 441 433 437 1 442 434 435 1 443 434 438 1 444 434 439 1 445 435 436 2 446 435 440 am 447 440 441 1 448 440 448 1 449 441 444 1 450 441 442 1 451 441 449 1 452 442 443 2 453 442 454 am 454 444 445 1 455 444 450 1 456 444 451 1 457 445 446 2 458 445 447 am 459 447 452 1 460 447 453 1 461 454 455 1 462 454 459 1 463 455 458 1 464 455 456 1 465 455 460 1 466 456 457 2 467 456 464 am 468 458 461 1 469 458 462 1 470 458 463 1 471 464 465 1 472 464 472 1 473 465 468 1 474 465 466 1 475 465 473 1 476 466 467 2 477 466 483 am 478 468 470 1 479 468 469 1 480 468 474 1 481 469 471 1 482 469 475 1 483 469 476 1 484 470 477 1 485 470 478 1 486 470 479 1 487 471 480 1 488 471 481 1 489 471 482 1 490 483 484 1 491 483 490 1 492 484 487 1 493 484 485 1 494 484 491 1 495 485 486 2 496 485 499 am 497 487 488 1 498 487 489 1 499 487 492 1 500 488 493 1 501 488 494 1 502 488 495 1 503 489 496 1 504 489 497 1 505 489 498 1 506 499 500 1 507 499 507 1 508 500 503 1 509 500 501 1 510 500 508 1 511 501 502 2 512 501 518 am 513 503 505 1 514 503 504 1 515 503 509 1 516 504 506 1 517 504 510 1 518 504 511 1 519 505 512 1 520 505 513 1 521 505 514 1 522 506 515 1 523 506 516 1 524 506 517 1 525 518 519 1 526 518 532 1 527 519 522 1 528 519 520 1 529 519 533 1 530 520 521 2 531 520 542 am 532 522 523 1 533 522 534 1 534 522 535 1 535 523 524 ar 536 523 525 ar 537 524 526 ar 538 524 536 1 539 525 527 ar 540 525 528 ar 541 526 527 ar 542 526 537 1 543 527 529 ar 544 528 530 ar 545 528 538 1 546 529 531 ar 547 529 539 1 548 530 531 ar 549 530 540 1 550 531 541 1 551 542 543 1 552 542 550 1 553 543 546 1 554 543 544 1 555 543 551 1 556 544 545 2 557 544 561 am 558 546 548 1 559 546 547 1 560 546 552 1 561 547 549 1 562 547 553 1 563 547 554 1 564 548 555 1 565 548 556 1 566 548 557 1 567 549 558 1 568 549 559 1 569 549 560 1 570 561 562 1 571 561 569 1 572 562 565 1 573 562 563 1 574 562 570 1 575 563 564 2 576 563 580 am 577 565 567 1 578 565 566 1 579 565 571 1 580 566 568 1 581 566 572 1 582 566 573 1 583 567 574 1 584 567 575 1 585 567 576 1 586 568 577 1 587 568 578 1 588 568 579 1 589 580 581 1 590 580 588 1 591 581 584 1 592 581 582 1 593 581 589 1 594 582 583 2 595 582 599 am 596 584 585 1 597 584 590 1 598 584 591 1 599 585 586 1 600 585 587 1 601 585 592 1 602 586 593 1 603 586 594 1 604 586 595 1 605 587 596 1 606 587 597 1 607 587 598 1 608 599 600 1 609 599 604 1 610 600 603 1 611 600 601 1 612 600 605 1 613 601 602 2 614 601 609 am 615 603 606 1 616 603 607 1 617 603 608 1 618 609 610 1 619 609 619 1 620 610 613 1 621 610 611 1 622 610 620 1 623 611 612 2 624 611 626 am 625 613 614 1 626 613 621 1 627 613 622 1 628 614 615 ar 629 614 616 ar 630 615 617 ar 631 616 618 ar 632 616 623 1 633 617 618 ar 634 617 624 1 635 618 625 1 636 626 627 1 637 626 637 1 638 627 630 1 639 627 628 1 640 627 638 1 641 628 629 2 642 628 650 am 643 630 631 1 644 630 639 1 645 630 640 1 646 631 632 1 647 631 641 1 648 631 642 1 649 632 633 1 650 632 643 1 651 632 644 1 652 633 634 ar 653 633 645 1 654 634 635 ar 655 634 636 ar 656 635 646 1 657 635 647 1 658 636 648 1 659 636 649 1 660 650 651 1 661 650 661 1 662 651 654 1 663 651 652 1 664 651 662 1 665 652 653 2 666 652 674 am 667 654 655 1 668 654 663 1 669 654 664 1 670 655 656 1 671 655 665 1 672 655 666 1 673 656 657 1 674 656 667 1 675 656 668 1 676 657 658 ar 677 657 669 1 678 658 659 ar 679 658 660 ar 680 659 670 1 681 659 671 1 682 660 672 1 683 660 673 1 684 674 675 1 685 674 682 1 686 675 678 1 687 675 676 1 688 675 683 1 689 676 677 2 690 676 691 am 691 678 679 1 692 678 684 1 693 678 685 1 694 679 680 1 695 679 686 1 696 679 687 1 697 680 681 1 698 681 688 1 699 681 689 1 700 681 690 1 701 691 692 1 702 691 702 1 703 692 695 1 704 692 693 1 705 692 703 1 706 693 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3902 1 3964 3903 3904 1 3965 3903 3913 1 3966 3904 3907 1 3967 3904 3905 1 3968 3904 3914 1 3969 3905 3906 2 3970 3905 3920 am 3971 3907 3908 1 3972 3907 3915 1 3973 3907 3916 1 3974 3908 3909 ar 3975 3908 3910 ar 3976 3909 3911 ar 3977 3910 3912 ar 3978 3910 3917 1 3979 3911 3912 ar 3980 3911 3918 1 3981 3912 3919 1 3982 3920 3921 1 3983 3920 3928 1 3984 3921 3924 1 3985 3921 3922 1 3986 3921 3929 1 3987 3922 3923 2 3988 3922 3939 am 3989 3924 3925 1 3990 3924 3930 1 3991 3924 3931 1 3992 3925 3926 1 3993 3925 3927 1 3994 3925 3932 1 3995 3926 3933 1 3996 3926 3934 1 3997 3926 3935 1 3998 3927 3936 1 3999 3927 3937 1 4000 3927 3938 1 4001 3939 3940 1 4002 3939 3951 1 4003 3940 3943 1 4004 3940 3941 1 4005 3940 3952 1 4006 3941 3942 2 4007 3941 3960 am 4008 3943 3944 1 4009 3943 3953 1 4010 3943 3954 1 4011 3944 3945 ar 4012 3944 3946 ar 4013 3945 3947 ar 4014 3945 3955 1 4015 3946 3948 ar 4016 3946 3956 1 4017 3947 3949 ar 4018 3947 3957 1 4019 3948 3949 ar 4020 3948 3958 1 4021 3949 3950 1 4022 3950 3959 1 4023 3960 3961 1 4024 3960 3971 1 4025 3961 3964 1 4026 3961 3962 1 4027 3961 3972 1 4028 3962 3963 2 4029 3962 3980 am 4030 3964 3965 1 4031 3964 3973 1 4032 3964 3974 1 4033 3965 3966 ar 4034 3965 3967 ar 4035 3966 3968 ar 4036 3966 3975 1 4037 3967 3969 ar 4038 3967 3976 1 4039 3968 3970 ar 4040 3968 3977 1 4041 3969 3970 ar 4042 3969 3978 1 4043 3970 3979 1 4044 3980 3981 1 4045 3980 3988 1 4046 3981 3984 1 4047 3981 3982 1 4048 3981 3989 1 4049 3982 3983 2 4050 3982 3999 am 4051 3984 3986 1 4052 3984 3985 1 4053 3984 3990 1 4054 3985 3987 1 4055 3985 3991 1 4056 3985 3992 1 4057 3986 3993 1 4058 3986 3994 1 4059 3986 3995 1 4060 3987 3996 1 4061 3987 3997 1 4062 3987 3998 1 4063 3999 4000 1 4064 3999 4007 1 4065 4000 4003 1 4066 4000 4001 1 4067 4000 4008 1 4068 4001 4002 2 4069 4001 4018 am 4070 4003 4004 1 4071 4003 4009 1 4072 4003 4010 1 4073 4004 4005 1 4074 4004 4006 1 4075 4004 4011 1 4076 4005 4012 1 4077 4005 4013 1 4078 4005 4014 1 4079 4006 4015 1 4080 4006 4016 1 4081 4006 4017 1 4082 4018 4019 1 4083 4018 4022 1 4084 4019 4020 1 4085 4019 4023 1 4086 4019 4024 1 4087 4020 4021 2 4088 4020 4025 am 4089 4025 4026 1 4090 4025 4031 1 4091 4026 4029 1 4092 4026 4027 1 4093 4026 4032 1 4094 4027 4028 2 4095 4027 4036 am 4096 4029 4030 1 4097 4029 4033 1 4098 4029 4034 1 4099 4030 4035 1 4100 4036 4037 1 4101 4036 4047 1 4102 4037 4040 1 4103 4037 4038 1 4104 4037 4048 1 4105 4038 4039 2 4106 4038 4056 am 4107 4040 4041 1 4108 4040 4049 1 4109 4040 4050 1 4110 4041 4042 ar 4111 4041 4043 ar 4112 4042 4044 ar 4113 4042 4051 1 4114 4043 4045 ar 4115 4043 4052 1 4116 4044 4046 ar 4117 4044 4053 1 4118 4045 4046 ar 4119 4045 4054 1 4120 4046 4055 1 4121 4056 4057 1 4122 4056 4065 1 4123 4057 4060 1 4124 4057 4058 1 4125 4057 4066 1 4126 4058 4059 2 4127 4058 4073 am 4128 4060 4061 1 4129 4060 4067 1 4130 4060 4068 1 4131 4061 4062 1 4132 4061 4069 1 4133 4061 4070 1 4134 4062 4063 2 4135 4062 4064 am 4136 4064 4071 1 4137 4064 4072 1 4138 4073 4074 1 4139 4073 4082 1 4140 4074 4077 1 4141 4074 4075 1 4142 4074 4083 1 4143 4075 4076 2 4144 4075 4088 am 4145 4077 4078 1 4146 4077 4084 1 4147 4077 4085 1 4148 4078 4079 1 4149 4078 4086 1 4150 4078 4087 1 4151 4079 4080 ar 4152 4079 4081 ar 4153 4088 4089 1 4154 4088 4096 1 4155 4089 4092 1 4156 4089 4090 1 4157 4089 4097 1 4158 4090 4091 2 4159 4090 4100 am 4160 4092 4093 1 4161 4092 4098 1 4162 4092 4099 1 4163 4093 4094 ar 4164 4093 4095 ar 4165 4100 4101 1 4166 4100 4108 1 4167 4101 4104 1 4168 4101 4102 1 4169 4101 4109 1 4170 4102 4103 2 4171 4102 4119 am 4172 4104 4106 1 4173 4104 4105 1 4174 4104 4110 1 4175 4105 4107 1 4176 4105 4111 1 4177 4105 4112 1 4178 4106 4113 1 4179 4106 4114 1 4180 4106 4115 1 4181 4107 4116 1 4182 4107 4117 1 4183 4107 4118 1 4184 4119 4120 1 4185 4119 4131 1 4186 4120 4123 1 4187 4120 4121 1 4188 4120 4132 1 4189 4121 4122 2 4190 4121 4140 am 4191 4123 4124 1 4192 4123 4133 1 4193 4123 4134 1 4194 4124 4125 ar 4195 4124 4126 ar 4196 4125 4127 ar 4197 4125 4135 1 4198 4126 4128 ar 4199 4126 4136 1 4200 4127 4129 ar 4201 4127 4137 1 4202 4128 4129 ar 4203 4128 4138 1 4204 4129 4130 1 4205 4130 4139 1 4206 4140 4141 1 4207 4140 4146 1 4208 4141 4144 1 4209 4141 4142 1 4210 4141 4147 1 4211 4142 4143 2 4212 4142 4151 am 4213 4144 4145 1 4214 4144 4148 1 4215 4144 4149 1 4216 4145 4150 1 4217 4151 4152 1 4218 4151 4161 1 4219 4152 4155 1 4220 4152 4153 1 4221 4152 4162 1 4222 4153 4154 2 4223 4153 4168 am 4224 4155 4156 1 4225 4155 4163 1 4226 4155 4164 1 4227 4156 4157 ar 4228 4156 4158 ar 4229 4157 4159 ar 4230 4158 4160 ar 4231 4158 4165 1 4232 4159 4160 ar 4233 4159 4166 1 4234 4160 4167 1 4235 4168 4169 1 4236 4168 4177 1 4237 4169 4172 1 4238 4169 4170 1 4239 4169 4178 1 4240 4170 4171 2 4241 4170 4190 am 4242 4172 4173 1 4243 4172 4179 1 4244 4172 4180 1 4245 4173 4174 1 4246 4173 4181 1 4247 4173 4182 1 4248 4174 4175 1 4249 4174 4183 1 4250 4174 4184 1 4251 4175 4176 1 4252 4175 4185 1 4253 4175 4186 1 4254 4176 4187 1 4255 4176 4188 1 4256 4176 4189 1 4257 4190 4191 1 4258 4190 4201 1 4259 4191 4194 1 4260 4191 4192 1 4261 4191 4202 1 4262 4192 4193 2 4263 4192 4210 am 4264 4194 4195 1 4265 4194 4203 1 4266 4194 4204 1 4267 4195 4196 ar 4268 4195 4197 ar 4269 4196 4198 ar 4270 4196 4205 1 4271 4197 4199 ar 4272 4197 4206 1 4273 4198 4200 ar 4274 4198 4207 1 4275 4199 4200 ar 4276 4199 4208 1 4277 4200 4209 1 4278 4210 4211 1 4279 4210 4218 1 4280 4211 4214 1 4281 4211 4212 1 4282 4211 4219 1 4283 4212 4213 2 4284 4212 4229 am 4285 4214 4216 1 4286 4214 4215 1 4287 4214 4220 1 4288 4215 4217 1 4289 4215 4221 1 4290 4215 4222 1 4291 4216 4223 1 4292 4216 4224 1 4293 4216 4225 1 4294 4217 4226 1 4295 4217 4227 1 4296 4217 4228 1 4297 4229 4230 1 4298 4229 4238 1 4299 4230 4233 1 4300 4230 4231 1 4301 4230 4239 1 4302 4231 4232 2 4303 4231 4246 am 4304 4233 4234 1 4305 4233 4240 1 4306 4233 4241 1 4307 4234 4235 1 4308 4234 4242 1 4309 4234 4243 1 4310 4235 4236 2 4311 4235 4237 am 4312 4237 4244 1 4313 4237 4245 1 4314 4246 4247 1 4315 4246 4255 1 4316 4247 4250 1 4317 4247 4248 1 4318 4247 4256 1 4319 4248 4249 2 4320 4248 4263 am 4321 4250 4251 1 4322 4250 4257 1 4323 4250 4258 1 4324 4251 4252 1 4325 4251 4259 1 4326 4251 4260 1 4327 4252 4253 2 4328 4252 4254 am 4329 4254 4261 1 4330 4254 4262 1 4331 4263 4264 1 4332 4263 4270 1 4333 4264 4267 1 4334 4264 4265 1 4335 4264 4271 1 4336 4265 4266 2 4337 4265 4279 am 4338 4267 4268 1 4339 4267 4269 1 4340 4267 4272 1 4341 4268 4273 1 4342 4268 4274 1 4343 4268 4275 1 4344 4269 4276 1 4345 4269 4277 1 4346 4269 4278 1 4347 4279 4280 1 4348 4279 4291 1 4349 4280 4283 1 4350 4280 4281 1 4351 4280 4292 1 4352 4281 4282 2 4353 4281 4300 am 4354 4283 4284 1 4355 4283 4293 1 4356 4283 4294 1 4357 4284 4285 ar 4358 4284 4286 ar 4359 4285 4287 ar 4360 4285 4295 1 4361 4286 4288 ar 4362 4286 4296 1 4363 4287 4289 ar 4364 4287 4297 1 4365 4288 4289 ar 4366 4288 4298 1 4367 4289 4290 1 4368 4290 4299 1 4369 4300 4301 1 4370 4300 4308 1 4371 4301 4304 1 4372 4301 4302 1 4373 4301 4309 1 4374 4302 4303 2 4375 4302 4319 am 4376 4304 4305 1 4377 4304 4310 1 4378 4304 4311 1 4379 4305 4306 1 4380 4305 4307 1 4381 4305 4312 1 4382 4306 4313 1 4383 4306 4314 1 4384 4306 4315 1 4385 4307 4316 1 4386 4307 4317 1 4387 4307 4318 1 4388 4319 4320 1 4389 4319 4324 1 4390 4320 4323 1 4391 4320 4321 1 4392 4320 4325 1 4393 4321 4322 2 4394 4321 4329 am 4395 4323 4326 1 4396 4323 4327 1 4397 4323 4328 1 4398 4329 4330 1 4399 4329 4337 1 4400 4330 4333 1 4401 4330 4331 1 4402 4330 4338 1 4403 4331 4332 2 4404 4331 4348 am 4405 4333 4334 1 4406 4333 4339 1 4407 4333 4340 1 4408 4334 4335 1 4409 4334 4336 1 4410 4334 4341 1 4411 4335 4342 1 4412 4335 4343 1 4413 4335 4344 1 4414 4336 4345 1 4415 4336 4346 1 4416 4336 4347 1 4417 4348 4349 1 4418 4348 4359 1 4419 4349 4352 1 4420 4349 4350 1 4421 4349 4360 1 4422 4350 4351 2 4423 4350 4368 am 4424 4352 4353 1 4425 4352 4361 1 4426 4352 4362 1 4427 4353 4354 ar 4428 4353 4355 ar 4429 4354 4356 ar 4430 4354 4363 1 4431 4355 4357 ar 4432 4355 4364 1 4433 4356 4358 ar 4434 4356 4365 1 4435 4357 4358 ar 4436 4357 4366 1 4437 4358 4367 1 4438 4368 4369 1 4439 4368 4382 1 4440 4369 4372 1 4441 4369 4370 1 4442 4369 4383 1 4443 4370 4371 2 4444 4370 4392 am 4445 4372 4373 1 4446 4372 4384 1 4447 4372 4385 1 4448 4373 4374 ar 4449 4373 4375 ar 4450 4374 4376 ar 4451 4374 4386 1 4452 4375 4377 ar 4453 4375 4378 ar 4454 4376 4377 ar 4455 4376 4387 1 4456 4377 4379 ar 4457 4378 4380 ar 4458 4378 4388 1 4459 4379 4381 ar 4460 4379 4389 1 4461 4380 4381 ar 4462 4380 4390 1 4463 4381 4391 1 4464 4392 4393 1 4465 4392 4400 1 4466 4393 4396 1 4467 4393 4394 1 4468 4393 4401 1 4469 4394 4395 2 4470 4394 4411 am 4471 4396 4397 1 4472 4396 4402 1 4473 4396 4403 1 4474 4397 4398 1 4475 4397 4399 1 4476 4397 4404 1 4477 4398 4405 1 4478 4398 4406 1 4479 4398 4407 1 4480 4399 4408 1 4481 4399 4409 1 4482 4399 4410 1 4483 4411 4412 1 4484 4411 4416 1 4485 4412 4415 1 4486 4412 4413 1 4487 4412 4417 1 4488 4413 4414 2 4489 4413 4421 am 4490 4415 4418 1 4491 4415 4419 1 4492 4415 4420 1 4493 4421 4422 1 4494 4421 4429 1 4495 4422 4425 1 4496 4422 4423 1 4497 4422 4430 1 4498 4423 4424 2 4499 4423 4438 am 4500 4425 4426 1 4501 4425 4431 1 4502 4425 4432 1 4503 4426 4427 1 4504 4426 4433 1 4505 4426 4434 1 4506 4427 4428 1 4507 4428 4435 1 4508 4428 4436 1 4509 4428 4437 1 4510 4438 4439 1 4511 4438 4444 1 4512 4439 4442 1 4513 4439 4440 1 4514 4439 4445 1 4515 4440 4441 2 4516 4440 4449 am 4517 4442 4443 1 4518 4442 4446 1 4519 4442 4447 1 4520 4443 4448 1 4521 4449 4450 1 4522 4449 4455 1 4523 4450 4453 1 4524 4450 4451 1 4525 4450 4456 1 4526 4451 4452 2 4527 4451 4460 am 4528 4453 4454 1 4529 4453 4457 1 4530 4453 4458 1 4531 4454 4459 1 4532 4460 4461 1 4533 4460 4467 1 4534 4461 4464 1 4535 4461 4462 1 4536 4461 4468 1 4537 4462 4463 2 4538 4462 4474 am 4539 4464 4466 1 4540 4464 4465 1 4541 4464 4469 1 4542 4465 4470 1 4543 4466 4471 1 4544 4466 4472 1 4545 4466 4473 1 4546 4474 4475 1 4547 4474 4482 1 4548 4475 4478 1 4549 4475 4476 1 4550 4475 4483 1 4551 4476 4477 2 4552 4476 4491 am 4553 4478 4479 1 4554 4478 4484 1 4555 4478 4485 1 4556 4479 4480 1 4557 4479 4486 1 4558 4479 4487 1 4559 4480 4481 1 4560 4481 4488 1 4561 4481 4489 1 4562 4481 4490 1 4563 4491 4492 1 4564 4491 4503 1 4565 4492 4495 1 4566 4492 4493 1 4567 4492 4504 1 4568 4493 4494 2 4569 4493 4512 am 4570 4495 4496 1 4571 4495 4505 1 4572 4495 4506 1 4573 4496 4497 ar 4574 4496 4498 ar 4575 4497 4499 ar 4576 4497 4507 1 4577 4498 4500 ar 4578 4498 4508 1 4579 4499 4501 ar 4580 4499 4509 1 4581 4500 4501 ar 4582 4500 4510 1 4583 4501 4502 1 4584 4502 4511 1 4585 4512 4513 1 4586 4512 4520 1 4587 4513 4516 1 4588 4513 4514 1 4589 4513 4521 1 4590 4514 4515 2 4591 4514 4526 am 4592 4516 4517 1 4593 4516 4522 1 4594 4516 4523 1 4595 4517 4518 2 4596 4517 4519 am 4597 4519 4524 1 4598 4519 4525 1 4599 4526 4532 1 4600 4526 4527 1 4601 4527 4530 1 4602 4527 4528 1 4603 4527 4533 1 4604 4528 4529 2 4605 4528 4540 am 4606 4530 4531 1 4607 4530 4534 1 4608 4530 4535 1 4609 4531 4532 1 4610 4531 4536 1 4611 4531 4537 1 4612 4532 4538 1 4613 4532 4539 1 4614 4540 4541 1 4615 4540 4548 1 4616 4541 4544 1 4617 4541 4542 1 4618 4541 4549 1 4619 4542 4543 2 4620 4542 4559 am 4621 4544 4546 1 4622 4544 4545 1 4623 4544 4550 1 4624 4545 4547 1 4625 4545 4551 1 4626 4545 4552 1 4627 4546 4553 1 4628 4546 4554 1 4629 4546 4555 1 4630 4547 4556 1 4631 4547 4557 1 4632 4547 4558 1 4633 4559 4560 1 4634 4559 4567 1 4635 4560 4563 1 4636 4560 4561 1 4637 4560 4568 1 4638 4561 4562 2 4639 4561 4578 am 4640 4563 4565 1 4641 4563 4564 1 4642 4563 4569 1 4643 4564 4566 1 4644 4564 4570 1 4645 4564 4571 1 4646 4565 4572 1 4647 4565 4573 1 4648 4565 4574 1 4649 4566 4575 1 4650 4566 4576 1 4651 4566 4577 1 4652 4578 4579 1 4653 4578 4590 1 4654 4579 4582 1 4655 4579 4580 1 4656 4579 4591 1 4657 4580 4581 2 4658 4580 4599 am 4659 4582 4583 1 4660 4582 4592 1 4661 4582 4593 1 4662 4583 4584 ar 4663 4583 4585 ar 4664 4584 4586 ar 4665 4584 4594 1 4666 4585 4587 ar 4667 4585 4595 1 4668 4586 4588 ar 4669 4586 4596 1 4670 4587 4588 ar 4671 4587 4597 1 4672 4588 4589 1 4673 4589 4598 1 4674 4599 4600 1 4675 4599 4605 1 4676 4600 4603 1 4677 4600 4601 1 4678 4600 4606 1 4679 4601 4602 2 4680 4601 4610 am 4681 4603 4604 1 4682 4603 4607 1 4683 4603 4608 1 4684 4604 4609 1 4685 4610 4611 1 4686 4610 4616 1 4687 4611 4614 1 4688 4611 4612 1 4689 4611 4617 1 4690 4612 4613 2 4691 4612 4621 am 4692 4614 4615 1 4693 4614 4618 1 4694 4614 4619 1 4695 4615 4620 1 4696 4621 4622 1 4697 4621 4629 1 4698 4622 4625 1 4699 4622 4623 1 4700 4622 4630 1 4701 4623 4624 2 4702 4623 4640 am 4703 4625 4626 1 4704 4625 4631 1 4705 4625 4632 1 4706 4626 4627 1 4707 4626 4628 1 4708 4626 4633 1 4709 4627 4634 1 4710 4627 4635 1 4711 4627 4636 1 4712 4628 4637 1 4713 4628 4638 1 4714 4628 4639 1 4715 4640 4641 1 4716 4640 4648 1 4717 4641 4644 1 4718 4641 4642 1 4719 4641 4649 1 4720 4642 4643 2 4721 4642 4654 am 4722 4644 4645 1 4723 4644 4650 1 4724 4644 4651 1 4725 4645 4646 2 4726 4645 4647 am 4727 4647 4652 1 4728 4647 4653 1 4729 4654 4655 1 4730 4654 4664 1 4731 4655 4658 1 4732 4655 4656 1 4733 4655 4665 1 4734 4656 4657 2 4735 4656 4671 am 4736 4658 4659 1 4737 4658 4666 1 4738 4658 4667 1 4739 4659 4660 ar 4740 4659 4661 ar 4741 4660 4662 ar 4742 4661 4663 ar 4743 4661 4668 1 4744 4662 4663 ar 4745 4662 4669 1 4746 4663 4670 1 4747 4671 4672 1 4748 4671 4682 1 4749 4672 4675 1 4750 4672 4673 1 4751 4672 4683 1 4752 4673 4674 2 4753 4673 4695 am 4754 4675 4676 1 4755 4675 4684 1 4756 4675 4685 1 4757 4676 4677 1 4758 4676 4686 1 4759 4676 4687 1 4760 4677 4678 1 4761 4677 4688 1 4762 4677 4689 1 4763 4678 4679 ar 4764 4678 4690 1 4765 4679 4680 ar 4766 4679 4681 ar 4767 4680 4691 1 4768 4680 4692 1 4769 4681 4693 1 4770 4681 4694 1 4771 4695 4696 1 4772 4695 4706 1 4773 4696 4699 1 4774 4696 4697 1 4775 4696 4707 1 4776 4697 4698 2 4777 4697 4715 am 4778 4699 4700 1 4779 4699 4708 1 4780 4699 4709 1 4781 4700 4701 ar 4782 4700 4702 ar 4783 4701 4703 ar 4784 4701 4710 1 4785 4702 4704 ar 4786 4702 4711 1 4787 4703 4705 ar 4788 4703 4712 1 4789 4704 4705 ar 4790 4704 4713 1 4791 4705 4714 1 4792 4715 4716 1 4793 4715 4726 1 4794 4716 4719 1 4795 4716 4717 1 4796 4716 4727 1 4797 4717 4718 2 4798 4717 4739 am 4799 4719 4720 1 4800 4719 4728 1 4801 4719 4729 1 4802 4720 4721 1 4803 4720 4730 1 4804 4720 4731 1 4805 4721 4722 1 4806 4721 4732 1 4807 4721 4733 1 4808 4722 4723 ar 4809 4722 4734 1 4810 4723 4724 ar 4811 4723 4725 ar 4812 4724 4735 1 4813 4724 4736 1 4814 4725 4737 1 4815 4725 4738 1 4816 4739 4740 1 4817 4739 4745 1 4818 4740 4743 1 4819 4740 4741 1 4820 4740 4746 1 4821 4741 4742 2 4822 4741 4750 am 4823 4743 4744 1 4824 4743 4747 1 4825 4743 4748 1 4826 4744 4749 1 4827 4750 4751 1 4828 4750 4754 1 4829 4751 4752 1 4830 4751 4755 1 4831 4751 4756 1 4832 4752 4753 2 4833 4752 4757 am 4834 4757 4758 1 4835 4757 4768 1 4836 4758 4761 1 4837 4758 4759 1 4838 4758 4769 1 4839 4759 4760 2 4840 4759 4777 am 4841 4761 4762 1 4842 4761 4770 1 4843 4761 4771 1 4844 4762 4763 ar 4845 4762 4764 ar 4846 4763 4765 ar 4847 4763 4772 1 4848 4764 4766 ar 4849 4764 4773 1 4850 4765 4767 ar 4851 4765 4774 1 4852 4766 4767 ar 4853 4766 4775 1 4854 4767 4776 1 4855 4777 4778 1 4856 4777 4788 1 4857 4778 4781 1 4858 4778 4779 1 4859 4778 4789 1 4860 4779 4780 2 4861 4779 4801 am 4862 4781 4782 1 4863 4781 4790 1 4864 4781 4791 1 4865 4782 4783 1 4866 4782 4792 1 4867 4782 4793 1 4868 4783 4784 1 4869 4783 4794 1 4870 4783 4795 1 4871 4784 4785 ar 4872 4784 4796 1 4873 4785 4786 ar 4874 4785 4787 ar 4875 4786 4797 1 4876 4786 4798 1 4877 4787 4799 1 4878 4787 4800 1 4879 4801 4802 1 4880 4801 4809 1 4881 4802 4805 1 4882 4802 4803 1 4883 4802 4810 1 4884 4803 4804 2 4885 4803 4820 am 4886 4805 4806 1 4887 4805 4811 1 4888 4805 4812 1 4889 4806 4807 1 4890 4806 4808 1 4891 4806 4813 1 4892 4807 4814 1 4893 4807 4815 1 4894 4807 4816 1 4895 4808 4817 1 4896 4808 4818 1 4897 4808 4819 1 4898 4820 4821 1 4899 4820 4825 1 4900 4821 4824 1 4901 4821 4822 1 4902 4821 4826 1 4903 4822 4823 2 4904 4822 4830 am 4905 4824 4827 1 4906 4824 4828 1 4907 4824 4829 1 4908 4830 4831 1 4909 4830 4841 1 4910 4831 4834 1 4911 4831 4832 1 4912 4831 4842 1 4913 4832 4833 2 4914 4832 4850 am 4915 4834 4835 1 4916 4834 4843 1 4917 4834 4844 1 4918 4835 4836 ar 4919 4835 4837 ar 4920 4836 4838 ar 4921 4836 4845 1 4922 4837 4839 ar 4923 4837 4846 1 4924 4838 4840 ar 4925 4838 4847 1 4926 4839 4840 ar 4927 4839 4848 1 4928 4840 4849 1 4929 4850 4851 1 4930 4850 4862 1 4931 4851 4854 1 4932 4851 4852 1 4933 4851 4863 1 4934 4852 4853 ar 4935 4852 4861 ar 4936 4854 4855 1 4937 4854 4864 1 4938 4854 4865 1 4939 4855 4856 1 4940 4855 4866 1 4941 4855 4867 1 4942 4856 4857 1 4943 4856 4868 1 4944 4856 4869 1 4945 4857 4858 ar 4946 4857 4870 1 4947 4858 4859 ar 4948 4858 4860 ar 4949 4859 4871 1 4950 4859 4872 1 4951 4860 4873 1 4952 4860 4874 1 @SUBSTRUCTURE 1 GLY1 2 RESIDUE 1 B GLY 1 ROOT 2 ILE2 11 RESIDUE 1 B ILE 2 3 THR3 30 RESIDUE 1 B THR 2 4 ALA4 44 RESIDUE 1 B ALA 2 5 PHE5 54 RESIDUE 1 B PHE 2 6 SER6 74 RESIDUE 1 B SER 2 7 MET7 85 RESIDUE 1 B MET 2 8 PRO8 102 RESIDUE 1 B PRO 2 9 SER9 116 RESIDUE 1 B SER 2 10 TRP10 127 RESIDUE 1 B TRP 2 11 GLN11 151 RESIDUE 1 B GLN 2 12 LEU12 168 RESIDUE 1 B LEU 2 13 ALA13 187 RESIDUE 1 B ALA 2 14 LEU14 197 RESIDUE 1 B LEU 2 15 TRP15 216 RESIDUE 1 B TRP 2 16 ALA16 240 RESIDUE 1 B ALA 2 17 THR17 250 RESIDUE 1 B THR 2 18 ALA18 264 RESIDUE 1 B ALA 2 19 TYR19 274 RESIDUE 1 B TYR 2 20 LEU20 295 RESIDUE 1 B LEU 2 21 ALA21 314 RESIDUE 1 B ALA 2 22 LEU22 324 RESIDUE 1 B LEU 2 23 VAL23 343 RESIDUE 1 B VAL 2 24 LEU24 359 RESIDUE 1 B LEU 2 25 VAL25 378 RESIDUE 1 B VAL 2 26 ALA26 394 RESIDUE 1 B ALA 2 27 VAL27 404 RESIDUE 1 B VAL 2 28 THR28 420 RESIDUE 1 B THR 2 29 GLY29 434 RESIDUE 1 B GLY 2 30 ASN30 441 RESIDUE 1 B ASN 2 31 ALA31 455 RESIDUE 1 B ALA 2 32 ILE32 465 RESIDUE 1 B ILE 2 33 VAL33 484 RESIDUE 1 B VAL 2 34 ILE34 500 RESIDUE 1 B ILE 2 35 TRP35 519 RESIDUE 1 B TRP 2 36 ILE36 543 RESIDUE 1 B ILE 2 37 ILE37 562 RESIDUE 1 B ILE 2 38 LEU38 581 RESIDUE 1 B LEU 2 39 ALA39 600 RESIDUE 1 B ALA 2 40 HIS40 610 RESIDUE 1 B HIS 2 41 ARG41 627 RESIDUE 1 B ARG 2 42 ARG42 651 RESIDUE 1 B ARG 2 43 MET43 675 RESIDUE 1 B MET 2 44 ARG44 692 RESIDUE 1 B ARG 2 45 THR45 716 RESIDUE 1 B THR 2 46 VAL46 730 RESIDUE 1 B VAL 2 47 THR47 746 RESIDUE 1 B THR 2 48 ASN48 760 RESIDUE 1 B ASN 2 49 TYR49 774 RESIDUE 1 B TYR 2 50 PHE50 795 RESIDUE 1 B PHE 2 51 ILE51 815 RESIDUE 1 B ILE 2 52 VAL52 834 RESIDUE 1 B VAL 2 53 ASN53 850 RESIDUE 1 B ASN 2 54 LEU54 864 RESIDUE 1 B LEU 2 55 ALA55 883 RESIDUE 1 B ALA 2 56 LEU56 893 RESIDUE 1 B LEU 2 57 ALA57 912 RESIDUE 1 B ALA 2 58 ASP58 922 RESIDUE 1 B ASP 2 59 LEU59 934 RESIDUE 1 B LEU 2 60 CYS60 953 RESIDUE 1 B CYS 2 61 MET61 964 RESIDUE 1 B MET 2 62 ALA62 981 RESIDUE 1 B ALA 2 63 ALA63 991 RESIDUE 1 B ALA 2 64 PHE64 1001 RESIDUE 1 B PHE 2 65 ASN65 1021 RESIDUE 1 B ASN 2 66 ALA66 1035 RESIDUE 1 B ALA 2 67 ALA67 1045 RESIDUE 1 B ALA 2 68 PHE68 1055 RESIDUE 1 B PHE 2 69 ASN69 1075 RESIDUE 1 B ASN 2 70 PHE70 1089 RESIDUE 1 B PHE 2 71 VAL71 1109 RESIDUE 1 B VAL 2 72 TYR72 1125 RESIDUE 1 B TYR 2 73 ALA73 1146 RESIDUE 1 B ALA 2 74 SER74 1156 RESIDUE 1 B SER 2 75 HIS75 1167 RESIDUE 1 B HIS 2 76 ASN76 1184 RESIDUE 1 B ASN 2 77 ILE77 1198 RESIDUE 1 B ILE 2 78 TRP78 1217 RESIDUE 1 B TRP 2 79 TYR79 1241 RESIDUE 1 B TYR 2 80 PHE80 1262 RESIDUE 1 B PHE 2 81 GLY81 1282 RESIDUE 1 B GLY 2 82 ARG82 1289 RESIDUE 1 B ARG 2 83 ALA83 1313 RESIDUE 1 B ALA 2 84 PHE84 1323 RESIDUE 1 B PHE 2 85 CYS85 1343 RESIDUE 1 B CYS 2 86 TYR86 1354 RESIDUE 1 B TYR 2 87 PHE87 1375 RESIDUE 1 B PHE 2 88 GLN88 1395 RESIDUE 1 B GLN 2 89 ASN89 1412 RESIDUE 1 B ASN 2 90 LEU90 1426 RESIDUE 1 B LEU 2 91 PHE91 1445 RESIDUE 1 B PHE 2 92 PRO92 1465 RESIDUE 1 B PRO 2 93 ILE93 1479 RESIDUE 1 B ILE 2 94 THR94 1498 RESIDUE 1 B THR 2 95 ALA95 1512 RESIDUE 1 B ALA 2 96 MET96 1522 RESIDUE 1 B MET 2 97 PHE97 1539 RESIDUE 1 B PHE 2 98 VAL98 1559 RESIDUE 1 B VAL 2 99 SER99 1575 RESIDUE 1 B SER 2 100 ILE100 1586 RESIDUE 1 B ILE 2 101 TYR101 1605 RESIDUE 1 B TYR 2 102 SER102 1626 RESIDUE 1 B SER 2 103 MET103 1637 RESIDUE 1 B MET 2 104 THR104 1654 RESIDUE 1 B THR 2 105 ALA105 1668 RESIDUE 1 B ALA 2 106 ILE106 1678 RESIDUE 1 B ILE 2 107 ALA107 1697 RESIDUE 1 B ALA 2 108 ALA108 1707 RESIDUE 1 B ALA 2 109 ASP109 1717 RESIDUE 1 B ASP 2 110 ARG110 1729 RESIDUE 1 B ARG 2 111 TYR111 1753 RESIDUE 1 B TYR 2 112 MET112 1774 RESIDUE 1 B MET 2 113 ALA113 1791 RESIDUE 1 B ALA 2 114 ILE114 1801 RESIDUE 1 B ILE 2 115 VAL115 1820 RESIDUE 1 B VAL 2 116 HIS116 1836 RESIDUE 1 B HIS 2 117 PRO117 1853 RESIDUE 1 B PRO 2 118 PHE118 1867 RESIDUE 1 B PHE 2 119 GLN119 1887 RESIDUE 1 B GLN 2 120 PRO120 1904 RESIDUE 1 B PRO 2 121 ARG121 1918 RESIDUE 1 B ARG 2 122 LEU122 1942 RESIDUE 1 B LEU 2 123 SER123 1961 RESIDUE 1 B SER 2 124 ALA124 1972 RESIDUE 1 B ALA 2 125 PRO125 1982 RESIDUE 1 B PRO 2 126 SER126 1996 RESIDUE 1 B SER 2 127 THR127 2007 RESIDUE 1 B THR 2 128 LYS128 2021 RESIDUE 1 B LYS 2 129 ALA129 2043 RESIDUE 1 B ALA 2 130 VAL130 2053 RESIDUE 1 B VAL 2 131 ILE131 2069 RESIDUE 1 B ILE 2 132 ALA132 2088 RESIDUE 1 B ALA 2 133 GLY133 2098 RESIDUE 1 B GLY 2 134 ILE134 2105 RESIDUE 1 B ILE 2 135 TRP135 2124 RESIDUE 1 B TRP 2 136 LEU136 2148 RESIDUE 1 B LEU 2 137 VAL137 2167 RESIDUE 1 B VAL 2 138 ALA138 2183 RESIDUE 1 B ALA 2 139 LEU139 2193 RESIDUE 1 B LEU 2 140 ALA140 2212 RESIDUE 1 B ALA 2 141 LEU141 2222 RESIDUE 1 B LEU 2 142 ALA142 2241 RESIDUE 1 B ALA 2 143 SER143 2251 RESIDUE 1 B SER 2 144 PRO144 2262 RESIDUE 1 B PRO 2 145 GLN145 2276 RESIDUE 1 B GLN 2 146 CYS146 2293 RESIDUE 1 B CYS 2 147 PHE147 2304 RESIDUE 1 B PHE 2 148 TYR148 2324 RESIDUE 1 B TYR 2 149 SER149 2345 RESIDUE 1 B SER 2 150 THR150 2356 RESIDUE 1 B THR 2 151 VAL151 2370 RESIDUE 1 B VAL 2 152 THR152 2386 RESIDUE 1 B THR 2 153 MET153 2400 RESIDUE 1 B MET 2 154 ASP154 2417 RESIDUE 1 B ASP 2 155 GLN155 2429 RESIDUE 1 B GLN 2 156 GLY156 2446 RESIDUE 1 B GLY 2 157 ALA157 2453 RESIDUE 1 B ALA 2 158 THR158 2463 RESIDUE 1 B THR 2 159 LYS159 2477 RESIDUE 1 B LYS 2 160 CYS160 2499 RESIDUE 1 B CYS 2 161 VAL161 2510 RESIDUE 1 B VAL 2 162 VAL162 2526 RESIDUE 1 B VAL 2 163 ALA163 2542 RESIDUE 1 B ALA 2 164 TRP164 2552 RESIDUE 1 B TRP 2 165 PRO165 2576 RESIDUE 1 B PRO 2 166 GLU166 2590 RESIDUE 1 B GLU 2 167 ASP167 2605 RESIDUE 1 B ASP 2 168 SER168 2617 RESIDUE 1 B SER 2 169 GLY169 2628 RESIDUE 1 B GLY 2 170 GLY170 2635 RESIDUE 1 B GLY 2 171 LYS171 2642 RESIDUE 1 B LYS 2 172 THR172 2664 RESIDUE 1 B THR 2 173 LEU173 2678 RESIDUE 1 B LEU 2 174 LEU174 2697 RESIDUE 1 B LEU 2 175 LEU175 2716 RESIDUE 1 B LEU 2 176 TYR176 2735 RESIDUE 1 B TYR 2 177 HIS177 2756 RESIDUE 1 B HIS 2 178 LEU178 2773 RESIDUE 1 B LEU 2 179 VAL179 2792 RESIDUE 1 B VAL 2 180 VAL180 2808 RESIDUE 1 B VAL 2 181 ILE181 2824 RESIDUE 1 B ILE 2 182 ALA182 2843 RESIDUE 1 B ALA 2 183 LEU183 2853 RESIDUE 1 B LEU 2 184 ILE184 2872 RESIDUE 1 B ILE 2 185 TYR185 2891 RESIDUE 1 B TYR 2 186 PHE186 2912 RESIDUE 1 B PHE 2 187 LEU187 2932 RESIDUE 1 B LEU 2 188 PRO188 2951 RESIDUE 1 B PRO 2 189 LEU189 2965 RESIDUE 1 B LEU 2 190 ALA190 2984 RESIDUE 1 B ALA 2 191 VAL191 2994 RESIDUE 1 B VAL 2 192 MET192 3010 RESIDUE 1 B MET 2 193 PHE193 3027 RESIDUE 1 B PHE 2 194 VAL194 3047 RESIDUE 1 B VAL 2 195 ALA195 3063 RESIDUE 1 B ALA 2 196 TYR196 3073 RESIDUE 1 B TYR 2 197 SER197 3094 RESIDUE 1 B SER 2 198 VAL198 3105 RESIDUE 1 B VAL 2 199 ILE199 3121 RESIDUE 1 B ILE 2 200 GLY200 3140 RESIDUE 1 B GLY 2 201 LEU201 3147 RESIDUE 1 B LEU 2 202 THR202 3166 RESIDUE 1 B THR 2 203 LEU203 3180 RESIDUE 1 B LEU 2 204 TRP204 3199 RESIDUE 1 B TRP 2 205 ARG205 3223 RESIDUE 1 B ARG 2 206 ARG206 3247 RESIDUE 1 B ARG 2 207 ALA207 3271 RESIDUE 1 B ALA 2 208 VAL208 3281 RESIDUE 1 B VAL 2 209 PRO209 3297 RESIDUE 1 B PRO 2 210 GLY210 3311 RESIDUE 1 B GLY 2 211 HIS211 3318 RESIDUE 1 B HIS 2 212 GLN212 3335 RESIDUE 1 B GLN 2 213 ALA213 3352 RESIDUE 1 B ALA 2 214 HIS214 3362 RESIDUE 1 B HIS 2 215 GLY215 3379 RESIDUE 1 B GLY 2 216 ALA216 3386 RESIDUE 1 B ALA 2 217 ASN217 3396 RESIDUE 1 B ASN 2 218 LEU218 3410 RESIDUE 1 B LEU 2 219 ARG219 3429 RESIDUE 1 B ARG 2 220 HIS220 3453 RESIDUE 1 B HIS 2 221 LEU221 3470 RESIDUE 1 B LEU 2 222 GLN222 3489 RESIDUE 1 B GLN 2 223 ALA223 3506 RESIDUE 1 B ALA 2 224 MET224 3516 RESIDUE 1 B MET 2 225 LYS225 3533 RESIDUE 1 B LYS 2 226 LYS226 3555 RESIDUE 1 B LYS 2 227 PHE227 3577 RESIDUE 1 B PHE 2 228 VAL228 3597 RESIDUE 1 B VAL 2 229 LYS229 3613 RESIDUE 1 B LYS 2 230 THR230 3635 RESIDUE 1 B THR 2 231 MET231 3649 RESIDUE 1 B MET 2 232 VAL232 3666 RESIDUE 1 B VAL 2 233 LEU233 3682 RESIDUE 1 B LEU 2 234 VAL234 3701 RESIDUE 1 B VAL 2 235 VAL235 3717 RESIDUE 1 B VAL 2 236 LEU236 3733 RESIDUE 1 B LEU 2 237 THR237 3752 RESIDUE 1 B THR 2 238 PHE238 3766 RESIDUE 1 B PHE 2 239 ALA239 3786 RESIDUE 1 B ALA 2 240 ILE240 3796 RESIDUE 1 B ILE 2 241 CYS241 3815 RESIDUE 1 B CYS 2 242 TRP242 3826 RESIDUE 1 B TRP 2 243 LEU243 3850 RESIDUE 1 B LEU 2 244 PRO244 3869 RESIDUE 1 B PRO 2 245 TYR245 3883 RESIDUE 1 B TYR 2 246 HIS246 3904 RESIDUE 1 B HIS 2 247 LEU247 3921 RESIDUE 1 B LEU 2 248 TYR248 3940 RESIDUE 1 B TYR 2 249 PHE249 3961 RESIDUE 1 B PHE 2 250 ILE250 3981 RESIDUE 1 B ILE 2 251 LEU251 4000 RESIDUE 1 B LEU 2 252 GLY252 4019 RESIDUE 1 B GLY 2 253 SER253 4026 RESIDUE 1 B SER 2 254 PHE254 4037 RESIDUE 1 B PHE 2 255 GLN255 4057 RESIDUE 1 B GLN 2 256 GLU256 4074 RESIDUE 1 B GLU 2 257 ASP257 4089 RESIDUE 1 B ASP 2 258 ILE258 4101 RESIDUE 1 B ILE 2 259 TYR259 4120 RESIDUE 1 B TYR 2 260 CYS260 4141 RESIDUE 1 B CYS 2 261 HIS261 4152 RESIDUE 1 B HIS 2 262 LYS262 4169 RESIDUE 1 B LYS 2 263 PHE263 4191 RESIDUE 1 B PHE 2 264 ILE264 4211 RESIDUE 1 B ILE 2 265 GLN265 4230 RESIDUE 1 B GLN 2 266 GLN266 4247 RESIDUE 1 B GLN 2 267 VAL267 4264 RESIDUE 1 B VAL 2 268 TYR268 4280 RESIDUE 1 B TYR 2 269 LEU269 4301 RESIDUE 1 B LEU 2 270 ALA270 4320 RESIDUE 1 B ALA 2 271 LEU271 4330 RESIDUE 1 B LEU 2 272 PHE272 4349 RESIDUE 1 B PHE 2 273 TRP273 4369 RESIDUE 1 B TRP 2 274 LEU274 4393 RESIDUE 1 B LEU 2 275 ALA275 4412 RESIDUE 1 B ALA 2 276 MET276 4422 RESIDUE 1 B MET 2 277 SER277 4439 RESIDUE 1 B SER 2 278 SER278 4450 RESIDUE 1 B SER 2 279 THR279 4461 RESIDUE 1 B THR 2 280 MET280 4475 RESIDUE 1 B MET 2 281 TYR281 4492 RESIDUE 1 B TYR 2 282 ASN282 4513 RESIDUE 1 B ASN 2 283 PRO283 4527 RESIDUE 1 B PRO 2 284 ILE284 4541 RESIDUE 1 B ILE 2 285 ILE285 4560 RESIDUE 1 B ILE 2 286 TYR286 4579 RESIDUE 1 B TYR 2 287 CYS287 4600 RESIDUE 1 B CYS 2 288 CYS288 4611 RESIDUE 1 B CYS 2 289 LEU289 4622 RESIDUE 1 B LEU 2 290 ASN290 4641 RESIDUE 1 B ASN 2 291 HIS291 4655 RESIDUE 1 B HIS 2 292 ARG292 4672 RESIDUE 1 B ARG 2 293 PHE293 4696 RESIDUE 1 B PHE 2 294 ARG294 4716 RESIDUE 1 B ARG 2 295 SER295 4740 RESIDUE 1 B SER 2 296 GLY296 4751 RESIDUE 1 B GLY 2 297 PHE297 4758 RESIDUE 1 B PHE 2 298 ARG298 4778 RESIDUE 1 B ARG 2 299 LEU299 4802 RESIDUE 1 B LEU 2 300 ALA300 4821 RESIDUE 1 B ALA 2 301 PHE301 4831 RESIDUE 1 B PHE 2 302 ARG302 4851 RESIDUE 1 B ARG 1