#################################################################### # DELTA # # Database for Extended Ligand-Target Analyses # # 2025 # #################################################################### @MOLECULE 3hzf_min 4194 4240 263 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.4 @ATOM 1 N 0.8990 -25.6920 26.5400 N.4 1 SER1 -0.0619 2 H1 0.0636 -25.4447 27.0960 H 1 SER1 0.2751 3 H2 0.6411 -26.0661 25.5935 H 1 SER1 0.2751 4 H3 1.4727 -24.8635 26.2612 H 1 SER1 0.2751 5 CA 1.7870 -26.6950 27.2110 C.3 1 SER1 0.2155 6 HA 2.0603 -26.2805 28.1819 H 1 SER1 0.0714 7 C 3.0780 -26.9510 26.4250 C.2 1 SER1 0.2338 8 O 3.0720 -27.5420 25.3290 O.2 1 SER1 -0.2772 9 CB 1.0896 -28.0485 27.4328 C.3 1 SER1 0.0806 10 HB1 0.8895 -28.5386 26.4713 H 1 SER1 0.0582 11 HB2 0.1256 -27.8922 27.9279 H 1 SER1 0.0582 12 OG 1.9173 -28.8633 28.2542 O.3 1 SER1 -0.3925 13 HG 1.5415 -29.7352 28.3738 H 1 SER1 0.2095 14 N 4.1770 -26.4990 27.0280 N.am 2 HIS2 -0.2448 15 H 4.0780 -26.1140 27.9680 H 2 HIS2 0.1312 16 CA 5.5070 -26.5160 26.4410 C.3 2 HIS2 0.0932 17 HA 5.4455 -25.9000 25.5410 H 2 HIS2 0.0561 18 C 5.9600 -27.9080 26.0180 C.2 2 HIS2 0.2190 19 O 6.6100 -28.0650 24.9660 O.2 2 HIS2 -0.2778 20 CB 6.5110 -25.9097 27.4300 C.3 2 HIS2 0.0146 21 HB1 7.5032 -25.8417 26.9843 H 2 HIS2 0.0348 22 HB2 6.5990 -26.5266 28.3251 H 2 HIS2 0.0348 23 CG 6.0591 -24.5241 27.8308 C.ar 2 HIS2 0.0551 24 ND1 5.2931 -24.2653 28.9144 N.ar 2 HIS2 -0.2469 25 CD2 6.3139 -23.3127 27.1677 C.ar 2 HIS2 0.0047 26 HD2 6.8852 -23.1882 26.2588 H 2 HIS2 0.0764 27 CE1 5.1190 -22.9321 28.9292 C.ar 2 HIS2 0.0737 28 HE1 4.5662 -22.4027 29.6924 H 2 HIS2 0.0963 29 NE2 5.7160 -22.3331 27.8834 N.ar 2 HIS2 -0.2539 30 HE2 5.7264 -21.3742 27.6787 H 2 HIS2 0.1339 31 N 5.6170 -28.9140 26.8180 N.am 3 MET3 -0.2456 32 H 5.0290 -28.7430 27.6340 H 3 MET3 0.1312 33 CA 6.0840 -30.2570 26.5230 C.3 3 MET3 0.0885 34 HA 7.1585 -30.2049 26.3347 H 3 MET3 0.0557 35 C 5.4210 -30.7960 25.2990 C.2 3 MET3 0.2187 36 O 6.0480 -31.5040 24.5300 O.2 3 MET3 -0.2778 37 CB 5.8043 -31.1678 27.7281 C.3 3 MET3 -0.0199 38 HB1 6.0855 -32.1935 27.4849 H 3 MET3 0.0293 39 HB2 4.7343 -31.1849 27.9413 H 3 MET3 0.0293 40 CG 6.5649 -30.7301 28.9861 C.3 3 MET3 -0.0047 41 HG1 6.2991 -29.7141 29.2784 H 3 MET3 0.0377 42 HG2 7.6386 -30.7157 28.7960 H 3 MET3 0.0377 43 SD 6.2256 -31.8250 30.3769 S.3 3 MET3 -0.1641 44 CE 7.4412 -33.1090 30.0276 C.3 3 MET3 -0.0181 45 HE1 7.4049 -33.8865 30.7906 H 3 MET3 0.0340 46 HE2 8.4437 -32.6815 30.0036 H 3 MET3 0.0340 47 HE3 7.2486 -33.5566 29.0527 H 3 MET3 0.0340 48 N 4.1580 -30.4410 25.1190 N.am 4 GLU4 -0.2456 49 H 3.7180 -29.8380 25.8140 H 4 GLU4 0.1312 50 CA 3.3650 -30.8740 23.9700 C.3 4 GLU4 0.0883 51 HA 3.5441 -31.9406 23.8217 H 4 GLU4 0.0557 52 C 3.8200 -30.1450 22.6960 C.2 4 GLU4 0.2187 53 O 4.0540 -30.7910 21.6750 O.2 4 GLU4 -0.2778 54 CB 1.8782 -30.6121 24.2371 C.3 4 GLU4 -0.0193 55 HB1 1.3446 -30.6124 23.2860 H 4 GLU4 0.0290 56 HB2 1.7367 -29.6049 24.6269 H 4 GLU4 0.0290 57 CG 1.2546 -31.6424 25.2006 C.3 4 GLU4 0.0356 58 HG1 1.0241 -31.1897 26.1632 H 4 GLU4 0.0374 59 HG2 1.9309 -32.4751 25.3950 H 4 GLU4 0.0374 60 CD -0.0377 -32.2031 24.5981 C.2 4 GLU4 0.1760 61 OE1 -0.0339 -33.3196 24.0884 O.co2 4 GLU4 -0.6478 62 OE2 -1.0492 -31.5153 24.6147 O.co2 4 GLU4 -0.6478 63 N 3.9630 -28.8170 22.7590 N.am 5 GLU5 -0.2456 64 H 3.6470 -28.3190 23.5910 H 5 GLU5 0.1312 65 CA 4.5610 -28.0670 21.6630 C.3 5 GLU5 0.0883 66 HA 3.8553 -28.1284 20.8341 H 5 GLU5 0.0557 67 C 5.8410 -28.7680 21.1860 C.2 5 GLU5 0.2187 68 O 6.0760 -28.9140 19.9810 O.2 5 GLU5 -0.2778 69 CB 4.5709 -26.5964 22.2112 C.3 5 GLU5 -0.0193 70 HB1 5.2046 -26.0045 21.5508 H 5 GLU5 0.0290 71 HB2 5.0546 -26.5566 23.1880 H 5 GLU5 0.0290 72 CG 3.1518 -25.8899 22.2797 C.3 5 GLU5 0.0356 73 HG1 2.4473 -26.4432 21.6599 H 5 GLU5 0.0374 74 HG2 3.2459 -24.9219 21.7894 H 5 GLU5 0.0374 75 CD 2.4166 -25.5710 23.6497 C.2 5 GLU5 0.1760 76 OE1 1.3132 -26.0669 23.9081 O.co2 5 GLU5 -0.6478 77 OE2 2.9126 -24.8168 24.4866 O.co2 5 GLU5 -0.6478 78 N 6.6530 -29.1900 22.1590 N.am 6 MET6 -0.2456 79 H 6.3410 -29.0690 23.1230 H 6 MET6 0.1312 80 CA 7.9590 -29.8140 21.9400 C.3 6 MET6 0.0885 81 HA 8.4817 -29.1566 21.2439 H 6 MET6 0.0557 82 C 7.9190 -31.1760 21.2660 C.2 6 MET6 0.2187 83 O 8.7010 -31.4450 20.3730 O.2 6 MET6 -0.2778 84 CB 8.7508 -29.8446 23.2552 C.3 6 MET6 -0.0199 85 HB1 9.6165 -30.5023 23.1652 H 6 MET6 0.0293 86 HB2 8.1323 -30.2605 24.0492 H 6 MET6 0.0293 87 CG 9.2481 -28.4501 23.6553 C.3 6 MET6 -0.0047 88 HG1 8.4325 -27.7317 23.6348 H 6 MET6 0.0377 89 HG2 9.9641 -28.0650 22.9364 H 6 MET6 0.0377 90 SD 9.9944 -28.4607 25.2954 S.3 6 MET6 -0.1641 91 CE 10.0153 -26.6835 25.5926 C.3 6 MET6 -0.0181 92 HE1 10.1377 -26.4794 26.6563 H 6 MET6 0.0340 93 HE2 9.0722 -26.2378 25.2759 H 6 MET6 0.0340 94 HE3 10.8206 -26.2114 25.0303 H 6 MET6 0.0340 95 N 7.0210 -32.0330 21.7230 N.am 7 ILE7 -0.2454 96 H 6.4580 -31.7670 22.5310 H 7 ILE7 0.1312 97 CA 6.8040 -33.3350 21.1230 C.3 7 ILE7 0.0903 98 HA 7.7751 -33.8248 21.0326 H 7 ILE7 0.0560 99 C 6.2060 -33.2020 19.7210 C.2 7 ILE7 0.2189 100 O 6.7040 -33.7930 18.7770 O.2 7 ILE7 -0.2778 101 CB 5.8794 -34.1467 22.0633 C.3 7 ILE7 -0.0201 102 HB 4.9968 -33.5338 22.2565 H 7 ILE7 0.0318 103 CG1 6.5639 -34.4258 23.4182 C.3 7 ILE7 -0.0514 104 HG11 7.1424 -33.5626 23.7437 H 7 ILE7 0.0266 105 HG12 7.2884 -35.2329 23.3058 H 7 ILE7 0.0266 106 CG2 5.4023 -35.4678 21.4299 C.3 7 ILE7 -0.0605 107 HG21 4.7707 -36.0327 22.1144 H 7 ILE7 0.0233 108 HG22 6.2484 -36.1002 21.1599 H 7 ILE7 0.0233 109 HG23 4.8127 -35.2974 20.5292 H 7 ILE7 0.0233 110 CD1 5.5702 -34.7684 24.5353 C.3 7 ILE7 -0.0650 111 HD11 6.0890 -34.9112 25.4832 H 7 ILE7 0.0230 112 HD12 5.0200 -35.6836 24.3195 H 7 ILE7 0.0230 113 HD13 4.8453 -33.9656 24.6738 H 7 ILE7 0.0230 114 N 5.1360 -32.4220 19.6040 N.am 8 ARG8 -0.2456 115 H 4.8710 -31.8360 20.3960 H 8 ARG8 0.1312 116 CA 4.3250 -32.3680 18.3950 C.3 8 ARG8 0.0879 117 HA 4.1335 -33.4036 18.1082 H 8 ARG8 0.0557 118 C 5.0750 -31.7390 17.2270 C.2 8 ARG8 0.2187 119 O 4.7660 -32.0330 16.0820 O.2 8 ARG8 -0.2778 120 CB 2.9751 -31.6488 18.6130 C.3 8 ARG8 -0.0258 121 HB1 2.5559 -31.4144 17.6327 H 8 ARG8 0.0286 122 HB2 3.1425 -30.6801 19.0864 H 8 ARG8 0.0286 123 CG 1.8917 -32.4617 19.3642 C.3 8 ARG8 -0.0154 124 HG1 2.0905 -33.5322 19.3033 H 8 ARG8 0.0299 125 HG2 0.9428 -32.3136 18.8514 H 8 ARG8 0.0299 126 CD 1.7429 -32.0291 20.8286 C.3 8 ARG8 0.1045 127 HD1 1.8079 -30.9438 20.9278 H 8 ARG8 0.0711 128 HD2 2.5345 -32.4845 21.4256 H 8 ARG8 0.0711 129 NE 0.5006 -32.4165 21.4859 N.pl3 8 ARG8 -0.4450 130 HE 0.4966 -33.0556 22.2646 H 8 ARG8 0.3153 131 CZ -0.7195 -31.9593 21.2503 C.cat 8 ARG8 0.5062 132 NH1 -0.9768 -31.1951 20.2260 N.pl3 8 ARG8 -0.4573 133 HH11 -1.9002 -30.8508 20.0936 H 8 ARG8 0.3114 134 HH12 -0.2351 -30.9672 19.6050 H 8 ARG8 0.3114 135 NH2 -1.6754 -32.2719 22.0720 N.pl3 8 ARG8 -0.4573 136 HH21 -2.6379 -32.1130 21.9029 H 8 ARG8 0.3114 137 HH22 -1.3873 -32.6721 22.9598 H 8 ARG8 0.3114 138 N 6.0590 -30.8880 17.5260 N.am 9 SER9 -0.2436 139 H 6.3700 -30.8150 18.4950 H 9 SER9 0.1312 140 CA 6.7100 -30.0520 16.5060 C.3 9 SER9 0.1109 141 HA 5.9248 -29.6944 15.8382 H 9 SER9 0.0580 142 C 7.7370 -30.8230 15.6730 C.2 9 SER9 0.2209 143 O 8.1950 -31.9030 16.0730 O.2 9 SER9 -0.2777 144 CB 7.3730 -28.8553 17.2077 C.3 9 SER9 0.0681 145 HB1 6.6209 -28.2587 17.7312 H 9 SER9 0.0577 146 HB2 7.8073 -28.1847 16.4665 H 9 SER9 0.0577 147 OG 8.4031 -29.2211 18.1128 O.3 9 SER9 -0.3930 148 HG 8.0829 -29.9177 18.6841 H 9 SER9 0.2095 149 N 8.0950 -30.2670 14.5200 N.am 10 LEU10 -0.2456 150 H 7.5880 -29.4480 14.1850 H 10 LEU10 0.1312 151 CA 9.1940 -30.7980 13.7230 C.3 10 LEU10 0.0880 152 HA 9.2323 -31.8780 13.8809 H 10 LEU10 0.0557 153 C 10.5300 -30.2100 14.1640 C.2 10 LEU10 0.2187 154 O 11.4170 -30.9320 14.6180 O.2 10 LEU10 -0.2778 155 CB 8.9066 -30.5157 12.2365 C.3 10 LEU10 -0.0266 156 HB1 8.7464 -29.4463 12.0945 H 10 LEU10 0.0287 157 HB2 7.9621 -30.9918 11.9698 H 10 LEU10 0.0287 158 CG 10.0004 -30.9964 11.2615 C.3 10 LEU10 -0.0449 159 HG 10.9355 -30.4899 11.5024 H 10 LEU10 0.0296 160 CD1 10.2463 -32.5076 11.3704 C.3 10 LEU10 -0.0626 161 HD11 10.9870 -32.8362 10.6409 H 10 LEU10 0.0232 162 HD12 9.3302 -33.0707 11.1901 H 10 LEU10 0.0232 163 HD13 10.6224 -32.7834 12.3554 H 10 LEU10 0.0232 164 CD2 9.6395 -30.6151 9.8203 C.3 10 LEU10 -0.0626 165 HD21 10.4246 -30.9164 9.1261 H 10 LEU10 0.0232 166 HD22 9.5045 -29.5381 9.7191 H 10 LEU10 0.0232 167 HD23 8.7142 -31.0986 9.5054 H 10 LEU10 0.0232 168 N 10.6660 -28.8950 14.0260 N.am 11 GLN11 -0.2456 169 H 10.1970 -28.1400 13.5250 H 11 GLN11 0.1312 170 CA 11.8570 -29.0470 14.9720 C.3 11 GLN11 0.0882 171 HA 12.0909 -29.6842 15.8707 H 11 GLN11 0.0557 172 C 11.4730 -28.0760 16.2030 C.2 11 GLN11 0.2187 173 O 10.3370 -28.2100 16.6570 O.2 11 GLN11 -0.2778 174 CB 13.1291 -28.5628 14.2221 C.3 11 GLN11 -0.0210 175 HB1 13.1520 -27.4729 14.1905 H 11 GLN11 0.0289 176 HB2 13.0433 -28.8628 13.1754 H 11 GLN11 0.0289 177 CG 14.4762 -29.0926 14.7593 C.3 11 GLN11 0.0225 178 HG1 14.6302 -28.8341 15.8053 H 11 GLN11 0.0356 179 HG2 15.2973 -28.6455 14.1978 H 11 GLN11 0.0356 180 CD 14.5888 -30.6117 14.5897 C.2 11 GLN11 0.1981 181 OE1 14.0436 -31.1848 13.6618 O.2 11 GLN11 -0.2798 182 NE2 15.3173 -31.2240 15.5346 N.am 11 GLN11 -0.2724 183 HE21 15.3913 -32.2213 15.4835 H 11 GLN11 0.1266 184 HE22 15.7946 -30.7489 16.2712 H 11 GLN11 0.1266 185 N 12.5370 -27.8550 16.9680 N.am 12 GLN12 -0.2456 186 H1 13.5372 -28.2323 16.6339 H 12 GLN12 0.1312 187 CA 12.4360 -27.1340 18.2310 C.3 12 GLN12 0.0882 188 HA 11.4589 -27.3358 18.6788 H 12 GLN12 0.0557 189 C 12.6090 -25.6330 18.0250 C.2 12 GLN12 0.2187 190 O 13.3680 -25.1990 17.1590 O.2 12 GLN12 -0.2778 191 CB 13.5744 -27.6334 19.1590 C.3 12 GLN12 -0.0210 192 HB1 14.5426 -27.3963 18.7139 H 12 GLN12 0.0289 193 HB2 13.5398 -28.7236 19.2113 H 12 GLN12 0.0289 194 CG 13.5606 -27.0831 20.5987 C.3 12 GLN12 0.0225 195 HG1 13.6094 -25.9948 20.6194 H 12 GLN12 0.0356 196 HG2 14.4240 -27.4474 21.1574 H 12 GLN12 0.0356 197 CD 12.2820 -27.5214 21.3095 C.2 12 GLN12 0.1981 198 OE1 11.2047 -27.0262 21.0159 O.2 12 GLN12 -0.2798 199 NE2 12.4645 -28.4733 22.2357 N.am 12 GLN12 -0.2724 200 HE21 11.6745 -28.8259 22.7385 H 12 GLN12 0.1266 201 HE22 13.3634 -28.8505 22.4554 H 12 GLN12 0.1266 202 N 11.8990 -24.8450 18.8260 N.am 13 ARG13 -0.2456 203 H 11.3170 -25.2670 19.5490 H 13 ARG13 0.1312 204 CA 11.9310 -23.3980 18.6980 C.3 13 ARG13 0.0881 205 HA 12.7631 -23.0859 18.0718 H 13 ARG13 0.0557 206 C 12.1890 -22.7940 20.0530 C.2 13 ARG13 0.2213 207 O 11.2510 -22.2900 20.6660 O.2 13 ARG13 -0.2776 208 CB 10.6183 -22.8891 18.0671 C.3 13 ARG13 -0.0258 209 HB1 10.5784 -21.7994 18.1052 H 13 ARG13 0.0286 210 HB2 9.7858 -23.2326 18.6836 H 13 ARG13 0.0286 211 CG 10.3762 -23.3501 16.6120 C.3 13 ARG13 -0.0154 212 HG1 9.3108 -23.2379 16.4068 H 13 ARG13 0.0299 213 HG2 10.5782 -24.4148 16.5035 H 13 ARG13 0.0299 214 CD 11.1316 -22.5517 15.5315 C.3 13 ARG13 0.1045 215 HD1 10.8935 -21.4917 15.6079 H 13 ARG13 0.0711 216 HD2 10.8297 -22.8750 14.5330 H 13 ARG13 0.0711 217 NE 12.5779 -22.7609 15.6240 N.pl3 13 ARG13 -0.4450 218 HE 12.9884 -23.5653 16.0379 H 13 ARG13 0.3153 219 CZ 13.5144 -21.9172 15.1918 C.cat 13 ARG13 0.5062 220 NH1 13.2325 -20.7640 14.6664 N.pl3 13 ARG13 -0.4573 221 HH11 14.0189 -20.2373 14.3175 H 13 ARG13 0.3114 222 HH12 12.3128 -20.3954 14.6225 H 13 ARG13 0.3114 223 NH2 14.7649 -22.2489 15.3000 N.pl3 13 ARG13 -0.4573 224 HH21 15.4413 -21.5462 15.0089 H 13 ARG13 0.3114 225 HH22 15.1096 -23.1036 15.6546 H 13 ARG13 0.3114 226 N 13.4430 -22.8170 20.5150 N.am 14 PRO14 -0.2316 227 CA 13.7550 -22.4050 21.8870 C.3 14 PRO14 0.0907 228 HA 13.0755 -22.9255 22.5638 H 14 PRO14 0.0559 229 C 13.6000 -20.9140 22.0080 C.2 14 PRO14 0.2189 230 O 13.9870 -20.1550 21.0940 O.2 14 PRO14 -0.2778 231 CB 15.2192 -22.8207 22.1006 C.3 14 PRO14 -0.0276 232 HB1 15.3456 -23.3952 23.0181 H 14 PRO14 0.0285 233 HB2 15.8723 -21.9532 22.1887 H 14 PRO14 0.0285 234 CG 15.6186 -23.6268 20.8672 C.3 14 PRO14 -0.0379 235 HG1 15.5122 -24.6890 21.0849 H 14 PRO14 0.0278 236 HG2 16.6551 -23.4507 20.5766 H 14 PRO14 0.0278 237 CD 14.6325 -23.2265 19.7717 C.3 14 PRO14 0.0071 238 HD1 14.9747 -22.3490 19.2180 H 14 PRO14 0.0431 239 HD2 14.4377 -24.0516 19.0963 H 14 PRO14 0.0431 240 N 13.0210 -20.5170 23.1390 N.am 15 GLU15 -0.2456 241 H 12.6890 -21.2360 23.7810 H 15 GLU15 0.1312 242 CA 12.8310 -19.1320 23.5190 C.3 15 GLU15 0.0885 243 HA 12.7336 -18.5403 22.6091 H 15 GLU15 0.0557 244 C 14.0130 -18.6910 24.3670 C.2 15 GLU15 0.2214 245 O 14.8390 -19.5130 24.7460 O.2 15 GLU15 -0.2776 246 CB 11.5563 -19.0817 24.4063 C.3 15 GLU15 -0.0192 247 HB1 11.1818 -18.0609 24.4842 H 15 GLU15 0.0290 248 HB2 11.8360 -19.3539 25.4259 H 15 GLU15 0.0290 249 CG 10.3979 -20.0384 24.0360 C.3 15 GLU15 0.0356 250 HG1 9.8829 -20.3205 24.9544 H 15 GLU15 0.0374 251 HG2 10.7090 -20.9812 23.5922 H 15 GLU15 0.0374 252 CD 9.3414 -19.4009 23.1344 C.2 15 GLU15 0.1760 253 OE1 8.3947 -18.8197 23.6566 O.co2 15 GLU15 -0.6478 254 OE2 9.4277 -19.4844 21.9101 O.co2 15 GLU15 -0.6478 255 N 14.1450 -17.3880 24.6210 N.am 16 PRO16 -0.2316 256 CA 15.3900 -16.8860 25.2050 C.3 16 PRO16 0.0907 257 HA 16.1849 -17.2090 24.5343 H 16 PRO16 0.0559 258 C 15.6210 -17.4700 26.5890 C.2 16 PRO16 0.2190 259 O 14.6920 -17.7310 27.3660 O.2 16 PRO16 -0.2778 260 CB 15.2535 -15.3628 25.1739 C.3 16 PRO16 -0.0276 261 HB1 16.1819 -14.8850 24.8604 H 16 PRO16 0.0285 262 HB2 15.0086 -14.9712 26.1557 H 16 PRO16 0.0285 263 CG 14.1059 -15.0973 24.2011 C.3 16 PRO16 -0.0379 264 HG1 14.5213 -15.0324 23.1961 H 16 PRO16 0.0278 265 HG2 13.5833 -14.1630 24.4000 H 16 PRO16 0.0278 266 CD 13.2008 -16.3306 24.2911 C.3 16 PRO16 0.0071 267 HD1 12.4829 -16.2675 25.1091 H 16 PRO16 0.0431 268 HD2 12.7044 -16.5388 23.3479 H 16 PRO16 0.0431 269 N 16.8840 -17.6940 26.8770 N.am 17 THR17 -0.2434 270 H 17.5980 -17.5310 26.1670 H 17 THR17 0.1313 271 CA 17.2740 -18.1650 28.1770 C.3 17 THR17 0.1137 272 HA 16.5056 -18.8524 28.5287 H 17 THR17 0.0583 273 C 17.3290 -16.8930 29.0220 C.2 17 THR17 0.2239 274 O 17.3310 -15.7900 28.4620 O.2 17 THR17 -0.2775 275 CB 18.6481 -18.8748 28.0975 C.3 17 THR17 0.0763 276 HB 18.7120 -19.5390 28.9634 H 17 THR17 0.0611 277 OG1 19.7054 -17.9337 28.1977 O.3 17 THR17 -0.3900 278 HG1 20.5469 -18.3513 28.0360 H 17 THR17 0.2098 279 CG2 18.7824 -19.7329 26.8233 C.3 17 THR17 -0.0370 280 HG21 19.6531 -20.3873 26.8649 H 17 THR17 0.0255 281 HG22 18.8862 -19.1132 25.9312 H 17 THR17 0.0255 282 HG23 17.9072 -20.3673 26.6836 H 17 THR17 0.0255 283 N 17.2860 -17.0150 30.3500 N.am 18 PRO18 -0.2315 284 CA 17.4630 -15.8340 31.2140 C.3 18 PRO18 0.0907 285 HA 16.5621 -15.2284 31.1133 H 18 PRO18 0.0559 286 C 18.6700 -15.0110 30.8410 C.2 18 PRO18 0.2189 287 O 18.5090 -13.7810 30.7260 O.2 18 PRO18 -0.2778 288 CB 17.5772 -16.4490 32.6149 C.3 18 PRO18 -0.0276 289 HB1 17.1606 -15.8010 33.3863 H 18 PRO18 0.0285 290 HB2 18.6202 -16.6379 32.8751 H 18 PRO18 0.0285 291 CG 16.8499 -17.7897 32.5096 C.3 18 PRO18 -0.0379 292 HG1 15.7819 -17.6298 32.6603 H 18 PRO18 0.0278 293 HG2 17.1877 -18.5114 33.2533 H 18 PRO18 0.0278 294 CD 17.0924 -18.2636 31.0748 C.3 18 PRO18 0.0071 295 HD1 18.0139 -18.8395 30.9840 H 18 PRO18 0.0431 296 HD2 16.2426 -18.8119 30.6677 H 18 PRO18 0.0431 297 N 19.8110 -15.6600 30.5920 N.am 19 GLU19 -0.2456 298 H 19.8350 -16.6750 30.6930 H 19 GLU19 0.1312 299 CA 21.0350 -14.9540 30.1760 C.3 19 GLU19 0.0883 300 HA 21.2617 -14.2578 30.9854 H 19 GLU19 0.0557 301 C 20.8510 -14.1260 28.8930 C.2 19 GLU19 0.2187 302 O 21.4250 -13.0350 28.7550 O.2 19 GLU19 -0.2778 303 CB 22.1706 -15.9849 30.0541 C.3 19 GLU19 -0.0193 304 HB1 22.0463 -16.5871 29.1552 H 19 GLU19 0.0290 305 HB2 22.0851 -16.6760 30.8935 H 19 GLU19 0.0290 306 CG 23.5802 -15.3659 30.0720 C.3 19 GLU19 0.0356 307 HG1 23.6953 -14.7072 30.9313 H 19 GLU19 0.0374 308 HG2 23.7425 -14.7629 29.1788 H 19 GLU19 0.0374 309 CD 24.6833 -16.4394 30.1642 C.2 19 GLU19 0.1760 310 OE1 24.5421 -17.3728 30.9551 O.co2 19 GLU19 -0.6478 311 OE2 25.6763 -16.3309 29.4466 O.co2 19 GLU19 -0.6478 312 N 20.0760 -14.6740 27.9580 N.am 20 GLU20 -0.2456 313 H 19.7400 -15.6260 28.1050 H 20 GLU20 0.1312 314 CA 19.6860 -13.9900 26.7440 C.3 20 GLU20 0.0883 315 HA 20.5833 -13.5124 26.3483 H 20 GLU20 0.0557 316 C 18.6550 -12.8960 27.0030 C.2 20 GLU20 0.2187 317 O 18.7650 -11.8170 26.4340 O.2 20 GLU20 -0.2778 318 CB 19.1540 -14.9840 25.7151 C.3 20 GLU20 -0.0193 319 HB1 18.7856 -14.4427 24.8420 H 20 GLU20 0.0290 320 HB2 18.2985 -15.5199 26.1246 H 20 GLU20 0.0290 321 CG 20.2312 -15.9797 25.2622 C.3 20 GLU20 0.0356 322 HG1 20.5398 -16.6287 26.0778 H 20 GLU20 0.0374 323 HG2 21.1178 -15.4510 24.9129 H 20 GLU20 0.0374 324 CD 19.7125 -16.8578 24.1240 C.2 20 GLU20 0.1760 325 OE1 18.5211 -17.1486 24.1060 O.co2 20 GLU20 -0.6478 326 OE2 20.5034 -17.2347 23.2657 O.co2 20 GLU20 -0.6478 327 N 17.6680 -13.1220 27.8610 N.am 21 TRP21 -0.2453 328 H 17.5740 -14.0290 28.3190 H 21 TRP21 0.1312 329 CA 16.7210 -12.0510 28.1370 C.3 21 TRP21 0.0918 330 HA 16.2395 -11.7764 27.2012 H 21 TRP21 0.0560 331 C 17.4230 -10.8320 28.6860 C.2 21 TRP21 0.2190 332 O 16.9340 -9.7240 28.4830 O.2 21 TRP21 -0.2778 333 CB 15.6922 -12.5158 29.1864 C.3 21 TRP21 -0.0021 334 HB1 15.2376 -11.6656 29.6989 H 21 TRP21 0.0334 335 HB2 16.1714 -13.1182 29.9582 H 21 TRP21 0.0334 336 CG 14.5681 -13.2951 28.5424 C.ar 21 TRP21 -0.0260 337 CD1 14.2676 -14.6446 28.7439 C.ar 21 TRP21 -0.0136 338 HD1 14.8374 -15.3262 29.3585 H 21 TRP21 0.0748 339 CD2 13.5662 -12.7802 27.6430 C.ar 21 TRP21 -0.0028 340 NE1 13.1683 -14.9684 28.0172 N.ar 21 TRP21 -0.2641 341 HE1 12.7806 -15.8675 27.9623 H 21 TRP21 0.1331 342 CE2 12.7006 -13.8538 27.3323 C.ar 21 TRP21 0.0269 343 CE3 13.3529 -11.5435 27.0963 C.ar 21 TRP21 -0.0528 344 HE3 14.0238 -10.7299 27.3326 H 21 TRP21 0.0624 345 CZ2 11.6517 -13.6585 26.4760 C.ar 21 TRP21 -0.0430 346 HZ2 11.0071 -14.4879 26.2277 H 21 TRP21 0.0633 347 CZ3 12.2814 -11.3396 26.2283 C.ar 21 TRP21 -0.0611 348 HZ3 12.1198 -10.3622 25.7988 H 21 TRP21 0.0618 349 CH2 11.4303 -12.4003 25.9139 C.ar 21 TRP21 -0.0602 350 HH2 10.6058 -12.2525 25.2319 H 21 TRP21 0.0618 351 N 18.5080 -11.0300 29.4410 N.am 22 ASP22 -0.2451 352 H 18.7920 -11.9850 29.6590 H 22 ASP22 0.1312 353 CA 19.3040 -9.9130 29.9660 C.3 22 ASP22 0.0974 354 HA 18.6062 -9.1929 30.4004 H 22 ASP22 0.0563 355 C 19.9990 -9.2200 28.8090 C.2 22 ASP22 0.2192 356 O 20.0470 -7.9930 28.7500 O.2 22 ASP22 -0.2778 357 CB 20.3062 -10.4167 31.0223 C.3 22 ASP22 0.0576 358 HB1 21.2731 -9.9207 30.9339 H 22 ASP22 0.0394 359 HB2 20.4906 -11.4853 30.9150 H 22 ASP22 0.0394 360 CG 19.7742 -10.1432 32.4361 C.2 22 ASP22 0.1780 361 OD1 20.2777 -9.2273 33.0844 O.co2 22 ASP22 -0.6478 362 OD2 18.8626 -10.8416 32.8727 O.co2 22 ASP22 -0.6478 363 N 20.5340 -10.0210 27.8950 N.am 23 LEU23 -0.2456 364 H 20.4970 -11.0290 28.0440 H 23 LEU23 0.1312 365 CA 21.1660 -9.5180 26.6990 C.3 23 LEU23 0.0880 366 HA 21.9558 -8.8483 27.0396 H 23 LEU23 0.0557 367 C 20.1730 -8.7010 25.8340 C.2 23 LEU23 0.2187 368 O 20.4960 -7.6160 25.3600 O.2 23 LEU23 -0.2778 369 CB 21.7604 -10.7023 25.9118 C.3 23 LEU23 -0.0266 370 HB1 20.9532 -11.3294 25.5355 H 23 LEU23 0.0287 371 HB2 22.3263 -11.3362 26.5963 H 23 LEU23 0.0287 372 CG 22.6676 -10.3031 24.7324 C.3 23 LEU23 -0.0449 373 HG 22.1065 -9.6401 24.0743 H 23 LEU23 0.0296 374 CD1 23.9221 -9.5602 25.2130 C.3 23 LEU23 -0.0626 375 HD11 24.6211 -9.3926 24.3944 H 23 LEU23 0.0232 376 HD12 24.4449 -10.1348 25.9778 H 23 LEU23 0.0232 377 HD13 23.6743 -8.5866 25.6350 H 23 LEU23 0.0232 378 CD2 23.0585 -11.5389 23.9079 C.3 23 LEU23 -0.0626 379 HD21 23.6869 -11.2689 23.0586 H 23 LEU23 0.0232 380 HD22 22.1766 -12.0461 23.5158 H 23 LEU23 0.0232 381 HD23 23.6110 -12.2584 24.5132 H 23 LEU23 0.0232 382 N 18.9660 -9.2280 25.6620 N.am 24 ILE24 -0.2454 383 H 18.7860 -10.1390 26.0840 H 24 ILE24 0.1312 384 CA 17.8730 -8.6020 24.9140 C.3 24 ILE24 0.0903 385 HA 18.2492 -8.3874 23.9137 H 24 ILE24 0.0560 386 C 17.4090 -7.2630 25.5320 C.2 24 ILE24 0.2189 387 O 17.2980 -6.2650 24.8140 O.2 24 ILE24 -0.2778 388 CB 16.7362 -9.6539 24.8500 C.3 24 ILE24 -0.0201 389 HB 16.6111 -10.0578 25.8542 H 24 ILE24 0.0318 390 CG1 17.1285 -10.8222 23.9166 C.3 24 ILE24 -0.0514 391 HG11 18.1631 -11.1145 24.0943 H 24 ILE24 0.0266 392 HG12 17.0962 -10.4912 22.8808 H 24 ILE24 0.0266 393 CG2 15.3845 -9.0458 24.4463 C.3 24 ILE24 -0.0605 394 HG21 14.6253 -9.8054 24.2658 H 24 ILE24 0.0233 395 HG22 15.5032 -8.4563 23.5441 H 24 ILE24 0.0233 396 HG23 14.9941 -8.3855 25.2206 H 24 ILE24 0.0233 397 CD1 16.2623 -12.0786 24.0781 C.3 24 ILE24 -0.0650 398 HD11 16.5996 -12.8678 23.4051 H 24 ILE24 0.0230 399 HD12 15.2152 -11.8857 23.8542 H 24 ILE24 0.0230 400 HD13 16.3212 -12.4716 25.0919 H 24 ILE24 0.0230 401 N 17.1590 -7.2320 26.8420 N.am 25 HIS25 -0.2453 402 H 17.2160 -8.0990 27.3770 H 25 HIS25 0.1312 403 CA 16.8050 -5.9890 27.5380 C.3 25 HIS25 0.0932 404 HA 15.9486 -5.5708 27.0072 H 25 HIS25 0.0561 405 C 17.8990 -4.9150 27.4610 C.2 25 HIS25 0.2190 406 O 17.5990 -3.7510 27.1350 O.2 25 HIS25 -0.2778 407 CB 16.4104 -6.2973 28.9907 C.3 25 HIS25 0.0146 408 HB1 16.1653 -5.3807 29.5276 H 25 HIS25 0.0348 409 HB2 17.2405 -6.7704 29.5184 H 25 HIS25 0.0348 410 CG 15.2054 -7.2184 29.0442 C.ar 25 HIS25 0.0551 411 ND1 14.9513 -8.0440 30.0803 N.ar 25 HIS25 -0.2469 412 CD2 14.1777 -7.3896 28.0971 C.ar 25 HIS25 0.0047 413 HD2 14.0836 -6.8706 27.1550 H 25 HIS25 0.0764 414 CE1 13.8462 -8.7315 29.7559 C.ar 25 HIS25 0.0737 415 HE1 13.4234 -9.5016 30.3851 H 25 HIS25 0.0963 416 NE2 13.3461 -8.3491 28.5667 N.ar 25 HIS25 -0.2539 417 HE2 12.5493 -8.7071 28.1248 H 25 HIS25 0.1339 418 N 19.1530 -5.2620 27.7370 N.am 26 ILE26 -0.2454 419 H 19.3730 -6.1920 28.0920 H 26 ILE26 0.1312 420 CA 20.2060 -4.2770 27.5180 C.3 26 ILE26 0.0903 421 HA 19.9987 -3.4341 28.1794 H 26 ILE26 0.0560 422 C 20.2470 -3.7440 26.0630 C.2 26 ILE26 0.2189 423 O 20.4050 -2.5300 25.8560 O.2 26 ILE26 -0.2778 424 CB 21.5589 -4.9287 27.9008 C.3 26 ILE26 -0.0201 425 HB 21.6462 -5.8506 27.3226 H 26 ILE26 0.0318 426 CG1 21.5981 -5.3122 29.3960 C.3 26 ILE26 -0.0514 427 HG11 20.6529 -5.7573 29.7053 H 26 ILE26 0.0266 428 HG12 21.7094 -4.4154 30.0059 H 26 ILE26 0.0266 429 CG2 22.7684 -4.0384 27.5500 C.3 26 ILE26 -0.0605 430 HG21 23.7029 -4.5043 27.8565 H 26 ILE26 0.0233 431 HG22 22.7016 -3.0708 28.0477 H 26 ILE26 0.0233 432 HG23 22.8482 -3.8570 26.4780 H 26 ILE26 0.0233 433 CD1 22.7077 -6.3158 29.7364 C.3 26 ILE26 -0.0650 434 HD11 22.6445 -6.6165 30.7827 H 26 ILE26 0.0230 435 HD12 23.7001 -5.8975 29.5740 H 26 ILE26 0.0230 436 HD13 22.6170 -7.2188 29.1318 H 26 ILE26 0.0230 437 N 20.0850 -4.6300 25.0740 N.am 27 ALA27 -0.2459 438 H 19.9340 -5.6110 25.3080 H 27 ALA27 0.1312 439 CA 20.1180 -4.2300 23.6650 C.3 27 ALA27 0.0850 440 HA 21.0309 -3.6530 23.5152 H 27 ALA27 0.0554 441 C 18.9220 -3.3400 23.3160 C.2 27 ALA27 0.2185 442 O 19.0660 -2.2540 22.6990 O.2 27 ALA27 -0.2778 443 CB 20.1304 -5.4892 22.7891 C.3 27 ALA27 -0.0411 444 HB1 20.1818 -5.2373 21.7291 H 27 ALA27 0.0249 445 HB2 19.2374 -6.0954 22.9481 H 27 ALA27 0.0249 446 HB3 20.9935 -6.1106 23.0254 H 27 ALA27 0.0249 447 N 17.7480 -3.7750 23.7780 N.am 28 THR28 -0.2434 448 H 17.7340 -4.6300 24.3330 H 28 THR28 0.1313 449 CA 16.4890 -3.0920 23.5300 C.3 28 THR28 0.1135 450 HA 16.4205 -2.9984 22.4460 H 28 THR28 0.0583 451 C 16.5200 -1.6790 24.0860 C.2 28 THR28 0.2212 452 O 16.2150 -0.7450 23.3480 O.2 28 THR28 -0.2777 453 CB 15.2962 -3.9384 23.9949 C.3 28 THR28 0.0763 454 HB 15.3546 -4.0626 25.0827 H 28 THR28 0.0611 455 OG1 15.4094 -5.1984 23.3513 O.3 28 THR28 -0.3900 456 HG1 14.6577 -5.7460 23.5575 H 28 THR28 0.2098 457 CG2 13.9643 -3.2930 23.5931 C.3 28 THR28 -0.0370 458 HG21 13.1068 -3.8381 23.9870 H 28 THR28 0.0255 459 HG22 13.8685 -3.2476 22.5091 H 28 THR28 0.0255 460 HG23 13.9100 -2.2776 23.9717 H 28 THR28 0.0255 461 N 16.9230 -1.5000 25.3490 N.am 29 GLU29 -0.2456 462 H 17.1410 -2.3030 25.9390 H 29 GLU29 0.1312 463 CA 17.0480 -0.1400 25.8750 C.3 29 GLU29 0.0883 464 HA 16.1366 0.3758 25.5812 H 29 GLU29 0.0557 465 C 18.1870 0.6700 25.2360 C.2 29 GLU29 0.2187 466 O 18.0480 1.8810 25.1020 O.2 29 GLU29 -0.2778 467 CB 17.0264 -0.2327 27.4104 C.3 29 GLU29 -0.0193 468 HB1 17.6942 0.5121 27.8435 H 29 GLU29 0.0290 469 HB2 17.4344 -1.1971 27.7153 H 29 GLU29 0.0290 470 CG 15.6202 -0.0485 28.0477 C.3 29 GLU29 0.0356 471 HG1 15.4342 1.0193 28.1611 H 29 GLU29 0.0374 472 HG2 15.6144 -0.4624 29.0550 H 29 GLU29 0.0374 473 CD 14.3970 -0.6380 27.2916 C.2 29 GLU29 0.1760 474 OE1 13.3992 0.0610 27.1430 O.co2 29 GLU29 -0.6478 475 OE2 14.4177 -1.7796 26.8463 O.co2 29 GLU29 -0.6478 476 N 19.2890 0.0130 24.8430 N.am 30 ALA30 -0.2459 477 H 19.3790 -0.9780 25.0680 H 30 ALA30 0.1312 478 CA 20.3660 0.6700 24.1030 C.3 30 ALA30 0.0850 479 HA 20.7595 1.4326 24.7714 H 30 ALA30 0.0554 480 C 19.8280 1.3590 22.8390 C.2 30 ALA30 0.2184 481 O 19.9520 2.5610 22.6540 O.2 30 ALA30 -0.2778 482 CB 21.4893 -0.3250 23.7747 C.3 30 ALA30 -0.0411 483 HB1 22.3046 0.1615 23.2389 H 30 ALA30 0.0249 484 HB2 21.1421 -1.1504 23.1572 H 30 ALA30 0.0249 485 HB3 21.9073 -0.7522 24.6863 H 30 ALA30 0.0249 486 N 19.1950 0.5790 21.9930 N.am 31 HIS31 -0.2453 487 H 19.1750 -0.4250 22.1740 H 31 HIS31 0.1312 488 CA 18.5240 1.0860 20.8120 C.3 31 HIS31 0.0932 489 HA 19.2725 1.5405 20.1668 H 31 HIS31 0.0561 490 C 17.4040 2.1120 21.1150 C.2 31 HIS31 0.2190 491 O 17.3970 3.1620 20.4960 O.2 31 HIS31 -0.2778 492 CB 17.8949 -0.1205 20.0920 C.3 31 HIS31 0.0146 493 HB1 17.2055 -0.6410 20.7591 H 31 HIS31 0.0348 494 HB2 18.6608 -0.8426 19.8132 H 31 HIS31 0.0348 495 CG 17.1453 0.3066 18.8455 C.ar 31 HIS31 0.0551 496 ND1 17.6214 1.1781 17.9244 N.ar 31 HIS31 -0.2469 497 CD2 15.8496 -0.0751 18.4620 C.ar 31 HIS31 0.0047 498 HD2 15.1913 -0.7388 19.0047 H 31 HIS31 0.0764 499 CE1 16.6582 1.2864 16.9917 C.ar 31 HIS31 0.0737 500 HE1 16.7320 1.9055 16.1096 H 31 HIS31 0.0963 501 NE2 15.5772 0.5472 17.2932 N.ar 31 HIS31 -0.2539 502 HE2 14.7447 0.4723 16.7804 H 31 HIS31 0.1339 503 N 16.4950 1.8320 22.0540 N.am 32 ARG32 -0.2456 504 H 16.5460 0.9290 22.5250 H 32 ARG32 0.1312 505 CA 15.4130 2.7740 22.4440 C.3 32 ARG32 0.0879 506 HA 14.7925 2.8929 21.5564 H 32 ARG32 0.0557 507 C 15.9310 4.1510 22.8470 C.2 32 ARG32 0.2187 508 O 15.4290 5.1770 22.4190 O.2 32 ARG32 -0.2778 509 CB 14.5873 2.1988 23.5845 C.3 32 ARG32 -0.0258 510 HB1 13.9971 2.9767 24.0726 H 32 ARG32 0.0286 511 HB2 15.2540 1.8027 24.3464 H 32 ARG32 0.0286 512 CG 13.6240 1.1279 23.0932 C.3 32 ARG32 -0.0154 513 HG1 14.1303 0.3999 22.4589 H 32 ARG32 0.0299 514 HG2 12.8511 1.5876 22.4762 H 32 ARG32 0.0299 515 CD 12.9957 0.4148 24.2749 C.3 32 ARG32 0.1045 516 HD1 12.6098 1.1121 25.0212 H 32 ARG32 0.0711 517 HD2 13.7401 -0.2369 24.7345 H 32 ARG32 0.0711 518 NE 11.8803 -0.3666 23.7877 N.pl3 32 ARG32 -0.4450 519 HE 11.4452 -0.1529 22.9058 H 32 ARG32 0.3153 520 CZ 11.3746 -1.3919 24.4382 C.cat 32 ARG32 0.5062 521 NH1 11.8245 -1.7532 25.6131 N.pl3 32 ARG32 -0.4573 522 HH11 11.4507 -2.5219 26.1109 H 32 ARG32 0.3114 523 HH12 12.5912 -1.2433 26.0421 H 32 ARG32 0.3114 524 NH2 10.4074 -2.0361 23.8513 N.pl3 32 ARG32 -0.4573 525 HH21 9.9667 -2.8217 24.2647 H 32 ARG32 0.3114 526 HH22 10.1328 -1.6941 22.9423 H 32 ARG32 0.3114 527 N 16.9640 4.1500 23.6680 N.am 33 SER33 -0.2436 528 H 17.3500 3.2560 23.9720 H 33 SER33 0.1312 529 CA 17.5670 5.3650 24.1510 C.3 33 SER33 0.1109 530 HA 16.7606 6.0423 24.4362 H 33 SER33 0.0580 531 C 18.4720 6.0780 23.1370 C.2 33 SER33 0.2210 532 O 18.9290 7.1640 23.4390 O.2 33 SER33 -0.2777 533 CB 18.4159 5.0299 25.3919 C.3 33 SER33 0.0681 534 HB1 17.8240 4.4805 26.1328 H 33 SER33 0.0577 535 HB2 18.7303 5.9514 25.8856 H 33 SER33 0.0577 536 OG 19.5927 4.3018 25.0727 O.3 33 SER33 -0.3930 537 HG 19.3409 3.5077 24.6042 H 33 SER33 0.2095 538 N 18.7600 5.4910 21.9720 N.am 34 THR34 -0.2433 539 H 18.3990 4.5570 21.7780 H 34 THR34 0.1313 540 CA 19.6020 6.1810 20.9500 C.3 34 THR34 0.1135 541 HA 19.7787 7.2122 21.2575 H 34 THR34 0.0583 542 C 18.8900 6.2260 19.6050 C.2 34 THR34 0.2212 543 O 19.4900 6.4740 18.5750 O.2 34 THR34 -0.2777 544 CB 20.9451 5.4496 20.7907 C.3 34 THR34 0.0763 545 HB 21.5682 6.0040 20.0861 H 34 THR34 0.0611 546 OG1 20.7779 4.1573 20.2442 O.3 34 THR34 -0.3900 547 HG1 20.2673 3.6455 20.8661 H 34 THR34 0.2098 548 CG2 21.7099 5.3741 22.1117 C.3 34 THR34 -0.0370 549 HG21 22.6415 4.8356 21.9667 H 34 THR34 0.0255 550 HG22 21.1515 4.8538 22.8892 H 34 THR34 0.0255 551 HG23 21.9443 6.3701 22.4877 H 34 THR34 0.0255 552 N 17.5960 5.9640 19.6620 N.am 35 ASN35 -0.2451 553 H 17.1960 5.8310 20.5910 H 35 ASN35 0.1312 554 CA 16.6840 5.8460 18.5330 C.3 35 ASN35 0.0957 555 HA 17.3176 5.5858 17.6827 H 35 ASN35 0.0562 556 C 15.9670 7.1150 18.0770 C.2 35 ASN35 0.2191 557 O 15.1310 7.0590 17.1950 O.2 35 ASN35 -0.2778 558 CB 15.7297 4.6368 18.7116 C.3 35 ASN35 0.0446 559 HB1 15.1585 4.7132 19.6351 H 35 ASN35 0.0375 560 HB2 16.3260 3.7384 18.7504 H 35 ASN35 0.0375 561 CG 14.8015 4.2878 17.5379 C.2 35 ASN35 0.2000 562 OD1 15.0753 4.5810 16.3805 O.2 35 ASN35 -0.2797 563 ND2 13.6906 3.6334 17.9087 N.am 35 ASN35 -0.2723 564 HD21 13.0246 3.3268 17.2292 H 35 ASN35 0.1266 565 HD22 13.4839 3.4108 18.8631 H 35 ASN35 0.1266 566 N 16.2880 8.2500 18.6830 N.am 36 ALA36 -0.2459 567 H 17.2000 8.3500 19.1280 H 36 ALA36 0.1312 568 CA 15.3390 9.3530 18.7130 C.3 36 ALA36 0.0850 569 HA 15.5406 9.9157 19.6247 H 36 ALA36 0.0554 570 C 13.9280 8.7780 18.7900 C.2 36 ALA36 0.2184 571 O 13.1630 8.8350 17.8270 O.2 36 ALA36 -0.2778 572 CB 15.5632 10.2224 17.4783 C.3 36 ALA36 -0.0411 573 HB1 14.8691 11.0535 17.4896 H 36 ALA36 0.0249 574 HB2 15.4149 9.6552 16.5595 H 36 ALA36 0.0249 575 HB3 16.5746 10.6280 17.4600 H 36 ALA36 0.0249 576 N 13.6000 8.2260 19.9520 N.am 37 GLN37 -0.2456 577 H 13.9990 8.6190 20.8040 H 37 GLN37 0.1312 578 CA 12.6910 7.0780 20.0730 C.3 37 GLN37 0.0882 579 HA 13.1714 6.3169 19.4551 H 37 GLN37 0.0557 580 C 11.3590 7.3270 19.4370 C.2 37 GLN37 0.2185 581 O 11.0800 6.8310 18.3320 O.2 37 GLN37 -0.2778 582 CB 12.6040 6.5082 21.5095 C.3 37 GLN37 -0.0210 583 HB1 11.7455 6.8924 22.0603 H 37 GLN37 0.0289 584 HB2 13.4724 6.8586 22.0674 H 37 GLN37 0.0289 585 CG 12.6198 4.9623 21.5747 C.3 37 GLN37 0.0225 586 HG1 12.6049 4.6250 22.6116 H 37 GLN37 0.0356 587 HG2 13.5450 4.6019 21.1405 H 37 GLN37 0.0356 588 CD 11.5136 4.2438 20.7879 C.2 37 GLN37 0.1981 589 OE1 11.3149 4.4810 19.6051 O.2 37 GLN37 -0.2798 590 NE2 10.8322 3.3384 21.5024 N.am 37 GLN37 -0.2724 591 HE21 10.1821 2.7377 21.0332 H 37 GLN37 0.1266 592 HE22 10.9632 3.2034 22.4826 H 37 GLN37 0.1266 593 N 10.5480 8.0810 20.1700 N.am 38 GLY38 -0.2485 594 H 10.8670 8.3580 21.0980 H 38 GLY38 0.1309 595 CA 9.2410 8.5380 19.7420 C.3 38 GLY38 0.0765 596 HA1 8.5480 7.6959 19.7336 H 38 GLY38 0.0521 597 HA2 9.3193 9.0177 18.7661 H 38 GLY38 0.0521 598 C 8.8970 9.5330 20.8280 C.2 38 GLY38 0.2156 599 O 7.7530 9.9930 20.9490 O.2 38 GLY38 -0.2781 600 N 9.9270 9.8410 21.6250 N.am 39 SER39 -0.2439 601 H 10.8200 9.3840 21.4420 H 39 SER39 0.1312 602 CA 9.8630 10.7860 22.7400 C.3 39 SER39 0.1109 603 HA 9.2536 10.3170 23.5136 H 39 SER39 0.0580 604 C 9.2050 12.1040 22.3330 C.2 39 SER39 0.2209 605 O 9.2000 12.4440 21.1410 O.2 39 SER39 -0.2777 606 CB 11.2849 11.0463 23.2604 C.3 39 SER39 0.0681 607 HB1 11.9063 11.4314 22.4452 H 39 SER39 0.0577 608 HB2 11.7165 10.0951 23.5923 H 39 SER39 0.0577 609 OG 11.2669 11.9829 24.3311 O.3 39 SER39 -0.3930 610 HG 12.1313 12.0913 24.7228 H 39 SER39 0.2095 611 N 8.6250 12.8120 23.3100 N.am 40 HIS40 -0.2452 612 H 8.3570 12.3320 24.1690 H 40 HIS40 0.1312 613 CA 8.3610 14.2380 23.1970 C.3 40 HIS40 0.0932 614 HA 7.3055 14.3308 22.9408 H 40 HIS40 0.0561 615 C 9.1980 14.8120 22.0200 C.2 40 HIS40 0.2190 616 O 8.7280 14.9530 20.8860 O.2 40 HIS40 -0.2778 617 CB 8.6565 14.9224 24.5429 C.3 40 HIS40 0.0146 618 HB1 9.7002 14.7970 24.8329 H 40 HIS40 0.0348 619 HB2 8.0592 14.4662 25.3324 H 40 HIS40 0.0348 620 CG 8.3268 16.3977 24.4751 C.ar 40 HIS40 0.0551 621 ND1 9.1479 17.3307 23.9449 N.ar 40 HIS40 -0.2469 622 CD2 7.1727 17.0435 24.9478 C.ar 40 HIS40 0.0047 623 HD2 6.3333 16.5721 25.4383 H 40 HIS40 0.0764 624 CE1 8.5245 18.5093 24.1114 C.ar 40 HIS40 0.0737 625 HE1 8.9473 19.4610 23.8209 H 40 HIS40 0.0963 626 NE2 7.3222 18.3647 24.6976 N.ar 40 HIS40 -0.2539 627 HE2 6.6967 19.0810 24.9359 H 40 HIS40 0.1339 628 N 10.4770 15.0400 22.3010 N.am 41 TRP41 -0.2453 629 H 10.8910 14.5350 23.0850 H 41 TRP41 0.1312 630 CA 11.3280 15.9680 21.5590 C.3 41 TRP41 0.0918 631 HA 10.8142 16.9306 21.5746 H 41 TRP41 0.0560 632 C 11.5970 15.6180 20.0940 C.2 41 TRP41 0.2190 633 O 11.7850 16.5120 19.2660 O.2 41 TRP41 -0.2778 634 CB 12.6456 16.0779 22.3501 C.3 41 TRP41 -0.0021 635 HB1 13.0752 15.0877 22.5059 H 41 TRP41 0.0334 636 HB2 12.4481 16.4871 23.3416 H 41 TRP41 0.0334 637 CG 13.6552 16.9669 21.6505 C.ar 41 TRP41 -0.0260 638 CD1 13.5564 18.3501 21.4775 C.ar 41 TRP41 -0.0136 639 HD1 12.7476 18.9684 21.8407 H 41 TRP41 0.0748 640 CD2 14.8910 16.5616 21.0253 C.ar 41 TRP41 -0.0028 641 NE1 14.6328 18.7892 20.7795 N.ar 41 TRP41 -0.2641 642 HE1 14.8044 19.7250 20.5413 H 41 TRP41 0.1331 643 CE2 15.4838 17.7303 20.4933 C.ar 41 TRP41 0.0269 644 CE3 15.5153 15.3505 20.8826 C.ar 41 TRP41 -0.0528 645 HE3 15.0644 14.4608 21.2963 H 41 TRP41 0.0624 646 CZ2 16.6863 17.6539 19.8447 C.ar 41 TRP41 -0.0430 647 HZ2 17.1413 18.5527 19.4545 H 41 TRP41 0.0633 648 CZ3 16.7409 15.2689 20.2207 C.ar 41 TRP41 -0.0611 649 HZ3 17.2418 14.3170 20.1235 H 41 TRP41 0.0618 650 CH2 17.3279 16.4230 19.7011 C.ar 41 TRP41 -0.0602 651 HH2 18.2842 16.3690 19.2011 H 41 TRP41 0.0618 652 N 11.5810 14.3320 19.7590 N.am 42 LYS42 -0.2456 653 H 11.3970 13.6240 20.4700 H 42 LYS42 0.1312 654 CA 11.8280 13.9260 18.3620 C.3 42 LYS42 0.0878 655 HA 12.2323 14.8208 17.9194 H 42 LYS42 0.0557 656 C 10.5380 13.9190 17.5050 C.2 42 LYS42 0.2187 657 O 10.5750 14.3110 16.3310 O.2 42 LYS42 -0.2778 658 CB 12.9523 12.9393 18.0360 C.3 42 LYS42 -0.0289 659 HB1 12.5272 11.9491 17.8658 H 42 LYS42 0.0285 660 HB2 13.6338 12.8439 18.8817 H 42 LYS42 0.0285 661 CG 13.7334 13.4214 16.7777 C.3 42 LYS42 -0.0496 662 HG1 13.0388 13.7901 16.0234 H 42 LYS42 0.0266 663 HG2 14.2071 12.5706 16.2945 H 42 LYS42 0.0266 664 CD 14.8323 14.4821 17.0428 C.3 42 LYS42 -0.0278 665 HD1 15.4780 14.5444 16.1674 H 42 LYS42 0.0282 666 HD2 15.4847 14.1101 17.8329 H 42 LYS42 0.0282 667 CE 14.3703 15.9132 17.4159 C.3 42 LYS42 0.1103 668 HE1 15.2425 16.5660 17.4774 H 42 LYS42 0.0559 669 HE2 13.9565 15.9062 18.4216 H 42 LYS42 0.0559 670 NZ 13.4038 16.5805 16.5294 N.4 42 LYS42 -0.0749 671 HZ1 12.9818 17.4028 17.0030 H 42 LYS42 0.2742 672 HZ2 12.6452 15.9382 16.2240 H 42 LYS42 0.2742 673 HZ3 13.8840 16.9403 15.6792 H 42 LYS42 0.2742 674 N 9.4120 13.5450 18.1030 N.am 43 GLN43 -0.2456 675 H 9.4410 13.2470 19.0780 H 43 GLN43 0.1312 676 CA 8.1320 13.5510 17.3960 C.3 43 GLN43 0.0882 677 HA 8.2814 12.9549 16.4958 H 43 GLN43 0.0557 678 C 7.6800 14.9370 16.9190 C.2 43 GLN43 0.2187 679 O 6.5660 15.0900 16.4190 O.2 43 GLN43 -0.2778 680 CB 7.0358 12.9341 18.2810 C.3 43 GLN43 -0.0210 681 HB1 6.0438 13.1109 17.8620 H 43 GLN43 0.0289 682 HB2 7.0454 13.4335 19.2512 H 43 GLN43 0.0289 683 CG 7.1987 11.4269 18.4968 C.3 43 GLN43 0.0225 684 HG1 6.5055 11.1093 19.2747 H 43 GLN43 0.0356 685 HG2 8.2103 11.2034 18.8283 H 43 GLN43 0.0356 686 CD 6.8985 10.5946 17.2399 C.2 43 GLN43 0.1981 687 OE1 6.8843 11.0820 16.1174 O.2 43 GLN43 -0.2798 688 NE2 6.6564 9.3033 17.5078 N.am 43 GLN43 -0.2724 689 HE21 6.4473 8.6724 16.7612 H 43 GLN43 0.1266 690 HE22 6.6720 8.9567 18.4457 H 43 GLN43 0.1266 691 N 8.5410 15.9390 17.0730 N.am 44 ARG44 -0.2457 692 H 9.2640 15.8640 17.7890 H 44 ARG44 0.1312 693 CA 8.4830 17.1580 16.2390 C.3 44 ARG44 0.0879 694 HA 7.4603 17.2936 15.8860 H 44 ARG44 0.0557 695 C 9.3880 17.0350 14.9880 C.2 44 ARG44 0.2187 696 O 10.5900 17.3220 14.9920 O.2 44 ARG44 -0.2778 697 CB 8.8884 18.3645 17.1083 C.3 44 ARG44 -0.0258 698 HB1 8.7561 19.2858 16.5395 H 44 ARG44 0.0286 699 HB2 9.9560 18.2981 17.3243 H 44 ARG44 0.0286 700 CG 8.1501 18.4841 18.4612 C.3 44 ARG44 -0.0154 701 HG1 8.6061 19.3085 19.0108 H 44 ARG44 0.0299 702 HG2 8.3285 17.6010 19.0767 H 44 ARG44 0.0299 703 CD 6.6383 18.7608 18.3715 C.3 44 ARG44 0.1045 704 HD1 6.4273 19.5738 17.6721 H 44 ARG44 0.0711 705 HD2 6.2506 19.0361 19.3559 H 44 ARG44 0.0711 706 NE 5.9252 17.5623 17.9328 N.pl3 44 ARG44 -0.4450 707 HE 6.4436 16.7327 17.7291 H 44 ARG44 0.3153 708 CZ 4.6122 17.4566 17.7694 C.cat 44 ARG44 0.5062 709 NH1 3.8072 18.4452 18.0543 N.pl3 44 ARG44 -0.4573 710 HH11 2.8231 18.3508 17.9224 H 44 ARG44 0.3114 711 HH12 4.1836 19.2976 18.4067 H 44 ARG44 0.3114 712 NH2 4.1253 16.3354 17.3120 N.pl3 44 ARG44 -0.4573 713 HH21 3.1420 16.2097 17.2069 H 44 ARG44 0.3114 714 HH22 4.7520 15.5961 17.0621 H 44 ARG44 0.3114 715 N 8.7720 16.5930 13.8970 N.am 45 ARG45 -0.2457 716 H 7.7530 16.6200 13.8560 H 45 ARG45 0.1312 717 CA 9.5140 16.0700 12.7560 C.3 45 ARG45 0.0879 718 HA 10.4811 16.5530 12.6917 H 45 ARG45 0.0557 719 C 8.7520 16.2910 11.4540 C.2 45 ARG45 0.2187 720 O 7.6990 15.6940 11.2300 O.2 45 ARG45 -0.2778 721 CB 9.6200 14.4998 12.9864 C.3 45 ARG45 -0.0258 722 HB1 9.9737 14.3730 14.0073 H 45 ARG45 0.0286 723 HB2 10.4152 14.0591 12.4110 H 45 ARG45 0.0286 724 CG 8.3980 13.5183 12.7946 C.3 45 ARG45 -0.0154 725 HG1 7.4501 14.0348 12.9418 H 45 ARG45 0.0299 726 HG2 8.4461 12.8080 13.6211 H 45 ARG45 0.0299 727 CD 8.3706 12.6469 11.4826 C.3 45 ARG45 0.1045 728 HD1 9.3704 12.2655 11.2621 H 45 ARG45 0.0711 729 HD2 8.0475 13.2404 10.6242 H 45 ARG45 0.0711 730 NE 7.4760 11.4574 11.5849 N.pl3 45 ARG45 -0.4450 731 HE 6.9659 11.2894 12.4245 H 45 ARG45 0.3153 732 CZ 7.2441 10.4999 10.6449 C.cat 45 ARG45 0.5062 733 NH1 7.7611 10.5181 9.4549 N.pl3 45 ARG45 -0.4573 734 HH11 7.4984 9.7529 8.8455 H 45 ARG45 0.3114 735 HH12 8.3834 11.2221 9.1471 H 45 ARG45 0.3114 736 NH2 6.4695 9.4699 10.8768 N.pl3 45 ARG45 -0.4573 737 HH21 6.3700 8.7787 10.1342 H 45 ARG45 0.3114 738 HH22 5.9792 9.3216 11.7250 H 45 ARG45 0.3114 739 N 9.2910 17.1520 10.5980 N.am 46 LYS46 -0.2457 740 H 10.2490 17.4670 10.7480 H 46 LYS46 0.1312 741 CA 8.5490 17.6590 9.4500 C.3 46 LYS46 0.0878 742 HA 7.4807 17.4951 9.6070 H 46 LYS46 0.0557 743 C 8.9820 16.9660 8.1630 C.2 46 LYS46 0.2187 744 O 10.1130 16.4930 8.0510 O.2 46 LYS46 -0.2778 745 CB 8.8570 19.1848 9.3243 C.3 46 LYS46 -0.0289 746 HB1 7.9007 19.7054 9.2641 H 46 LYS46 0.0285 747 HB2 9.3567 19.4249 8.3828 H 46 LYS46 0.0285 748 CG 9.6813 19.8226 10.4747 C.3 46 LYS46 -0.0496 749 HG1 9.2566 19.5256 11.4347 H 46 LYS46 0.0266 750 HG2 9.5473 20.9044 10.4382 H 46 LYS46 0.0266 751 CD 11.2049 19.5367 10.4317 C.3 46 LYS46 -0.0278 752 HD1 11.6808 20.2083 9.7161 H 46 LYS46 0.0282 753 HD2 11.4007 18.5385 10.0420 H 46 LYS46 0.0282 754 CE 11.8737 19.6782 11.8148 C.3 46 LYS46 0.1103 755 HE1 11.2686 19.1658 12.5662 H 46 LYS46 0.0559 756 HE2 11.9302 20.7266 12.1117 H 46 LYS46 0.0559 757 NZ 13.2151 19.0987 11.9038 N.4 46 LYS46 -0.0749 758 HZ1 13.5481 19.0938 12.8955 H 46 LYS46 0.2742 759 HZ2 13.8916 19.5743 11.2780 H 46 LYS46 0.2742 760 HZ3 13.1593 18.0794 11.6887 H 46 LYS46 0.2742 761 N 8.0750 16.9080 7.1930 N.am 47 PHE47 -0.2453 762 H 7.1270 17.2350 7.3790 H 47 PHE47 0.1312 763 CA 8.4000 16.3900 5.8700 C.3 47 PHE47 0.0917 764 HA 8.8057 15.3932 5.9979 H 47 PHE47 0.0560 765 C 9.4920 17.2740 5.3030 C.2 47 PHE47 0.2190 766 O 9.5610 18.4470 5.6210 O.2 47 PHE47 -0.2778 767 CB 7.1630 16.3887 4.9616 C.3 47 PHE47 -0.0036 768 HB1 7.4555 16.2049 3.9259 H 47 PHE47 0.0333 769 HB2 6.6708 17.3619 4.9751 H 47 PHE47 0.0333 770 CG 6.1982 15.3110 5.3714 C.ar 47 PHE47 -0.0454 771 CD1 5.0715 15.6003 6.1352 C.ar 47 PHE47 -0.0585 772 HD1 4.8607 16.6193 6.4246 H 47 PHE47 0.0620 773 CD2 6.4474 13.9929 5.0086 C.ar 47 PHE47 -0.0585 774 HD2 7.3273 13.7562 4.4279 H 47 PHE47 0.0620 775 CE1 4.2118 14.5832 6.5333 C.ar 47 PHE47 -0.0615 776 HE1 3.3365 14.8131 7.1231 H 47 PHE47 0.0618 777 CE2 5.6006 12.9734 5.4179 C.ar 47 PHE47 -0.0615 778 HE2 5.8230 11.9523 5.1460 H 47 PHE47 0.0618 779 CZ 4.4779 13.2677 6.1777 C.ar 47 PHE47 -0.0617 780 HZ 3.8146 12.4735 6.4895 H 47 PHE47 0.0618 781 N 10.3830 16.7160 4.5030 N.am 48 LEU48 -0.2456 782 H 10.4470 15.7000 4.4310 H 48 LEU48 0.1312 783 CA 11.2640 17.5580 3.7330 C.3 48 LEU48 0.0883 784 HA 11.7360 18.2421 4.4319 H 48 LEU48 0.0557 785 C 10.3950 18.2380 2.6690 C.2 48 LEU48 0.2214 786 O 9.7290 17.5490 1.8880 O.2 48 LEU48 -0.2776 787 CB 12.3730 16.7405 3.0564 C.3 48 LEU48 -0.0266 788 HB1 11.9202 15.9977 2.3991 H 48 LEU48 0.0287 789 HB2 12.9082 16.1859 3.8239 H 48 LEU48 0.0287 790 CG 13.3842 17.6039 2.2656 C.3 48 LEU48 -0.0449 791 HG 12.8457 18.3743 1.7129 H 48 LEU48 0.0296 792 CD1 14.3847 18.3086 3.1920 C.3 48 LEU48 -0.0626 793 HD11 15.0210 18.9928 2.6298 H 48 LEU48 0.0232 794 HD12 15.0370 17.5879 3.6824 H 48 LEU48 0.0232 795 HD13 13.8862 18.8902 3.9661 H 48 LEU48 0.0232 796 CD2 14.1324 16.7696 1.2222 C.3 48 LEU48 -0.0626 797 HD21 14.9354 17.3410 0.7562 H 48 LEU48 0.0232 798 HD22 13.4611 16.4532 0.4281 H 48 LEU48 0.0232 799 HD23 14.5639 15.8783 1.6714 H 48 LEU48 0.0232 800 N 10.3890 19.5750 2.6560 N.am 49 PRO49 -0.2316 801 CA 9.5340 20.3570 1.7450 C.3 49 PRO49 0.0907 802 HA 8.5065 20.2398 2.0892 H 49 PRO49 0.0559 803 C 9.6700 19.9440 0.2710 C.2 49 PRO49 0.2189 804 O 10.7940 19.7890 -0.2330 O.2 49 PRO49 -0.2778 805 CB 10.0344 21.7988 1.9129 C.3 49 PRO49 -0.0276 806 HB1 9.2407 22.5353 1.7846 H 49 PRO49 0.0285 807 HB2 10.8089 22.0380 1.1803 H 49 PRO49 0.0285 808 CG 10.6622 21.8381 3.2980 C.3 49 PRO49 -0.0379 809 HG1 9.8908 22.0671 4.0334 H 49 PRO49 0.0278 810 HG2 11.4402 22.5976 3.3816 H 49 PRO49 0.0278 811 CD 11.1926 20.4250 3.5386 C.3 49 PRO49 0.0071 812 HD1 12.2345 20.3150 3.2410 H 49 PRO49 0.0431 813 HD2 11.0502 20.1482 4.5821 H 49 PRO49 0.0431 814 N 8.5260 19.7680 -0.3970 N.am 50 ASP50 -0.2451 815 H 7.6540 20.0610 0.0430 H 50 ASP50 0.1312 816 CA 8.4690 19.1700 -1.7400 C.3 50 ASP50 0.0974 817 HA 8.9100 18.1799 -1.6245 H 50 ASP50 0.0563 818 C 9.2900 19.9060 -2.8030 C.2 50 ASP50 0.2192 819 O 9.7520 19.2820 -3.7610 O.2 50 ASP50 -0.2778 820 CB 6.9930 19.0288 -2.1784 C.3 50 ASP50 0.0576 821 HB1 6.6521 19.9002 -2.7370 H 50 ASP50 0.0394 822 HB2 6.3574 18.9643 -1.2959 H 50 ASP50 0.0394 823 CG 6.7300 17.7600 -3.0205 C.2 50 ASP50 0.1780 824 OD1 7.4123 17.5210 -4.0093 O.co2 50 ASP50 -0.6478 825 OD2 5.8399 16.9789 -2.6926 O.co2 50 ASP50 -0.6478 826 N 9.4800 21.2180 -2.6570 N.am 51 ASP51 -0.2451 827 H 8.9850 21.7400 -1.9340 H 51 ASP51 0.1312 828 CA 10.4170 21.8920 -3.5600 C.3 51 ASP51 0.0974 829 HA 10.1587 21.6059 -4.5764 H 51 ASP51 0.0563 830 C 11.9210 21.5380 -3.3510 C.2 51 ASP51 0.2192 831 O 12.7660 21.8920 -4.1730 O.2 51 ASP51 -0.2778 832 CB 10.1896 23.4131 -3.4222 C.3 51 ASP51 0.0576 833 HB1 9.2548 23.6791 -3.9133 H 51 ASP51 0.0394 834 HB2 10.9721 23.9788 -3.9276 H 51 ASP51 0.0394 835 CG 10.0776 23.9016 -1.9611 C.2 51 ASP51 0.1780 836 OD1 9.0053 23.7695 -1.3685 O.co2 51 ASP51 -0.6478 837 OD2 11.0563 24.4166 -1.4308 O.co2 51 ASP51 -0.6478 838 N 12.2510 20.8290 -2.2800 N.am 52 ILE52 -0.2454 839 H 11.5500 20.6220 -1.5690 H 52 ILE52 0.1312 840 CA 13.6170 20.3460 -2.1200 C.3 52 ILE52 0.0903 841 HA 14.2910 20.9748 -2.7059 H 52 ILE52 0.0560 842 C 13.7960 18.8810 -2.5890 C.2 52 ILE52 0.2187 843 O 13.0100 17.9770 -2.2280 O.2 52 ILE52 -0.2778 844 CB 14.0389 20.4821 -0.6345 C.3 52 ILE52 -0.0201 845 HB 13.4106 19.8141 -0.0442 H 52 ILE52 0.0318 846 CG1 13.7999 21.9157 -0.1125 C.3 52 ILE52 -0.0514 847 HG11 12.7472 22.1805 -0.2187 H 52 ILE52 0.0266 848 HG12 14.3506 22.6301 -0.7253 H 52 ILE52 0.0266 849 CG2 15.5086 20.0599 -0.4202 C.3 52 ILE52 -0.0605 850 HG21 15.7944 20.1060 0.6296 H 52 ILE52 0.0233 851 HG22 16.1894 20.7036 -0.9785 H 52 ILE52 0.0233 852 HG23 15.6878 19.0344 -0.7391 H 52 ILE52 0.0233 853 CD1 14.1784 22.1106 1.3608 C.3 52 ILE52 -0.0650 854 HD11 13.8392 23.0828 1.7184 H 52 ILE52 0.0230 855 HD12 15.2574 22.0687 1.5082 H 52 ILE52 0.0230 856 HD13 13.7215 21.3462 1.9863 H 52 ILE52 0.0230 857 N 14.8500 18.6490 -3.3650 N.am 53 GLY53 -0.2485 858 H 15.4460 19.4290 -3.6430 H 53 GLY53 0.1309 859 CA 15.1700 17.3150 -3.8240 C.3 53 GLY53 0.0765 860 HA1 14.8166 16.5730 -3.1074 H 53 GLY53 0.0521 861 HA2 16.2504 17.2341 -3.8933 H 53 GLY53 0.0521 862 C 14.6200 17.0210 -5.2060 C.2 53 GLY53 0.2155 863 O 14.6150 15.8630 -5.6190 O.2 53 GLY53 -0.2781 864 N 14.1550 18.0490 -5.9200 N.am 54 GLN54 -0.2459 865 H 14.1880 18.9900 -5.5290 H 54 GLN54 0.1312 866 CA 13.6000 17.8420 -7.2550 C.3 54 GLN54 0.0882 867 HA 13.4651 16.7725 -7.4224 H 54 GLN54 0.0557 868 C 14.5380 18.3200 -8.3640 C.2 54 GLN54 0.2187 869 O 14.2960 18.0770 -9.5450 O.2 54 GLN54 -0.2778 870 CB 12.2146 18.4959 -7.3633 C.3 54 GLN54 -0.0210 871 HB1 11.5482 18.0162 -6.6446 H 54 GLN54 0.0289 872 HB2 11.8019 18.2714 -8.3485 H 54 GLN54 0.0289 873 CG 12.1990 20.0159 -7.1281 C.3 54 GLN54 0.0225 874 HG1 12.9495 20.5169 -7.7393 H 54 GLN54 0.0356 875 HG2 12.4157 20.2525 -6.0868 H 54 GLN54 0.0356 876 CD 10.8240 20.5897 -7.5010 C.2 54 GLN54 0.1981 877 OE1 10.6730 21.3262 -8.4672 O.2 54 GLN54 -0.2798 878 NE2 9.8327 20.2019 -6.6854 N.am 54 GLN54 -0.2724 879 HE21 8.8965 20.5071 -6.8502 H 54 GLN54 0.1266 880 HE22 10.0025 19.6108 -5.8951 H 54 GLN54 0.1266 881 N 15.6230 18.9740 -7.9700 N.am 55 SER55 -0.2436 882 H 15.8090 19.0560 -6.9700 H 55 SER55 0.1312 883 CA 16.5560 19.5770 -8.9040 C.3 55 SER55 0.1111 884 HA 16.1567 19.5253 -9.9171 H 55 SER55 0.0580 885 C 17.9480 18.9210 -8.9030 C.2 55 SER55 0.2236 886 O 18.9400 19.6330 -8.6960 O.2 55 SER55 -0.2775 887 CB 16.6788 21.0506 -8.4814 C.3 55 SER55 0.0681 888 HB1 17.4621 21.5563 -9.0527 H 55 SER55 0.0577 889 HB2 16.9628 21.0866 -7.4189 H 55 SER55 0.0577 890 OG 15.4448 21.7203 -8.7262 O.3 55 SER55 -0.3930 891 HG 15.3834 22.5252 -8.2171 H 55 SER55 0.2095 892 N 18.0630 17.6070 -9.1600 N.am 56 PRO56 -0.2315 893 CA 19.3860 16.9590 -9.1750 C.3 56 PRO56 0.0907 894 HA 19.8751 17.2106 -8.2541 H 56 PRO56 0.0559 895 C 20.1880 17.4980 -10.3490 C.2 56 PRO56 0.2189 896 O 19.6440 17.5410 -11.4580 O.2 56 PRO56 -0.2778 897 CB 19.0615 15.4691 -9.3104 C.3 56 PRO56 -0.0276 898 HB1 18.9946 15.0228 -8.3182 H 56 PRO56 0.0285 899 HB2 19.8067 14.9055 -9.8697 H 56 PRO56 0.0285 900 CG 17.6907 15.4412 -9.9806 C.3 56 PRO56 -0.0379 901 HG1 17.1370 14.5247 -9.7843 H 56 PRO56 0.0278 902 HG2 17.8186 15.5201 -11.0605 H 56 PRO56 0.0278 903 CD 16.9734 16.6902 -9.4670 C.3 56 PRO56 0.0071 904 HD1 16.3292 17.1269 -10.2281 H 56 PRO56 0.0431 905 HD2 16.4383 16.4870 -8.5386 H 56 PRO56 0.0431 906 N 21.4110 17.9630 -10.1330 N.am 57 ILE57 -0.2454 907 H 21.8440 17.8740 -9.2140 H 57 ILE57 0.1312 908 CA 22.1350 18.6100 -11.2420 C.3 57 ILE57 0.0903 909 HA 21.7584 18.2271 -12.1834 H 57 ILE57 0.0560 910 C 23.6450 18.4010 -11.2560 C.2 57 ILE57 0.2189 911 O 24.2590 18.5390 -12.2980 O.2 57 ILE57 -0.2778 912 CB 21.8570 20.1377 -11.1929 C.3 57 ILE57 -0.0201 913 HB 22.5378 20.6299 -11.8898 H 57 ILE57 0.0318 914 CG1 22.1169 20.7373 -9.7921 C.3 57 ILE57 -0.0514 915 HG11 23.0958 20.4264 -9.4295 H 57 ILE57 0.0266 916 HG12 21.3944 20.3507 -9.0721 H 57 ILE57 0.0266 917 CG2 20.4423 20.4753 -11.6933 C.3 57 ILE57 -0.0605 918 HG21 20.3138 21.5489 -11.8276 H 57 ILE57 0.0233 919 HG22 19.6753 20.1452 -10.9952 H 57 ILE57 0.0233 920 HG23 20.2385 20.0040 -12.6545 H 57 ILE57 0.0233 921 CD1 22.0700 22.2688 -9.7630 C.3 57 ILE57 -0.0650 922 HD11 22.3273 22.6412 -8.7710 H 57 ILE57 0.0230 923 HD12 21.0740 22.6426 -9.9997 H 57 ILE57 0.0230 924 HD13 22.7741 22.7005 -10.4741 H 57 ILE57 0.0230 925 N 24.2370 18.0900 -10.1120 N.am 58 VAL58 -0.2454 926 H 23.7110 18.1480 -9.2400 H 58 VAL58 0.1312 927 CA 25.6300 17.6670 -10.0870 C.3 58 VAL58 0.0901 928 HA 26.1969 18.3040 -10.7693 H 58 VAL58 0.0560 929 C 25.7560 16.2060 -10.5100 C.2 58 VAL58 0.2190 930 O 25.2090 15.3000 -9.8760 O.2 58 VAL58 -0.2778 931 CB 26.1781 17.8552 -8.6533 C.3 58 VAL58 -0.0227 932 HB 25.6072 17.2129 -7.9831 H 58 VAL58 0.0315 933 CG1 27.6579 17.4454 -8.5377 C.3 58 VAL58 -0.0608 934 HG11 28.0292 17.5930 -7.5230 H 58 VAL58 0.0233 935 HG12 28.2863 18.0336 -9.2070 H 58 VAL58 0.0233 936 HG13 27.8115 16.3932 -8.7811 H 58 VAL58 0.0233 937 CG2 25.9894 19.2960 -8.1506 C.3 58 VAL58 -0.0608 938 HG21 26.4093 19.4165 -7.1513 H 58 VAL58 0.0233 939 HG22 24.9364 19.5707 -8.0860 H 58 VAL58 0.0233 940 HG23 26.4864 20.0108 -8.8066 H 58 VAL58 0.0233 941 N 26.4910 16.0320 -11.6120 N.am 59 SER59 -0.2436 942 H 26.9530 16.8520 -12.0040 H 59 SER59 0.1312 943 CA 26.6810 14.7690 -12.2920 C.3 59 SER59 0.1109 944 HA 25.7215 14.3073 -12.5012 H 59 SER59 0.0580 945 C 27.5060 13.8380 -11.4290 C.2 59 SER59 0.2209 946 O 28.5320 14.2350 -10.8560 O.2 59 SER59 -0.2777 947 CB 27.4838 15.0025 -13.5858 C.3 59 SER59 0.0681 948 HB1 27.6908 14.0333 -14.0572 H 59 SER59 0.0577 949 HB2 28.4561 15.4419 -13.3202 H 59 SER59 0.0577 950 OG 26.7925 15.8491 -14.5080 O.3 59 SER59 -0.3930 951 HG 27.3442 16.0062 -15.2734 H 59 SER59 0.2095 952 N 27.0320 12.6020 -11.3250 N.am 60 MET60 -0.2456 953 H 26.1150 12.3910 -11.7190 H 60 MET60 0.1312 954 CA 27.7750 11.5420 -10.6690 C.3 60 MET60 0.0888 955 HA 28.6573 11.9691 -10.1967 H 60 MET60 0.0557 956 C 28.1430 10.4910 -11.7110 C.2 60 MET60 0.2214 957 O 27.3700 10.2550 -12.6390 O.2 60 MET60 -0.2776 958 CB 26.8610 10.8752 -9.6315 C.3 60 MET60 -0.0199 959 HB1 27.2672 9.9121 -9.3196 H 60 MET60 0.0293 960 HB2 25.9044 10.6516 -10.1063 H 60 MET60 0.0293 961 CG 26.6229 11.7381 -8.3901 C.3 60 MET60 -0.0047 962 HG1 25.7489 11.3645 -7.8616 H 60 MET60 0.0377 963 HG2 26.4009 12.7711 -8.6594 H 60 MET60 0.0377 964 SD 28.0144 11.7060 -7.2441 S.3 60 MET60 -0.1641 965 CE 27.6496 10.1542 -6.4052 C.3 60 MET60 -0.0181 966 HE1 28.4135 9.9306 -5.6637 H 60 MET60 0.0340 967 HE2 27.6070 9.3363 -7.1246 H 60 MET60 0.0340 968 HE3 26.6825 10.2158 -5.9083 H 60 MET60 0.0340 969 N 29.2870 9.8210 -11.5420 N.am 61 PRO61 -0.2316 970 CA 29.8120 8.9120 -12.5930 C.3 61 PRO61 0.0907 971 HA 30.1803 9.5501 -13.3967 H 61 PRO61 0.0559 972 C 28.7900 7.8940 -13.1550 C.2 61 PRO61 0.2189 973 O 28.8760 7.5670 -14.3460 O.2 61 PRO61 -0.2778 974 CB 30.9613 8.1964 -11.8709 C.3 61 PRO61 -0.0276 975 HB1 31.7688 7.9176 -12.5475 H 61 PRO61 0.0285 976 HB2 30.6048 7.2859 -11.3863 H 61 PRO61 0.0285 977 CG 31.4153 9.1702 -10.7868 C.3 61 PRO61 -0.0379 978 HG1 32.1301 9.8763 -11.2127 H 61 PRO61 0.0278 979 HG2 31.9020 8.6768 -9.9467 H 61 PRO61 0.0278 980 CD 30.1574 9.9324 -10.3725 C.3 61 PRO61 0.0071 981 HD1 29.6341 9.4754 -9.5333 H 61 PRO61 0.0431 982 HD2 30.4069 10.9725 -10.1642 H 61 PRO61 0.0431 983 N 27.8380 7.4470 -12.3310 N.am 62 ASP62 -0.2451 984 H 27.8350 7.7760 -11.3660 H 62 ASP62 0.1312 985 CA 26.7960 6.5030 -12.7530 C.3 62 ASP62 0.0974 986 HA 27.2333 5.7914 -13.4531 H 62 ASP62 0.0563 987 C 25.5500 7.1530 -13.4120 C.2 62 ASP62 0.2190 988 O 24.5600 6.4690 -13.7190 O.2 62 ASP62 -0.2778 989 CB 26.3333 5.7846 -11.4544 C.3 62 ASP62 0.0576 990 HB1 27.1566 5.1897 -11.0619 H 62 ASP62 0.0394 991 HB2 25.5184 5.0912 -11.6587 H 62 ASP62 0.0394 992 CG 25.8760 6.7437 -10.3157 C.2 62 ASP62 0.1780 993 OD1 25.8163 6.3472 -9.1512 O.co2 62 ASP62 -0.6478 994 OD2 25.5770 7.8997 -10.5814 O.co2 62 ASP62 -0.6478 995 N 25.6080 8.4770 -13.6040 N.am 63 GLY63 -0.2485 996 H 26.3970 8.9890 -13.2090 H 63 GLY63 0.1309 997 CA 24.5980 9.2270 -14.3520 C.3 63 GLY63 0.0765 998 HA1 24.1789 8.5773 -15.1211 H 63 GLY63 0.0521 999 HA2 25.1305 10.0365 -14.8486 H 63 GLY63 0.0521 1000 C 23.4690 9.8220 -13.5280 C.2 63 GLY63 0.2155 1001 O 22.7310 10.6740 -14.0150 O.2 63 GLY63 -0.2781 1002 N 23.3510 9.3720 -12.2810 N.am 64 ASP64 -0.2454 1003 H 24.0210 8.6760 -11.9530 H 64 ASP64 0.1312 1004 CA 22.3140 9.8220 -11.3590 C.3 64 ASP64 0.0974 1005 HA 21.4204 10.0175 -11.9556 H 64 ASP64 0.0563 1006 C 22.7020 11.1000 -10.6290 C.2 64 ASP64 0.2192 1007 O 23.2630 11.0540 -9.5420 O.2 64 ASP64 -0.2778 1008 CB 22.0477 8.5806 -10.4748 C.3 64 ASP64 0.0576 1009 HB1 22.7087 8.5401 -9.6244 H 64 ASP64 0.0394 1010 HB2 22.2768 7.6787 -11.0437 H 64 ASP64 0.0394 1011 CG 20.6129 8.3761 -9.9741 C.2 64 ASP64 0.1780 1012 OD1 20.3664 8.5167 -8.7834 O.co2 64 ASP64 -0.6478 1013 OD2 19.7287 8.0431 -10.7572 O.co2 64 ASP64 -0.6478 1014 N 22.4010 12.2330 -11.2510 N.am 65 LYS65 -0.2456 1015 H 21.9480 12.1760 -12.1630 H 65 LYS65 0.1312 1016 CA 22.6830 13.5600 -10.7020 C.3 65 LYS65 0.0878 1017 HA 23.7708 13.6216 -10.7079 H 65 LYS65 0.0557 1018 C 22.2580 13.7620 -9.2270 C.2 65 LYS65 0.2187 1019 O 21.3610 13.0720 -8.7060 O.2 65 LYS65 -0.2778 1020 CB 22.0787 14.6031 -11.6531 C.3 65 LYS65 -0.0289 1021 HB1 21.9174 15.5431 -11.1297 H 65 LYS65 0.0285 1022 HB2 21.1047 14.2756 -12.0191 H 65 LYS65 0.0285 1023 CG 23.0558 14.8550 -12.7994 C.3 65 LYS65 -0.0496 1024 HG1 23.3541 13.9205 -13.2779 H 65 LYS65 0.0266 1025 HG2 23.9338 15.2549 -12.3054 H 65 LYS65 0.0266 1026 CD 22.6145 15.8705 -13.8534 C.3 65 LYS65 -0.0278 1027 HD1 22.0035 16.6280 -13.3776 H 65 LYS65 0.0282 1028 HD2 21.9683 15.3967 -14.5933 H 65 LYS65 0.0282 1029 CE 23.8432 16.5121 -14.5207 C.3 65 LYS65 0.1103 1030 HE1 24.1467 15.9453 -15.4035 H 65 LYS65 0.0559 1031 HE2 24.6864 16.4965 -13.8311 H 65 LYS65 0.0559 1032 NZ 23.6678 17.9152 -14.8836 N.4 65 LYS65 -0.0749 1033 HZ1 24.5267 18.2586 -15.3597 H 65 LYS65 0.2742 1034 HZ2 23.5331 18.4732 -14.0132 H 65 LYS65 0.2742 1035 HZ3 22.8432 18.0249 -15.5074 H 65 LYS65 0.2742 1036 N 22.9120 14.7400 -8.5970 N.am 66 VAL66 -0.2454 1037 H 23.6110 15.2570 -9.1310 H 66 VAL66 0.1312 1038 CA 22.7100 15.1240 -7.2240 C.3 66 VAL66 0.0901 1039 HA 21.9651 14.4411 -6.8143 H 66 VAL66 0.0560 1040 C 22.1340 16.5300 -7.0820 C.2 66 VAL66 0.2189 1041 O 22.6320 17.5020 -7.6370 O.2 66 VAL66 -0.2778 1042 CB 24.0007 14.9231 -6.4030 C.3 66 VAL66 -0.0227 1043 HB 24.7998 15.4995 -6.8675 H 66 VAL66 0.0315 1044 CG1 23.8574 15.3956 -4.9436 C.3 66 VAL66 -0.0608 1045 HG11 24.7541 15.1688 -4.3665 H 66 VAL66 0.0233 1046 HG12 23.0135 14.9103 -4.4516 H 66 VAL66 0.0233 1047 HG13 23.7018 16.4730 -4.8810 H 66 VAL66 0.0233 1048 CG2 24.4145 13.4462 -6.4271 C.3 66 VAL66 -0.0608 1049 HG21 25.3626 13.2883 -5.9123 H 66 VAL66 0.0233 1050 HG22 24.5278 13.0967 -7.4499 H 66 VAL66 0.0233 1051 HG23 23.6608 12.8176 -5.9536 H 66 VAL66 0.0233 1052 N 21.0760 16.6230 -6.2920 N.am 67 ASP67 -0.2451 1053 H 20.6530 15.7610 -5.9490 H 67 ASP67 0.1312 1054 CA 20.4840 17.8880 -5.8860 C.3 67 ASP67 0.0974 1055 HA 20.5327 18.5902 -6.7206 H 67 ASP67 0.0563 1056 C 21.3580 18.3840 -4.7570 C.2 67 ASP67 0.2192 1057 O 21.4730 17.7390 -3.7120 O.2 67 ASP67 -0.2778 1058 CB 19.0249 17.6560 -5.4757 C.3 67 ASP67 0.0576 1059 HB1 18.9575 16.9989 -4.6145 H 67 ASP67 0.0394 1060 HB2 18.4938 17.1568 -6.2852 H 67 ASP67 0.0394 1061 CG 18.2844 18.9637 -5.1715 C.2 67 ASP67 0.1780 1062 OD1 17.0866 19.0208 -5.4080 O.co2 67 ASP67 -0.6478 1063 OD2 18.9022 19.9128 -4.7053 O.co2 67 ASP67 -0.6478 1064 N 21.9950 19.5170 -4.9960 N.am 68 LEU68 -0.2456 1065 H 21.8160 19.9940 -5.8800 H 68 LEU68 0.1312 1066 CA 22.9320 20.1170 -4.0720 C.3 68 LEU68 0.0880 1067 HA 23.6560 19.3385 -3.8309 H 68 LEU68 0.0557 1068 C 22.2550 20.5360 -2.7770 C.2 68 LEU68 0.2187 1069 O 22.7470 20.2700 -1.6720 O.2 68 LEU68 -0.2778 1070 CB 23.6318 21.2974 -4.7648 C.3 68 LEU68 -0.0266 1071 HB1 22.8805 22.0293 -5.0656 H 68 LEU68 0.0287 1072 HB2 24.0867 20.9402 -5.6893 H 68 LEU68 0.0287 1073 CG 24.7081 21.9961 -3.9110 C.3 68 LEU68 -0.0449 1074 HG 24.2332 22.3923 -3.0119 H 68 LEU68 0.0296 1075 CD1 25.8180 21.0312 -3.4697 C.3 68 LEU68 -0.0626 1076 HD11 26.5922 21.5626 -2.9167 H 68 LEU68 0.0232 1077 HD12 26.2901 20.5509 -4.3271 H 68 LEU68 0.0232 1078 HD13 25.4338 20.2504 -2.8133 H 68 LEU68 0.0232 1079 CD2 25.3039 23.1876 -4.6706 C.3 68 LEU68 -0.0626 1080 HD21 26.0352 23.7163 -4.0587 H 68 LEU68 0.0232 1081 HD22 24.5279 23.9015 -4.9482 H 68 LEU68 0.0232 1082 HD23 25.8031 22.8628 -5.5837 H 68 LEU68 0.0232 1083 N 21.1290 21.2260 -2.9170 N.am 69 GLU69 -0.2456 1084 H 20.7940 21.4520 -3.8540 H 69 GLU69 0.1312 1085 CA 20.3730 21.6610 -1.7720 C.3 69 GLU69 0.0883 1086 HA 21.1511 22.0924 -1.1402 H 69 GLU69 0.0557 1087 C 19.8680 20.5040 -0.9550 C.2 69 GLU69 0.2187 1088 O 19.9140 20.5740 0.2620 O.2 69 GLU69 -0.2778 1089 CB 19.3800 22.8113 -1.9630 C.3 69 GLU69 -0.0193 1090 HB1 18.5238 22.4735 -2.5479 H 69 GLU69 0.0290 1091 HB2 19.8633 23.5960 -2.5449 H 69 GLU69 0.0290 1092 CG 18.9054 23.4119 -0.6082 C.3 69 GLU69 0.0356 1093 HG1 18.2363 22.7076 -0.1133 H 69 GLU69 0.0374 1094 HG2 18.3209 24.3127 -0.7873 H 69 GLU69 0.0374 1095 CD 20.0440 23.7765 0.3927 C.2 69 GLU69 0.1760 1096 OE1 20.9849 24.4717 0.0216 O.co2 69 GLU69 -0.6478 1097 OE2 19.9920 23.3610 1.5499 O.co2 69 GLU69 -0.6478 1098 N 19.3680 19.4460 -1.6020 N.am 70 ALA70 -0.2459 1099 H 19.3840 19.4200 -2.6220 H 70 ALA70 0.1312 1100 CA 18.7920 18.3150 -0.8470 C.3 70 ALA70 0.0850 1101 HA 18.1070 18.7385 -0.1102 H 70 ALA70 0.0554 1102 C 19.9020 17.6260 -0.1150 C.2 70 ALA70 0.2184 1103 O 19.7170 17.2310 1.0350 O.2 70 ALA70 -0.2778 1104 CB 18.0325 17.3868 -1.7783 C.3 70 ALA70 -0.0411 1105 HB1 17.5432 16.5758 -1.2382 H 70 ALA70 0.0249 1106 HB2 18.6870 16.9591 -2.5310 H 70 ALA70 0.0249 1107 HB3 17.2705 17.9747 -2.2798 H 70 ALA70 0.0249 1108 N 21.0440 17.4870 -0.7980 N.am 71 PHE71 -0.2453 1109 H 21.0540 17.7580 -1.7810 H 71 PHE71 0.1312 1110 CA 22.2680 16.9720 -0.2150 C.3 71 PHE71 0.0917 1111 HA 22.0361 15.9418 0.0527 H 71 PHE71 0.0560 1112 C 22.6660 17.6550 1.0800 C.2 71 PHE71 0.2191 1113 O 22.8950 17.0100 2.1040 O.2 71 PHE71 -0.2778 1114 CB 23.3948 16.9814 -1.2651 C.3 71 PHE71 -0.0036 1115 HB1 23.5459 17.9899 -1.6455 H 71 PHE71 0.0333 1116 HB2 23.0933 16.3809 -2.1237 H 71 PHE71 0.0333 1117 CG 24.7042 16.4398 -0.7417 C.ar 71 PHE71 -0.0454 1118 CD1 24.7999 15.1258 -0.2908 C.ar 71 PHE71 -0.0585 1119 HD1 23.9332 14.4849 -0.3118 H 71 PHE71 0.0620 1120 CD2 25.8362 17.2498 -0.6927 C.ar 71 PHE71 -0.0585 1121 HD2 25.7828 18.2746 -1.0319 H 71 PHE71 0.0620 1122 CE1 25.9971 14.6313 0.2095 C.ar 71 PHE71 -0.0615 1123 HE1 26.0540 13.6147 0.5711 H 71 PHE71 0.0618 1124 CE2 27.0384 16.7555 -0.2018 C.ar 71 PHE71 -0.0615 1125 HE2 27.9127 17.3890 -0.1697 H 71 PHE71 0.0618 1126 CZ 27.1176 15.4478 0.2552 C.ar 71 PHE71 -0.0617 1127 HZ 28.0466 15.0703 0.6548 H 71 PHE71 0.0618 1128 N 22.7630 18.9620 1.0160 N.am 72 SER72 -0.2436 1129 H 22.5970 19.4150 0.1180 H 72 SER72 0.1312 1130 CA 23.0940 19.7960 2.1560 C.3 72 SER72 0.1109 1131 HA 24.0997 19.5286 2.4743 H 72 SER72 0.0580 1132 C 22.0980 19.5480 3.3110 C.2 72 SER72 0.2209 1133 O 22.5170 19.3320 4.4460 O.2 72 SER72 -0.2777 1134 CB 23.0378 21.2561 1.6656 C.3 72 SER72 0.0681 1135 HB1 21.9978 21.5480 1.4684 H 72 SER72 0.0577 1136 HB2 23.5615 21.3166 0.7047 H 72 SER72 0.0577 1137 OG 23.6497 22.1508 2.5904 O.3 72 SER72 -0.3930 1138 HG 23.5819 23.0504 2.2703 H 72 SER72 0.2095 1139 N 20.7980 19.5060 3.0160 N.am 73 GLU73 -0.2456 1140 H 20.5000 19.6550 2.0520 H 73 GLU73 0.1312 1141 CA 19.7940 19.2520 4.0430 C.3 73 GLU73 0.0883 1142 HA 19.9450 19.9996 4.8119 H 73 GLU73 0.0557 1143 C 19.9880 17.9190 4.7390 C.2 73 GLU73 0.2187 1144 O 19.6190 17.7990 5.9260 O.2 73 GLU73 -0.2778 1145 CB 18.3628 19.3658 3.4677 C.3 73 GLU73 -0.0193 1146 HB1 17.6825 18.6981 3.9997 H 73 GLU73 0.0290 1147 HB2 18.3527 19.0219 2.4331 H 73 GLU73 0.0290 1148 CG 17.7604 20.7830 3.5515 C.3 73 GLU73 0.0356 1149 HG1 16.7392 20.7778 3.1721 H 73 GLU73 0.0374 1150 HG2 18.3200 21.4737 2.9213 H 73 GLU73 0.0374 1151 CD 17.7199 21.3101 5.0060 C.2 73 GLU73 0.1760 1152 OE1 18.1407 22.4394 5.2490 O.co2 73 GLU73 -0.6478 1153 OE2 17.2797 20.5875 5.8925 O.co2 73 GLU73 -0.6478 1154 N 20.5540 16.9300 4.0300 N.am 74 PHE74 -0.2453 1155 H 20.8350 17.1100 3.0660 H 74 PHE74 0.1312 1156 CA 20.7790 15.6070 4.5960 C.3 74 PHE74 0.0917 1157 HA 19.9904 15.4171 5.3191 H 74 PHE74 0.0560 1158 C 22.0630 15.5610 5.3890 C.2 74 PHE74 0.2191 1159 O 22.0580 15.0510 6.4930 O.2 74 PHE74 -0.2778 1160 CB 20.7203 14.5390 3.4906 C.3 74 PHE74 -0.0036 1161 HB1 20.9079 13.5547 3.9193 H 74 PHE74 0.0333 1162 HB2 21.5107 14.7241 2.7612 H 74 PHE74 0.0333 1163 CG 19.3915 14.4696 2.7692 C.ar 74 PHE74 -0.0454 1164 CD1 19.3494 14.0496 1.4426 C.ar 74 PHE74 -0.0585 1165 HD1 20.2625 13.8182 0.9153 H 74 PHE74 0.0620 1166 CD2 18.1860 14.7877 3.3982 C.ar 74 PHE74 -0.0585 1167 HD2 18.1510 15.1247 4.4218 H 74 PHE74 0.0620 1168 CE1 18.1389 13.9309 0.7749 C.ar 74 PHE74 -0.0615 1169 HE1 18.1094 13.5841 -0.2424 H 74 PHE74 0.0618 1170 CE2 16.9823 14.7079 2.7144 C.ar 74 PHE74 -0.0615 1171 HE2 16.0659 14.9949 3.2059 H 74 PHE74 0.0618 1172 CZ 16.9529 14.2619 1.4047 C.ar 74 PHE74 -0.0617 1173 HZ 16.0160 14.1855 0.8723 H 74 PHE74 0.0618 1174 N 23.1760 16.0530 4.8410 N.am 75 THR75 -0.2434 1175 H 23.1890 16.2820 3.8470 H 75 THR75 0.1313 1176 CA 24.3970 16.2720 5.6590 C.3 75 THR75 0.1135 1177 HA 24.6772 15.2843 6.0226 H 75 THR75 0.0583 1178 C 24.0970 17.1370 6.9080 C.2 75 THR75 0.2212 1179 O 24.6570 16.9060 7.9760 O.2 75 THR75 -0.2777 1180 CB 25.5593 16.8324 4.8273 C.3 75 THR75 0.0763 1181 HB 26.3994 16.8730 5.5180 H 75 THR75 0.0611 1182 OG1 25.2829 18.1438 4.3690 O.3 75 THR75 -0.3900 1183 HG1 26.0334 18.4994 3.8994 H 75 THR75 0.2098 1184 CG2 25.9217 15.9060 3.6547 C.3 75 THR75 -0.0370 1185 HG21 26.8477 16.2139 3.1688 H 75 THR75 0.0255 1186 HG22 25.1363 15.9017 2.8990 H 75 THR75 0.0255 1187 HG23 26.0630 14.8801 3.9953 H 75 THR75 0.0255 1188 N 23.2110 18.1140 6.7890 N.am 76 LYS76 -0.2456 1189 H 22.7730 18.3210 5.8920 H 76 LYS76 0.1312 1190 CA 22.8780 18.8920 7.9940 C.3 76 LYS76 0.0878 1191 HA 23.7963 19.3502 8.3633 H 76 LYS76 0.0557 1192 C 22.2440 18.0680 9.1390 C.2 76 LYS76 0.2187 1193 O 22.2200 18.5210 10.2740 O.2 76 LYS76 -0.2778 1194 CB 21.8399 19.9838 7.6266 C.3 76 LYS76 -0.0289 1195 HB1 21.3596 20.3761 8.5250 H 76 LYS76 0.0285 1196 HB2 21.0413 19.5055 7.0596 H 76 LYS76 0.0285 1197 CG 22.3611 21.2024 6.8383 C.3 76 LYS76 -0.0496 1198 HG1 23.0237 20.8726 6.0432 H 76 LYS76 0.0266 1199 HG2 22.9878 21.8196 7.4821 H 76 LYS76 0.0266 1200 CD 21.1972 22.0527 6.2685 C.3 76 LYS76 -0.0278 1201 HD1 20.9375 22.8477 6.9677 H 76 LYS76 0.0282 1202 HD2 20.3013 21.4394 6.2256 H 76 LYS76 0.0282 1203 CE 21.4658 22.6476 4.8711 C.3 76 LYS76 0.1103 1204 HE1 22.0884 21.9652 4.3042 H 76 LYS76 0.0559 1205 HE2 22.0198 23.5826 4.9564 H 76 LYS76 0.0559 1206 NZ 20.2731 22.8939 4.0578 N.4 76 LYS76 -0.0749 1207 HZ1 20.4918 23.4178 3.1831 H 76 LYS76 0.2742 1208 HZ2 19.5324 23.3845 4.6013 H 76 LYS76 0.2742 1209 HZ3 19.8233 22.0026 3.7767 H 76 LYS76 0.2742 1210 N 21.7150 16.8760 8.8590 N.am 77 ILE77 -0.2454 1211 H 21.7900 16.4830 7.9210 H 77 ILE77 0.1312 1212 CA 21.0290 16.1450 9.9130 C.3 77 ILE77 0.0903 1213 HA 21.0516 16.7003 10.8511 H 77 ILE77 0.0560 1214 C 21.6590 14.8340 10.2250 C.2 77 ILE77 0.2189 1215 O 21.2120 14.1460 11.1390 O.2 77 ILE77 -0.2778 1216 CB 19.5432 15.9581 9.5196 C.3 77 ILE77 -0.0201 1217 HB 19.0448 15.4399 10.3392 H 77 ILE77 0.0318 1218 CG1 19.3661 15.1168 8.2387 C.3 77 ILE77 -0.0514 1219 HG11 20.0654 14.2822 8.2157 H 77 ILE77 0.0266 1220 HG12 19.6149 15.7360 7.3807 H 77 ILE77 0.0266 1221 CG2 18.8409 17.3194 9.3796 C.3 77 ILE77 -0.0605 1222 HG21 17.7689 17.2009 9.2263 H 77 ILE77 0.0233 1223 HG22 19.2290 17.8875 8.5333 H 77 ILE77 0.0233 1224 HG23 18.9787 17.9264 10.2743 H 77 ILE77 0.0233 1225 CD1 17.9524 14.5516 8.0683 C.3 77 ILE77 -0.0650 1226 HD11 17.8714 13.9910 7.1367 H 77 ILE77 0.0230 1227 HD12 17.2120 15.3485 8.0383 H 77 ILE77 0.0230 1228 HD13 17.6909 13.8793 8.8853 H 77 ILE77 0.0230 1229 N 22.7390 14.5190 9.5120 N.am 78 ILE78 -0.2454 1230 H 23.1530 15.2280 8.9070 H 78 ILE78 0.1312 1231 CA 23.3470 13.2060 9.5650 C.3 78 ILE78 0.0903 1232 HA 22.5188 12.4993 9.6495 H 78 ILE78 0.0560 1233 C 24.2710 12.9550 10.7860 C.2 78 ILE78 0.2190 1234 O 24.3940 11.8230 11.2680 O.2 78 ILE78 -0.2778 1235 CB 24.0898 12.9255 8.2412 C.3 78 ILE78 -0.0201 1236 HB 23.4579 13.3062 7.4396 H 78 ILE78 0.0318 1237 CG1 24.2429 11.4154 8.0043 C.3 78 ILE78 -0.0514 1238 HG11 23.3087 10.9127 8.2514 H 78 ILE78 0.0266 1239 HG12 24.9954 11.0061 8.6773 H 78 ILE78 0.0266 1240 CG2 25.4524 13.6400 8.1513 C.3 78 ILE78 -0.0605 1241 HG21 25.8548 13.6153 7.1392 H 78 ILE78 0.0233 1242 HG22 26.1914 13.1755 8.8048 H 78 ILE78 0.0233 1243 HG23 25.3710 14.6832 8.4455 H 78 ILE78 0.0233 1244 CD1 24.5966 11.0799 6.5554 C.3 78 ILE78 -0.0650 1245 HD11 24.7917 10.0146 6.4379 H 78 ILE78 0.0230 1246 HD12 25.4801 11.6220 6.2313 H 78 ILE78 0.0230 1247 HD13 23.7864 11.3542 5.8819 H 78 ILE78 0.0230 1248 N 24.9100 13.9930 11.2940 N.am 79 THR79 -0.2434 1249 H 24.7540 14.9260 10.9140 H 79 THR79 0.1313 1250 CA 25.8490 13.7980 12.4120 C.3 79 THR79 0.1137 1251 HA 26.5850 13.0806 12.0466 H 79 THR79 0.0583 1252 C 25.1690 13.1220 13.6430 C.2 79 THR79 0.2239 1253 O 25.6880 12.1330 14.1890 O.2 79 THR79 -0.2775 1254 CB 26.6143 15.1040 12.7337 C.3 79 THR79 0.0763 1255 HB 25.9075 15.8804 13.0312 H 79 THR79 0.0611 1256 OG1 27.2723 15.5109 11.5438 O.3 79 THR79 -0.3900 1257 HG1 27.7168 16.3431 11.6722 H 79 THR79 0.2098 1258 CG2 27.6505 14.9476 13.8598 C.3 79 THR79 -0.0370 1259 HG21 28.0590 15.9124 14.1607 H 79 THR79 0.0255 1260 HG22 28.4866 14.3308 13.5392 H 79 THR79 0.0255 1261 HG23 27.2155 14.4956 14.7503 H 79 THR79 0.0255 1262 N 24.0120 13.6130 14.0790 N.am 80 PRO80 -0.2315 1263 CA 23.3510 12.9970 15.2420 C.3 80 PRO80 0.0907 1264 HA 24.0456 13.0571 16.0805 H 80 PRO80 0.0559 1265 C 22.9500 11.5480 14.9850 C.2 80 PRO80 0.2189 1266 O 22.9730 10.6830 15.8950 O.2 80 PRO80 -0.2778 1267 CB 22.1108 13.8771 15.4709 C.3 80 PRO80 -0.0276 1268 HB1 21.9017 14.0308 16.5296 H 80 PRO80 0.0285 1269 HB2 21.2199 13.4342 15.0219 H 80 PRO80 0.0285 1270 CG 22.4102 15.1831 14.7433 C.3 80 PRO80 -0.0379 1271 HG1 22.9707 15.8468 15.4027 H 80 PRO80 0.0278 1272 HG2 21.5101 15.7097 14.4250 H 80 PRO80 0.0278 1273 CD 23.2947 14.7746 13.5703 C.3 80 PRO80 0.0071 1274 HD1 22.7135 14.4211 12.7339 H 80 PRO80 0.0431 1275 HD2 23.9505 15.5784 13.2580 H 80 PRO80 0.0431 1276 N 22.5940 11.2820 13.7400 N.am 81 ALA81 -0.2459 1277 H 22.5820 12.0330 13.0500 H 81 ALA81 0.1312 1278 CA 22.2200 9.9380 13.3400 C.3 81 ALA81 0.0850 1279 HA 21.4570 9.5809 14.0252 H 81 ALA81 0.0554 1280 C 23.4140 8.9880 13.4760 C.2 81 ALA81 0.2184 1281 O 23.2310 7.8410 13.9380 O.2 81 ALA81 -0.2778 1282 CB 21.6884 9.9389 11.9089 C.3 81 ALA81 -0.0411 1283 HB1 21.5084 8.9213 11.5627 H 81 ALA81 0.0249 1284 HB2 22.3828 10.4069 11.2130 H 81 ALA81 0.0249 1285 HB3 20.7466 10.4806 11.8583 H 81 ALA81 0.0249 1286 N 24.6060 9.4490 13.0300 N.am 82 ILE82 -0.2454 1287 H 24.6440 10.3640 12.5800 H 82 ILE82 0.1312 1288 CA 25.8510 8.6740 13.1720 C.3 82 ILE82 0.0903 1289 HA 25.6511 7.6805 12.7660 H 82 ILE82 0.0560 1290 C 26.2430 8.5100 14.6380 C.2 82 ILE82 0.2190 1291 O 26.6620 7.4350 15.0640 O.2 82 ILE82 -0.2778 1292 CB 26.9753 9.3506 12.3546 C.3 82 ILE82 -0.0201 1293 HB 27.0937 10.3656 12.7343 H 82 ILE82 0.0318 1294 CG1 26.6270 9.4518 10.8544 C.3 82 ILE82 -0.0514 1295 HG11 25.5842 9.7287 10.7169 H 82 ILE82 0.0266 1296 HG12 26.7348 8.4736 10.3841 H 82 ILE82 0.0266 1297 CG2 28.3072 8.6028 12.5285 C.3 82 ILE82 -0.0605 1298 HG21 29.0903 9.0151 11.8963 H 82 ILE82 0.0233 1299 HG22 28.1870 7.5533 12.2623 H 82 ILE82 0.0233 1300 HG23 28.6723 8.6430 13.5543 H 82 ILE82 0.0233 1301 CD1 27.4824 10.4850 10.1091 C.3 82 ILE82 -0.0650 1302 HD11 27.2212 10.5140 9.0522 H 82 ILE82 0.0230 1303 HD12 28.5441 10.2565 10.1778 H 82 ILE82 0.0230 1304 HD13 27.3309 11.4853 10.5141 H 82 ILE82 0.0230 1305 N 26.1010 9.5980 15.3790 N.am 83 THR83 -0.2434 1306 H 25.7850 10.4600 14.9350 H 83 THR83 0.1313 1307 CA 26.3800 9.6020 16.8000 C.3 83 THR83 0.1135 1308 HA 27.4020 9.2389 16.9201 H 83 THR83 0.0583 1309 C 25.4410 8.6460 17.5430 C.2 83 THR83 0.2212 1310 O 25.8660 7.8580 18.3900 O.2 83 THR83 -0.2777 1311 CB 26.2777 11.0402 17.3401 C.3 83 THR83 0.0763 1312 HB 25.2695 11.4096 17.1233 H 83 THR83 0.0611 1313 OG1 27.2317 11.8209 16.6385 O.3 83 THR83 -0.3900 1314 HG1 27.1763 12.7380 16.8867 H 83 THR83 0.2098 1315 CG2 26.5504 11.1281 18.8528 C.3 83 THR83 -0.0370 1316 HG21 26.4676 12.1511 19.2207 H 83 THR83 0.0255 1317 HG22 27.5529 10.7695 19.0863 H 83 THR83 0.0255 1318 HG23 25.8403 10.5298 19.4232 H 83 THR83 0.0255 1319 N 24.1590 8.6890 17.2240 N.am 84 ARG84 -0.2456 1320 H 23.8100 9.3230 16.5050 H 84 ARG84 0.1312 1321 CA 23.2760 7.8000 17.9370 C.3 84 ARG84 0.0879 1322 HA 23.3898 8.0180 19.0018 H 84 ARG84 0.0557 1323 C 23.7600 6.3370 17.7460 C.2 84 ARG84 0.2187 1324 O 23.8520 5.6010 18.7270 O.2 84 ARG84 -0.2778 1325 CB 21.8491 8.1105 17.4943 C.3 84 ARG84 -0.0258 1326 HB1 21.2640 7.2086 17.5694 H 84 ARG84 0.0286 1327 HB2 21.8347 8.3809 16.4373 H 84 ARG84 0.0286 1328 CG 21.2711 9.2443 18.3681 C.3 84 ARG84 -0.0154 1329 HG1 21.8859 10.1359 18.2387 H 84 ARG84 0.0299 1330 HG2 21.3671 8.9669 19.4187 H 84 ARG84 0.0299 1331 CD 19.8057 9.6179 18.1180 C.3 84 ARG84 0.1045 1332 HD1 19.5284 10.4675 18.7454 H 84 ARG84 0.0711 1333 HD2 19.1143 8.8143 18.3677 H 84 ARG84 0.0711 1334 NE 19.6088 10.0415 16.7383 N.pl3 84 ARG84 -0.4450 1335 HE 19.8137 10.9759 16.4551 H 84 ARG84 0.3153 1336 CZ 19.1779 9.2458 15.7682 C.cat 84 ARG84 0.5062 1337 NH1 18.9031 7.9876 15.9501 N.pl3 84 ARG84 -0.4573 1338 HH11 18.6336 7.4923 15.1084 H 84 ARG84 0.3114 1339 HH12 18.9620 7.5344 16.8323 H 84 ARG84 0.3114 1340 NH2 19.0240 9.7257 14.5779 N.pl3 84 ARG84 -0.4573 1341 HH21 18.7158 9.0618 13.8825 H 84 ARG84 0.3114 1342 HH22 19.2005 10.6716 14.3359 H 84 ARG84 0.3114 1343 N 24.1120 5.9390 16.5130 N.am 85 VAL85 -0.2454 1344 H 23.9790 6.5820 15.7330 H 85 VAL85 0.1312 1345 CA 24.6810 4.6120 16.2450 C.3 85 VAL85 0.0901 1346 HA 23.9012 3.8976 16.5072 H 85 VAL85 0.0560 1347 C 25.9000 4.2510 17.1360 C.2 85 VAL85 0.2189 1348 O 25.9900 3.1260 17.6380 O.2 85 VAL85 -0.2778 1349 CB 25.0216 4.4297 14.7471 C.3 85 VAL85 -0.0227 1350 HB 25.7129 5.2155 14.4419 H 85 VAL85 0.0315 1351 CG1 25.7025 3.0777 14.4631 C.3 85 VAL85 -0.0608 1352 HG11 25.8246 2.9182 13.3929 H 85 VAL85 0.0233 1353 HG12 25.1125 2.2492 14.8542 H 85 VAL85 0.0233 1354 HG13 26.6963 3.0196 14.9080 H 85 VAL85 0.0233 1355 CG2 23.7677 4.5427 13.8745 C.3 85 VAL85 -0.0608 1356 HG21 23.9882 4.3082 12.8335 H 85 VAL85 0.0233 1357 HG22 23.3422 5.5394 13.8996 H 85 VAL85 0.0233 1358 HG23 23.0024 3.8529 14.2176 H 85 VAL85 0.0233 1359 N 26.8440 5.1930 17.2730 N.am 86 VAL86 -0.2454 1360 H 26.7850 6.0200 16.6780 H 86 VAL86 0.1312 1361 CA 27.9630 5.1080 18.2310 C.3 86 VAL86 0.0901 1362 HA 28.5159 4.2057 17.9704 H 86 VAL86 0.0560 1363 C 27.4220 4.9030 19.6730 C.2 86 VAL86 0.2189 1364 O 27.8540 4.0020 20.4140 O.2 86 VAL86 -0.2778 1365 CB 28.8865 6.3345 18.0701 C.3 86 VAL86 -0.0227 1366 HB 28.3009 7.2353 18.2525 H 86 VAL86 0.0315 1367 CG1 30.0515 6.3177 19.0688 C.3 86 VAL86 -0.0608 1368 HG11 30.7359 7.1469 18.8876 H 86 VAL86 0.0233 1369 HG12 30.6227 5.3914 18.9940 H 86 VAL86 0.0233 1370 HG13 29.6948 6.4138 20.0900 H 86 VAL86 0.0233 1371 CG2 29.4485 6.4278 16.6420 C.3 86 VAL86 -0.0608 1372 HG21 30.0654 7.3185 16.5204 H 86 VAL86 0.0233 1373 HG22 28.6647 6.4757 15.8906 H 86 VAL86 0.0233 1374 HG23 30.0661 5.5633 16.4039 H 86 VAL86 0.0233 1375 N 26.4640 5.7110 20.0810 N.am 87 ASP87 -0.2451 1376 H 26.1260 6.4690 19.4870 H 87 ASP87 0.1312 1377 CA 25.9030 5.4880 21.4060 C.3 87 ASP87 0.0974 1378 HA 26.7672 5.4625 22.0634 H 87 ASP87 0.0563 1379 C 25.2520 4.1360 21.6010 C.2 87 ASP87 0.2192 1380 O 25.3670 3.5250 22.6660 O.2 87 ASP87 -0.2778 1381 CB 25.0438 6.6912 21.8159 C.3 87 ASP87 0.0576 1382 HB1 24.0271 6.5992 21.4394 H 87 ASP87 0.0394 1383 HB2 25.4483 7.5982 21.3680 H 87 ASP87 0.0394 1384 CG 25.0313 6.9273 23.3428 C.2 87 ASP87 0.1780 1385 OD1 24.1412 7.5981 23.8295 O.co2 87 ASP87 -0.6478 1386 OD2 25.8986 6.4510 24.0743 O.co2 87 ASP87 -0.6478 1387 N 24.5550 3.6810 20.5850 N.am 88 PHE88 -0.2453 1388 H 24.4110 4.2790 19.7710 H 88 PHE88 0.1312 1389 CA 23.9860 2.3470 20.5960 C.3 88 PHE88 0.0917 1390 HA 23.2455 2.3336 21.3981 H 88 PHE88 0.0560 1391 C 25.0330 1.3250 20.9350 C.2 88 PHE88 0.2190 1392 O 24.8920 0.6030 21.9380 O.2 88 PHE88 -0.2778 1393 CB 23.3003 2.0269 19.2532 C.3 88 PHE88 -0.0036 1394 HB1 23.9536 2.2671 18.4188 H 88 PHE88 0.0333 1395 HB2 22.4187 2.6528 19.1372 H 88 PHE88 0.0333 1396 CG 22.8894 0.5786 19.1499 C.ar 88 PHE88 -0.0454 1397 CD1 21.9156 0.0693 19.9993 C.ar 88 PHE88 -0.0585 1398 HD1 21.4384 0.7295 20.7039 H 88 PHE88 0.0620 1399 CD2 23.5530 -0.2921 18.2891 C.ar 88 PHE88 -0.0585 1400 HD2 24.3429 0.0732 17.6484 H 88 PHE88 0.0620 1401 CE1 21.5948 -1.2816 19.9887 C.ar 88 PHE88 -0.0615 1402 HE1 20.8468 -1.6675 20.6671 H 88 PHE88 0.0618 1403 CE2 23.2466 -1.6467 18.2851 C.ar 88 PHE88 -0.0615 1404 HE2 23.7834 -2.3208 17.6328 H 88 PHE88 0.0618 1405 CZ 22.2586 -2.1406 19.1258 C.ar 88 PHE88 -0.0617 1406 HZ 22.0262 -3.1959 19.1259 H 88 PHE88 0.0618 1407 N 26.0620 1.2510 20.0760 N.am 89 ALA89 -0.2459 1408 H 26.0690 1.8720 19.2670 H 89 ALA89 0.1312 1409 CA 27.1720 0.3190 20.2510 C.3 89 ALA89 0.0850 1410 HA 26.7610 -0.6852 20.1369 H 89 ALA89 0.0554 1411 C 27.8250 0.4210 21.6460 C.2 89 ALA89 0.2184 1412 O 27.9700 -0.5830 22.3130 O.2 89 ALA89 -0.2778 1413 CB 28.1939 0.6142 19.1521 C.3 89 ALA89 -0.0411 1414 HB1 29.0133 -0.0991 19.1681 H 89 ALA89 0.0249 1415 HB2 28.6157 1.6133 19.2653 H 89 ALA89 0.0249 1416 HB3 27.7298 0.5554 18.1674 H 89 ALA89 0.0249 1417 N 28.1280 1.6340 22.1030 N.am 90 LYS90 -0.2457 1418 H 27.8930 2.4400 21.5240 H 90 LYS90 0.1312 1419 CA 28.7860 1.8770 23.4020 C.3 90 LYS90 0.0878 1420 HA 29.7820 1.4332 23.3610 H 90 LYS90 0.0557 1421 C 28.0530 1.3050 24.5750 C.2 90 LYS90 0.2187 1422 O 28.6880 0.9330 25.5690 O.2 90 LYS90 -0.2778 1423 CB 28.8433 3.3968 23.6420 C.3 90 LYS90 -0.0289 1424 HB1 29.0221 3.5965 24.7004 H 90 LYS90 0.0285 1425 HB2 27.8612 3.8145 23.4146 H 90 LYS90 0.0285 1426 CG 29.9242 4.1573 22.8619 C.3 90 LYS90 -0.0496 1427 HG1 30.0336 3.7279 21.8648 H 90 LYS90 0.0266 1428 HG2 30.8878 4.0192 23.3542 H 90 LYS90 0.0266 1429 CD 29.6026 5.6581 22.7212 C.3 90 LYS90 -0.0278 1430 HD1 28.8173 5.7526 21.9789 H 90 LYS90 0.0282 1431 HD2 30.4620 6.1770 22.2956 H 90 LYS90 0.0282 1432 CE 29.1495 6.3704 24.0119 C.3 90 LYS90 0.1103 1433 HE1 30.0113 6.7516 24.5627 H 90 LYS90 0.0559 1434 HE2 28.6198 5.6965 24.6842 H 90 LYS90 0.0559 1435 NZ 28.2257 7.4750 23.7478 N.4 90 LYS90 -0.0749 1436 HZ1 27.9221 7.9145 24.6388 H 90 LYS90 0.2742 1437 HZ2 27.3535 7.0954 23.3177 H 90 LYS90 0.2742 1438 HZ3 28.6533 8.1781 23.1162 H 90 LYS90 0.2742 1439 N 26.7250 1.2130 24.4390 N.am 91 LYS91 -0.2457 1440 H 26.3230 1.5200 23.5530 H 91 LYS91 0.1312 1441 CA 25.7940 0.7050 25.4640 C.3 91 LYS91 0.0878 1442 HA 26.2226 0.9663 26.4325 H 91 LYS91 0.0557 1443 C 25.6160 -0.8290 25.4760 C.2 91 LYS91 0.2187 1444 O 24.8950 -1.3960 26.3400 O.2 91 LYS91 -0.2778 1445 CB 24.4222 1.3816 25.3238 C.3 91 LYS91 -0.0289 1446 HB1 23.7006 0.8966 25.9840 H 91 LYS91 0.0285 1447 HB2 24.0506 1.2383 24.3090 H 91 LYS91 0.0285 1448 CG 24.4420 2.8790 25.6602 C.3 91 LYS91 -0.0496 1449 HG1 25.1069 3.3968 24.9729 H 91 LYS91 0.0266 1450 HG2 24.8709 3.0312 26.6511 H 91 LYS91 0.0266 1451 CD 23.0311 3.4867 25.6162 C.3 91 LYS91 -0.0278 1452 HD1 22.5765 3.4469 26.6066 H 91 LYS91 0.0282 1453 HD2 22.3950 2.8783 24.9737 H 91 LYS91 0.0282 1454 CE 22.9899 4.9089 25.0579 C.3 91 LYS91 0.1103 1455 HE1 21.9712 5.2994 25.0907 H 91 LYS91 0.0559 1456 HE2 23.2977 4.8769 24.0160 H 91 LYS91 0.0559 1457 NZ 23.8646 5.8729 25.7088 N.4 91 LYS91 -0.0749 1458 HZ1 23.6610 6.8233 25.3279 H 91 LYS91 0.2742 1459 HZ2 24.8489 5.6997 25.4118 H 91 LYS91 0.2742 1460 HZ3 23.7539 5.8559 26.7377 H 91 LYS91 0.2742 1461 N 26.2370 -1.4860 24.5060 N.am 92 LEU92 -0.2456 1462 H 26.6300 -0.9510 23.7310 H 92 LEU92 0.1312 1463 CA 26.3870 -2.9540 24.4950 C.3 92 LEU92 0.0883 1464 HA 25.5095 -3.3711 24.9772 H 92 LEU92 0.0557 1465 C 27.7230 -3.3660 25.1500 C.2 92 LEU92 0.2214 1466 O 28.8030 -2.9900 24.6660 O.2 92 LEU92 -0.2776 1467 CB 26.3847 -3.4732 23.0477 C.3 92 LEU92 -0.0266 1468 HB1 26.4538 -4.5623 23.0689 H 92 LEU92 0.0287 1469 HB2 27.2811 -3.1265 22.5317 H 92 LEU92 0.0287 1470 CG 25.1616 -3.0715 22.2031 C.3 92 LEU92 -0.0449 1471 HG 25.2095 -1.9969 22.0215 H 92 LEU92 0.0296 1472 CD1 25.2390 -3.7795 20.8467 C.3 92 LEU92 -0.0626 1473 HD11 24.4366 -3.4656 20.1835 H 92 LEU92 0.0232 1474 HD12 25.1724 -4.8621 20.9602 H 92 LEU92 0.0232 1475 HD13 26.1852 -3.5557 20.3597 H 92 LEU92 0.0232 1476 CD2 23.8195 -3.3714 22.8885 C.3 92 LEU92 -0.0626 1477 HD21 22.9868 -3.1291 22.2278 H 92 LEU92 0.0232 1478 HD22 23.6887 -2.7799 23.7948 H 92 LEU92 0.0232 1479 HD23 23.7356 -4.4242 23.1572 H 92 LEU92 0.0232 1480 N 27.6310 -4.1410 26.2370 N.am 93 PRO93 -0.2316 1481 CA 28.7900 -4.6410 27.0070 C.3 93 PRO93 0.0907 1482 HA 29.2261 -3.7735 27.5037 H 93 PRO93 0.0559 1483 C 29.8770 -5.3510 26.1790 C.2 93 PRO93 0.2189 1484 O 31.0790 -5.1390 26.4540 O.2 93 PRO93 -0.2778 1485 CB 28.1772 -5.6150 28.0224 C.3 93 PRO93 -0.0276 1486 HB1 28.7266 -5.6349 28.9639 H 93 PRO93 0.0285 1487 HB2 28.1628 -6.6342 27.6317 H 93 PRO93 0.0285 1488 CG 26.7401 -5.1478 28.1920 C.3 93 PRO93 -0.0379 1489 HG1 26.7032 -4.3664 28.9519 H 93 PRO93 0.0278 1490 HG2 26.0679 -5.9468 28.5062 H 93 PRO93 0.0278 1491 CD 26.3577 -4.5552 26.8376 C.3 93 PRO93 0.0071 1492 HD1 25.8958 -5.2897 26.1755 H 93 PRO93 0.0431 1493 HD2 25.7108 -3.6902 26.9853 H 93 PRO93 0.0431 1494 N 29.4560 -6.1860 25.2110 N.am 94 MET94 -0.2456 1495 H 28.4540 -6.2720 25.0390 H 94 MET94 0.1312 1496 CA 30.3850 -6.9780 24.3930 C.3 94 MET94 0.0885 1497 HA 31.1077 -7.4356 25.0711 H 94 MET94 0.0557 1498 C 31.1380 -6.0770 23.4200 C.2 94 MET94 0.2187 1499 O 32.1710 -6.4750 22.8610 O.2 94 MET94 -0.2778 1500 CB 29.6023 -8.0558 23.6256 C.3 94 MET94 -0.0199 1501 HB1 30.2989 -8.6472 23.0307 H 94 MET94 0.0293 1502 HB2 28.9136 -7.5824 22.9242 H 94 MET94 0.0293 1503 CG 28.8094 -9.0041 24.5351 C.3 94 MET94 -0.0047 1504 HG1 28.0716 -8.4576 25.1230 H 94 MET94 0.0377 1505 HG2 29.4673 -9.4972 25.2517 H 94 MET94 0.0377 1506 SD 27.9521 -10.2579 23.5627 S.3 94 MET94 -0.1641 1507 CE 27.1090 -11.1373 24.8912 C.3 94 MET94 -0.0181 1508 HE1 26.2044 -11.6117 24.5091 H 94 MET94 0.0340 1509 HE2 26.8075 -10.4447 25.6768 H 94 MET94 0.0340 1510 HE3 27.7594 -11.8981 25.3227 H 94 MET94 0.0340 1511 N 30.6140 -4.8610 23.2400 N.am 95 PHE95 -0.2453 1512 H 29.7440 -4.6330 23.7220 H 95 PHE95 0.1312 1513 CA 31.2240 -3.8420 22.3880 C.3 95 PHE95 0.0917 1514 HA 31.7295 -4.3656 21.5739 H 95 PHE95 0.0560 1515 C 32.2440 -3.0120 23.0870 C.2 95 PHE95 0.2191 1516 O 33.3020 -2.7890 22.5450 O.2 95 PHE95 -0.2778 1517 CB 30.1438 -2.9220 21.7945 C.3 95 PHE95 -0.0036 1518 HB1 29.6582 -2.3423 22.5759 H 95 PHE95 0.0333 1519 HB2 29.3579 -3.5072 21.3238 H 95 PHE95 0.0333 1520 CG 30.7223 -1.9742 20.7781 C.ar 95 PHE95 -0.0454 1521 CD1 30.9713 -2.4029 19.4793 C.ar 95 PHE95 -0.0585 1522 HD1 30.7204 -3.4111 19.1829 H 95 PHE95 0.0620 1523 CD2 31.0749 -0.6779 21.1444 C.ar 95 PHE95 -0.0585 1524 HD2 30.9128 -0.3426 22.1589 H 95 PHE95 0.0620 1525 CE1 31.5505 -1.5439 18.5577 C.ar 95 PHE95 -0.0615 1526 HE1 31.7294 -1.8839 17.5511 H 95 PHE95 0.0618 1527 CE2 31.6594 0.1809 20.2250 C.ar 95 PHE95 -0.0615 1528 HE2 31.9445 1.1790 20.5228 H 95 PHE95 0.0618 1529 CZ 31.8967 -0.2534 18.9297 C.ar 95 PHE95 -0.0617 1530 HZ 32.3664 0.4073 18.2183 H 95 PHE95 0.0618 1531 N 31.8970 -2.5120 24.2650 N.am 96 SER96 -0.2436 1532 H 31.0070 -2.7840 24.6820 H 96 SER96 0.1312 1533 CA 32.7640 -1.5830 24.9720 C.3 96 SER96 0.1109 1534 HA 33.1271 -0.8559 24.2453 H 96 SER96 0.0580 1535 C 33.9880 -2.2870 25.5840 C.2 96 SER96 0.2209 1536 O 34.9690 -1.6460 25.9070 O.2 96 SER96 -0.2777 1537 CB 31.9697 -0.8470 26.0512 C.3 96 SER96 0.0681 1538 HB1 32.6471 -0.3519 26.7547 H 96 SER96 0.0577 1539 HB2 31.3572 -1.5657 26.6099 H 96 SER96 0.0577 1540 OG 31.1751 0.1402 25.4108 O.3 96 SER96 -0.3930 1541 HG 30.5262 0.5012 26.0095 H 96 SER96 0.2095 1542 N 33.9240 -3.6100 25.7340 N.am 97 GLU97 -0.2456 1543 H 33.0800 -4.1010 25.4380 H 97 GLU97 0.1312 1544 CA 35.0340 -4.3850 26.3140 C.3 97 GLU97 0.0883 1545 HA 35.4163 -3.9123 27.2193 H 97 GLU97 0.0557 1546 C 36.1360 -4.5710 25.2630 C.2 97 GLU97 0.2187 1547 O 37.2170 -5.0710 25.5320 O.2 97 GLU97 -0.2778 1548 CB 34.5974 -5.8652 26.4937 C.3 97 GLU97 -0.0193 1549 HB1 35.4851 -6.5066 26.5134 H 97 GLU97 0.0290 1550 HB2 34.0411 -6.1646 25.6010 H 97 GLU97 0.0290 1551 CG 33.8050 -6.3037 27.7309 C.3 97 GLU97 0.0356 1552 HG1 32.8256 -5.8413 27.7990 H 97 GLU97 0.0374 1553 HG2 34.3472 -6.0774 28.6486 H 97 GLU97 0.0374 1554 CD 33.6650 -7.8362 27.5804 C.2 97 GLU97 0.1760 1555 OE1 34.4724 -8.5781 28.1350 O.co2 97 GLU97 -0.6478 1556 OE2 32.7801 -8.3117 26.8716 O.co2 97 GLU97 -0.6478 1557 N 35.8270 -4.1510 24.0510 N.am 98 LEU98 -0.2456 1558 H 34.9650 -3.6180 23.9330 H 98 LEU98 0.1312 1559 CA 36.6370 -4.4010 22.8810 C.3 98 LEU98 0.0883 1560 HA 37.0729 -5.3877 23.0144 H 98 LEU98 0.0557 1561 C 37.7010 -3.3220 22.7720 C.2 98 LEU98 0.2214 1562 O 37.4450 -2.2030 23.1790 O.2 98 LEU98 -0.2776 1563 CB 35.6328 -4.3891 21.7071 C.3 98 LEU98 -0.0266 1564 HB1 35.4720 -3.3629 21.3744 H 98 LEU98 0.0287 1565 HB2 34.6646 -4.7320 22.0745 H 98 LEU98 0.0287 1566 CG 35.9535 -5.2802 20.5011 C.3 98 LEU98 -0.0449 1567 HG 36.9189 -4.9934 20.1029 H 98 LEU98 0.0296 1568 CD1 35.9987 -6.7699 20.8706 C.3 98 LEU98 -0.0626 1569 HD11 36.1282 -7.3807 19.9785 H 98 LEU98 0.0232 1570 HD12 35.0751 -7.0862 21.3561 H 98 LEU98 0.0232 1571 HD13 36.8293 -6.9959 21.5383 H 98 LEU98 0.0232 1572 CD2 34.9235 -5.0401 19.3918 C.3 98 LEU98 -0.0626 1573 HD21 35.1635 -5.6282 18.5068 H 98 LEU98 0.0232 1574 HD22 34.9089 -3.9907 19.0944 H 98 LEU98 0.0232 1575 HD23 33.9183 -5.3119 19.7151 H 98 LEU98 0.0232 1576 N 38.8800 -3.6490 22.2160 N.am 99 PRO99 -0.2316 1577 CA 39.9260 -2.6450 21.9460 C.3 99 PRO99 0.0907 1578 HA 40.3246 -2.3223 22.9080 H 99 PRO99 0.0559 1579 C 39.3490 -1.4950 21.1760 C.2 99 PRO99 0.2189 1580 O 38.5600 -1.7020 20.2550 O.2 99 PRO99 -0.2778 1581 CB 40.9587 -3.4091 21.1103 C.3 99 PRO99 -0.0276 1582 HB1 41.9735 -3.0361 21.2504 H 99 PRO99 0.0285 1583 HB2 40.7304 -3.3442 20.0436 H 99 PRO99 0.0285 1584 CG 40.7897 -4.8576 21.5454 C.3 99 PRO99 -0.0379 1585 HG1 41.3644 -5.0316 22.4550 H 99 PRO99 0.0278 1586 HG2 41.1443 -5.5546 20.7869 H 99 PRO99 0.0278 1587 CD 39.2951 -5.0041 21.8459 C.3 99 PRO99 0.0071 1588 HD1 38.7467 -5.3048 20.9588 H 99 PRO99 0.0431 1589 HD2 39.1185 -5.6976 22.6674 H 99 PRO99 0.0431 1590 N 39.7210 -0.2900 21.5610 N.am 100 CAS100 -0.2449 1591 H 40.3460 -0.1890 22.3600 H 100 CAS100 0.1312 1592 CA 39.2570 0.8890 20.8690 C.3 100 CAS100 0.0965 1593 HA 38.2005 1.0078 21.1108 H 100 CAS100 0.0565 1594 CB 40.0697 2.0948 21.3579 C.3 100 CAS100 0.0147 1595 HB1 41.1340 1.9372 21.1655 H 100 CAS100 0.0394 1596 HB2 39.9640 2.1870 22.4382 H 100 CAS100 0.0394 1597 C 39.4030 0.7720 19.3530 C.2 100 CAS100 0.2195 1598 O 38.5080 1.1940 18.6240 O.2 100 CAS100 -0.2778 1599 SG 39.5739 3.6624 20.5943 S.3 100 CAS100 -0.1762 1600 HG 40.1431 3.7297 19.3863 H 100 CAS100 0.1017 1601 N 40.5390 0.2060 18.8940 N.am 101 GLU101 -0.2456 1602 H 41.2400 -0.0780 19.5780 H 101 GLU101 0.1312 1603 CA 40.8320 -0.0280 17.4720 C.3 101 GLU101 0.0883 1604 HA 40.8663 0.9494 16.9905 H 101 GLU101 0.0557 1605 C 39.7290 -0.8510 16.8210 C.2 101 GLU101 0.2187 1606 O 39.2390 -0.5100 15.7590 O.2 101 GLU101 -0.2778 1607 CB 42.1999 -0.7296 17.3837 C.3 101 GLU101 -0.0193 1608 HB1 42.3353 -1.1479 16.3857 H 101 GLU101 0.0290 1609 HB2 42.2152 -1.5768 18.0711 H 101 GLU101 0.0290 1610 CG 43.4011 0.1938 17.6791 C.3 101 GLU101 0.0356 1611 HG1 43.4627 0.9757 16.9227 H 101 GLU101 0.0374 1612 HG2 44.3290 -0.3732 17.6215 H 101 GLU101 0.0374 1613 CD 43.3480 0.8591 19.0660 C.2 101 GLU101 0.1760 1614 OE1 43.2466 2.0825 19.1293 O.co2 101 GLU101 -0.6478 1615 OE2 43.4007 0.1482 20.0677 O.co2 101 GLU101 -0.6478 1616 N 39.3270 -1.9250 17.4790 N.am 102 ASP102 -0.2451 1617 H 39.8020 -2.1790 18.3450 H 102 ASP102 0.1312 1618 CA 38.2340 -2.7550 17.0120 C.3 102 ASP102 0.0974 1619 HA 38.4743 -3.0791 15.9989 H 102 ASP102 0.0563 1620 C 36.9020 -2.0430 16.9750 C.2 102 ASP102 0.2192 1621 O 36.0870 -2.2910 16.0840 O.2 102 ASP102 -0.2778 1622 CB 38.0520 -3.9713 17.9546 C.3 102 ASP102 0.0576 1623 HB1 37.0311 -4.3446 17.9061 H 102 ASP102 0.0394 1624 HB2 38.2319 -3.6792 18.9861 H 102 ASP102 0.0394 1625 CG 38.9039 -5.2072 17.6413 C.2 102 ASP102 0.1780 1626 OD1 39.0473 -5.5425 16.4750 O.co2 102 ASP102 -0.6478 1627 OD2 39.4057 -5.8424 18.5661 O.co2 102 ASP102 -0.6478 1628 N 36.6750 -1.1800 17.9620 N.am 103 GLN103 -0.2456 1629 H 37.4000 -1.0330 18.6640 H 103 GLN103 0.1312 1630 CA 35.4210 -0.4350 18.0740 C.3 103 GLN103 0.0882 1631 HA 34.6221 -1.1779 18.0560 H 103 GLN103 0.0557 1632 C 35.1820 0.5230 16.8940 C.2 103 GLN103 0.2187 1633 O 34.0970 0.5350 16.3490 O.2 103 GLN103 -0.2778 1634 CB 35.3577 0.3579 19.3910 C.3 103 GLN103 -0.0210 1635 HB1 34.4898 1.0180 19.3517 H 103 GLN103 0.0289 1636 HB2 36.2236 1.0133 19.4794 H 103 GLN103 0.0289 1637 CG 35.2467 -0.5269 20.6435 C.3 103 GLN103 0.0225 1638 HG1 36.1738 -1.0745 20.8131 H 103 GLN103 0.0356 1639 HG2 34.4515 -1.2629 20.5261 H 103 GLN103 0.0356 1640 CD 34.9211 0.3264 21.8830 C.2 103 GLN103 0.1981 1641 OE1 34.3090 1.3846 21.8028 O.2 103 GLN103 -0.2798 1642 NE2 35.3665 -0.1940 23.0319 N.am 103 GLN103 -0.2724 1643 HE21 35.2269 0.2834 23.8975 H 103 GLN103 0.1266 1644 HE22 35.8452 -1.0709 23.0411 H 103 GLN103 0.1266 1645 N 36.2020 1.2760 16.4820 N.am 104 ILE104 -0.2454 1646 H 37.0760 1.2400 17.0070 H 104 ILE104 0.1312 1647 CA 36.1280 2.1500 15.3160 C.3 104 ILE104 0.0903 1648 HA 35.2950 2.8339 15.4841 H 104 ILE104 0.0560 1649 C 35.8530 1.3670 14.0380 C.2 104 ILE104 0.2189 1650 O 34.9290 1.7240 13.2720 O.2 104 ILE104 -0.2778 1651 CB 37.4595 2.9347 15.2284 C.3 104 ILE104 -0.0201 1652 HB 38.2655 2.2009 15.1602 H 104 ILE104 0.0318 1653 CG1 37.7113 3.7776 16.4988 C.3 104 ILE104 -0.0514 1654 HG11 37.4558 3.2169 17.3971 H 104 ILE104 0.0266 1655 HG12 37.0576 4.6502 16.5003 H 104 ILE104 0.0266 1656 CG2 37.5210 3.8254 13.9744 C.3 104 ILE104 -0.0605 1657 HG21 38.4598 4.3752 13.9198 H 104 ILE104 0.0233 1658 HG22 36.7093 4.5534 13.9723 H 104 ILE104 0.0233 1659 HG23 37.4476 3.2377 13.0596 H 104 ILE104 0.0233 1660 CD1 39.1720 4.2184 16.6523 C.3 104 ILE104 -0.0650 1661 HD11 39.3129 4.7691 17.5826 H 104 ILE104 0.0230 1662 HD12 39.4904 4.8656 15.8360 H 104 ILE104 0.0230 1663 HD13 39.8385 3.3552 16.6804 H 104 ILE104 0.0230 1664 N 36.6440 0.3040 13.8140 N.am 105 ILE105 -0.2454 1665 H 37.4120 0.1090 14.4560 H 105 ILE105 0.1312 1666 CA 36.4260 -0.5750 12.6730 C.3 105 ILE105 0.0903 1667 HA 36.5890 0.0372 11.7853 H 105 ILE105 0.0560 1668 C 34.9680 -1.0840 12.6130 C.2 105 ILE105 0.2189 1669 O 34.2710 -0.9180 11.5960 O.2 105 ILE105 -0.2778 1670 CB 37.4475 -1.7317 12.6900 C.3 105 ILE105 -0.0201 1671 HB 37.3375 -2.2563 13.6408 H 105 ILE105 0.0318 1672 CG1 38.8880 -1.1884 12.6129 C.3 105 ILE105 -0.0514 1673 HG11 39.0268 -0.3566 13.3016 H 105 ILE105 0.0266 1674 HG12 39.0784 -0.7849 11.6183 H 105 ILE105 0.0266 1675 CG2 37.1938 -2.7365 11.5462 C.3 105 ILE105 -0.0605 1676 HG21 37.9098 -3.5569 11.5639 H 105 ILE105 0.0233 1677 HG22 37.2732 -2.2528 10.5728 H 105 ILE105 0.0233 1678 HG23 36.2049 -3.1897 11.6129 H 105 ILE105 0.0233 1679 CD1 39.9414 -2.2445 12.9493 C.3 105 ILE105 -0.0650 1680 HD11 40.9434 -1.8161 12.9313 H 105 ILE105 0.0230 1681 HD12 39.9186 -3.0610 12.2308 H 105 ILE105 0.0230 1682 HD13 39.7812 -2.6636 13.9435 H 105 ILE105 0.0230 1683 N 34.4940 -1.6540 13.7140 N.am 106 LEU106 -0.2456 1684 H 35.1090 -1.7700 14.5190 H 106 LEU106 0.1312 1685 CA 33.1210 -2.1150 13.7970 C.3 106 LEU106 0.0880 1686 HA 33.0107 -2.8407 12.9925 H 106 LEU106 0.0557 1687 C 32.0920 -1.0400 13.4780 C.2 106 LEU106 0.2187 1688 O 31.1390 -1.3340 12.7790 O.2 106 LEU106 -0.2778 1689 CB 32.8357 -2.8111 15.1353 C.3 106 LEU106 -0.0266 1690 HB1 31.7590 -2.9577 15.2405 H 106 LEU106 0.0287 1691 HB2 33.1401 -2.1448 15.9421 H 106 LEU106 0.0287 1692 CG 33.5216 -4.1819 15.3252 C.3 106 LEU106 -0.0449 1693 HG 34.5946 -4.0279 15.4295 H 106 LEU106 0.0296 1694 CD1 33.0168 -4.8335 16.6184 C.3 106 LEU106 -0.0626 1695 HD11 33.5386 -5.7696 16.8150 H 106 LEU106 0.0232 1696 HD12 31.9506 -5.0550 16.5577 H 106 LEU106 0.0232 1697 HD13 33.1706 -4.1751 17.4728 H 106 LEU106 0.0232 1698 CD2 33.3231 -5.1432 14.1420 C.3 106 LEU106 -0.0626 1699 HD21 33.7153 -6.1328 14.3758 H 106 LEU106 0.0232 1700 HD22 33.8532 -4.8045 13.2524 H 106 LEU106 0.0232 1701 HD23 32.2701 -5.2594 13.8889 H 106 LEU106 0.0232 1702 N 32.2840 0.1900 13.9610 N.am 107 LEU107 -0.2456 1703 H 33.1200 0.3900 14.5100 H 107 LEU107 0.1312 1704 CA 31.3120 1.2530 13.7140 C.3 107 LEU107 0.0880 1705 HA 30.3199 0.8334 13.8869 H 107 LEU107 0.0557 1706 C 31.3340 1.7510 12.2780 C.2 107 LEU107 0.2187 1707 O 30.2810 1.9020 11.6590 O.2 107 LEU107 -0.2778 1708 CB 31.5872 2.4030 14.6972 C.3 107 LEU107 -0.0266 1709 HB1 31.1520 3.3380 14.3398 H 107 LEU107 0.0287 1710 HB2 32.6644 2.5736 14.7420 H 107 LEU107 0.0287 1711 CG 31.0385 2.1137 16.1041 C.3 107 LEU107 -0.0449 1712 HG 31.2554 1.0743 16.3518 H 107 LEU107 0.0296 1713 CD1 31.7282 2.9867 17.1607 C.3 107 LEU107 -0.0626 1714 HD11 31.3258 2.7915 18.1552 H 107 LEU107 0.0232 1715 HD12 31.5985 4.0467 16.9488 H 107 LEU107 0.0232 1716 HD13 32.7994 2.7843 17.1937 H 107 LEU107 0.0232 1717 CD2 29.5152 2.3041 16.1474 C.3 107 LEU107 -0.0626 1718 HD21 29.1326 2.1374 17.1508 H 107 LEU107 0.0232 1719 HD22 29.0004 1.6079 15.4857 H 107 LEU107 0.0232 1720 HD23 29.2329 3.3144 15.8506 H 107 LEU107 0.0232 1721 N 32.5360 1.9780 11.7470 N.am 108 LYS108 -0.2457 1722 H 33.3570 1.9370 12.3500 H 108 LYS108 0.1312 1723 CA 32.7140 2.2810 10.3390 C.3 108 LYS108 0.0878 1724 HA 32.1513 3.1970 10.1480 H 108 LYS108 0.0557 1725 C 32.0400 1.1770 9.5460 C.2 108 LYS108 0.2185 1726 O 31.1510 1.4340 8.7400 O.2 108 LYS108 -0.2778 1727 CB 34.1856 2.5001 9.9550 C.3 108 LYS108 -0.0289 1728 HB1 34.2402 2.6513 8.8755 H 108 LYS108 0.0285 1729 HB2 34.7831 1.6150 10.1776 H 108 LYS108 0.0285 1730 CG 34.7781 3.7306 10.6571 C.3 108 LYS108 -0.0496 1731 HG1 35.0746 3.4684 11.6706 H 108 LYS108 0.0266 1732 HG2 34.0032 4.4886 10.7658 H 108 LYS108 0.0266 1733 CD 35.9652 4.3643 9.9182 C.3 108 LYS108 -0.0278 1734 HD1 35.6213 4.7592 8.9603 H 108 LYS108 0.0282 1735 HD2 36.7222 3.6118 9.6960 H 108 LYS108 0.0282 1736 CE 36.5765 5.4910 10.7575 C.3 108 LYS108 0.1103 1737 HE1 37.0938 5.0833 11.6243 H 108 LYS108 0.0559 1738 HE2 35.7784 6.1252 11.1476 H 108 LYS108 0.0559 1739 NZ 37.5131 6.3640 10.0595 N.4 108 LYS108 -0.0749 1740 HZ1 37.8896 7.0657 10.7399 H 108 LYS108 0.2742 1741 HZ2 37.0190 6.9548 9.3620 H 108 LYS108 0.2742 1742 HZ3 38.2910 5.8493 9.6164 H 108 LYS108 0.2742 1743 N 32.4150 -0.0620 9.8500 N.am 109 GLY109 -0.2485 1744 H 33.1410 -0.1930 10.5550 H 109 GLY109 0.1309 1745 CA 31.8380 -1.2340 9.2250 C.3 109 GLY109 0.0765 1746 HA1 32.0646 -2.0700 9.8831 H 109 GLY109 0.0521 1747 HA2 32.3501 -1.3834 8.2744 H 109 GLY109 0.0521 1748 C 30.3430 -1.1700 8.9910 C.2 109 GLY109 0.2156 1749 O 29.8840 -1.4590 7.8770 O.2 109 GLY109 -0.2781 1750 N 29.5770 -0.7720 10.0120 N.am 110 CYS110 -0.2451 1751 H 30.0060 -0.2810 10.7960 H 110 CYS110 0.1312 1752 CA 28.1350 -1.0270 10.0270 C.3 110 CYS110 0.0965 1753 HA 27.8573 -1.5488 9.1136 H 110 CYS110 0.0565 1754 C 27.2610 0.2410 10.1010 C.2 110 CYS110 0.2195 1755 O 26.0160 0.1740 10.1310 O.2 110 CYS110 -0.2778 1756 CB 27.7952 -1.9001 11.2407 C.3 110 CYS110 0.0147 1757 HB1 28.3956 -2.8096 11.2332 H 110 CYS110 0.0394 1758 HB2 26.7543 -2.2233 11.1856 H 110 CYS110 0.0394 1759 SG 28.0482 -1.0311 12.8125 S.3 110 CYS110 -0.1762 1760 HG 27.4806 -1.7230 13.8022 H 110 CYS110 0.1017 1761 N 27.9060 1.3890 10.1430 N.am 111 CYS111 -0.2448 1762 H 28.9090 1.4240 9.9620 H 111 CYS111 0.1312 1763 CA 27.1830 2.5860 10.4460 C.3 111 CYS111 0.0965 1764 HA 26.7830 2.4704 11.4527 H 111 CYS111 0.0565 1765 C 26.0020 2.8000 9.4770 C.2 111 CYS111 0.2195 1766 O 24.8570 3.0440 9.9010 O.2 111 CYS111 -0.2778 1767 CB 28.1158 3.8069 10.3879 C.3 111 CYS111 0.0147 1768 HB1 28.6114 3.8552 9.4177 H 111 CYS111 0.0394 1769 HB2 28.9059 3.7098 11.1281 H 111 CYS111 0.0394 1770 SG 27.2772 5.3860 10.6912 S.3 111 CYS111 -0.1762 1771 HG 28.1366 6.3908 10.5012 H 111 CYS111 0.1017 1772 N 26.2860 2.7310 8.1780 N.am 112 MET112 -0.2456 1773 H 27.2460 2.5420 7.8900 H 112 MET112 0.1312 1774 CA 25.2660 2.9180 7.1600 C.3 112 MET112 0.0885 1775 HA 24.7935 3.8800 7.3633 H 112 MET112 0.0557 1776 C 24.2180 1.8530 7.2310 C.2 112 MET112 0.2187 1777 O 23.0390 2.1270 7.0710 O.2 112 MET112 -0.2778 1778 CB 25.8944 2.9278 5.7567 C.3 112 MET112 -0.0199 1779 HB1 26.4545 2.0062 5.5913 H 112 MET112 0.0293 1780 HB2 26.6193 3.7368 5.6916 H 112 MET112 0.0293 1781 CG 24.8608 3.1062 4.6332 C.3 112 MET112 -0.0047 1782 HG1 24.1751 2.2607 4.5801 H 112 MET112 0.0377 1783 HG2 25.3623 3.1170 3.6717 H 112 MET112 0.0377 1784 SD 23.9211 4.6352 4.8288 S.3 112 MET112 -0.1641 1785 CE 22.9313 4.5724 3.3242 C.3 112 MET112 -0.0181 1786 HE1 21.9356 4.9622 3.5341 H 112 MET112 0.0340 1787 HE2 22.8182 3.5474 2.9697 H 112 MET112 0.0340 1788 HE3 23.3791 5.1852 2.5431 H 112 MET112 0.0340 1789 N 24.6550 0.6300 7.4660 N.am 113 GLU113 -0.2456 1790 H 25.6590 0.4580 7.5150 H 113 GLU113 0.1312 1791 CA 23.7310 -0.4770 7.6570 C.3 113 GLU113 0.0883 1792 HA 23.2050 -0.6234 6.7122 H 113 GLU113 0.0557 1793 C 22.7370 -0.1830 8.7440 C.2 113 GLU113 0.2187 1794 O 21.5550 -0.3970 8.5400 O.2 113 GLU113 -0.2778 1795 CB 24.5029 -1.7635 8.0618 C.3 113 GLU113 -0.0193 1796 HB1 23.8107 -2.6058 8.0523 H 113 GLU113 0.0290 1797 HB2 24.8444 -1.6772 9.0937 H 113 GLU113 0.0290 1798 CG 25.7243 -2.1324 7.1929 C.3 113 GLU113 0.0356 1799 HG1 26.4278 -1.3033 7.1375 H 113 GLU113 0.0374 1800 HG2 25.4078 -2.3537 6.1734 H 113 GLU113 0.0374 1801 CD 26.5142 -3.3501 7.7397 C.2 113 GLU113 0.1760 1802 OE1 26.4420 -3.6729 8.9202 O.co2 113 GLU113 -0.6478 1803 OE2 27.2236 -3.9943 6.9815 O.co2 113 GLU113 -0.6478 1804 N 23.1990 0.3380 9.8840 N.am 114 ILE114 -0.2454 1805 H 24.1950 0.5410 9.9640 H 114 ILE114 0.1312 1806 CA 22.3340 0.6250 11.0100 C.3 114 ILE114 0.0903 1807 HA 21.6589 -0.2251 11.1261 H 114 ILE114 0.0560 1808 C 21.4540 1.8760 10.7050 C.2 114 ILE114 0.2189 1809 O 20.2370 1.9140 10.9690 O.2 114 ILE114 -0.2778 1810 CB 23.1968 0.7730 12.2818 C.3 114 ILE114 -0.0201 1811 HB 23.9950 1.4871 12.0696 H 114 ILE114 0.0318 1812 CG1 23.8420 -0.5842 12.6431 C.3 114 ILE114 -0.0514 1813 HG11 24.3585 -0.9934 11.7740 H 114 ILE114 0.0266 1814 HG12 23.0655 -1.3082 12.8931 H 114 ILE114 0.0266 1815 CG2 22.3706 1.3211 13.4558 C.3 114 ILE114 -0.0605 1816 HG21 22.9624 1.4299 14.3631 H 114 ILE114 0.0233 1817 HG22 21.5408 0.6584 13.6691 H 114 ILE114 0.0233 1818 HG23 21.9417 2.2951 13.2279 H 114 ILE114 0.0233 1819 CD1 24.8547 -0.5107 13.7911 C.3 114 ILE114 -0.0650 1820 HD11 25.3367 -1.4780 13.9349 H 114 ILE114 0.0230 1821 HD12 24.3816 -0.2397 14.7343 H 114 ILE114 0.0230 1822 HD13 25.6347 0.2200 13.5769 H 114 ILE114 0.0230 1823 N 22.0600 2.8990 10.1420 N.am 115 MET115 -0.2456 1824 H 23.0670 2.8750 9.9820 H 115 MET115 0.1312 1825 CA 21.2900 4.0530 9.7530 C.3 115 MET115 0.0886 1826 HA 20.8403 4.4612 10.6592 H 115 MET115 0.0557 1827 C 20.1640 3.7360 8.7730 C.2 115 MET115 0.2188 1828 O 19.0760 4.3190 8.9040 O.2 115 MET115 -0.2778 1829 CB 22.2330 5.0927 9.1235 C.3 115 MET115 -0.0199 1830 HB1 21.6556 5.8771 8.6328 H 115 MET115 0.0293 1831 HB2 22.8213 4.6166 8.3384 H 115 MET115 0.0293 1832 CG 23.1730 5.7529 10.1408 C.3 115 MET115 -0.0047 1833 HG1 23.7136 5.0150 10.7288 H 115 MET115 0.0377 1834 HG2 22.6009 6.3453 10.8564 H 115 MET115 0.0377 1835 SD 24.3781 6.8156 9.3232 S.3 115 MET115 -0.1641 1836 CE 23.3419 8.2587 9.0305 C.3 115 MET115 -0.0181 1837 HE1 23.4697 8.5938 8.0017 H 115 MET115 0.0340 1838 HE2 23.6330 9.0726 9.6927 H 115 MET115 0.0340 1839 HE3 22.2891 8.0280 9.1782 H 115 MET115 0.0340 1840 N 20.4470 2.8410 7.8100 N.am 116 SER116 -0.2436 1841 H 21.3790 2.4260 7.8150 H 116 SER116 0.1312 1842 CA 19.5230 2.4110 6.7500 C.3 116 SER116 0.1109 1843 HA 19.1094 3.3100 6.2919 H 116 SER116 0.0580 1844 C 18.3770 1.6160 7.3560 C.2 116 SER116 0.2209 1845 O 17.1910 1.9530 7.1530 O.2 116 SER116 -0.2777 1846 CB 20.2765 1.5796 5.7008 C.3 116 SER116 0.0681 1847 HB1 19.5709 1.1362 4.9962 H 116 SER116 0.0577 1848 HB2 20.8153 0.7410 6.1579 H 116 SER116 0.0577 1849 OG 21.1679 2.3829 4.9472 O.3 116 SER116 -0.3930 1850 HG 21.7968 2.7945 5.5363 H 116 SER116 0.2095 1851 N 18.7060 0.6000 8.1420 N.am 117 LEU117 -0.2456 1852 H 19.6750 0.2830 8.1700 H 117 LEU117 0.1312 1853 CA 17.6920 -0.0870 8.9830 C.3 117 LEU117 0.0880 1854 HA 17.0397 -0.6314 8.3014 H 117 LEU117 0.0557 1855 C 16.8710 0.9000 9.7590 C.2 117 LEU117 0.2187 1856 O 15.6540 0.8750 9.7040 O.2 117 LEU117 -0.2778 1857 CB 18.4289 -1.0592 9.9248 C.3 117 LEU117 -0.0266 1858 HB1 19.1973 -0.5050 10.4659 H 117 LEU117 0.0287 1859 HB2 18.9693 -1.7954 9.3295 H 117 LEU117 0.0287 1860 CG 17.5303 -1.7901 10.9436 C.3 117 LEU117 -0.0449 1861 HG 16.9806 -1.0474 11.5224 H 117 LEU117 0.0296 1862 CD1 16.5073 -2.7094 10.2627 C.3 117 LEU117 -0.0626 1863 HD11 15.8493 -3.1727 10.9988 H 117 LEU117 0.0232 1864 HD12 17.0020 -3.5092 9.7128 H 117 LEU117 0.0232 1865 HD13 15.8783 -2.1623 9.5610 H 117 LEU117 0.0232 1866 CD2 18.3868 -2.5806 11.9374 C.3 117 LEU117 -0.0626 1867 HD21 17.7724 -3.0285 12.7182 H 117 LEU117 0.0232 1868 HD22 19.1186 -1.9340 12.4192 H 117 LEU117 0.0232 1869 HD23 18.9307 -3.3782 11.4342 H 117 LEU117 0.0232 1870 N 17.5250 1.7850 10.4880 N.am 118 ARG118 -0.2457 1871 H 18.5450 1.7920 10.5030 H 118 ARG118 0.1312 1872 CA 16.7600 2.7570 11.2750 C.3 118 ARG118 0.0879 1873 HA 16.1613 2.1903 11.9901 H 118 ARG118 0.0557 1874 C 15.8070 3.5560 10.4170 C.2 118 ARG118 0.2187 1875 O 14.7140 3.8750 10.8780 O.2 118 ARG118 -0.2778 1876 CB 17.7033 3.7104 12.0145 C.3 118 ARG118 -0.0258 1877 HB1 17.1516 4.5923 12.3478 H 118 ARG118 0.0286 1878 HB2 18.4687 4.0783 11.3312 H 118 ARG118 0.0286 1879 CG 18.3585 3.0815 13.2478 C.3 118 ARG118 -0.0154 1880 HG1 18.9527 2.2095 12.9779 H 118 ARG118 0.0299 1881 HG2 17.5885 2.7305 13.9353 H 118 ARG118 0.0299 1882 CD 19.2292 4.1221 13.9422 C.3 118 ARG118 0.1045 1883 HD1 18.6107 4.9716 14.2386 H 118 ARG118 0.0711 1884 HD2 20.0223 4.4613 13.2691 H 118 ARG118 0.0711 1885 NE 19.8299 3.5828 15.1545 N.pl3 118 ARG118 -0.4450 1886 HE 19.5874 2.6597 15.4537 H 118 ARG118 0.3153 1887 CZ 20.6955 4.2820 15.8737 C.cat 118 ARG118 0.5062 1888 NH1 21.0877 5.4670 15.4871 N.pl3 118 ARG118 -0.4573 1889 HH11 21.7858 5.9706 15.9822 H 118 ARG118 0.3114 1890 HH12 20.6804 5.8789 14.6614 H 118 ARG118 0.3114 1891 NH2 21.1554 3.7678 16.9807 N.pl3 118 ARG118 -0.4573 1892 HH21 21.7893 4.2753 17.5585 H 118 ARG118 0.3114 1893 HH22 20.8582 2.8534 17.2471 H 118 ARG118 0.3114 1894 N 16.1780 3.8600 9.1770 N.am 119 ALA119 -0.2459 1895 H 17.0890 3.5760 8.8170 H 119 ALA119 0.1312 1896 CA 15.2420 4.6120 8.3480 C.3 119 ALA119 0.0850 1897 HA 14.7472 5.3729 8.9553 H 119 ALA119 0.0554 1898 C 14.2130 3.6650 7.8170 C.2 119 ALA119 0.2184 1899 O 13.0110 3.9640 7.8340 O.2 119 ALA119 -0.2778 1900 CB 16.0101 5.2841 7.2039 C.3 119 ALA119 -0.0411 1901 HB1 15.3394 5.8261 6.5367 H 119 ALA119 0.0249 1902 HB2 16.5654 4.5584 6.6082 H 119 ALA119 0.0249 1903 HB3 16.7246 6.0034 7.6006 H 119 ALA119 0.0249 1904 N 14.7030 2.5080 7.3700 N.am 120 ALA120 -0.2459 1905 H 15.7090 2.3480 7.4180 H 120 ALA120 0.1312 1906 CA 13.8480 1.4630 6.8150 C.3 120 ALA120 0.0850 1907 HA 13.4778 1.8470 5.8639 H 120 ALA120 0.0554 1908 C 12.6630 1.2030 7.7000 C.2 120 ALA120 0.2184 1909 O 11.5550 1.2480 7.2330 O.2 120 ALA120 -0.2778 1910 CB 14.6576 0.1857 6.5619 C.3 120 ALA120 -0.0411 1911 HB1 14.0627 -0.5535 6.0273 H 120 ALA120 0.0249 1912 HB2 14.9956 -0.2687 7.4918 H 120 ALA120 0.0249 1913 HB3 15.5343 0.3943 5.9490 H 120 ALA120 0.0249 1914 N 12.8770 0.9760 8.9860 N.am 121 VAL121 -0.2454 1915 H 13.8250 1.0300 9.3580 H 121 VAL121 0.1312 1916 CA 11.7540 0.6450 9.8890 C.3 121 VAL121 0.0901 1917 HA 11.1500 -0.1018 9.3693 H 121 VAL121 0.0560 1918 C 10.8210 1.8100 10.1980 C.2 121 VAL121 0.2189 1919 O 9.7450 1.6290 10.7620 O.2 121 VAL121 -0.2778 1920 CB 12.3069 0.0061 11.1815 C.3 121 VAL121 -0.0227 1921 HB 11.4553 -0.3093 11.7870 H 121 VAL121 0.0315 1922 CG1 13.1203 -1.2586 10.8671 C.3 121 VAL121 -0.0608 1923 HG11 13.4458 -1.7519 11.7814 H 121 VAL121 0.0233 1924 HG12 14.0125 -1.0288 10.2865 H 121 VAL121 0.0233 1925 HG13 12.5274 -1.9742 10.2971 H 121 VAL121 0.0233 1926 CG2 13.1335 0.9859 12.0308 C.3 121 VAL121 -0.0608 1927 HG21 13.5127 0.4977 12.9287 H 121 VAL121 0.0233 1928 HG22 12.5350 1.8379 12.3522 H 121 VAL121 0.0233 1929 HG23 13.9876 1.3712 11.4778 H 121 VAL121 0.0233 1930 N 11.2730 3.0160 9.8590 N.am 122 ARG122 -0.2456 1931 H 12.2030 3.0890 9.4460 H 122 ARG122 0.1312 1932 CA 10.5060 4.2230 10.0500 C.3 122 ARG122 0.0879 1933 HA 9.7605 4.0345 10.8250 H 122 ARG122 0.0557 1934 C 9.7070 4.5330 8.7970 C.2 122 ARG122 0.2187 1935 O 9.0010 5.5340 8.7620 O.2 122 ARG122 -0.2778 1936 CB 11.4066 5.3666 10.5153 C.3 122 ARG122 -0.0258 1937 HB1 10.8094 6.2768 10.5355 H 122 ARG122 0.0286 1938 HB2 12.2238 5.5299 9.8113 H 122 ARG122 0.0286 1939 CG 11.9416 5.1005 11.9303 C.3 122 ARG122 -0.0154 1940 HG1 12.5750 4.2150 11.9361 H 122 ARG122 0.0299 1941 HG2 11.0974 4.8559 12.5731 H 122 ARG122 0.0299 1942 CD 12.7125 6.2952 12.5059 C.3 122 ARG122 0.1045 1943 HD1 12.1409 7.2230 12.4282 H 122 ARG122 0.0711 1944 HD2 13.6465 6.4420 11.9572 H 122 ARG122 0.0711 1945 NE 13.0619 6.0862 13.9149 N.pl3 122 ARG122 -0.4450 1946 HE 14.0106 5.8954 14.1675 H 122 ARG122 0.3153 1947 CZ 12.1908 6.1289 14.9224 C.cat 122 ARG122 0.5062 1948 NH1 10.9095 6.2806 14.7253 N.pl3 122 ARG122 -0.4573 1949 HH11 10.2912 6.3117 15.5072 H 122 ARG122 0.3114 1950 HH12 10.5582 6.3531 13.7957 H 122 ARG122 0.3114 1951 NH2 12.6213 6.0174 16.1432 N.pl3 122 ARG122 -0.4573 1952 HH21 11.9819 6.0497 16.9121 H 122 ARG122 0.3114 1953 HH22 13.5982 5.8972 16.3181 H 122 ARG122 0.3114 1954 N 9.8110 3.6640 7.7840 N.am 123 TYR123 -0.2453 1955 H 10.4840 2.9010 7.8550 H 123 TYR123 0.1312 1956 CA 8.9940 3.7740 6.5850 C.3 123 TYR123 0.0917 1957 HA 9.2814 4.7064 6.1013 H 123 TYR123 0.0560 1958 C 7.5500 3.8570 6.9810 C.2 123 TYR123 0.2190 1959 O 7.0930 3.1610 7.9080 O.2 123 TYR123 -0.2778 1960 CB 9.2452 2.5704 5.6604 C.3 123 TYR123 -0.0036 1961 HB1 9.0389 1.6389 6.1903 H 123 TYR123 0.0333 1962 HB2 10.2905 2.5195 5.3643 H 123 TYR123 0.0333 1963 CG 8.3902 2.6554 4.4250 C.ar 123 TYR123 -0.0453 1964 CD1 8.5993 3.6626 3.4876 C.ar 123 TYR123 -0.0561 1965 HD1 9.4288 4.3460 3.6003 H 123 TYR123 0.0621 1966 CD2 7.2892 1.8192 4.2878 C.ar 123 TYR123 -0.0561 1967 HD2 7.1062 1.0615 5.0345 H 123 TYR123 0.0621 1968 CE1 7.7027 3.8465 2.4445 C.ar 123 TYR123 -0.0317 1969 HE1 7.8522 4.6526 1.7422 H 123 TYR123 0.0643 1970 CE2 6.4036 1.9872 3.2341 C.ar 123 TYR123 -0.0317 1971 HE2 5.5394 1.3478 3.1422 H 123 TYR123 0.0643 1972 CZ 6.6039 3.0088 2.3203 C.ar 123 TYR123 0.0726 1973 OH 5.7125 3.1756 1.2823 O.3 123 TYR123 -0.3598 1974 HH 5.7056 4.0933 1.0208 H 123 TYR123 0.2173 1975 N 6.8370 4.7280 6.2790 N.am 124 ASP124 -0.2451 1976 H 7.2700 5.2150 5.4940 H 124 ASP124 0.1312 1977 CA 5.4560 4.9980 6.6080 C.3 124 ASP124 0.0977 1978 HA 5.1047 4.4144 7.4546 H 124 ASP124 0.0563 1979 C 4.6230 4.9120 5.3390 C.2 124 ASP124 0.2219 1980 O 4.7770 5.7370 4.4460 O.2 124 ASP124 -0.2776 1981 CB 5.3996 6.5274 7.0075 C.3 124 ASP124 0.0576 1982 HB1 4.3628 6.8640 6.9960 H 124 ASP124 0.0394 1983 HB2 5.9049 7.0836 6.2199 H 124 ASP124 0.0394 1984 CG 5.9795 7.0964 8.3590 C.2 124 ASP124 0.1780 1985 OD1 5.7820 6.5175 9.4219 O.co2 124 ASP124 -0.6478 1986 OD2 6.6193 8.1607 8.3623 O.co2 124 ASP124 -0.6478 1987 N 3.7470 3.9110 5.2610 N.am 125 PRO125 -0.2316 1988 CA 3.0840 3.5960 4.0020 C.3 125 PRO125 0.0907 1989 HA 3.8582 3.4404 3.2506 H 125 PRO125 0.0559 1990 C 2.1110 4.6870 3.5250 C.2 125 PRO125 0.2189 1991 O 2.0770 4.9130 2.3360 O.2 125 PRO125 -0.2778 1992 CB 2.3066 2.3019 4.2971 C.3 125 PRO125 -0.0276 1993 HB1 2.3656 1.5918 3.4723 H 125 PRO125 0.0285 1994 HB2 1.2481 2.5020 4.4748 H 125 PRO125 0.0285 1995 CG 2.9056 1.7464 5.5826 C.3 125 PRO125 -0.0379 1996 HG1 3.7375 1.0866 5.3330 H 125 PRO125 0.0278 1997 HG2 2.1906 1.1719 6.1715 H 125 PRO125 0.0278 1998 CD 3.4425 2.9619 6.3334 C.3 125 PRO125 0.0071 1999 HD1 2.7067 3.4279 6.9906 H 125 PRO125 0.0431 2000 HD2 4.3373 2.6700 6.8828 H 125 PRO125 0.0431 2001 N 1.3620 5.3480 4.3900 N.am 126 GLU126 -0.2456 2002 H 1.4580 5.1730 5.3900 H 126 GLU126 0.1312 2003 CA 0.3940 6.3320 3.9040 C.3 126 GLU126 0.0883 2004 HA -0.1954 5.8532 3.1200 H 126 GLU126 0.0557 2005 C 1.0840 7.5620 3.3050 C.2 126 GLU126 0.2187 2006 O 0.5990 8.1100 2.3180 O.2 126 GLU126 -0.2778 2007 CB -0.5266 6.7244 5.0675 C.3 126 GLU126 -0.0193 2008 HB1 0.0475 7.2153 5.8549 H 126 GLU126 0.0290 2009 HB2 -0.9289 5.8128 5.5118 H 126 GLU126 0.0290 2010 CG -1.6949 7.6249 4.6375 C.3 126 GLU126 0.0356 2011 HG1 -2.2543 7.1698 3.8213 H 126 GLU126 0.0374 2012 HG2 -1.3383 8.5927 4.2861 H 126 GLU126 0.0374 2013 CD -2.6547 7.8448 5.8098 C.2 126 GLU126 0.1760 2014 OE1 -3.4402 6.9437 6.0964 O.co2 126 GLU126 -0.6478 2015 OE2 -2.6054 8.9099 6.4205 O.co2 126 GLU126 -0.6478 2016 N 2.2180 7.9700 3.8800 N.am 127 SER127 -0.2436 2017 H 2.5510 7.4800 4.7100 H 127 SER127 0.1312 2018 CA 3.0030 9.0980 3.3610 C.3 127 SER127 0.1109 2019 HA 2.3040 9.7871 2.8848 H 127 SER127 0.0580 2020 C 4.0420 8.7090 2.3010 C.2 127 SER127 0.2209 2021 O 4.4650 9.5600 1.5140 O.2 127 SER127 -0.2777 2022 CB 3.6781 9.8315 4.5273 C.3 127 SER127 0.0681 2023 HB1 2.9080 10.1052 5.2578 H 127 SER127 0.0577 2024 HB2 4.1261 10.7558 4.1515 H 127 SER127 0.0577 2025 OG 4.6820 9.0294 5.1348 O.3 127 SER127 -0.3930 2026 HG 5.0243 9.4345 5.9309 H 127 SER127 0.2095 2027 N 4.4570 7.4370 2.2970 N.am 128 ASP128 -0.2451 2028 H 4.0300 6.7920 2.9630 H 128 ASP128 0.1312 2029 CA 5.4930 6.9100 1.3900 C.3 128 ASP128 0.0974 2030 HA 5.6337 5.9090 1.7959 H 128 ASP128 0.0563 2031 C 6.8610 7.6020 1.5560 C.2 128 ASP128 0.2193 2032 O 7.6050 7.8610 0.5670 O.2 128 ASP128 -0.2778 2033 CB 5.0220 6.7736 -0.0737 C.3 128 ASP128 0.0576 2034 HB1 5.2721 7.6539 -0.6647 H 128 ASP128 0.0394 2035 HB2 3.9372 6.6718 -0.0978 H 128 ASP128 0.0394 2036 CG 5.6270 5.5115 -0.7407 C.2 128 ASP128 0.1780 2037 OD1 4.9393 4.8066 -1.4747 O.co2 128 ASP128 -0.6478 2038 OD2 6.7932 5.1958 -0.5223 O.co2 128 ASP128 -0.6478 2039 N 7.1760 7.8790 2.8200 N.am 129 THR129 -0.2434 2040 H 6.4990 7.6460 3.5460 H 129 THR129 0.1313 2041 CA 8.4210 8.4900 3.2220 C.3 129 THR129 0.1135 2042 HA 9.0322 8.5869 2.3279 H 129 THR129 0.0583 2043 C 9.1290 7.5490 4.1510 C.2 129 THR129 0.2212 2044 O 8.5010 6.7360 4.8380 O.2 129 THR129 -0.2777 2045 CB 8.1755 9.8740 3.8603 C.3 129 THR129 0.0763 2046 HB 9.1415 10.2964 4.1355 H 129 THR129 0.0611 2047 OG1 7.4307 9.8236 5.0587 O.3 129 THR129 -0.3900 2048 HG1 6.6726 9.2628 4.9201 H 129 THR129 0.2098 2049 CG2 7.5052 10.8408 2.8763 C.3 129 THR129 -0.0370 2050 HG21 7.4918 11.8505 3.2784 H 129 THR129 0.0255 2051 HG22 6.4767 10.5533 2.6643 H 129 THR129 0.0255 2052 HG23 8.0392 10.8744 1.9274 H 129 THR129 0.0255 2053 N 10.4490 7.6850 4.1830 N.am 130 LEU130 -0.2456 2054 H 10.9210 8.1100 3.3850 H 130 LEU130 0.1312 2055 CA 11.2400 7.2490 5.3150 C.3 130 LEU130 0.0880 2056 HA 10.7184 6.4573 5.8548 H 130 LEU130 0.0557 2057 C 11.4670 8.4550 6.2560 C.2 130 LEU130 0.2187 2058 O 11.3230 9.6330 5.8650 O.2 130 LEU130 -0.2778 2059 CB 12.6383 6.8033 4.8346 C.3 130 LEU130 -0.0266 2060 HB1 13.2769 6.5934 5.6942 H 130 LEU130 0.0287 2061 HB2 13.1046 7.6421 4.3137 H 130 LEU130 0.0287 2062 CG 12.6681 5.5803 3.9053 C.3 130 LEU130 -0.0449 2063 HG 11.9447 5.7307 3.1078 H 130 LEU130 0.0296 2064 CD1 14.0609 5.4298 3.2791 C.3 130 LEU130 -0.0626 2065 HD11 14.0896 4.5944 2.5792 H 130 LEU130 0.0232 2066 HD12 14.8145 5.2551 4.0468 H 130 LEU130 0.0232 2067 HD13 14.3539 6.3290 2.7382 H 130 LEU130 0.0232 2068 CD2 12.2861 4.2941 4.6364 C.3 130 LEU130 -0.0626 2069 HD21 12.1805 3.4598 3.9420 H 130 LEU130 0.0232 2070 HD22 11.3457 4.4125 5.1673 H 130 LEU130 0.0232 2071 HD23 13.0487 4.0258 5.3623 H 130 LEU130 0.0232 2072 N 11.8070 8.1550 7.5040 N.am 131 THR131 -0.2434 2073 H 11.7760 7.1830 7.8100 H 131 THR131 0.1313 2074 CA 12.2250 9.1880 8.4480 C.3 131 THR131 0.1135 2075 HA 11.9923 10.1665 8.0333 H 131 THR131 0.0583 2076 C 13.7330 9.0990 8.6950 C.2 131 THR131 0.2212 2077 O 14.2530 8.0590 9.1260 O.2 131 THR131 -0.2777 2078 CB 11.4989 9.0578 9.7988 C.3 131 THR131 0.0763 2079 HB 11.8043 8.1313 10.2886 H 131 THR131 0.0611 2080 OG1 10.0942 9.0660 9.6542 O.3 131 THR131 -0.3900 2081 HG1 9.8140 8.3920 9.0338 H 131 THR131 0.2098 2082 CG2 11.8267 10.2220 10.7466 C.3 131 THR131 -0.0370 2083 HG21 11.2695 10.1335 11.6794 H 131 THR131 0.0255 2084 HG22 11.5661 11.1796 10.2944 H 131 THR131 0.0255 2085 HG23 12.8867 10.2494 10.9976 H 131 THR131 0.0255 2086 N 14.4230 10.1920 8.3880 N.am 132 LEU132 -0.2456 2087 H 13.9220 10.9800 7.9770 H 132 LEU132 0.1312 2088 CA 15.8580 10.3250 8.6070 C.3 132 LEU132 0.0880 2089 HA 16.3001 9.3286 8.6711 H 132 LEU132 0.0557 2090 C 16.1660 11.1240 9.9140 C.2 132 LEU132 0.2187 2091 O 15.5040 12.1340 10.2000 O.2 132 LEU132 -0.2778 2092 CB 16.4894 11.1107 7.4405 C.3 132 LEU132 -0.0266 2093 HB1 17.5737 11.0223 7.5045 H 132 LEU132 0.0287 2094 HB2 16.2765 12.1730 7.5630 H 132 LEU132 0.0287 2095 CG 16.0282 10.7283 6.0232 C.3 132 LEU132 -0.0449 2096 HG 14.9744 10.9916 5.9190 H 132 LEU132 0.0296 2097 CD1 16.8158 11.5618 5.0022 C.3 132 LEU132 -0.0626 2098 HD11 16.5058 11.3474 3.9829 H 132 LEU132 0.0232 2099 HD12 17.8854 11.3612 5.0683 H 132 LEU132 0.0232 2100 HD13 16.6690 12.6290 5.1723 H 132 LEU132 0.0232 2101 CD2 16.1660 9.2290 5.7284 C.3 132 LEU132 -0.0626 2102 HD21 15.8166 8.9979 4.7221 H 132 LEU132 0.0232 2103 HD22 15.5829 8.6220 6.4205 H 132 LEU132 0.0232 2104 HD23 17.2032 8.9130 5.7992 H 132 LEU132 0.0232 2105 N 17.1530 10.6540 10.6870 N.am 133 SER133 -0.2436 2106 H 17.6810 9.8460 10.3570 H 133 SER133 0.1312 2107 CA 17.5170 11.2360 11.9810 C.3 133 SER133 0.1109 2108 HA 18.2009 10.5072 12.4010 H 133 SER133 0.0580 2109 C 16.3640 11.4530 12.9640 C.2 133 SER133 0.2207 2110 O 16.3380 12.4750 13.6890 O.2 133 SER133 -0.2777 2111 CB 18.2636 12.5530 11.7291 C.3 133 SER133 0.0681 2112 HB1 18.6322 12.9815 12.6663 H 133 SER133 0.0577 2113 HB2 17.5950 13.2825 11.2564 H 133 SER133 0.0577 2114 OG 19.3575 12.2509 10.8838 O.3 133 SER133 -0.3930 2115 HG 19.8086 13.0386 10.5938 H 133 SER133 0.2095 2116 N 15.4390 10.4980 13.0000 N.am 134 GLY134 -0.2484 2117 H 15.5970 9.6370 12.4760 H 134 GLY134 0.1309 2118 CA 14.2160 10.6420 13.7580 C.3 134 GLY134 0.0765 2119 HA1 14.4806 10.6351 14.8133 H 134 GLY134 0.0521 2120 HA2 13.6154 9.7564 13.5530 H 134 GLY134 0.0521 2121 C 13.3770 11.8820 13.4680 C.2 134 GLY134 0.2155 2122 O 12.4000 12.1430 14.1780 O.2 134 GLY134 -0.2781 2123 N 13.7300 12.6480 12.4370 N.am 135 GLU135 -0.2459 2124 H 14.3940 12.2990 11.7460 H 135 GLU135 0.1312 2125 CA 13.1630 13.9960 12.2940 C.3 135 GLU135 0.0883 2126 HA 12.4328 14.2322 13.0676 H 135 GLU135 0.0557 2127 C 12.6200 14.3110 10.9170 C.2 135 GLU135 0.2187 2128 O 11.5800 14.9250 10.7840 O.2 135 GLU135 -0.2778 2129 CB 14.4414 14.8928 12.3900 C.3 135 GLU135 -0.0193 2130 HB1 14.5333 15.6299 11.5866 H 135 GLU135 0.0290 2131 HB2 15.3349 14.2826 12.2512 H 135 GLU135 0.0290 2132 CG 14.5791 15.6419 13.7096 C.3 135 GLU135 0.0356 2133 HG1 15.6219 15.8974 13.8988 H 135 GLU135 0.0374 2134 HG2 14.2262 15.0118 14.5173 H 135 GLU135 0.0374 2135 CD 13.7520 16.9301 13.6825 C.2 135 GLU135 0.1760 2136 OE1 12.7090 16.9540 13.0683 O.co2 135 GLU135 -0.6478 2137 OE2 14.1353 17.9280 14.2757 O.co2 135 GLU135 -0.6478 2138 N 13.3530 13.9270 9.8870 N.am 136 MET136 -0.2456 2139 H 14.1330 13.2850 10.0250 H 136 MET136 0.1312 2140 CA 13.0450 14.4200 8.5650 C.3 136 MET136 0.0885 2141 HA 12.3706 15.2779 8.6219 H 136 MET136 0.0557 2142 C 12.3910 13.3200 7.7850 C.2 136 MET136 0.2187 2143 O 13.0310 12.2880 7.5100 O.2 136 MET136 -0.2778 2144 CB 14.3515 14.8684 7.8955 C.3 136 MET136 -0.0199 2145 HB1 15.0060 14.0103 7.7424 H 136 MET136 0.0293 2146 HB2 14.8884 15.5353 8.5703 H 136 MET136 0.0293 2147 CG 14.1316 15.5961 6.5635 C.3 136 MET136 -0.0047 2148 HG1 13.6054 16.5403 6.7087 H 136 MET136 0.0377 2149 HG2 13.5042 15.0085 5.8944 H 136 MET136 0.0377 2150 SD 15.7007 15.8983 5.7368 S.3 136 MET136 -0.1641 2151 CE 16.0830 17.5326 6.3979 C.3 136 MET136 -0.0181 2152 HE1 17.1139 17.8038 6.1733 H 136 MET136 0.0340 2153 HE2 15.9628 17.5397 7.4803 H 136 MET136 0.0340 2154 HE3 15.4158 18.2863 5.9797 H 136 MET136 0.0340 2155 N 11.1160 13.5290 7.4480 N.am 137 ALA137 -0.2459 2156 H 10.6430 14.3730 7.7710 H 137 ALA137 0.1312 2157 CA 10.3940 12.5740 6.6290 C.3 137 ALA137 0.0850 2158 HA 10.7911 11.5875 6.8376 H 137 ALA137 0.0554 2159 C 10.6180 12.9340 5.1690 C.2 137 ALA137 0.2184 2160 O 10.2720 14.0260 4.7480 O.2 137 ALA137 -0.2778 2161 CB 8.9162 12.5898 7.0180 C.3 137 ALA137 -0.0411 2162 HB1 8.3553 11.8168 6.4910 H 137 ALA137 0.0249 2163 HB2 8.4450 13.5460 6.8204 H 137 ALA137 0.0249 2164 HB3 8.8157 12.4196 8.0856 H 137 ALA137 0.0249 2165 N 11.2170 12.0210 4.4040 N.am 138 VAL138 -0.2454 2166 H 11.4760 11.1270 4.8210 H 138 VAL138 0.1312 2167 CA 11.5170 12.2510 2.9920 C.3 138 VAL138 0.0901 2168 HA 11.1546 13.2374 2.6951 H 138 VAL138 0.0560 2169 C 10.9420 11.2130 2.0320 C.2 138 VAL138 0.2189 2170 O 10.7710 10.0430 2.3620 O.2 138 VAL138 -0.2778 2171 CB 13.0607 12.1735 2.8337 C.3 138 VAL138 -0.0227 2172 HB 13.3065 12.4529 1.8070 H 138 VAL138 0.0315 2173 CG1 13.7850 13.1683 3.7450 C.3 138 VAL138 -0.0608 2174 HG11 14.8584 13.1252 3.5761 H 138 VAL138 0.0233 2175 HG12 13.6190 12.9552 4.8012 H 138 VAL138 0.0233 2176 HG13 13.4587 14.1834 3.5417 H 138 VAL138 0.0233 2177 CG2 13.6357 10.7593 3.0721 C.3 138 VAL138 -0.0608 2178 HG21 14.7181 10.7585 2.9684 H 138 VAL138 0.0233 2179 HG22 13.2660 10.0321 2.3494 H 138 VAL138 0.0233 2180 HG23 13.3986 10.3910 4.0707 H 138 VAL138 0.0233 2181 N 10.6900 11.6440 0.8100 N.am 139 LYS139 -0.2456 2182 H 10.8840 12.6170 0.5730 H 139 LYS139 0.1312 2183 CA 10.1390 10.7550 -0.2080 C.3 139 LYS139 0.0878 2184 HA 9.4997 10.0047 0.2625 H 139 LYS139 0.0557 2185 C 11.2550 10.1020 -0.9720 C.2 139 LYS139 0.2187 2186 O 12.4230 10.4740 -0.8000 O.2 139 LYS139 -0.2778 2187 CB 9.3810 11.5238 -1.2941 C.3 139 LYS139 -0.0289 2188 HB1 8.7592 10.8042 -1.8281 H 139 LYS139 0.0285 2189 HB2 10.1005 11.9015 -2.0275 H 139 LYS139 0.0285 2190 CG 8.4952 12.7164 -0.9377 C.3 139 LYS139 -0.0496 2191 HG1 9.0223 13.4396 -0.3175 H 139 LYS139 0.0266 2192 HG2 7.6011 12.3984 -0.4008 H 139 LYS139 0.0266 2193 CD 8.1550 13.3265 -2.3010 C.3 139 LYS139 -0.0278 2194 HD1 7.6586 12.5666 -2.9058 H 139 LYS139 0.0282 2195 HD2 9.0912 13.5674 -2.8056 H 139 LYS139 0.0282 2196 CE 7.3072 14.5738 -2.3505 C.3 139 LYS139 0.1103 2197 HE1 7.6872 15.3622 -1.6982 H 139 LYS139 0.0559 2198 HE2 6.2738 14.3610 -2.0739 H 139 LYS139 0.0559 2199 NZ 7.3363 15.0564 -3.7276 N.4 139 LYS139 -0.0749 2200 HZ1 6.5526 15.7350 -3.8705 H 139 LYS139 0.2742 2201 HZ2 7.3541 14.2661 -4.4077 H 139 LYS139 0.2742 2202 HZ3 8.1683 15.6617 -3.8753 H 139 LYS139 0.2742 2203 N 10.8780 9.1260 -1.7980 N.am 140 ARG140 -0.2457 2204 H 9.8780 8.9820 -1.9390 H 140 ARG140 0.1312 2205 CA 11.8000 8.2490 -2.5150 C.3 140 ARG140 0.0879 2206 HA 12.4627 7.7832 -1.7952 H 140 ARG140 0.0557 2207 C 12.6440 9.1260 -3.4100 C.2 140 ARG140 0.2187 2208 O 13.8390 9.0750 -3.3360 O.2 140 ARG140 -0.2778 2209 CB 11.0942 7.1969 -3.3869 C.3 140 ARG140 -0.0258 2210 HB1 10.3864 7.7053 -4.0441 H 140 ARG140 0.0286 2211 HB2 10.4969 6.5381 -2.7558 H 140 ARG140 0.0286 2212 CG 12.0892 6.3586 -4.2335 C.3 140 ARG140 -0.0154 2213 HG1 12.5831 5.6161 -3.6052 H 140 ARG140 0.0299 2214 HG2 12.8947 6.9716 -4.6343 H 140 ARG140 0.0299 2215 CD 11.4341 5.6923 -5.4441 C.3 140 ARG140 0.1045 2216 HD1 12.1645 5.2851 -6.1454 H 140 ARG140 0.0711 2217 HD2 10.8341 6.4108 -6.0053 H 140 ARG140 0.0711 2218 NE 10.5427 4.6365 -4.9917 N.pl3 140 ARG140 -0.4450 2219 HE 9.5788 4.8289 -4.8361 H 140 ARG140 0.3153 2220 CZ 10.9531 3.3973 -4.7468 C.cat 140 ARG140 0.5062 2221 NH1 12.1808 3.0002 -4.9308 N.pl3 140 ARG140 -0.4573 2222 HH11 12.3773 2.0395 -4.7006 H 140 ARG140 0.3114 2223 HH12 12.9055 3.6016 -5.2876 H 140 ARG140 0.3114 2224 NH2 10.0811 2.5470 -4.3031 N.pl3 140 ARG140 -0.4573 2225 HH21 10.4063 1.6123 -4.0799 H 140 ARG140 0.3114 2226 HH22 9.1294 2.7728 -4.1769 H 140 ARG140 0.3114 2227 N 12.0080 9.9610 -4.2120 N.am 141 GLU141 -0.2456 2228 H 10.9890 9.9740 -4.1800 H 141 GLU141 0.1312 2229 CA 12.6830 10.8730 -5.1480 C.3 141 GLU141 0.0883 2230 HA 13.2600 10.2346 -5.8177 H 141 GLU141 0.0557 2231 C 13.6570 11.8550 -4.4350 C.2 141 GLU141 0.2187 2232 O 14.7550 12.1360 -4.9080 O.2 141 GLU141 -0.2778 2233 CB 11.7151 11.7658 -5.9795 C.3 141 GLU141 -0.0193 2234 HB1 12.1928 11.9389 -6.9443 H 141 GLU141 0.0290 2235 HB2 11.6220 12.7664 -5.5492 H 141 GLU141 0.0290 2236 CG 10.2896 11.2488 -6.2404 C.3 141 GLU141 0.0356 2237 HG1 10.2699 10.1651 -6.3518 H 141 GLU141 0.0374 2238 HG2 9.9103 11.6671 -7.1723 H 141 GLU141 0.0374 2239 CD 9.3177 11.6802 -5.1282 C.2 141 GLU141 0.1760 2240 OE1 9.0872 10.8777 -4.2347 O.co2 141 GLU141 -0.6478 2241 OE2 8.8015 12.8040 -5.1616 O.co2 141 GLU141 -0.6478 2242 N 13.2310 12.3840 -3.2950 N.am 142 GLN142 -0.2456 2243 H 12.3270 12.1040 -2.9140 H 142 GLN142 0.1312 2244 CA 14.0490 13.3670 -2.5790 C.3 142 GLN142 0.0882 2245 HA 14.2499 14.1784 -3.2821 H 142 GLN142 0.0557 2246 C 15.3920 12.7980 -2.1430 C.2 142 GLN142 0.2187 2247 O 16.4540 13.4380 -2.3410 O.2 142 GLN142 -0.2778 2248 CB 13.2656 13.9108 -1.3758 C.3 142 GLN142 -0.0210 2249 HB1 13.9101 14.5793 -0.8031 H 142 GLN142 0.0289 2250 HB2 12.9989 13.0895 -0.7081 H 142 GLN142 0.0289 2251 CG 11.9989 14.6736 -1.7985 C.3 142 GLN142 0.0225 2252 HG1 11.3019 14.0155 -2.3156 H 142 GLN142 0.0356 2253 HG2 12.2524 15.4818 -2.4856 H 142 GLN142 0.0356 2254 CD 11.2867 15.2564 -0.5710 C.2 142 GLN142 0.1981 2255 OE1 11.1395 14.6029 0.4533 O.2 142 GLN142 -0.2798 2256 NE2 10.8640 16.5176 -0.7325 N.am 142 GLN142 -0.2724 2257 HE21 10.3804 16.9877 0.0056 H 142 GLN142 0.1266 2258 HE22 11.0290 17.0282 -1.5778 H 142 GLN142 0.1266 2259 N 15.3310 11.5920 -1.5790 N.am 143 LEU143 -0.2456 2260 H 14.4390 11.0980 -1.5480 H 143 LEU143 0.1312 2261 CA 16.5190 10.9660 -1.0040 C.3 143 LEU143 0.0880 2262 HA 17.0709 11.7375 -0.4766 H 143 LEU143 0.0557 2263 C 17.4210 10.4210 -2.1160 C.2 143 LEU143 0.2187 2264 O 18.6580 10.4660 -2.0400 O.2 143 LEU143 -0.2778 2265 CB 16.0535 9.9044 0.0043 C.3 143 LEU143 -0.0266 2266 HB1 15.3620 9.2179 -0.4802 H 143 LEU143 0.0287 2267 HB2 15.4607 10.4018 0.7719 H 143 LEU143 0.0287 2268 CG 17.1865 9.1154 0.6833 C.3 143 LEU143 -0.0449 2269 HG 17.7532 8.5990 -0.0913 H 143 LEU143 0.0296 2270 CD1 18.1496 10.0402 1.4450 C.3 143 LEU143 -0.0626 2271 HD11 18.8915 9.4712 2.0047 H 143 LEU143 0.0232 2272 HD12 17.6132 10.6688 2.1543 H 143 LEU143 0.0232 2273 HD13 18.6932 10.6962 0.7650 H 143 LEU143 0.0232 2274 CD2 16.6038 8.0422 1.6131 C.3 143 LEU143 -0.0626 2275 HD21 17.3914 7.4673 2.1006 H 143 LEU143 0.0232 2276 HD22 15.9820 7.3408 1.0554 H 143 LEU143 0.0232 2277 HD23 15.9851 8.4891 2.3915 H 143 LEU143 0.0232 2278 N 16.7700 9.9300 -3.1450 N.am 144 LYS144 -0.2457 2279 H 15.7570 9.8280 -3.0810 H 144 LYS144 0.1312 2280 CA 17.4240 9.5340 -4.3460 C.3 144 LYS144 0.0878 2281 HA 18.1029 8.7077 -4.1341 H 144 LYS144 0.0557 2282 C 18.2180 10.7100 -4.9690 C.2 144 LYS144 0.2187 2283 O 19.4050 10.5450 -5.3030 O.2 144 LYS144 -0.2778 2284 CB 16.2398 9.0990 -5.2425 C.3 144 LYS144 -0.0289 2285 HB1 15.4248 9.8045 -5.1040 H 144 LYS144 0.0285 2286 HB2 15.8521 8.1421 -4.8933 H 144 LYS144 0.0285 2287 CG 16.4603 9.0187 -6.7517 C.3 144 LYS144 -0.0496 2288 HG1 16.8244 9.9670 -7.1490 H 144 LYS144 0.0266 2289 HG2 15.4921 8.8497 -7.2250 H 144 LYS144 0.0266 2290 CD 17.3956 7.8849 -7.1376 C.3 144 LYS144 -0.0278 2291 HD1 17.0930 6.9608 -6.6433 H 144 LYS144 0.0282 2292 HD2 18.3929 8.1302 -6.7813 H 144 LYS144 0.0282 2293 CE 17.4211 7.6769 -8.6468 C.3 144 LYS144 0.1103 2294 HE1 17.6469 8.6177 -9.1542 H 144 LYS144 0.0559 2295 HE2 16.4610 7.3135 -9.0160 H 144 LYS144 0.0559 2296 NZ 18.4504 6.7259 -9.0155 N.4 144 LYS144 -0.0749 2297 HZ1 18.5967 6.7597 -10.0472 H 144 LYS144 0.2742 2298 HZ2 18.2262 5.7783 -8.6555 H 144 LYS144 0.2742 2299 HZ3 19.3586 7.0790 -8.6474 H 144 LYS144 0.2742 2300 N 17.5490 11.8640 -5.1580 N.am 145 ASN145 -0.2452 2301 H 16.5830 11.9320 -4.8370 H 145 ASN145 0.1312 2302 CA 18.1620 13.0250 -5.8100 C.3 145 ASN145 0.0957 2303 HA 18.7241 12.6527 -6.6700 H 145 ASN145 0.0562 2304 C 19.1660 13.7380 -4.9280 C.2 145 ASN145 0.2189 2305 O 20.0240 14.4430 -5.4140 O.2 145 ASN145 -0.2778 2306 CB 17.0439 13.9691 -6.2792 C.3 145 ASN145 0.0446 2307 HB1 17.4402 14.9165 -6.6439 H 145 ASN145 0.0375 2308 HB2 16.3739 14.1930 -5.4497 H 145 ASN145 0.0375 2309 CG 16.2508 13.3131 -7.4249 C.2 145 ASN145 0.2000 2310 OD1 16.7790 12.5320 -8.2043 O.2 145 ASN145 -0.2797 2311 ND2 14.9608 13.6676 -7.4914 N.am 145 ASN145 -0.2723 2312 HD21 14.3866 13.2998 -8.2205 H 145 ASN145 0.1266 2313 HD22 14.5615 14.2925 -6.8219 H 145 ASN145 0.1266 2314 N 19.0150 13.5640 -3.6230 N.am 146 GLY146 -0.2485 2315 H 18.3140 12.8990 -3.2940 H 146 GLY146 0.1309 2316 CA 19.8040 14.2790 -2.6490 C.3 146 GLY146 0.0765 2317 HA1 19.2148 14.3959 -1.7493 H 146 GLY146 0.0521 2318 HA2 20.0153 15.2790 -3.0319 H 146 GLY146 0.0521 2319 C 21.1160 13.5990 -2.3500 C.2 146 GLY146 0.2153 2320 O 21.8160 14.0020 -1.4250 O.2 146 GLY146 -0.2781 2321 N 21.4670 12.5580 -3.0980 N.am 147 GLY147 -0.2487 2322 H 20.8140 12.1490 -3.7670 H 147 GLY147 0.1309 2323 CA 22.8010 12.0200 -2.9380 C.3 147 GLY147 0.0765 2324 HA1 23.2297 12.3035 -1.9748 H 147 GLY147 0.0521 2325 HA2 23.4144 12.4810 -3.7112 H 147 GLY147 0.0521 2326 C 22.9380 10.5360 -3.0340 C.2 147 GLY147 0.2155 2327 O 23.9220 10.0290 -3.5910 O.2 147 GLY147 -0.2781 2328 N 21.9640 9.8330 -2.4980 N.am 148 LEU148 -0.2459 2329 H 21.1160 10.3130 -2.1970 H 148 LEU148 0.1312 2330 CA 22.0580 8.3980 -2.3220 C.3 148 LEU148 0.0880 2331 HA 23.0776 8.1631 -2.0179 H 148 LEU148 0.0557 2332 C 21.8070 7.6020 -3.6040 C.2 148 LEU148 0.2185 2333 O 22.0120 6.3930 -3.6060 O.2 148 LEU148 -0.2778 2334 CB 21.0374 7.9054 -1.2652 C.3 148 LEU148 -0.0266 2335 HB1 20.8536 6.8394 -1.3970 H 148 LEU148 0.0287 2336 HB2 20.0703 8.3759 -1.4464 H 148 LEU148 0.0287 2337 CG 21.4316 8.0931 0.2119 C.3 148 LEU148 -0.0449 2338 HG 21.3226 9.1454 0.4684 H 148 LEU148 0.0296 2339 CD1 20.4839 7.2873 1.1119 C.3 148 LEU148 -0.0626 2340 HD11 20.6546 7.5078 2.1660 H 148 LEU148 0.0232 2341 HD12 20.6288 6.2159 0.9691 H 148 LEU148 0.0232 2342 HD13 19.4421 7.5044 0.8891 H 148 LEU148 0.0232 2343 CD2 22.8759 7.6620 0.4978 C.3 148 LEU148 -0.0626 2344 HD21 23.0647 7.6110 1.5688 H 148 LEU148 0.0232 2345 HD22 23.5989 8.3616 0.0789 H 148 LEU148 0.0232 2346 HD23 23.0709 6.6716 0.0861 H 148 LEU148 0.0232 2347 N 21.3410 8.2360 -4.6770 N.am 149 GLY149 -0.2485 2348 H 21.1710 9.2410 -4.6420 H 149 GLY149 0.1309 2349 CA 21.0750 7.4970 -5.8980 C.3 149 GLY149 0.0765 2350 HA1 22.0237 7.2497 -6.3738 H 149 GLY149 0.0521 2351 HA2 20.5472 8.2091 -6.5188 H 149 GLY149 0.0521 2352 C 20.2050 6.2490 -5.7320 C.2 149 GLY149 0.2155 2353 O 19.1290 6.3200 -5.1360 O.2 149 GLY149 -0.2781 2354 N 20.6280 5.1070 -6.2750 N.am 150 VAL150 -0.2456 2355 H 21.5180 5.0730 -6.7720 H 150 VAL150 0.1312 2356 CA 19.7980 3.8930 -6.1520 C.3 150 VAL150 0.0901 2357 HA 18.7595 4.1851 -6.3041 H 150 VAL150 0.0560 2358 C 19.8830 3.2570 -4.7290 C.2 150 VAL150 0.2189 2359 O 19.1420 2.3160 -4.3920 O.2 150 VAL150 -0.2778 2360 CB 20.1931 2.8830 -7.2457 C.3 150 VAL150 -0.0227 2361 HB 19.5676 1.9975 -7.1187 H 150 VAL150 0.0315 2362 CG1 19.8913 3.4428 -8.6437 C.3 150 VAL150 -0.0608 2363 HG11 20.0958 2.6992 -9.4142 H 150 VAL150 0.0233 2364 HG12 20.4965 4.3224 -8.8658 H 150 VAL150 0.0233 2365 HG13 18.8416 3.7262 -8.7307 H 150 VAL150 0.0233 2366 CG2 21.6611 2.4367 -7.1411 C.3 150 VAL150 -0.0608 2367 HG21 21.8918 1.6877 -7.8989 H 150 VAL150 0.0233 2368 HG22 21.8766 1.9929 -6.1691 H 150 VAL150 0.0233 2369 HG23 22.3469 3.2714 -7.2879 H 150 VAL150 0.0233 2370 N 20.8020 3.7560 -3.9100 N.am 151 VAL151 -0.2454 2371 H 21.4870 4.4190 -4.2720 H 151 VAL151 0.1312 2372 CA 20.8510 3.3790 -2.5150 C.3 151 VAL151 0.0901 2373 HA 20.8904 2.2883 -2.4893 H 151 VAL151 0.0560 2374 C 19.5360 3.8250 -1.7940 C.2 151 VAL151 0.2190 2375 O 19.1150 3.1820 -0.8340 O.2 151 VAL151 -0.2778 2376 CB 22.1011 3.9521 -1.8056 C.3 151 VAL151 -0.0227 2377 HB 21.9855 5.0281 -1.7145 H 151 VAL151 0.0315 2378 CG1 22.2555 3.4145 -0.3743 C.3 151 VAL151 -0.0608 2379 HG11 23.0896 3.9013 0.1285 H 151 VAL151 0.0233 2380 HG12 22.4420 2.3401 -0.3735 H 151 VAL151 0.0233 2381 HG13 21.3704 3.6042 0.2318 H 151 VAL151 0.0233 2382 CG2 23.3907 3.6917 -2.5988 C.3 151 VAL151 -0.0608 2383 HG21 24.2572 4.0986 -2.0785 H 151 VAL151 0.0233 2384 HG22 23.3667 4.1505 -3.5871 H 151 VAL151 0.0233 2385 HG23 23.5532 2.6235 -2.7297 H 151 VAL151 0.0233 2386 N 18.9100 4.9210 -2.2490 N.am 152 SER152 -0.2436 2387 H 19.3590 5.4920 -2.9650 H 152 SER152 0.1312 2388 CA 17.5950 5.3130 -1.7380 C.3 152 SER152 0.1109 2389 HA 17.6742 5.4130 -0.6547 H 152 SER152 0.0580 2390 C 16.5120 4.2810 -2.0610 C.2 152 SER152 0.2209 2391 O 15.7230 3.8480 -1.1860 O.2 152 SER152 -0.2777 2392 CB 17.1868 6.6505 -2.3715 C.3 152 SER152 0.0681 2393 HB1 17.1135 6.5324 -3.4622 H 152 SER152 0.0577 2394 HB2 17.9618 7.3951 -2.1798 H 152 SER152 0.0577 2395 OG 15.9693 7.1081 -1.7914 O.3 152 SER152 -0.3930 2396 HG 15.4716 7.6559 -2.3964 H 152 SER152 0.2095 2397 N 16.4920 3.8790 -3.3250 N.am 153 ASP153 -0.2451 2398 H 17.1540 4.2950 -3.9800 H 153 ASP153 0.1312 2399 CA 15.5610 2.8640 -3.8200 C.3 153 ASP153 0.0974 2400 HA 14.5682 3.2931 -3.6809 H 153 ASP153 0.0563 2401 C 15.5830 1.5780 -2.9860 C.2 153 ASP153 0.2192 2402 O 14.5260 1.0170 -2.6850 O.2 153 ASP153 -0.2778 2403 CB 15.8107 2.6321 -5.3210 C.3 153 ASP153 0.0576 2404 HB1 15.1531 1.8531 -5.7053 H 153 ASP153 0.0394 2405 HB2 16.8360 2.3143 -5.5049 H 153 ASP153 0.0394 2406 CG 15.5230 3.9239 -6.1179 C.2 153 ASP153 0.1780 2407 OD1 14.4022 4.4216 -6.0268 O.co2 153 ASP153 -0.6478 2408 OD2 16.4076 4.4231 -6.8175 O.co2 153 ASP153 -0.6478 2409 N 16.8040 1.1470 -2.6410 N.am 154 ALA154 -0.2459 2410 H 17.6000 1.7010 -2.9560 H 154 ALA154 0.1312 2411 CA 17.0920 -0.0410 -1.8570 C.3 154 ALA154 0.0850 2412 HA 16.5530 -0.8656 -2.3265 H 154 ALA154 0.0554 2413 C 16.5960 0.0980 -0.4250 C.2 154 ALA154 0.2184 2414 O 15.9890 -0.8490 0.1060 O.2 154 ALA154 -0.2778 2415 CB 18.6014 -0.2997 -1.8924 C.3 154 ALA154 -0.0411 2416 HB1 18.8506 -1.2313 -1.3840 H 154 ALA154 0.0249 2417 HB2 19.1572 0.5100 -1.4178 H 154 ALA154 0.0249 2418 HB3 18.9531 -0.3812 -2.9209 H 154 ALA154 0.0249 2419 N 16.8200 1.2630 0.1960 N.am 155 ILE155 -0.2454 2420 H 17.3160 2.0080 -0.2940 H 155 ILE155 0.1312 2421 CA 16.3640 1.4790 1.5620 C.3 155 ILE155 0.0903 2422 HA 16.6606 0.5984 2.1347 H 155 ILE155 0.0560 2423 C 14.8490 1.5330 1.5770 C.2 155 ILE155 0.2189 2424 O 14.2000 0.9250 2.4490 O.2 155 ILE155 -0.2778 2425 CB 17.0169 2.7271 2.1972 C.3 155 ILE155 -0.0201 2426 HB 16.7534 3.5882 1.5801 H 155 ILE155 0.0318 2427 CG1 18.5524 2.5948 2.2281 C.3 155 ILE155 -0.0514 2428 HG11 18.9242 2.1529 1.3061 H 155 ILE155 0.0266 2429 HG12 18.8386 1.8977 3.0131 H 155 ILE155 0.0266 2430 CG2 16.5023 2.9660 3.6326 C.3 155 ILE155 -0.0605 2431 HG21 16.9065 3.8859 4.0539 H 155 ILE155 0.0233 2432 HG22 16.7881 2.1468 4.2934 H 155 ILE155 0.0233 2433 HG23 15.4171 3.0444 3.6736 H 155 ILE155 0.0233 2434 CD1 19.2724 3.9288 2.4438 C.3 155 ILE155 -0.0650 2435 HD11 20.3507 3.7865 2.3935 H 155 ILE155 0.0230 2436 HD12 19.0407 4.3616 3.4168 H 155 ILE155 0.0230 2437 HD13 18.9944 4.6496 1.6745 H 155 ILE155 0.0230 2438 N 14.2710 2.2520 0.6330 N.am 156 PHE156 -0.2453 2439 H 14.8320 2.7810 -0.0350 H 156 PHE156 0.1312 2440 CA 12.8140 2.2750 0.5640 C.3 156 PHE156 0.0917 2441 HA 12.4481 2.6796 1.5100 H 156 PHE156 0.0560 2442 C 12.2160 0.8590 0.4070 C.2 156 PHE156 0.2190 2443 O 11.3460 0.4700 1.1850 O.2 156 PHE156 -0.2778 2444 CB 12.3844 3.1623 -0.6199 C.3 156 PHE156 -0.0036 2445 HB1 11.5050 2.7594 -1.1269 H 156 PHE156 0.0333 2446 HB2 13.1652 3.2034 -1.3809 H 156 PHE156 0.0333 2447 CG 12.0484 4.5486 -0.1491 C.ar 156 PHE156 -0.0454 2448 CD1 13.0384 5.5127 0.0143 C.ar 156 PHE156 -0.0585 2449 HD1 14.0648 5.2889 -0.2292 H 156 PHE156 0.0620 2450 CD2 10.7367 4.8607 0.1892 C.ar 156 PHE156 -0.0585 2451 HD2 9.9557 4.1213 0.0879 H 156 PHE156 0.0620 2452 CE1 12.7219 6.7682 0.5137 C.ar 156 PHE156 -0.0615 2453 HE1 13.4935 7.5152 0.6317 H 156 PHE156 0.0618 2454 CE2 10.4160 6.1195 0.6695 C.ar 156 PHE156 -0.0615 2455 HE2 9.3950 6.3437 0.9321 H 156 PHE156 0.0618 2456 CZ 11.4065 7.0760 0.8239 C.ar 156 PHE156 -0.0617 2457 HZ 11.1525 8.0569 1.1859 H 156 PHE156 0.0618 2458 N 12.6900 0.0840 -0.5710 N.am 157 GLU157 -0.2456 2459 H 13.4640 0.4110 -1.1490 H 157 GLU157 0.1312 2460 CA 12.1010 -1.2390 -0.8180 C.3 157 GLU157 0.0883 2461 HA 11.0242 -1.0742 -0.8812 H 157 GLU157 0.0557 2462 C 12.3020 -2.1400 0.4200 C.2 157 GLU157 0.2187 2463 O 11.4320 -2.9010 0.7980 O.2 157 GLU157 -0.2778 2464 CB 12.5843 -1.8319 -2.1502 C.3 157 GLU157 -0.0193 2465 HB1 12.8720 -2.8755 -2.0199 H 157 GLU157 0.0290 2466 HB2 13.4849 -1.3173 -2.4860 H 157 GLU157 0.0290 2467 CG 11.4966 -1.7643 -3.2415 C.3 157 GLU157 0.0356 2468 HG1 10.6303 -2.3568 -2.9486 H 157 GLU157 0.0374 2469 HG2 11.8720 -2.1925 -4.1702 H 157 GLU157 0.0374 2470 CD 11.0282 -0.3264 -3.5341 C.2 157 GLU157 0.1760 2471 OE1 11.7239 0.3848 -4.2471 O.co2 157 GLU157 -0.6478 2472 OE2 9.9689 0.0918 -3.0615 O.co2 157 GLU157 -0.6478 2473 N 13.4510 -1.9910 1.0670 N.am 158 LEU158 -0.2456 2474 H 14.1690 -1.3960 0.6540 H 158 LEU158 0.1312 2475 CA 13.7310 -2.6390 2.3380 C.3 158 LEU158 0.0880 2476 HA 13.6013 -3.7057 2.1576 H 158 LEU158 0.0557 2477 C 12.7150 -2.2240 3.4180 C.2 158 LEU158 0.2185 2478 O 12.1450 -3.0980 4.1010 O.2 158 LEU158 -0.2778 2479 CB 15.1750 -2.3751 2.7931 C.3 158 LEU158 -0.0266 2480 HB1 15.3488 -1.3004 2.8374 H 158 LEU158 0.0287 2481 HB2 15.8614 -2.7591 2.0376 H 158 LEU158 0.0287 2482 CG 15.5138 -3.0007 4.1626 C.3 158 LEU158 -0.0449 2483 HG 14.8556 -2.5656 4.9141 H 158 LEU158 0.0296 2484 CD1 15.3091 -4.5227 4.1838 C.3 158 LEU158 -0.0626 2485 HD11 15.5892 -4.9444 5.1490 H 158 LEU158 0.0232 2486 HD12 15.9209 -5.0046 3.4228 H 158 LEU158 0.0232 2487 HD13 14.2701 -4.7964 4.0032 H 158 LEU158 0.0232 2488 CD2 16.9415 -2.6609 4.5836 C.3 158 LEU158 -0.0626 2489 HD21 17.1182 -3.0359 5.5895 H 158 LEU158 0.0232 2490 HD22 17.1149 -1.5844 4.5874 H 158 LEU158 0.0232 2491 HD23 17.6689 -3.1254 3.9178 H 158 LEU158 0.0232 2492 N 12.5040 -0.9120 3.5660 N.am 159 GLY159 -0.2485 2493 H 13.0690 -0.2620 3.0180 H 159 GLY159 0.1309 2494 CA 11.5020 -0.3690 4.4760 C.3 159 GLY159 0.0765 2495 HA1 11.5577 0.7165 4.4043 H 159 GLY159 0.0521 2496 HA2 11.7722 -0.6700 5.4878 H 159 GLY159 0.0521 2497 C 10.0740 -0.8280 4.1790 C.2 159 GLY159 0.2155 2498 O 9.3040 -1.1160 5.0940 O.2 159 GLY159 -0.2781 2499 N 9.7280 -0.9070 2.8960 N.am 160 LYS160 -0.2459 2500 H 10.4260 -0.6690 2.1920 H 160 LYS160 0.1312 2501 CA 8.3980 -1.3170 2.4420 C.3 160 LYS160 0.0878 2502 HA 7.6737 -0.6463 2.9012 H 160 LYS160 0.0557 2503 C 8.1330 -2.7450 2.8530 C.2 160 LYS160 0.2187 2504 O 7.0470 -3.0800 3.3100 O.2 160 LYS160 -0.2778 2505 CB 8.4144 -1.2281 0.8948 C.3 160 LYS160 -0.0289 2506 HB1 8.5792 -2.2054 0.4370 H 160 LYS160 0.0285 2507 HB2 9.2889 -0.6634 0.5757 H 160 LYS160 0.0285 2508 CG 7.1728 -0.5847 0.2629 C.3 160 LYS160 -0.0496 2509 HG1 6.3579 -0.5216 0.9851 H 160 LYS160 0.0266 2510 HG2 6.8145 -1.2215 -0.5469 H 160 LYS160 0.0266 2511 CD 7.4990 0.8014 -0.3072 C.3 160 LYS160 -0.0278 2512 HD1 8.3357 0.7244 -1.0038 H 160 LYS160 0.0282 2513 HD2 7.8473 1.4422 0.5017 H 160 LYS160 0.0282 2514 CE 6.3119 1.4450 -1.0259 C.3 160 LYS160 0.1103 2515 HE1 5.4079 1.3866 -0.4175 H 160 LYS160 0.0559 2516 HE2 6.1101 0.9302 -1.9664 H 160 LYS160 0.0559 2517 NZ 6.5615 2.8494 -1.3139 N.4 160 LYS160 -0.0749 2518 HZ1 5.7678 3.3011 -1.8170 H 160 LYS160 0.2742 2519 HZ2 7.4416 3.0023 -1.8333 H 160 LYS160 0.2742 2520 HZ3 6.6184 3.4125 -0.4366 H 160 LYS160 0.2742 2521 N 9.1530 -3.5810 2.6620 N.am 161 SER161 -0.2436 2522 H 10.0570 -3.2000 2.3830 H 161 SER161 0.1312 2523 CA 9.0190 -5.0190 2.8380 C.3 161 SER161 0.1109 2524 HA 8.0441 -5.3083 2.4436 H 161 SER161 0.0580 2525 C 9.0610 -5.3400 4.3330 C.2 161 SER161 0.2209 2526 O 8.3640 -6.2490 4.7830 O.2 161 SER161 -0.2777 2527 CB 10.1344 -5.7455 2.0668 C.3 161 SER161 0.0681 2528 HB1 10.1833 -5.3246 1.0546 H 161 SER161 0.0577 2529 HB2 9.8706 -6.8021 1.9710 H 161 SER161 0.0577 2530 OG 11.3929 -5.6499 2.7260 O.3 161 SER161 -0.3930 2531 HG 12.1133 -5.8996 2.1521 H 161 SER161 0.2095 2532 N 9.8460 -4.5730 5.0900 N.am 162 LEU162 -0.2456 2533 H 10.4460 -3.8810 4.6410 H 162 LEU162 0.1312 2534 CA 9.8690 -4.6980 6.5490 C.3 162 LEU162 0.0880 2535 HA 10.0212 -5.7532 6.7669 H 162 LEU162 0.0557 2536 C 8.5560 -4.3130 7.2410 C.2 162 LEU162 0.2187 2537 O 8.3440 -4.6780 8.3950 O.2 162 LEU162 -0.2778 2538 CB 11.0358 -3.8763 7.1262 C.3 162 LEU162 -0.0266 2539 HB1 10.9061 -3.7436 8.2019 H 162 LEU162 0.0287 2540 HB2 11.0051 -2.8734 6.6966 H 162 LEU162 0.0287 2541 CG 12.4252 -4.5024 6.8953 C.3 162 LEU162 -0.0449 2542 HG 12.5663 -4.6782 5.8297 H 162 LEU162 0.0296 2543 CD1 13.5228 -3.5338 7.3557 C.3 162 LEU162 -0.0626 2544 HD11 14.5156 -3.9303 7.1422 H 162 LEU162 0.0232 2545 HD12 13.4603 -3.3454 8.4279 H 162 LEU162 0.0232 2546 HD13 13.4319 -2.5766 6.8437 H 162 LEU162 0.0232 2547 CD2 12.5688 -5.8568 7.6045 C.3 162 LEU162 -0.0626 2548 HD21 13.6081 -6.1847 7.6201 H 162 LEU162 0.0232 2549 HD22 11.9910 -6.6343 7.1056 H 162 LEU162 0.0232 2550 HD23 12.2207 -5.7984 8.6340 H 162 LEU162 0.0232 2551 N 7.6950 -3.5640 6.5520 N.am 163 SER163 -0.2436 2552 H 7.9410 -3.2670 5.6080 H 163 SER163 0.1312 2553 CA 6.4080 -3.1570 7.1130 C.3 163 SER163 0.1109 2554 HA 6.6204 -2.4311 7.8988 H 163 SER163 0.0580 2555 C 5.6630 -4.3250 7.7090 C.2 163 SER163 0.2209 2556 O 5.2360 -4.2570 8.8660 O.2 163 SER163 -0.2777 2557 CB 5.5343 -2.5249 6.0162 C.3 163 SER163 0.0681 2558 HB1 4.5593 -2.2550 6.4360 H 163 SER163 0.0577 2559 HB2 5.3655 -3.2599 5.2197 H 163 SER163 0.0577 2560 OG 6.1486 -1.3580 5.4901 O.3 163 SER163 -0.3930 2561 HG 5.6752 -1.0312 4.7300 H 163 SER163 0.2095 2562 N 5.5050 -5.3720 6.9020 N.am 164 ALA164 -0.2459 2563 H 5.9410 -5.3470 5.9800 H 164 ALA164 0.1312 2564 CA 4.7410 -6.5450 7.2750 C.3 164 ALA164 0.0850 2565 HA 3.8222 -6.2012 7.7535 H 164 ALA164 0.0554 2566 C 5.4780 -7.4530 8.2640 C.2 164 ALA164 0.2184 2567 O 4.9330 -8.4550 8.7070 O.2 164 ALA164 -0.2778 2568 CB 4.4064 -7.3241 5.9985 C.3 164 ALA164 -0.0411 2569 HB1 3.7875 -8.1958 6.2146 H 164 ALA164 0.0249 2570 HB2 5.3121 -7.6681 5.4972 H 164 ALA164 0.0249 2571 HB3 3.8577 -6.6965 5.2961 H 164 ALA164 0.0249 2572 N 6.7200 -7.1130 8.5950 N.am 165 PHE165 -0.2453 2573 H 7.1340 -6.2780 8.1810 H 165 PHE165 0.1312 2574 CA 7.5070 -7.9060 9.5370 C.3 165 PHE165 0.0917 2575 HA 7.2126 -8.9510 9.4406 H 165 PHE165 0.0560 2576 C 7.2010 -7.4660 10.9370 C.2 165 PHE165 0.2190 2577 O 7.6640 -8.0860 11.8970 O.2 165 PHE165 -0.2778 2578 CB 9.0312 -7.7537 9.3097 C.3 165 PHE165 -0.0036 2579 HB1 9.5669 -8.0531 10.2122 H 165 PHE165 0.0333 2580 HB2 9.3005 -6.7111 9.1566 H 165 PHE165 0.0333 2581 CG 9.5983 -8.5747 8.1764 C.ar 165 PHE165 -0.0454 2582 CD1 10.6856 -9.4172 8.4031 C.ar 165 PHE165 -0.0585 2583 HD1 11.0878 -9.5258 9.4010 H 165 PHE165 0.0620 2584 CD2 9.1194 -8.4422 6.8777 C.ar 165 PHE165 -0.0585 2585 HD2 8.2962 -7.7766 6.6718 H 165 PHE165 0.0620 2586 CE1 11.2866 -10.1030 7.3558 C.ar 165 PHE165 -0.0615 2587 HE1 12.1377 -10.7387 7.5509 H 165 PHE165 0.0618 2588 CE2 9.7237 -9.1165 5.8248 C.ar 165 PHE165 -0.0615 2589 HE2 9.3590 -8.9681 4.8190 H 165 PHE165 0.0618 2590 CZ 10.8120 -9.9442 6.0617 C.ar 165 PHE165 -0.0617 2591 HZ 11.2984 -10.4477 5.2405 H 165 PHE165 0.0618 2592 N 6.4530 -6.3750 11.0520 N.am 166 ASN166 -0.2452 2593 H 6.1070 -5.9300 10.2020 H 166 ASN166 0.1312 2594 CA 6.1000 -5.7760 12.3550 C.3 166 ASN166 0.0957 2595 HA 5.9634 -4.7110 12.1675 H 166 ASN166 0.0562 2596 C 7.2240 -5.9140 13.3680 C.2 166 ASN166 0.2191 2597 O 7.0660 -6.4980 14.4240 O.2 166 ASN166 -0.2778 2598 CB 4.8053 -6.4205 12.8847 C.3 166 ASN166 0.0446 2599 HB1 4.4873 -5.9445 13.8119 H 166 ASN166 0.0375 2600 HB2 4.9732 -7.4754 13.1063 H 166 ASN166 0.0375 2601 CG 3.6396 -6.3412 11.8840 C.2 166 ASN166 0.2000 2602 OD1 2.9007 -7.2963 11.6943 O.2 166 ASN166 -0.2797 2603 ND2 3.5061 -5.1612 11.2575 N.am 166 ASN166 -0.2723 2604 HD21 2.7609 -5.0482 10.6017 H 166 ASN166 0.1266 2605 HD22 4.1292 -4.3969 11.4162 H 166 ASN166 0.1266 2606 N 8.3900 -5.4280 13.0190 N.am 167 LEU167 -0.2456 2607 H 8.5200 -4.9990 12.1030 H 167 LEU167 0.1312 2608 CA 9.4980 -5.5120 13.9630 C.3 167 LEU167 0.0880 2609 HA 9.6009 -6.5449 14.2912 H 167 LEU167 0.0557 2610 C 9.2100 -4.5990 15.1360 C.2 167 LEU167 0.2187 2611 O 8.5760 -3.5440 14.9790 O.2 167 LEU167 -0.2778 2612 CB 10.8141 -5.0426 13.3080 C.3 167 LEU167 -0.0266 2613 HB1 11.6145 -5.1279 14.0450 H 167 LEU167 0.0287 2614 HB2 10.7413 -3.9812 13.0645 H 167 LEU167 0.0287 2615 CG 11.2481 -5.8013 12.0401 C.3 167 LEU167 -0.0449 2616 HG 10.4995 -5.6455 11.2620 H 167 LEU167 0.0296 2617 CD1 12.5868 -5.2446 11.5348 C.3 167 LEU167 -0.0626 2618 HD11 12.9516 -5.8050 10.6757 H 167 LEU167 0.0232 2619 HD12 13.3523 -5.3081 12.3091 H 167 LEU167 0.0232 2620 HD13 12.4937 -4.1992 11.2416 H 167 LEU167 0.0232 2621 CD2 11.3690 -7.3088 12.2810 C.3 167 LEU167 -0.0626 2622 HD21 11.6897 -7.8317 11.3799 H 167 LEU167 0.0232 2623 HD22 10.4120 -7.7325 12.5802 H 167 LEU167 0.0232 2624 HD23 12.0947 -7.5264 13.0645 H 167 LEU167 0.0232 2625 N 9.6310 -5.0450 16.3160 N.am 168 ASP168 -0.2451 2626 H 10.0390 -5.9780 16.3740 H 168 ASP168 0.1312 2627 CA 9.5300 -4.2540 17.5140 C.3 168 ASP168 0.0974 2628 HA 8.9757 -3.3421 17.2878 H 168 ASP168 0.0563 2629 C 10.9500 -3.8080 17.8260 C.2 168 ASP168 0.2192 2630 O 11.8930 -4.2310 17.1160 O.2 168 ASP168 -0.2778 2631 CB 8.8186 -4.9309 18.7087 C.3 168 ASP168 0.0576 2632 HB1 7.7910 -5.1448 18.4221 H 168 ASP168 0.0394 2633 HB2 8.7515 -4.2263 19.5368 H 168 ASP168 0.0394 2634 CG 9.4224 -6.2269 19.2872 C.2 168 ASP168 0.1780 2635 OD1 10.5746 -6.5444 19.0266 O.co2 168 ASP168 -0.6478 2636 OD2 8.7058 -6.9261 20.0056 O.co2 168 ASP168 -0.6478 2637 N 11.0880 -2.9210 18.8230 N.am 169 ASP169 -0.2451 2638 H 10.2500 -2.6160 19.3170 H 169 ASP169 0.1312 2639 CA 12.3830 -2.3650 19.2410 C.3 169 ASP169 0.0974 2640 HA 12.6755 -1.6249 18.4961 H 169 ASP169 0.0563 2641 C 13.5030 -3.4070 19.3960 C.2 169 ASP169 0.2193 2642 O 14.6330 -3.2020 18.9270 O.2 169 ASP169 -0.2778 2643 CB 12.2740 -1.7372 20.6443 C.3 169 ASP169 0.0576 2644 HB1 13.2463 -1.3750 20.9807 H 169 ASP169 0.0394 2645 HB2 11.9569 -2.4879 21.3691 H 169 ASP169 0.0394 2646 CG 11.3154 -0.5524 20.7517 C.2 169 ASP169 0.1780 2647 OD1 11.6287 0.5133 20.2345 O.co2 169 ASP169 -0.6478 2648 OD2 10.2696 -0.7001 21.3828 O.co2 169 ASP169 -0.6478 2649 N 13.1640 -4.5300 20.0230 N.am 170 THR170 -0.2434 2650 H 12.2060 -4.6480 20.3540 H 170 THR170 0.1313 2651 CA 14.1270 -5.5880 20.2450 C.3 170 THR170 0.1135 2652 HA 14.9459 -5.1596 20.8219 H 170 THR170 0.0583 2653 C 14.6840 -6.1640 18.9670 C.2 170 THR170 0.2212 2654 O 15.9070 -6.3550 18.8270 O.2 170 THR170 -0.2777 2655 CB 13.4390 -6.7021 21.0547 C.3 170 THR170 0.0763 2656 HB 12.5522 -7.0141 20.4874 H 170 THR170 0.0611 2657 OG1 13.0496 -6.1894 22.3236 O.3 170 THR170 -0.3900 2658 HG1 12.4245 -6.7762 22.7416 H 170 THR170 0.2098 2659 CG2 14.3698 -7.9072 21.2554 C.3 170 THR170 -0.0370 2660 HG21 13.9726 -8.6202 21.9741 H 170 THR170 0.0255 2661 HG22 15.3493 -7.5774 21.5999 H 170 THR170 0.0255 2662 HG23 14.5174 -8.4472 20.3210 H 170 THR170 0.0255 2663 N 13.7860 -6.4490 18.0380 N.am 171 GLU171 -0.2456 2664 H 12.8100 -6.1880 18.1800 H 171 GLU171 0.1312 2665 CA 14.1780 -7.1290 16.8210 C.3 171 GLU171 0.0883 2666 HA 14.7819 -7.9860 17.1233 H 171 GLU171 0.0557 2667 C 15.0980 -6.2030 16.0310 C.2 171 GLU171 0.2187 2668 O 16.0720 -6.6670 15.4150 O.2 171 GLU171 -0.2778 2669 CB 12.9844 -7.6297 15.9992 C.3 171 GLU171 -0.0193 2670 HB1 13.3524 -8.0002 15.0410 H 171 GLU171 0.0290 2671 HB2 12.2917 -6.8170 15.7763 H 171 GLU171 0.0290 2672 CG 12.2568 -8.7691 16.7299 C.3 171 GLU171 0.0356 2673 HG1 11.6353 -8.3533 17.5185 H 171 GLU171 0.0374 2674 HG2 12.9754 -9.4386 17.1996 H 171 GLU171 0.0374 2675 CD 11.3599 -9.6259 15.8253 C.2 171 GLU171 0.1760 2676 OE1 10.9868 -9.1875 14.7446 O.co2 171 GLU171 -0.6478 2677 OE2 11.0121 -10.7348 16.2155 O.co2 171 GLU171 -0.6478 2678 N 14.7990 -4.9060 16.0710 N.am 172 VAL172 -0.2454 2679 H 13.9920 -4.5990 16.6140 H 172 VAL172 0.1312 2680 CA 15.5930 -3.9160 15.3610 C.3 172 VAL172 0.0901 2681 HA 15.8055 -4.3079 14.3647 H 172 VAL172 0.0560 2682 C 16.9210 -3.7760 16.1330 C.2 172 VAL172 0.2189 2683 O 18.0030 -3.6710 15.5100 O.2 172 VAL172 -0.2778 2684 CB 14.8276 -2.5796 15.2658 C.3 172 VAL172 -0.0227 2685 HB 14.5891 -2.2466 16.2778 H 172 VAL172 0.0315 2686 CG1 15.6653 -1.4807 14.5899 C.3 172 VAL172 -0.0608 2687 HG11 15.1109 -0.5434 14.5416 H 172 VAL172 0.0233 2688 HG12 15.9286 -1.7625 13.5706 H 172 VAL172 0.0233 2689 HG13 16.5892 -1.2825 15.1336 H 172 VAL172 0.0233 2690 CG2 13.5022 -2.7582 14.5106 C.3 172 VAL172 -0.0608 2691 HG21 12.9768 -1.8091 14.4019 H 172 VAL172 0.0233 2692 HG22 12.8319 -3.4390 15.0306 H 172 VAL172 0.0233 2693 HG23 13.6710 -3.1663 13.5147 H 172 VAL172 0.0233 2694 N 16.8190 -3.7580 17.4770 N.am 173 ALA173 -0.2459 2695 H 15.8870 -3.7800 17.8920 H 173 ALA173 0.1312 2696 CA 17.9840 -3.7080 18.3790 C.3 173 ALA173 0.0850 2697 HA 18.4992 -2.7779 18.1490 H 173 ALA173 0.0554 2698 C 18.9600 -4.8720 18.1080 C.2 173 ALA173 0.2184 2699 O 20.1730 -4.6760 18.0370 O.2 173 ALA173 -0.2778 2700 CB 17.5437 -3.6943 19.8473 C.3 173 ALA173 -0.0411 2701 HB1 18.4003 -3.5617 20.5073 H 173 ALA173 0.0249 2702 HB2 17.0499 -4.6204 20.1352 H 173 ALA173 0.0249 2703 HB3 16.8523 -2.8757 20.0416 H 173 ALA173 0.0249 2704 N 18.4250 -6.0780 17.9500 N.am 174 LEU174 -0.2457 2705 H 17.4100 -6.1830 17.9360 H 174 LEU174 0.1312 2706 CA 19.2690 -7.2450 17.7980 C.3 174 LEU174 0.0880 2707 HA 20.1332 -7.1208 18.4506 H 174 LEU174 0.0557 2708 C 19.7980 -7.3240 16.4000 C.2 174 LEU174 0.2187 2709 O 20.9410 -7.7480 16.1790 O.2 174 LEU174 -0.2778 2710 CB 18.4911 -8.4949 18.2290 C.3 174 LEU174 -0.0266 2711 HB1 19.0859 -9.3827 18.0215 H 174 LEU174 0.0287 2712 HB2 17.5898 -8.5705 17.6187 H 174 LEU174 0.0287 2713 CG 18.1013 -8.4914 19.7238 C.3 174 LEU174 -0.0449 2714 HG 17.6064 -7.5513 19.9604 H 174 LEU174 0.0296 2715 CD1 17.1053 -9.6130 20.0299 C.3 174 LEU174 -0.0626 2716 HD11 16.6546 -9.4739 21.0105 H 174 LEU174 0.0232 2717 HD12 17.6082 -10.5775 20.0380 H 174 LEU174 0.0232 2718 HD13 16.2974 -9.6481 19.2984 H 174 LEU174 0.0232 2719 CD2 19.3191 -8.6144 20.6502 C.3 174 LEU174 -0.0626 2720 HD21 19.0116 -8.6247 21.6960 H 174 LEU174 0.0232 2721 HD22 20.0141 -7.7847 20.5271 H 174 LEU174 0.0232 2722 HD23 19.8557 -9.5429 20.4562 H 174 LEU174 0.0232 2723 N 18.9830 -6.8930 15.4430 N.am 175 LEU175 -0.2456 2724 H 18.0200 -6.6520 15.6800 H 175 LEU175 0.1312 2725 CA 19.4340 -6.7560 14.0590 C.3 175 LEU175 0.0880 2726 HA 19.7474 -7.7469 13.7315 H 175 LEU175 0.0557 2727 C 20.6280 -5.8670 14.0660 C.2 175 LEU175 0.2187 2728 O 21.6430 -6.1930 13.4330 O.2 175 LEU175 -0.2778 2729 CB 18.2928 -6.2200 13.1662 C.3 175 LEU175 -0.0266 2730 HB1 18.1632 -5.1537 13.3464 H 175 LEU175 0.0287 2731 HB2 17.3584 -6.6726 13.4875 H 175 LEU175 0.0287 2732 CG 18.4063 -6.4830 11.6449 C.3 175 LEU175 -0.0449 2733 HG 17.7029 -5.7985 11.1681 H 175 LEU175 0.0296 2734 CD1 19.7894 -6.1885 11.0560 C.3 175 LEU175 -0.0626 2735 HD11 19.7645 -6.2166 9.9675 H 175 LEU175 0.0232 2736 HD12 20.5183 -6.9333 11.3740 H 175 LEU175 0.0232 2737 HD13 20.1498 -5.2071 11.3567 H 175 LEU175 0.0232 2738 CD2 17.9563 -7.8995 11.2595 C.3 175 LEU175 -0.0626 2739 HD21 17.8707 -8.0013 10.1771 H 175 LEU175 0.0232 2740 HD22 16.9831 -8.1418 11.6871 H 175 LEU175 0.0232 2741 HD23 18.6715 -8.6473 11.5983 H 175 LEU175 0.0232 2742 N 20.5300 -4.7380 14.7700 N.am 176 GLN176 -0.2456 2743 H 19.6740 -4.5280 15.2840 H 176 GLN176 0.1312 2744 CA 21.6570 -3.7990 14.8020 C.3 176 GLN176 0.0882 2745 HA 21.8944 -3.5316 13.7722 H 176 GLN176 0.0557 2746 C 22.8830 -4.5170 15.4050 C.2 176 GLN176 0.2187 2747 O 23.9980 -4.4570 14.8840 O.2 176 GLN176 -0.2778 2748 CB 21.3325 -2.5481 15.6261 C.3 176 GLN176 -0.0210 2749 HB1 22.2523 -1.9839 15.7820 H 176 GLN176 0.0289 2750 HB2 20.9865 -2.8715 16.6056 H 176 GLN176 0.0289 2751 CG 20.3203 -1.5975 14.9669 C.3 176 GLN176 0.0225 2752 HG1 19.3927 -2.0979 14.7194 H 176 GLN176 0.0356 2753 HG2 20.7193 -1.2396 14.0210 H 176 GLN176 0.0356 2754 CD 19.9870 -0.3890 15.8646 C.2 176 GLN176 0.1981 2755 OE1 19.8804 0.7437 15.4145 O.2 176 GLN176 -0.2798 2756 NE2 19.8255 -0.6867 17.1596 N.am 176 GLN176 -0.2724 2757 HE21 19.5758 0.0281 17.8111 H 176 GLN176 0.1266 2758 HE22 19.9424 -1.6196 17.4979 H 176 GLN176 0.1266 2759 N 22.6720 -5.2180 16.5060 N.am 177 ALA177 -0.2459 2760 H 21.7270 -5.2730 16.8870 H 177 ALA177 0.1312 2761 CA 23.7470 -5.9080 17.1840 C.3 177 ALA177 0.0850 2762 HA 24.4885 -5.1553 17.4571 H 177 ALA177 0.0554 2763 C 24.3910 -6.8970 16.2230 C.2 177 ALA177 0.2184 2764 O 25.6130 -6.9890 16.1330 O.2 177 ALA177 -0.2778 2765 CB 23.2096 -6.5994 18.4395 C.3 177 ALA177 -0.0411 2766 HB1 24.0261 -7.0366 19.0120 H 177 ALA177 0.0249 2767 HB2 22.5040 -7.3937 18.1960 H 177 ALA177 0.0249 2768 HB3 22.6986 -5.8864 19.0868 H 177 ALA177 0.0249 2769 N 23.5870 -7.6070 15.4600 N.am 178 VAL178 -0.2454 2770 H 22.5760 -7.4870 15.5200 H 178 VAL178 0.1312 2771 CA 24.1630 -8.5640 14.5310 C.3 178 VAL178 0.0901 2772 HA 24.8475 -9.2067 15.0890 H 178 VAL178 0.0560 2773 C 24.9930 -7.7840 13.4990 C.2 178 VAL178 0.2189 2774 O 26.1010 -8.1700 13.1780 O.2 178 VAL178 -0.2778 2775 CB 23.0473 -9.4171 13.8929 C.3 178 VAL178 -0.0227 2776 HB 22.2606 -8.7459 13.5453 H 178 VAL178 0.0315 2777 CG1 23.5349 -10.2265 12.6786 C.3 178 VAL178 -0.0608 2778 HG11 22.7250 -10.8243 12.2608 H 178 VAL178 0.0233 2779 HG12 24.3458 -10.9022 12.9548 H 178 VAL178 0.0233 2780 HG13 23.8955 -9.5811 11.8774 H 178 VAL178 0.0233 2781 CG2 22.4375 -10.3702 14.9322 C.3 178 VAL178 -0.0608 2782 HG21 21.6356 -10.9598 14.4917 H 178 VAL178 0.0233 2783 HG22 22.0248 -9.8405 15.7881 H 178 VAL178 0.0233 2784 HG23 23.1873 -11.0614 15.3155 H 178 VAL178 0.0233 2785 N 24.4580 -6.6810 12.9800 N.am 179 LEU179 -0.2456 2786 H 23.5220 -6.3960 13.2690 H 179 LEU179 0.1312 2787 CA 25.1800 -5.8730 12.0090 C.3 179 LEU179 0.0880 2788 HA 25.4218 -6.5111 11.1600 H 179 LEU179 0.0557 2789 C 26.4830 -5.3750 12.6210 C.2 179 LEU179 0.2187 2790 O 27.5380 -5.4200 11.9890 O.2 179 LEU179 -0.2778 2791 CB 24.3590 -4.6398 11.5766 C.3 179 LEU179 -0.0266 2792 HB1 24.9932 -3.9513 11.0162 H 179 LEU179 0.0287 2793 HB2 24.0524 -4.0889 12.4652 H 179 LEU179 0.0287 2794 CG 23.1164 -4.9295 10.7217 C.3 179 LEU179 -0.0449 2795 HG 22.5099 -5.6739 11.2322 H 179 LEU179 0.0296 2796 CD1 22.2849 -3.6460 10.5789 C.3 179 LEU179 -0.0626 2797 HD11 21.4259 -3.8006 9.9314 H 179 LEU179 0.0232 2798 HD12 22.8780 -2.8374 10.1530 H 179 LEU179 0.0232 2799 HD13 21.9117 -3.3050 11.5435 H 179 LEU179 0.0232 2800 CD2 23.4756 -5.4915 9.3385 C.3 179 LEU179 -0.0626 2801 HD21 22.5776 -5.6875 8.7515 H 179 LEU179 0.0232 2802 HD22 24.0259 -6.4279 9.4159 H 179 LEU179 0.0232 2803 HD23 24.0902 -4.7920 8.7734 H 179 LEU179 0.0232 2804 N 26.4320 -4.9310 13.8720 N.am 180 LEU180 -0.2456 2805 H 25.5750 -5.0390 14.4150 H 180 LEU180 0.1312 2806 CA 27.5890 -4.2940 14.4670 C.3 180 LEU180 0.0880 2807 HA 27.9657 -3.5494 13.7664 H 180 LEU180 0.0557 2808 C 28.6890 -5.3060 14.7380 C.2 180 LEU180 0.2187 2809 O 29.8700 -5.0090 14.5520 O.2 180 LEU180 -0.2778 2810 CB 27.1006 -3.6427 15.7709 C.3 180 LEU180 -0.0266 2811 HB1 26.6139 -4.4119 16.3732 H 180 LEU180 0.0287 2812 HB2 26.3175 -2.9218 15.5349 H 180 LEU180 0.0287 2813 CG 28.1784 -2.9549 16.6283 C.3 180 LEU180 -0.0449 2814 HG 28.9687 -3.6737 16.8495 H 180 LEU180 0.0296 2815 CD1 28.8128 -1.7519 15.9176 C.3 180 LEU180 -0.0626 2816 HD11 29.5354 -1.2498 16.5599 H 180 LEU180 0.0232 2817 HD12 28.0588 -1.0158 15.6381 H 180 LEU180 0.0232 2818 HD13 29.3413 -2.0598 15.0153 H 180 LEU180 0.0232 2819 CD2 27.5636 -2.5382 17.9667 C.3 180 LEU180 -0.0626 2820 HD21 28.3172 -2.1518 18.6491 H 180 LEU180 0.0232 2821 HD22 27.0992 -3.3972 18.4461 H 180 LEU180 0.0232 2822 HD23 26.7973 -1.7738 17.8346 H 180 LEU180 0.0232 2823 N 28.2980 -6.4980 15.1870 N.am 181 MET181 -0.2456 2824 H 27.3030 -6.7240 15.2050 H 181 MET181 0.1312 2825 CA 29.2640 -7.4860 15.6530 C.3 181 MET181 0.0886 2826 HA 30.1510 -6.9765 16.0348 H 181 MET181 0.0557 2827 C 29.6670 -8.3650 14.4990 C.2 181 MET181 0.2188 2828 O 29.5970 -9.5840 14.5750 O.2 181 MET181 -0.2778 2829 CB 28.6107 -8.3368 16.7600 C.3 181 MET181 -0.0199 2830 HB1 29.2925 -9.1268 17.0814 H 181 MET181 0.0293 2831 HB2 27.7301 -8.8411 16.3577 H 181 MET181 0.0293 2832 CG 28.1919 -7.5231 17.9887 C.3 181 MET181 -0.0047 2833 HG1 27.6242 -8.1473 18.6770 H 181 MET181 0.0377 2834 HG2 27.5261 -6.7063 17.7111 H 181 MET181 0.0377 2835 SD 29.6113 -6.8411 18.8624 S.3 181 MET181 -0.1641 2836 CE 28.7171 -5.8418 20.0636 C.3 181 MET181 -0.0181 2837 HE1 29.2802 -5.7956 20.9946 H 181 MET181 0.0340 2838 HE2 27.7478 -6.2837 20.2922 H 181 MET181 0.0340 2839 HE3 28.5673 -4.8337 19.6791 H 181 MET181 0.0340 2840 N 30.0790 -7.7320 13.4180 N.am 182 SER182 -0.2436 2841 H 30.1620 -6.7160 13.4290 H 182 SER182 0.1312 2842 CA 30.4140 -8.4620 12.2190 C.3 182 SER182 0.1109 2843 HA 29.9548 -9.4532 12.1925 H 182 SER182 0.0580 2844 C 31.9320 -8.5420 12.0600 C.2 182 SER182 0.2210 2845 O 32.6370 -7.5720 12.3140 O.2 182 SER182 -0.2777 2846 CB 29.8890 -7.5278 11.1198 C.3 182 SER182 0.0681 2847 HB1 30.0534 -6.4907 11.4214 H 182 SER182 0.0577 2848 HB2 28.8054 -7.6177 11.0375 H 182 SER182 0.0577 2849 OG 30.5223 -7.6436 9.8621 O.3 182 SER182 -0.3930 2850 HG 30.4417 -8.5326 9.5189 H 182 SER182 0.2095 2851 N 32.4380 -9.6900 11.6280 N.am 183 THR183 -0.2433 2852 H 31.8300 -10.5020 11.5250 H 183 THR183 0.1313 2853 CA 33.8540 -9.8030 11.2990 C.3 183 THR183 0.1135 2854 HA 34.4369 -9.0446 11.8228 H 183 THR183 0.0583 2855 C 34.1230 -9.7130 9.8050 C.2 183 THR183 0.2212 2856 O 35.2080 -10.0650 9.3690 O.2 183 THR183 -0.2777 2857 CB 34.2527 -11.2178 11.7803 C.3 183 THR183 0.0763 2858 HB 35.2989 -11.4130 11.5288 H 183 THR183 0.0611 2859 OG1 33.4435 -12.1260 11.0502 O.3 183 THR183 -0.3900 2860 HG1 33.4007 -12.9817 11.4870 H 183 THR183 0.2098 2861 CG2 34.0829 -11.3848 13.3045 C.3 183 THR183 -0.0370 2862 HG21 34.4822 -12.3398 13.6475 H 183 THR183 0.0255 2863 HG22 33.0349 -11.3501 13.6035 H 183 THR183 0.0255 2864 HG23 34.6144 -10.6026 13.8449 H 183 THR183 0.0255 2865 N 33.1630 -9.2240 9.0140 N.am 184 ASP184 -0.2450 2866 H 32.2240 -9.0880 9.3880 H 184 ASP184 0.1312 2867 CA 33.4440 -8.8790 7.6070 C.3 184 ASP184 0.0974 2868 HA 34.2453 -9.5593 7.3131 H 184 ASP184 0.0563 2869 C 34.1290 -7.5180 7.4560 C.2 184 ASP184 0.2192 2870 O 33.6590 -6.6640 6.6960 O.2 184 ASP184 -0.2778 2871 CB 32.3564 -9.2857 6.5899 C.3 184 ASP184 0.0576 2872 HB1 32.2189 -10.3658 6.6417 H 184 ASP184 0.0394 2873 HB2 32.7030 -9.0806 5.5772 H 184 ASP184 0.0394 2874 CG 30.9678 -8.6667 6.7498 C.2 184 ASP184 0.1780 2875 OD1 30.2088 -9.1000 7.6078 O.co2 184 ASP184 -0.6478 2876 OD2 30.6263 -7.7559 6.0025 O.co2 184 ASP184 -0.6478 2877 N 35.2260 -7.3040 8.1800 N.am 185 ARG185 -0.2456 2878 H 35.5480 -8.0420 8.8060 H 185 ARG185 0.1312 2879 CA 35.9950 -6.0490 8.1170 C.3 185 ARG185 0.0879 2880 HA 35.8584 -5.6150 7.1246 H 185 ARG185 0.0557 2881 C 37.4610 -6.3700 8.2790 C.2 185 ARG185 0.2187 2882 O 37.8240 -7.2980 8.9870 O.2 185 ARG185 -0.2778 2883 CB 35.4652 -5.0842 9.2124 C.3 185 ARG185 -0.0258 2884 HB1 36.1231 -4.2140 9.2275 H 185 ARG185 0.0286 2885 HB2 35.5677 -5.5391 10.1984 H 185 ARG185 0.0286 2886 CG 34.0099 -4.5644 9.0187 C.3 185 ARG185 -0.0154 2887 HG1 33.7743 -4.4909 7.9573 H 185 ARG185 0.0299 2888 HG2 33.9755 -3.5391 9.3892 H 185 ARG185 0.0299 2889 CD 32.8986 -5.3440 9.7653 C.3 185 ARG185 0.1045 2890 HD1 33.1115 -5.3694 10.8364 H 185 ARG185 0.0711 2891 HD2 32.8180 -6.3872 9.4552 H 185 ARG185 0.0711 2892 NE 31.5777 -4.6967 9.6223 N.pl3 185 ARG185 -0.4450 2893 HE 31.2458 -4.0495 10.3034 H 185 ARG185 0.3153 2894 CZ 30.7151 -4.9288 8.6235 C.cat 185 ARG185 0.5062 2895 NH1 31.0349 -5.7404 7.6632 N.pl3 185 ARG185 -0.4573 2896 HH11 30.3930 -6.0153 6.9442 H 185 ARG185 0.3114 2897 HH12 31.9378 -6.1563 7.6165 H 185 ARG185 0.3114 2898 NH2 29.5409 -4.3457 8.6080 N.pl3 185 ARG185 -0.4573 2899 HH21 28.8987 -4.4630 7.8411 H 185 ARG185 0.3114 2900 HH22 29.2237 -3.7591 9.3449 H 185 ARG185 0.3114 2901 N 38.3260 -5.5800 7.6860 N.am 186 SER186 -0.2436 2902 H 38.0200 -4.7760 7.1380 H 186 SER186 0.1312 2903 CA 39.7380 -5.8950 7.8410 C.3 186 SER186 0.1109 2904 HA 39.8781 -6.9724 7.9558 H 186 SER186 0.0580 2905 C 40.2840 -5.1860 9.0660 C.2 186 SER186 0.2207 2906 O 39.7920 -4.1130 9.4580 O.2 186 SER186 -0.2777 2907 CB 40.4879 -5.4364 6.5803 C.3 186 SER186 0.0681 2908 HB1 40.1338 -6.0296 5.7305 H 186 SER186 0.0577 2909 HB2 41.5603 -5.6308 6.6959 H 186 SER186 0.0577 2910 OG 40.2572 -4.0552 6.3283 O.3 186 SER186 -0.3930 2911 HG 40.7324 -3.7531 5.5574 H 186 SER186 0.2095 2912 N 41.2980 -5.7910 9.6720 N.am 187 GLY187 -0.2484 2913 H 41.5010 -6.7670 9.4550 H 187 GLY187 0.1309 2914 CA 42.1210 -5.0920 10.6350 C.3 187 GLY187 0.0765 2915 HA1 42.1994 -4.0403 10.3533 H 187 GLY187 0.0521 2916 HA2 43.1158 -5.5319 10.5803 H 187 GLY187 0.0521 2917 C 41.6280 -5.1930 12.0600 C.2 187 GLY187 0.2155 2918 O 41.9700 -4.3550 12.9010 O.2 187 GLY187 -0.2781 2919 N 40.8430 -6.2130 12.3590 N.am 188 LEU188 -0.2459 2920 H 40.5440 -6.8680 11.6360 H 188 LEU188 0.1312 2921 CA 40.4140 -6.3840 13.7370 C.3 188 LEU188 0.0880 2922 HA 40.3224 -5.4151 14.2344 H 188 LEU188 0.0557 2923 C 41.3810 -7.2730 14.5190 C.2 188 LEU188 0.2187 2924 O 42.0610 -8.1370 13.9440 O.2 188 LEU188 -0.2778 2925 CB 39.0375 -7.0914 13.7003 C.3 188 LEU188 -0.0266 2926 HB1 38.7274 -7.3771 14.7073 H 188 LEU188 0.0287 2927 HB2 39.1590 -8.0263 13.1553 H 188 LEU188 0.0287 2928 CG 37.8909 -6.2982 13.0351 C.3 188 LEU188 -0.0449 2929 HG 38.2515 -5.8679 12.1005 H 188 LEU188 0.0296 2930 CD1 36.7209 -7.2303 12.6841 C.3 188 LEU188 -0.0626 2931 HD11 35.8965 -6.6791 12.2317 H 188 LEU188 0.0232 2932 HD12 36.3350 -7.7293 13.5734 H 188 LEU188 0.0232 2933 HD13 37.0294 -8.0017 11.9779 H 188 LEU188 0.0232 2934 CD2 37.3941 -5.1556 13.9304 C.3 188 LEU188 -0.0626 2935 HD21 36.5719 -4.6132 13.4659 H 188 LEU188 0.0232 2936 HD22 38.1916 -4.4432 14.1364 H 188 LEU188 0.0232 2937 HD23 37.0292 -5.5332 14.8858 H 188 LEU188 0.0232 2938 N 41.4420 -7.0260 15.8260 N.am 189 LEU189 -0.2456 2939 H 40.9000 -6.2450 16.1960 H 189 LEU189 0.1312 2940 CA 42.2370 -7.8070 16.7490 C.3 189 LEU189 0.0880 2941 HA 43.1089 -8.1833 16.2132 H 189 LEU189 0.0557 2942 C 41.4330 -9.0060 17.2530 C.2 189 LEU189 0.2187 2943 O 41.8270 -10.1580 17.0660 O.2 189 LEU189 -0.2778 2944 CB 42.6841 -6.9167 17.9298 C.3 189 LEU189 -0.0266 2945 HB1 43.3196 -7.5172 18.5811 H 189 LEU189 0.0287 2946 HB2 41.8260 -6.6359 18.5408 H 189 LEU189 0.0287 2947 CG 43.4549 -5.6299 17.5591 C.3 189 LEU189 -0.0449 2948 HG 43.9560 -5.3090 18.4732 H 189 LEU189 0.0296 2949 CD1 44.5482 -5.8697 16.5096 C.3 189 LEU189 -0.0626 2950 HD11 45.1573 -4.9758 16.3745 H 189 LEU189 0.0232 2951 HD12 44.1193 -6.1227 15.5397 H 189 LEU189 0.0232 2952 HD13 45.2095 -6.6824 16.8095 H 189 LEU189 0.0232 2953 CD2 42.5373 -4.4595 17.1645 C.3 189 LEU189 -0.0626 2954 HD21 43.1073 -3.5335 17.0953 H 189 LEU189 0.0232 2955 HD22 41.7515 -4.3053 17.9050 H 189 LEU189 0.0232 2956 HD23 42.0566 -4.6074 16.1988 H 189 LEU189 0.0232 2957 N 40.2980 -8.7250 17.8780 N.am 190 CAS190 -0.2449 2958 H 39.9690 -7.7600 17.8860 H 190 CAS190 0.1312 2959 CA 39.5020 -9.7400 18.5530 C.3 190 CAS190 0.0965 2960 HA 40.1798 -10.5040 18.9364 H 190 CAS190 0.0565 2961 CB 38.7898 -9.0558 19.7200 C.3 190 CAS190 0.0147 2962 HB1 38.2933 -9.8066 20.3231 H 190 CAS190 0.0394 2963 HB2 38.0328 -8.3649 19.3469 H 190 CAS190 0.0394 2964 C 38.5230 -10.3900 17.6170 C.2 190 CAS190 0.2195 2965 O 37.3240 -10.4460 17.8690 O.2 190 CAS190 -0.2778 2966 SG 39.9131 -8.1321 20.7924 S.3 190 CAS190 -0.1762 2967 HG 40.2142 -6.9934 20.1544 H 190 CAS190 0.1017 2968 N 39.0520 -10.9040 16.5140 N.am 191 VAL191 -0.2454 2969 H 40.0650 -10.8890 16.3970 H 191 VAL191 0.1312 2970 CA 38.2270 -11.4880 15.4670 C.3 191 VAL191 0.0901 2971 HA 37.5977 -10.6832 15.0825 H 191 VAL191 0.0560 2972 C 37.3090 -12.5670 16.0550 C.2 191 VAL191 0.2189 2973 O 36.1590 -12.7090 15.6150 O.2 191 VAL191 -0.2778 2974 CB 39.1174 -12.0528 14.3397 C.3 191 VAL191 -0.0227 2975 HB 39.7247 -12.8580 14.7555 H 191 VAL191 0.0315 2976 CG1 38.2783 -12.6374 13.1900 C.3 191 VAL191 -0.0608 2977 HG11 38.9153 -13.0060 12.3862 H 191 VAL191 0.0233 2978 HG12 37.6114 -11.8845 12.7680 H 191 VAL191 0.0233 2979 HG13 37.6623 -13.4737 13.5219 H 191 VAL191 0.0233 2980 CG2 40.0798 -10.9887 13.7888 C.3 191 VAL191 -0.0608 2981 HG21 40.7120 -11.4030 13.0037 H 191 VAL191 0.0233 2982 HG22 40.7418 -10.5895 14.5574 H 191 VAL191 0.0233 2983 HG23 39.5267 -10.1555 13.3596 H 191 VAL191 0.0233 2984 N 37.8050 -13.2740 17.0770 N.am 192 ASP192 -0.2451 2985 H 38.7510 -13.0780 17.4030 H 192 ASP192 0.1312 2986 CA 37.0330 -14.3110 17.7330 C.3 192 ASP192 0.0974 2987 HA 36.4361 -14.7968 16.9571 H 192 ASP192 0.0563 2988 C 36.0380 -13.8990 18.8200 C.2 192 ASP192 0.2192 2989 O 34.9650 -14.5110 18.9450 O.2 192 ASP192 -0.2778 2990 CB 37.9905 -15.3828 18.2934 C.3 192 ASP192 0.0576 2991 HB1 38.6939 -14.9330 18.9934 H 192 ASP192 0.0394 2992 HB2 38.5808 -15.8162 17.4876 H 192 ASP192 0.0394 2993 CG 37.2523 -16.5339 19.0123 C.2 192 ASP192 0.1780 2994 OD1 37.3279 -16.5983 20.2379 O.co2 192 ASP192 -0.6478 2995 OD2 36.6086 -17.3425 18.3447 O.co2 192 ASP192 -0.6478 2996 N 36.3900 -12.9000 19.6280 N.am 193 LYS193 -0.2456 2997 H 37.3340 -12.5180 19.5690 H 193 LYS193 0.1312 2998 CA 35.4460 -12.3380 20.6020 C.3 193 LYS193 0.0878 2999 HA 35.0778 -13.1869 21.1816 H 193 LYS193 0.0557 3000 C 34.2460 -11.7890 19.8070 C.2 193 LYS193 0.2187 3001 O 33.0690 -12.0010 20.1460 O.2 193 LYS193 -0.2778 3002 CB 35.9837 -11.2675 21.5768 C.3 193 LYS193 -0.0289 3003 HB1 36.5239 -10.5088 21.0207 H 193 LYS193 0.0285 3004 HB2 36.6900 -11.7286 22.2672 H 193 LYS193 0.0285 3005 CG 34.8324 -10.5698 22.3466 C.3 193 LYS193 -0.0496 3006 HG1 34.0495 -11.2931 22.5788 H 193 LYS193 0.0266 3007 HG2 34.3646 -9.8604 21.6612 H 193 LYS193 0.0266 3008 CD 35.2017 -9.7991 23.6281 C.3 193 LYS193 -0.0278 3009 HD1 34.4919 -8.9746 23.7217 H 193 LYS193 0.0282 3010 HD2 36.1815 -9.3287 23.5348 H 193 LYS193 0.0282 3011 CE 35.1083 -10.6545 24.9076 C.3 193 LYS193 0.1103 3012 HE1 36.0852 -11.0657 25.1674 H 193 LYS193 0.0559 3013 HE2 34.4389 -11.5025 24.7537 H 193 LYS193 0.0559 3014 NZ 34.5881 -9.9198 26.0613 N.4 193 LYS193 -0.0749 3015 HZ1 34.4948 -10.4942 26.9207 H 193 LYS193 0.2742 3016 HZ2 33.6452 -9.5068 25.8882 H 193 LYS193 0.2742 3017 HZ3 35.1744 -9.1060 26.3424 H 193 LYS193 0.2742 3018 N 34.5400 -11.1260 18.7020 N.am 194 ILE194 -0.2454 3019 H 35.5110 -11.0170 18.4090 H 194 ILE194 0.1312 3020 CA 33.4650 -10.5530 17.9080 C.3 194 ILE194 0.0903 3021 HA 32.8549 -9.9494 18.5816 H 194 ILE194 0.0560 3022 C 32.5330 -11.6090 17.2690 C.2 194 ILE194 0.2189 3023 O 31.3030 -11.4740 17.2850 O.2 194 ILE194 -0.2778 3024 CB 34.0863 -9.6217 16.8337 C.3 194 ILE194 -0.0201 3025 HB 34.7769 -10.2268 16.2427 H 194 ILE194 0.0318 3026 CG1 34.8980 -8.4768 17.4829 C.3 194 ILE194 -0.0514 3027 HG11 35.5106 -8.8541 18.2991 H 194 ILE194 0.0266 3028 HG12 34.2186 -7.7575 17.9399 H 194 ILE194 0.0266 3029 CG2 33.0277 -9.0377 15.8735 C.3 194 ILE194 -0.0605 3030 HG21 33.4860 -8.4145 15.1064 H 194 ILE194 0.0233 3031 HG22 32.3023 -8.4260 16.4099 H 194 ILE194 0.0233 3032 HG23 32.4770 -9.8163 15.3457 H 194 ILE194 0.0233 3033 CD1 35.8399 -7.7578 16.5071 C.3 194 ILE194 -0.0650 3034 HD11 36.4514 -7.0195 17.0277 H 194 ILE194 0.0230 3035 HD12 35.2922 -7.2336 15.7258 H 194 ILE194 0.0230 3036 HD13 36.5214 -8.4611 16.0275 H 194 ILE194 0.0230 3037 N 33.1270 -12.6740 16.7440 N.am 195 GLU195 -0.2456 3038 H 34.1460 -12.7280 16.7350 H 195 GLU195 0.1312 3039 CA 32.3470 -13.7660 16.1810 C.3 195 GLU195 0.0883 3040 HA 31.7073 -13.3170 15.4196 H 195 GLU195 0.0557 3041 C 31.4420 -14.3970 17.2790 C.2 195 GLU195 0.2187 3042 O 30.2330 -14.5200 17.1030 O.2 195 GLU195 -0.2778 3043 CB 33.2985 -14.7987 15.5550 C.3 195 GLU195 -0.0193 3044 HB1 33.6677 -15.4867 16.3161 H 195 GLU195 0.0290 3045 HB2 34.1877 -14.2956 15.1728 H 195 GLU195 0.0290 3046 CG 32.6465 -15.5782 14.4031 C.3 195 GLU195 0.0356 3047 HG1 31.6493 -15.9265 14.6718 H 195 GLU195 0.0374 3048 HG2 33.2411 -16.4580 14.1600 H 195 GLU195 0.0374 3049 CD 32.5576 -14.6994 13.1454 C.2 195 GLU195 0.1760 3050 OE1 33.4475 -14.7936 12.3041 O.co2 195 GLU195 -0.6478 3051 OE2 31.6070 -13.9302 13.0201 O.co2 195 GLU195 -0.6478 3052 N 32.0200 -14.7070 18.4260 N.am 196 LYS196 -0.2457 3053 H 33.0290 -14.5860 18.5180 H 196 LYS196 0.1312 3054 CA 31.2700 -15.2130 19.5580 C.3 196 LYS196 0.0878 3055 HA 30.7503 -16.1076 19.2093 H 196 LYS196 0.0557 3056 C 30.1780 -14.2390 20.0550 C.2 196 LYS196 0.2187 3057 O 29.0580 -14.6560 20.3960 O.2 196 LYS196 -0.2778 3058 CB 32.2006 -15.5851 20.7333 C.3 196 LYS196 -0.0289 3059 HB1 31.5760 -15.9263 21.5602 H 196 LYS196 0.0285 3060 HB2 32.7047 -14.6866 21.0919 H 196 LYS196 0.0285 3061 CG 33.2687 -16.6762 20.4900 C.3 196 LYS196 -0.0496 3062 HG1 33.6486 -16.9756 21.4672 H 196 LYS196 0.0266 3063 HG2 34.1413 -16.2888 19.9792 H 196 LYS196 0.0266 3064 CD 32.7998 -17.9358 19.7531 C.3 196 LYS196 -0.0278 3065 HD1 31.7850 -18.1842 20.0608 H 196 LYS196 0.0282 3066 HD2 33.4243 -18.7715 20.0703 H 196 LYS196 0.0282 3067 CE 32.9135 -17.8204 18.2240 C.3 196 LYS196 0.1103 3068 HE1 33.9434 -17.6290 17.9122 H 196 LYS196 0.0559 3069 HE2 32.3029 -17.0130 17.8405 H 196 LYS196 0.0559 3070 NZ 32.4300 -19.0091 17.5466 N.4 196 LYS196 -0.0749 3071 HZ1 32.2202 -18.8002 16.5488 H 196 LYS196 0.2742 3072 HZ2 31.4834 -19.2533 17.9179 H 196 LYS196 0.2742 3073 HZ3 33.0861 -19.7989 17.6530 H 196 LYS196 0.2742 3074 N 30.4680 -12.9460 20.0710 N.am 197 SER197 -0.2436 3075 H 31.4110 -12.6310 19.8430 H 197 SER197 0.1312 3076 CA 29.4430 -11.9820 20.4130 C.3 197 SER197 0.1109 3077 HA 29.0435 -12.2286 21.3976 H 197 SER197 0.0580 3078 C 28.2760 -11.9610 19.3690 C.2 197 SER197 0.2209 3079 O 27.0690 -11.8330 19.7380 O.2 197 SER197 -0.2777 3080 CB 30.1121 -10.5962 20.4126 C.3 197 SER197 0.0681 3081 HB1 30.5983 -10.4445 19.4411 H 197 SER197 0.0577 3082 HB2 30.9004 -10.5811 21.1709 H 197 SER197 0.0577 3083 OG 29.1811 -9.5507 20.6779 O.3 197 SER197 -0.3930 3084 HG 29.5648 -8.6947 20.4984 H 197 SER197 0.2095 3085 N 28.6210 -12.0860 18.0790 N.am 198 GLN198 -0.2456 3086 H 29.6050 -12.1110 17.8120 H 198 GLN198 0.1312 3087 CA 27.5830 -12.1860 17.0600 C.3 198 GLN198 0.0882 3088 HA 26.9360 -11.3155 17.1782 H 198 GLN198 0.0557 3089 C 26.7420 -13.4680 17.2020 C.2 198 GLN198 0.2187 3090 O 25.5020 -13.4230 17.0230 O.2 198 GLN198 -0.2778 3091 CB 28.2613 -12.1711 15.6794 C.3 198 GLN198 -0.0210 3092 HB1 28.7220 -13.1391 15.4733 H 198 GLN198 0.0289 3093 HB2 29.0909 -11.4718 15.7217 H 198 GLN198 0.0289 3094 CG 27.2866 -11.7804 14.5496 C.3 198 GLN198 0.0225 3095 HG1 26.8003 -10.8366 14.7958 H 198 GLN198 0.0356 3096 HG2 26.4982 -12.5254 14.4586 H 198 GLN198 0.0356 3097 CD 27.9325 -11.6016 13.1616 C.2 198 GLN198 0.1981 3098 OE1 27.4201 -10.8694 12.3225 O.2 198 GLN198 -0.2798 3099 NE2 29.0642 -12.2943 12.9577 N.am 198 GLN198 -0.2724 3100 HE21 29.5494 -12.2536 12.0847 H 198 GLN198 0.1266 3101 HE22 29.4971 -12.8819 13.6434 H 198 GLN198 0.1266 3102 N 27.3990 -14.5820 17.5440 N.am 199 GLU199 -0.2456 3103 H 28.4140 -14.5490 17.6400 H 199 GLU199 0.1312 3104 CA 26.7070 -15.8400 17.7830 C.3 199 GLU199 0.0883 3105 HA 26.1633 -16.0893 16.8708 H 199 GLU199 0.0557 3106 C 25.7140 -15.7160 18.9000 C.2 199 GLU199 0.2187 3107 O 24.5830 -16.1370 18.7340 O.2 199 GLU199 -0.2778 3108 CB 27.7270 -16.9500 18.1189 C.3 199 GLU199 -0.0193 3109 HB1 27.2053 -17.8272 18.5060 H 199 GLU199 0.0290 3110 HB2 28.3771 -16.6077 18.9243 H 199 GLU199 0.0290 3111 CG 28.5846 -17.4044 16.9206 C.3 199 GLU199 0.0356 3112 HG1 29.1083 -16.5622 16.4741 H 199 GLU199 0.0374 3113 HG2 27.9476 -17.8247 16.1434 H 199 GLU199 0.0374 3114 CD 29.6423 -18.4661 17.2999 C.2 199 GLU199 0.1760 3115 OE1 29.9322 -18.6710 18.4748 O.co2 199 GLU199 -0.6478 3116 OE2 30.2086 -19.1048 16.4173 O.co2 199 GLU199 -0.6478 3117 N 26.1190 -15.1210 20.0230 N.am 200 ALA200 -0.2459 3118 H 27.0730 -14.7630 20.0770 H 200 ALA200 0.1312 3119 CA 25.2370 -14.9670 21.1780 C.3 200 ALA200 0.0850 3120 HA 24.8672 -15.9569 21.4512 H 200 ALA200 0.0554 3121 C 24.0510 -14.0840 20.7990 C.2 200 ALA200 0.2184 3122 O 22.8920 -14.4360 21.0950 O.2 200 ALA200 -0.2778 3123 CB 26.0319 -14.3429 22.3310 C.3 200 ALA200 -0.0411 3124 HB1 25.4092 -14.2154 23.2175 H 200 ALA200 0.0249 3125 HB2 26.4346 -13.3667 22.0572 H 200 ALA200 0.0249 3126 HB3 26.8727 -14.9798 22.6059 H 200 ALA200 0.0249 3127 N 24.3280 -12.9660 20.1240 N.am 201 TYR201 -0.2453 3128 H 25.3040 -12.7230 19.9530 H 201 TYR201 0.1312 3129 CA 23.2830 -12.0820 19.6240 C.3 201 TYR201 0.0917 3130 HA 22.6573 -11.8582 20.4893 H 201 TYR201 0.0560 3131 C 22.3300 -12.7330 18.6010 C.2 201 TYR201 0.2190 3132 O 21.1300 -12.5070 18.6740 O.2 201 TYR201 -0.2778 3133 CB 23.8896 -10.7787 19.0598 C.3 201 TYR201 -0.0036 3134 HB1 23.2111 -10.3186 18.3391 H 201 TYR201 0.0333 3135 HB2 24.8065 -10.9974 18.5107 H 201 TYR201 0.0333 3136 CG 24.1455 -9.7432 20.1298 C.ar 201 TYR201 -0.0453 3137 CD1 25.4273 -9.2591 20.3770 C.ar 201 TYR201 -0.0561 3138 HD1 26.2672 -9.6249 19.8085 H 201 TYR201 0.0621 3139 CD2 23.0831 -9.2131 20.8577 C.ar 201 TYR201 -0.0561 3140 HD2 22.0804 -9.5667 20.6737 H 201 TYR201 0.0621 3141 CE1 25.6471 -8.2937 21.3518 C.ar 201 TYR201 -0.0317 3142 HE1 26.6492 -7.9448 21.5511 H 201 TYR201 0.0643 3143 CE2 23.2966 -8.2386 21.8239 C.ar 201 TYR201 -0.0317 3144 HE2 22.4645 -7.8484 22.3900 H 201 TYR201 0.0643 3145 CZ 24.5810 -7.7802 22.0747 C.ar 201 TYR201 0.0726 3146 OH 24.7993 -6.8261 23.0478 O.3 201 TYR201 -0.3598 3147 HH 23.9904 -6.6576 23.5131 H 201 TYR201 0.2173 3148 N 22.8600 -13.5130 17.6450 N.am 202 LEU202 -0.2456 3149 H 23.8750 -13.5820 17.5730 H 202 LEU202 0.1312 3150 CA 22.0300 -14.2700 16.6990 C.3 202 LEU202 0.0880 3151 HA 21.3620 -13.5664 16.2031 H 202 LEU202 0.0557 3152 C 21.1820 -15.2910 17.4400 C.2 202 LEU202 0.2187 3153 O 19.9870 -15.4690 17.1700 O.2 202 LEU202 -0.2778 3154 CB 22.9455 -14.9946 15.6935 C.3 202 LEU202 -0.0266 3155 HB1 22.4029 -15.7965 15.1895 H 202 LEU202 0.0287 3156 HB2 23.7462 -15.4856 16.2494 H 202 LEU202 0.0287 3157 CG 23.5522 -14.0727 14.6218 C.3 202 LEU202 -0.0449 3158 HG 23.9028 -13.1596 15.1009 H 202 LEU202 0.0296 3159 CD1 24.7702 -14.7325 13.9628 C.3 202 LEU202 -0.0626 3160 HD11 25.2081 -14.0830 13.2043 H 202 LEU202 0.0232 3161 HD12 24.4980 -15.6718 13.4812 H 202 LEU202 0.0232 3162 HD13 25.5462 -14.9475 14.6984 H 202 LEU202 0.0232 3163 CD2 22.5100 -13.6968 13.5591 C.3 202 LEU202 -0.0626 3164 HD21 22.9422 -13.0400 12.8055 H 202 LEU202 0.0232 3165 HD22 21.6540 -13.1853 13.9965 H 202 LEU202 0.0232 3166 HD23 22.1369 -14.5835 13.0460 H 202 LEU202 0.0232 3167 N 21.8350 -15.9700 18.3780 N.am 203 LEU203 -0.2456 3168 H 22.8200 -15.7670 18.5470 H 203 LEU203 0.1312 3169 CA 21.1810 -16.9860 19.1610 C.3 203 LEU203 0.0880 3170 HA 20.7290 -17.6985 18.4710 H 203 LEU203 0.0557 3171 C 20.0440 -16.3310 19.9510 C.2 203 LEU203 0.2187 3172 O 18.9260 -16.8080 19.8890 O.2 203 LEU203 -0.2778 3173 CB 22.1766 -17.6846 20.1024 C.3 203 LEU203 -0.0266 3174 HB1 21.6417 -18.1969 20.9049 H 203 LEU203 0.0287 3175 HB2 22.7838 -16.9271 20.5973 H 203 LEU203 0.0287 3176 CG 23.0816 -18.7055 19.3874 C.3 203 LEU203 -0.0449 3177 HG 23.4451 -18.2651 18.4593 H 203 LEU203 0.0296 3178 CD1 24.3043 -19.0451 20.2497 C.3 203 LEU203 -0.0626 3179 HD11 24.9624 -19.7488 19.7401 H 203 LEU203 0.0232 3180 HD12 24.0024 -19.4910 21.1979 H 203 LEU203 0.0232 3181 HD13 24.8880 -18.1526 20.4743 H 203 LEU203 0.0232 3182 CD2 22.3101 -19.9832 19.0272 C.3 203 LEU203 -0.0626 3183 HD21 22.9593 -20.7057 18.5327 H 203 LEU203 0.0232 3184 HD22 21.4796 -19.7759 18.3531 H 203 LEU203 0.0232 3185 HD23 21.9009 -20.4575 19.9198 H 203 LEU203 0.0232 3186 N 20.3030 -15.2130 20.6280 N.am 204 ALA204 -0.2459 3187 H 21.2330 -14.7960 20.5860 H 204 ALA204 0.1312 3188 CA 19.2570 -14.5850 21.4290 C.3 204 ALA204 0.0850 3189 HA 18.8297 -15.3589 22.0699 H 204 ALA204 0.0554 3190 C 18.1560 -14.0390 20.5420 C.2 204 ALA204 0.2184 3191 O 16.9890 -14.0330 20.9360 O.2 204 ALA204 -0.2778 3192 CB 19.8843 -13.4800 22.2846 C.3 204 ALA204 -0.0411 3193 HB1 19.1401 -12.9976 22.9181 H 204 ALA204 0.0249 3194 HB2 20.3572 -12.7165 21.6662 H 204 ALA204 0.0249 3195 HB3 20.6498 -13.9000 22.9379 H 204 ALA204 0.0249 3196 N 18.5610 -13.5780 19.3500 N.am 205 PHE205 -0.2453 3197 H 19.5510 -13.6650 19.1200 H 205 PHE205 0.1312 3198 CA 17.6850 -12.9610 18.3590 C.3 205 PHE205 0.0917 3199 HA 17.0708 -12.2564 18.9143 H 205 PHE205 0.0560 3200 C 16.7180 -13.9940 17.7630 C.2 205 PHE205 0.2190 3201 O 15.4910 -13.8130 17.8010 O.2 205 PHE205 -0.2778 3202 CB 18.5140 -12.2221 17.3018 C.3 205 PHE205 -0.0036 3203 HB1 19.1166 -12.9338 16.7368 H 205 PHE205 0.0333 3204 HB2 19.2094 -11.5663 17.8175 H 205 PHE205 0.0333 3205 CG 17.7550 -11.3397 16.3388 C.ar 205 PHE205 -0.0454 3206 CD1 16.3991 -11.0336 16.4734 C.ar 205 PHE205 -0.0585 3207 HD1 15.8043 -11.4290 17.2814 H 205 PHE205 0.0620 3208 CD2 18.4642 -10.7580 15.2947 C.ar 205 PHE205 -0.0585 3209 HD2 19.5164 -10.9670 15.1836 H 205 PHE205 0.0620 3210 CE1 15.7678 -10.2001 15.5602 C.ar 205 PHE205 -0.0615 3211 HE1 14.7120 -9.9912 15.6584 H 205 PHE205 0.0618 3212 CE2 17.8381 -9.9183 14.3885 C.ar 205 PHE205 -0.0615 3213 HE2 18.4024 -9.4934 13.5770 H 205 PHE205 0.0618 3214 CZ 16.4900 -9.6331 14.5222 C.ar 205 PHE205 -0.0617 3215 HZ 16.0063 -8.9657 13.8251 H 205 PHE205 0.0618 3216 N 17.2330 -15.0920 17.2400 N.am 206 GLU206 -0.2456 3217 H 18.2410 -15.2110 17.1430 H 206 GLU206 0.1312 3218 CA 16.3150 -16.1110 16.8130 C.3 206 GLU206 0.0883 3219 HA 15.6669 -15.6267 16.0796 H 206 GLU206 0.0557 3220 C 15.4220 -16.5880 17.9780 C.2 206 GLU206 0.2187 3221 O 14.2330 -16.8270 17.7960 O.2 206 GLU206 -0.2778 3222 CB 16.9316 -17.3548 16.1298 C.3 206 GLU206 -0.0193 3223 HB1 17.4381 -17.9808 16.8660 H 206 GLU206 0.0290 3224 HB2 17.6897 -17.0546 15.4073 H 206 GLU206 0.0290 3225 CG 15.8062 -18.1450 15.4065 C.3 206 GLU206 0.0356 3226 HG1 15.4631 -17.5790 14.5463 H 206 GLU206 0.0374 3227 HG2 14.9328 -18.2373 16.0451 H 206 GLU206 0.0374 3228 CD 16.0825 -19.5950 14.9764 C.2 206 GLU206 0.1760 3229 OE1 16.6313 -20.3731 15.7437 O.co2 206 GLU206 -0.6478 3230 OE2 15.7045 -19.9841 13.8717 O.co2 206 GLU206 -0.6478 3231 N 16.0050 -16.7610 19.1590 N.am 207 HIS207 -0.2453 3232 H 16.9900 -16.5230 19.2770 H 207 HIS207 0.1312 3233 CA 15.2630 -17.2790 20.2670 C.3 207 HIS207 0.0932 3234 HA 14.8184 -18.2145 19.9370 H 207 HIS207 0.0561 3235 C 14.1190 -16.3450 20.5810 C.2 207 HIS207 0.2190 3236 O 13.0250 -16.7660 20.8800 O.2 207 HIS207 -0.2778 3237 CB 16.1785 -17.5584 21.4698 C.3 207 HIS207 0.0146 3238 HB1 15.5841 -17.6759 22.3716 H 207 HIS207 0.0348 3239 HB2 16.8667 -16.7327 21.6514 H 207 HIS207 0.0348 3240 CG 16.9672 -18.8428 21.2796 C.ar 207 HIS207 0.0551 3241 ND1 17.2851 -19.6730 22.2956 N.ar 207 HIS207 -0.2469 3242 CD2 17.5345 -19.3728 20.1048 C.ar 207 HIS207 0.0047 3243 HD2 17.4797 -18.9446 19.1158 H 207 HIS207 0.0764 3244 CE1 18.1458 -20.5679 21.7894 C.ar 207 HIS207 0.0737 3245 HE1 18.6700 -21.2885 22.3983 H 207 HIS207 0.0963 3246 NE2 18.2614 -20.4591 20.4543 N.ar 207 HIS207 -0.2539 3247 HE2 18.8364 -20.9876 19.8655 H 207 HIS207 0.1339 3248 N 14.3950 -15.0570 20.4710 N.am 208 TYR208 -0.2453 3249 H 15.3490 -14.7770 20.2440 H 208 TYR208 0.1312 3250 CA 13.3960 -14.0310 20.6600 C.3 208 TYR208 0.0917 3251 HA 12.9230 -14.2389 21.6210 H 208 TYR208 0.0560 3252 C 12.2840 -14.0370 19.5940 C.2 208 TYR208 0.2190 3253 O 11.0930 -13.8660 19.9480 O.2 208 TYR208 -0.2778 3254 CB 14.0894 -12.6622 20.7232 C.3 208 TYR208 -0.0036 3255 HB1 14.6056 -12.4494 19.7864 H 208 TYR208 0.0333 3256 HB2 14.8579 -12.6779 21.4963 H 208 TYR208 0.0333 3257 CG 13.1186 -11.5527 21.0340 C.ar 208 TYR208 -0.0453 3258 CD1 12.6473 -11.3729 22.3310 C.ar 208 TYR208 -0.0561 3259 HD1 12.9852 -12.0258 23.1226 H 208 TYR208 0.0621 3260 CD2 12.6461 -10.7214 20.0223 C.ar 208 TYR208 -0.0561 3261 HD2 12.9744 -10.8669 19.0030 H 208 TYR208 0.0621 3262 CE1 11.7370 -10.3630 22.6153 C.ar 208 TYR208 -0.0317 3263 HE1 11.3731 -10.2169 23.6194 H 208 TYR208 0.0643 3264 CE2 11.7425 -9.7069 20.3103 C.ar 208 TYR208 -0.0317 3265 HE2 11.3848 -9.0506 19.5324 H 208 TYR208 0.0643 3266 CZ 11.2936 -9.5213 21.6082 C.ar 208 TYR208 0.0726 3267 OH 10.4194 -8.4973 21.9094 O.3 208 TYR208 -0.3598 3268 HH 10.2233 -7.9801 21.1259 H 208 TYR208 0.2173 3269 N 12.6700 -14.1870 18.3150 N.am 209 VAL209 -0.2454 3270 H 13.6690 -14.1810 18.1060 H 209 VAL209 0.1312 3271 CA 11.7340 -14.3570 17.2120 C.3 209 VAL209 0.0901 3272 HA 11.1283 -13.4497 17.1552 H 209 VAL209 0.0560 3273 C 10.8110 -15.5390 17.5120 C.2 209 VAL209 0.2189 3274 O 9.5600 -15.4410 17.4550 O.2 209 VAL209 -0.2778 3275 CB 12.5495 -14.5558 15.9159 C.3 209 VAL209 -0.0227 3276 HB 13.3556 -15.2570 16.1264 H 209 VAL209 0.0315 3277 CG1 11.7252 -15.1593 14.7706 C.3 209 VAL209 -0.0608 3278 HG11 12.3158 -15.2041 13.8569 H 209 VAL209 0.0233 3279 HG12 10.8322 -14.5631 14.5832 H 209 VAL209 0.0233 3280 HG13 11.4072 -16.1776 14.9935 H 209 VAL209 0.0233 3281 CG2 13.1986 -13.2367 15.4713 C.3 209 VAL209 -0.0608 3282 HG21 13.8819 -13.3927 14.6394 H 209 VAL209 0.0233 3283 HG22 13.7643 -12.7693 16.2765 H 209 VAL209 0.0233 3284 HG23 12.4456 -12.5216 15.1440 H 209 VAL209 0.0233 3285 N 11.4230 -16.6520 17.8850 N.am 210 ASN210 -0.2452 3286 H 12.4360 -16.7270 17.7940 H 210 ASN210 0.1312 3287 CA 10.6620 -17.7710 18.4240 C.3 210 ASN210 0.0957 3288 HA 10.0949 -18.1579 17.5761 H 210 ASN210 0.0562 3289 C 9.6220 -17.3330 19.4210 C.2 210 ASN210 0.2191 3290 O 8.4710 -17.7340 19.3170 O.2 210 ASN210 -0.2778 3291 CB 11.5615 -18.8916 18.9845 C.3 210 ASN210 0.0446 3292 HB1 10.9617 -19.6738 19.4508 H 210 ASN210 0.0375 3293 HB2 12.2475 -18.5395 19.7451 H 210 ASN210 0.0375 3294 CG 12.3539 -19.5345 17.8420 C.2 210 ASN210 0.2000 3295 OD1 11.8245 -19.7550 16.7614 O.2 210 ASN210 -0.2797 3296 ND2 13.6342 -19.8169 18.1238 N.am 210 ASN210 -0.2723 3297 HD21 14.2703 -20.1506 17.4274 H 210 ASN210 0.1266 3298 HD22 13.9910 -19.6734 19.0482 H 210 ASN210 0.1266 3299 N 10.0170 -16.4700 20.3480 N.am 211 HIS211 -0.2453 3300 H 10.9630 -16.0910 20.3030 H 211 HIS211 0.1312 3301 CA 9.1380 -16.0520 21.4230 C.3 211 HIS211 0.0932 3302 HA 8.7852 -16.9499 21.9177 H 211 HIS211 0.0561 3303 C 7.9390 -15.2600 20.8820 C.2 211 HIS211 0.2190 3304 O 6.8160 -15.4400 21.3270 O.2 211 HIS211 -0.2778 3305 CB 9.9321 -15.2290 22.4525 C.3 211 HIS211 0.0146 3306 HB1 10.2939 -14.2897 22.0443 H 211 HIS211 0.0348 3307 HB2 10.8034 -15.7937 22.7734 H 211 HIS211 0.0348 3308 CG 9.0883 -14.9116 23.6655 C.ar 211 HIS211 0.0551 3309 ND1 9.0226 -15.6903 24.7637 N.ar 211 HIS211 -0.2469 3310 CD2 8.2811 -13.7818 23.8785 C.ar 211 HIS211 0.0047 3311 HD2 8.1363 -12.9688 23.1821 H 211 HIS211 0.0764 3312 CE1 8.1748 -15.0776 25.6045 C.ar 211 HIS211 0.0737 3313 HE1 7.9074 -15.4772 26.5724 H 211 HIS211 0.0963 3314 NE2 7.7185 -13.9148 25.1023 N.ar 211 HIS211 -0.2539 3315 HE2 7.0975 -13.2932 25.5350 H 211 HIS211 0.1339 3316 N 8.2030 -14.4220 19.8770 N.am 212 ARG212 -0.2456 3317 H 9.1500 -14.4160 19.4990 H 212 ARG212 0.1312 3318 CA 7.2100 -13.4970 19.2720 C.3 212 ARG212 0.0879 3319 HA 6.7002 -13.0041 20.1009 H 212 ARG212 0.0557 3320 C 6.1510 -14.2110 18.4650 C.2 212 ARG212 0.2187 3321 O 5.0200 -13.7500 18.3710 O.2 212 ARG212 -0.2778 3322 CB 7.9444 -12.4402 18.4220 C.3 212 ARG212 -0.0258 3323 HB1 7.2131 -11.8381 17.8799 H 212 ARG212 0.0286 3324 HB2 8.5399 -12.9345 17.6527 H 212 ARG212 0.0286 3325 CG 8.8570 -11.5147 19.2570 C.3 212 ARG212 -0.0154 3326 HG1 9.8972 -11.6718 18.9674 H 212 ARG212 0.0299 3327 HG2 8.8042 -11.7824 20.3126 H 212 ARG212 0.0299 3328 CD 8.5087 -10.0242 19.1143 C.3 212 ARG212 0.1045 3329 HD1 9.0589 -9.4109 19.8275 H 212 ARG212 0.0711 3330 HD2 7.4436 -9.8574 19.2833 H 212 ARG212 0.0711 3331 NE 8.8742 -9.5600 17.7833 N.pl3 212 ARG212 -0.4450 3332 HE 9.5742 -10.0343 17.2425 H 212 ARG212 0.3153 3333 CZ 8.3614 -8.5004 17.1788 C.cat 212 ARG212 0.5062 3334 NH1 7.4728 -7.7459 17.7457 N.pl3 212 ARG212 -0.4573 3335 HH11 6.9110 -7.1229 17.2193 H 212 ARG212 0.3114 3336 HH12 7.4274 -7.7979 18.7457 H 212 ARG212 0.3114 3337 NH2 8.7457 -8.1883 15.9861 N.pl3 212 ARG212 -0.4573 3338 HH21 8.3436 -7.4235 15.4973 H 212 ARG212 0.3114 3339 HH22 9.4749 -8.7356 15.5575 H 212 ARG212 0.3114 3340 N 6.5400 -15.3360 17.8880 N.am 213 LYS213 -0.2457 3341 H 7.4970 -15.6570 18.0370 H 213 LYS213 0.1312 3342 CA 5.6630 -16.1320 17.0530 C.3 213 LYS213 0.0878 3343 HA 6.3112 -16.8127 16.5019 H 213 LYS213 0.0557 3344 C 4.9490 -15.2520 16.0310 C.2 213 LYS213 0.2187 3345 O 3.7320 -15.1560 16.0430 O.2 213 LYS213 -0.2778 3346 CB 4.5613 -16.9274 17.8058 C.3 213 LYS213 -0.0289 3347 HB1 3.8277 -17.2882 17.0817 H 213 LYS213 0.0285 3348 HB2 4.0060 -16.2727 18.4795 H 213 LYS213 0.0285 3349 CG 5.0230 -18.1872 18.5351 C.3 213 LYS213 -0.0496 3350 HG1 5.7878 -18.6979 17.9486 H 213 LYS213 0.0266 3351 HG2 4.1869 -18.8820 18.6270 H 213 LYS213 0.0266 3352 CD 5.5343 -17.8607 19.9260 C.3 213 LYS213 -0.0278 3353 HD1 4.7560 -17.3882 20.5264 H 213 LYS213 0.0282 3354 HD2 6.3072 -17.1140 19.8020 H 213 LYS213 0.0282 3355 CE 6.0924 -19.0814 20.6516 C.3 213 LYS213 0.1103 3356 HE1 6.5686 -19.7778 19.9594 H 213 LYS213 0.0559 3357 HE2 5.3088 -19.6193 21.1872 H 213 LYS213 0.0559 3358 NZ 7.1054 -18.6624 21.5950 N.4 213 LYS213 -0.0749 3359 HZ1 7.4578 -19.4458 22.1901 H 213 LYS213 0.2742 3360 HZ2 6.7908 -17.9184 22.2448 H 213 LYS213 0.2742 3361 HZ3 7.9794 -18.3579 21.1164 H 213 LYS213 0.2742 3362 N 5.7090 -14.5960 15.1590 N.am 214 HIS214 -0.2453 3363 H 6.7210 -14.5910 15.2880 H 214 HIS214 0.1312 3364 CA 5.1300 -13.8790 14.0150 C.3 214 HIS214 0.0932 3365 HA 4.4894 -13.0772 14.3872 H 214 HIS214 0.0561 3366 C 4.3370 -14.8460 13.1630 C.2 214 HIS214 0.2191 3367 O 4.6350 -16.0280 13.1240 O.2 214 HIS214 -0.2778 3368 CB 6.2703 -13.3807 13.1274 C.3 214 HIS214 0.0146 3369 HB1 5.9170 -13.0834 12.1404 H 214 HIS214 0.0348 3370 HB2 7.0283 -14.1506 12.9771 H 214 HIS214 0.0348 3371 CG 6.8915 -12.1784 13.7643 C.ar 214 HIS214 0.0551 3372 ND1 6.4142 -10.9359 13.5710 N.ar 214 HIS214 -0.2469 3373 CD2 8.0524 -12.1165 14.5472 C.ar 214 HIS214 0.0047 3374 HD2 8.6904 -12.9357 14.8445 H 214 HIS214 0.0764 3375 CE1 7.3026 -10.1271 14.1597 C.ar 214 HIS214 0.0737 3376 HE1 7.2406 -9.0523 14.1010 H 214 HIS214 0.0963 3377 NE2 8.2996 -10.8099 14.7543 N.ar 214 HIS214 -0.2539 3378 HE2 9.1148 -10.4469 15.1686 H 214 HIS214 0.1339 3379 N 3.3130 -14.3630 12.4830 N.am 215 ASN215 -0.2452 3380 H 3.0890 -13.3680 12.5200 H 215 ASN215 0.1312 3381 CA 2.5020 -15.2790 11.6730 C.3 215 ASN215 0.0957 3382 HA 2.7161 -16.3158 11.9412 H 215 ASN215 0.0562 3383 C 2.8230 -15.1090 10.1860 C.2 215 ASN215 0.2191 3384 O 1.9460 -15.2080 9.3130 O.2 215 ASN215 -0.2778 3385 CB 1.0209 -14.9851 11.9754 C.3 215 ASN215 0.0446 3386 HB1 0.7313 -14.0078 11.5878 H 215 ASN215 0.0375 3387 HB2 0.8666 -14.9575 13.0538 H 215 ASN215 0.0375 3388 CG 0.0815 -16.0638 11.4121 C.2 215 ASN215 0.2000 3389 OD1 0.4381 -17.2267 11.2851 O.2 215 ASN215 -0.2797 3390 ND2 -1.1355 -15.6068 11.0819 N.am 215 ASN215 -0.2723 3391 HD21 -1.8037 -16.2480 10.7066 H 215 ASN215 0.1266 3392 HD22 -1.3861 -14.6473 11.2006 H 215 ASN215 0.1266 3393 N 4.0980 -14.8200 9.9340 N.am 216 ILE216 -0.2454 3394 H 4.6920 -14.5360 10.7130 H 216 ILE216 0.1312 3395 CA 4.6860 -14.8880 8.6130 C.3 216 ILE216 0.0906 3396 HA 3.8874 -14.8048 7.8788 H 216 ILE216 0.0560 3397 C 5.4240 -16.2290 8.5500 C.2 216 ILE216 0.2216 3398 O 6.1580 -16.5580 9.4850 O.2 216 ILE216 -0.2776 3399 CB 5.6507 -13.6879 8.4584 C.3 216 ILE216 -0.0201 3400 HB 6.3547 -13.7322 9.2876 H 216 ILE216 0.0318 3401 CG1 4.9197 -12.3257 8.5293 C.3 216 ILE216 -0.0514 3402 HG11 3.9283 -12.4041 8.0819 H 216 ILE216 0.0266 3403 HG12 5.4534 -11.5893 7.9270 H 216 ILE216 0.0266 3404 CG2 6.4732 -13.7682 7.1617 C.3 216 ILE216 -0.0605 3405 HG21 7.1096 -12.8897 7.0483 H 216 ILE216 0.0233 3406 HG22 5.8253 -13.8323 6.2878 H 216 ILE216 0.0233 3407 HG23 7.1342 -14.6301 7.1722 H 216 ILE216 0.0233 3408 CD1 4.8120 -11.7329 9.9414 C.3 216 ILE216 -0.0650 3409 HD11 4.3334 -10.7537 9.9106 H 216 ILE216 0.0230 3410 HD12 5.7982 -11.5947 10.3853 H 216 ILE216 0.0230 3411 HD13 4.2219 -12.3552 10.6112 H 216 ILE216 0.0230 3412 N 5.2070 -17.0120 7.4830 N.am 217 PRO217 -0.2316 3413 CA 6.0400 -18.2010 7.2100 C.3 217 PRO217 0.0907 3414 HA 5.8531 -18.9117 8.0173 H 217 PRO217 0.0559 3415 C 7.5410 -17.8480 7.1240 C.2 217 PRO217 0.2189 3416 O 7.8750 -16.7960 6.5810 O.2 217 PRO217 -0.2778 3417 CB 5.5058 -18.7097 5.8637 C.3 217 PRO217 -0.0276 3418 HB1 5.5188 -19.7983 5.7993 H 217 PRO217 0.0285 3419 HB2 6.1021 -18.3284 5.0337 H 217 PRO217 0.0285 3420 CG 4.0942 -18.1375 5.7547 C.3 217 PRO217 -0.0379 3421 HG1 3.3977 -18.8127 6.2542 H 217 PRO217 0.0278 3422 HG2 3.7581 -18.0253 4.7237 H 217 PRO217 0.0278 3423 CD 4.1333 -16.8108 6.5141 C.3 217 PRO217 0.0071 3424 HD1 4.4038 -15.9655 5.8810 H 217 PRO217 0.0431 3425 HD2 3.1907 -16.6242 7.0342 H 217 PRO217 0.0431 3426 N 8.4190 -18.6990 7.6460 N.am 218 HIS218 -0.2453 3427 H 8.0690 -19.4980 8.1750 H 218 HIS218 0.1312 3428 CA 9.8790 -18.5380 7.4940 C.3 218 HIS218 0.0932 3429 HA 10.3100 -19.2513 8.1970 H 218 HIS218 0.0561 3430 C 10.4190 -17.1790 7.8570 C.2 218 HIS218 0.2190 3431 O 11.2980 -16.6750 7.1770 O.2 218 HIS218 -0.2778 3432 CB 10.3218 -18.9141 6.0650 C.3 218 HIS218 0.0146 3433 HB1 11.3977 -19.0912 6.0267 H 218 HIS218 0.0348 3434 HB2 10.1089 -18.1084 5.3649 H 218 HIS218 0.0348 3435 CG 9.5944 -20.1477 5.5839 C.ar 218 HIS218 0.0551 3436 ND1 8.4329 -20.1051 4.8932 N.ar 218 HIS218 -0.2469 3437 CD2 9.9660 -21.4913 5.7512 C.ar 218 HIS218 0.0047 3438 HD2 10.8499 -21.8553 6.2551 H 218 HIS218 0.0764 3439 CE1 8.1048 -21.3872 4.6521 C.ar 218 HIS218 0.0737 3440 HE1 7.2213 -21.6977 4.1109 H 218 HIS218 0.0963 3441 NE2 9.0093 -22.2432 5.1612 N.ar 218 HIS218 -0.2539 3442 HE2 8.9842 -23.2222 5.1032 H 218 HIS218 0.1339 3443 N 9.9040 -16.6070 8.9460 N.am 219 PHE219 -0.2453 3444 H 9.2030 -17.1260 9.4750 H 219 PHE219 0.1312 3445 CA 10.2870 -15.2770 9.4260 C.3 219 PHE219 0.0917 3446 HA 9.9853 -14.5822 8.6413 H 219 PHE219 0.0560 3447 C 11.7830 -15.1390 9.6000 C.2 219 PHE219 0.2190 3448 O 12.3690 -14.1990 9.1310 O.2 219 PHE219 -0.2778 3449 CB 9.5147 -14.9565 10.7086 C.3 219 PHE219 -0.0036 3450 HB1 9.8349 -15.6001 11.5294 H 219 PHE219 0.0333 3451 HB2 8.4530 -15.1587 10.5599 H 219 PHE219 0.0333 3452 CG 9.6679 -13.5143 11.1034 C.ar 219 PHE219 -0.0454 3453 CD1 8.8757 -12.5309 10.5217 C.ar 219 PHE219 -0.0585 3454 HD1 8.1668 -12.7845 9.7533 H 219 PHE219 0.0620 3455 CD2 10.6003 -13.1444 12.0638 C.ar 219 PHE219 -0.0585 3456 HD2 11.2533 -13.8822 12.4957 H 219 PHE219 0.0620 3457 CE1 8.9768 -11.2111 10.9330 C.ar 219 PHE219 -0.0615 3458 HE1 8.3334 -10.4578 10.5111 H 219 PHE219 0.0618 3459 CE2 10.6896 -11.8300 12.4917 C.ar 219 PHE219 -0.0615 3460 HE2 11.3697 -11.5546 13.2862 H 219 PHE219 0.0618 3461 CZ 9.8804 -10.8611 11.9223 C.ar 219 PHE219 -0.0617 3462 HZ 9.9339 -9.8449 12.2813 H 219 PHE219 0.0618 3463 N 12.4020 -16.0800 10.2930 N.am 220 TRP220 -0.2453 3464 H 11.8940 -16.9190 10.5730 H 220 TRP220 0.1312 3465 CA 13.8100 -15.9270 10.6610 C.3 220 TRP220 0.0920 3466 HA 13.8864 -14.9148 11.0623 H 220 TRP220 0.0561 3467 C 14.7960 -15.9480 9.4480 C.2 220 TRP220 0.2217 3468 O 15.6300 -15.0400 9.3470 O.2 220 TRP220 -0.2776 3469 CB 14.2317 -16.8735 11.8022 C.3 220 TRP220 -0.0021 3470 HB1 13.9672 -17.9095 11.6068 H 220 TRP220 0.0334 3471 HB2 13.7124 -16.6044 12.7213 H 220 TRP220 0.0334 3472 CG 15.7267 -16.7753 12.0432 C.ar 220 TRP220 -0.0260 3473 CD1 16.6656 -17.7876 11.8251 C.ar 220 TRP220 -0.0136 3474 HD1 16.4398 -18.7863 11.4805 H 220 TRP220 0.0748 3475 CD2 16.4630 -15.6383 12.5383 C.ar 220 TRP220 -0.0028 3476 NE1 17.8984 -17.3362 12.1610 N.ar 220 TRP220 -0.2641 3477 HE1 18.7182 -17.8716 12.1276 H 220 TRP220 0.1331 3478 CE2 17.8213 -16.0260 12.6112 C.ar 220 TRP220 0.0269 3479 CE3 16.0899 -14.3781 12.9170 C.ar 220 TRP220 -0.0528 3480 HE3 15.0554 -14.0780 12.8546 H 220 TRP220 0.0624 3481 CZ2 18.7605 -15.1481 13.0789 C.ar 220 TRP220 -0.0430 3482 HZ2 19.7926 -15.4566 13.1494 H 220 TRP220 0.0633 3483 CZ3 17.0445 -13.4783 13.3847 C.ar 220 TRP220 -0.0611 3484 HZ3 16.7368 -12.4885 13.6835 H 220 TRP220 0.0618 3485 CH2 18.3825 -13.8645 13.4719 C.ar 220 TRP220 -0.0602 3486 HH2 19.1243 -13.1753 13.8455 H 220 TRP220 0.0618 3487 N 14.7060 -16.9370 8.5420 N.am 221 PRO221 -0.2316 3488 CA 15.4820 -16.8800 7.3110 C.3 221 PRO221 0.0907 3489 HA 16.5371 -16.9341 7.5846 H 221 PRO221 0.0559 3490 C 15.1740 -15.5800 6.5900 C.2 221 PRO221 0.2189 3491 O 16.0810 -14.8680 6.1550 O.2 221 PRO221 -0.2778 3492 CB 15.0122 -18.1126 6.5250 C.3 221 PRO221 -0.0276 3493 HB1 15.8166 -18.5614 5.9418 H 221 PRO221 0.0285 3494 HB2 14.2073 -17.8611 5.8325 H 221 PRO221 0.0285 3495 CG 14.4601 -19.0617 7.5843 C.3 221 PRO221 -0.0379 3496 HG1 15.2776 -19.6620 7.9861 H 221 PRO221 0.0278 3497 HG2 13.7080 -19.7457 7.1911 H 221 PRO221 0.0278 3498 CD 13.9159 -18.1545 8.6869 C.3 221 PRO221 0.0071 3499 HD1 12.8711 -17.9069 8.5377 H 221 PRO221 0.0431 3500 HD2 14.0746 -18.5938 9.6682 H 221 PRO221 0.0431 3501 N 13.8980 -15.2290 6.4830 N.am 222 LYS222 -0.2456 3502 H 13.1600 -15.8250 6.8570 H 222 LYS222 0.1312 3503 CA 13.5730 -13.9590 5.8110 C.3 222 LYS222 0.0878 3504 HA 13.9547 -14.0182 4.7901 H 222 LYS222 0.0557 3505 C 14.2740 -12.7860 6.5190 C.2 222 LYS222 0.2187 3506 O 14.8380 -11.8990 5.8670 O.2 222 LYS222 -0.2778 3507 CB 12.0503 -13.7349 5.8181 C.3 222 LYS222 -0.0289 3508 HB1 11.8290 -12.7025 5.5478 H 222 LYS222 0.0285 3509 HB2 11.6719 -13.8648 6.8311 H 222 LYS222 0.0285 3510 CG 11.2754 -14.6510 4.8603 C.3 222 LYS222 -0.0496 3511 HG1 11.5939 -15.6854 4.9883 H 222 LYS222 0.0266 3512 HG2 11.5227 -14.3858 3.8317 H 222 LYS222 0.0266 3513 CD 9.7587 -14.5431 5.0845 C.3 222 LYS222 -0.0278 3514 HD1 9.4518 -13.5009 4.9860 H 222 LYS222 0.0282 3515 HD2 9.5330 -14.8308 6.1125 H 222 LYS222 0.0282 3516 CE 8.9471 -15.4134 4.1160 C.3 222 LYS222 0.1103 3517 HE1 9.2654 -16.4544 4.1860 H 222 LYS222 0.0559 3518 HE2 9.1149 -15.0957 3.0848 H 222 LYS222 0.0559 3519 NZ 7.5086 -15.3663 4.3849 N.4 222 LYS222 -0.0749 3520 HZ1 7.0043 -15.9990 3.7313 H 222 LYS222 0.2742 3521 HZ2 7.1558 -14.3943 4.2769 H 222 LYS222 0.2742 3522 HZ3 7.3301 -15.6829 5.3613 H 222 LYS222 0.2742 3523 N 14.2310 -12.7920 7.8470 N.am 223 LEU223 -0.2456 3524 H 13.7780 -13.5710 8.3260 H 223 LEU223 0.1312 3525 CA 14.8140 -11.7140 8.6380 C.3 223 LEU223 0.0880 3526 HA 14.5502 -10.7889 8.1253 H 223 LEU223 0.0557 3527 C 16.3360 -11.7980 8.6430 C.2 223 LEU223 0.2187 3528 O 17.0150 -10.9140 9.1650 O.2 223 LEU223 -0.2778 3529 CB 14.1943 -11.6817 10.0481 C.3 223 LEU223 -0.0266 3530 HB1 14.4356 -12.6056 10.5753 H 223 LEU223 0.0287 3531 HB2 13.1087 -11.6769 9.9410 H 223 LEU223 0.0287 3532 CG 14.6050 -10.4686 10.9171 C.3 223 LEU223 -0.0449 3533 HG 15.6496 -10.5876 11.2063 H 223 LEU223 0.0296 3534 CD1 14.4636 -9.1255 10.1814 C.3 223 LEU223 -0.0626 3535 HD11 14.6677 -8.2913 10.8533 H 223 LEU223 0.0232 3536 HD12 13.4543 -8.9930 9.7917 H 223 LEU223 0.0232 3537 HD13 15.1625 -9.0421 9.3504 H 223 LEU223 0.0232 3538 CD2 13.7821 -10.4245 12.2087 C.3 223 LEU223 -0.0626 3539 HD21 14.1200 -9.6318 12.8734 H 223 LEU223 0.0232 3540 HD22 13.8347 -11.3661 12.7564 H 223 LEU223 0.0232 3541 HD23 12.7397 -10.2101 11.9845 H 223 LEU223 0.0232 3542 N 16.8500 -12.7910 7.9510 N.am 224 LEU224 -0.2456 3543 H 16.2210 -13.4240 7.4570 H 224 LEU224 0.1312 3544 CA 18.2670 -13.0160 7.8660 C.3 224 LEU224 0.0880 3545 HA 18.7648 -12.4014 8.6158 H 224 LEU224 0.0557 3546 C 18.7110 -12.5440 6.5220 C.2 224 LEU224 0.2187 3547 O 19.8380 -12.1860 6.3220 O.2 224 LEU224 -0.2778 3548 CB 18.5856 -14.4959 8.1361 C.3 224 LEU224 -0.0266 3549 HB1 18.1387 -15.1177 7.3626 H 224 LEU224 0.0287 3550 HB2 18.1065 -14.7900 9.0706 H 224 LEU224 0.0287 3551 CG 20.0865 -14.8252 8.2377 C.3 224 LEU224 -0.0449 3552 HG 20.5672 -14.5534 7.2973 H 224 LEU224 0.0296 3553 CD1 20.7782 -14.0486 9.3692 C.3 224 LEU224 -0.0626 3554 HD11 21.8165 -14.3619 9.4793 H 224 LEU224 0.0232 3555 HD12 20.2786 -14.2157 10.3243 H 224 LEU224 0.0232 3556 HD13 20.7881 -12.9763 9.1758 H 224 LEU224 0.0232 3557 CD2 20.2797 -16.3341 8.4351 C.3 224 LEU224 -0.0626 3558 HD21 21.3376 -16.5945 8.4721 H 224 LEU224 0.0232 3559 HD22 19.8281 -16.8985 7.6189 H 224 LEU224 0.0232 3560 HD23 19.8204 -16.6700 9.3658 H 224 LEU224 0.0232 3561 N 17.7940 -12.5580 5.5870 N.am 225 MET225 -0.2456 3562 H 16.8510 -12.8770 5.8100 H 225 MET225 0.1312 3563 CA 18.0970 -12.1340 4.2680 C.3 225 MET225 0.0885 3564 HA 19.1218 -12.4109 4.0094 H 225 MET225 0.0557 3565 C 17.9720 -10.6560 4.2270 C.2 225 MET225 0.2187 3566 O 18.5330 -10.0150 3.3880 O.2 225 MET225 -0.2778 3567 CB 17.1017 -12.7689 3.2849 C.3 225 MET225 -0.0199 3568 HB1 17.1987 -12.2999 2.3044 H 225 MET225 0.0293 3569 HB2 16.0817 -12.5792 3.6206 H 225 MET225 0.0293 3570 CG 17.3016 -14.2778 3.1150 C.3 225 MET225 -0.0047 3571 HG1 17.2827 -14.7914 4.0744 H 225 MET225 0.0377 3572 HG2 18.2816 -14.4939 2.6880 H 225 MET225 0.0377 3573 SD 16.0130 -14.9791 2.0664 S.3 225 MET225 -0.1641 3574 CE 16.8492 -14.8369 0.4761 C.3 225 MET225 -0.0181 3575 HE1 16.1749 -15.1055 -0.3371 H 225 MET225 0.0340 3576 HE2 17.7253 -15.4852 0.4506 H 225 MET225 0.0340 3577 HE3 17.1908 -13.8132 0.3215 H 225 MET225 0.0340 3578 N 17.2450 -10.1120 5.1760 N.am 226 LYS226 -0.2457 3579 H 16.7280 -10.7040 5.8260 H 226 LYS226 0.1312 3580 CA 17.1790 -8.6740 5.2980 C.3 226 LYS226 0.0878 3581 HA 17.0144 -8.2570 4.3055 H 226 LYS226 0.0557 3582 C 18.5710 -8.2070 5.7000 C.2 226 LYS226 0.2187 3583 O 19.0330 -7.1850 5.2030 O.2 226 LYS226 -0.2778 3584 CB 16.0480 -8.2142 6.2226 C.3 226 LYS226 -0.0289 3585 HB1 16.1007 -7.1286 6.3172 H 226 LYS226 0.0285 3586 HB2 16.1945 -8.6157 7.2262 H 226 LYS226 0.0285 3587 CG 14.6427 -8.5895 5.7091 C.3 226 LYS226 -0.0496 3588 HG1 13.9208 -7.9950 6.2681 H 226 LYS226 0.0266 3589 HG2 14.4046 -9.6163 5.9697 H 226 LYS226 0.0266 3590 CD 14.4068 -8.3555 4.1993 C.3 226 LYS226 -0.0278 3591 HD1 14.9274 -7.4559 3.8730 H 226 LYS226 0.0282 3592 HD2 13.3498 -8.1209 4.0648 H 226 LYS226 0.0282 3593 CE 14.7328 -9.5727 3.2966 C.3 226 LYS226 0.1103 3594 HE1 13.8283 -9.8668 2.7629 H 226 LYS226 0.0559 3595 HE2 15.0166 -10.4382 3.8920 H 226 LYS226 0.0559 3596 NZ 15.7688 -9.3708 2.2810 N.4 226 LYS226 -0.0749 3597 HZ1 15.9356 -10.1963 1.6821 H 226 LYS226 0.2742 3598 HZ2 16.6877 -9.0803 2.6851 H 226 LYS226 0.2742 3599 HZ3 15.5549 -8.5492 1.6723 H 226 LYS226 0.2742 3600 N 19.2640 -8.9790 6.5380 N.am 227 VAL227 -0.2454 3601 H 18.8520 -9.8400 6.8980 H 227 VAL227 0.1312 3602 CA 20.6170 -8.5880 6.9400 C.3 227 VAL227 0.0901 3603 HA 20.5282 -7.6098 7.4150 H 227 VAL227 0.0560 3604 C 21.5180 -8.4220 5.7100 C.2 227 VAL227 0.2190 3605 O 22.2490 -7.4560 5.5820 O.2 227 VAL227 -0.2778 3606 CB 21.2074 -9.5945 7.9525 C.3 227 VAL227 -0.0227 3607 HB 21.2990 -10.5641 7.4634 H 227 VAL227 0.0315 3608 CG1 22.6090 -9.1781 8.4292 C.3 227 VAL227 -0.0608 3609 HG11 23.0077 -9.8960 9.1466 H 227 VAL227 0.0233 3610 HG12 22.5790 -8.2049 8.9184 H 227 VAL227 0.0233 3611 HG13 23.3187 -9.1165 7.6039 H 227 VAL227 0.0233 3612 CG2 20.2902 -9.7701 9.1706 C.3 227 VAL227 -0.0608 3613 HG21 20.7030 -10.4945 9.8731 H 227 VAL227 0.0233 3614 HG22 19.3032 -10.1252 8.8834 H 227 VAL227 0.0233 3615 HG23 20.1650 -8.8269 9.7015 H 227 VAL227 0.0233 3616 N 21.4390 -9.3310 4.7700 N.am 228 THR228 -0.2434 3617 H 20.8420 -10.1490 4.8920 H 228 THR228 0.1313 3618 CA 22.2040 -9.1610 3.5640 C.3 228 THR228 0.1135 3619 HA 23.2190 -8.9042 3.8690 H 228 THR228 0.0583 3620 C 21.7480 -8.0590 2.6340 C.2 228 THR228 0.2212 3621 O 22.5430 -7.4060 2.0240 O.2 228 THR228 -0.2777 3622 CB 22.2868 -10.5040 2.8100 C.3 228 THR228 0.0763 3623 HB 22.8647 -10.3341 1.8923 H 228 THR228 0.0611 3624 OG1 20.9832 -10.9584 2.4827 O.3 228 THR228 -0.3900 3625 HG1 21.0188 -11.7315 1.9288 H 228 THR228 0.2098 3626 CG2 23.0022 -11.5745 3.6507 C.3 228 THR228 -0.0370 3627 HG21 23.1677 -12.4891 3.0812 H 228 THR228 0.0255 3628 HG22 22.4211 -11.8364 4.5356 H 228 THR228 0.0255 3629 HG23 23.9772 -11.2199 3.9852 H 228 THR228 0.0255 3630 N 20.4580 -7.8080 2.5870 N.am 229 ASP229 -0.2450 3631 H 19.7980 -8.5180 2.9050 H 229 ASP229 0.1312 3632 CA 19.9580 -6.5480 2.0950 C.3 229 ASP229 0.0974 3633 HA 20.1279 -6.5791 1.0200 H 229 ASP229 0.0563 3634 C 20.7160 -5.3580 2.6290 C.2 229 ASP229 0.2192 3635 O 21.3160 -4.6300 1.8800 O.2 229 ASP229 -0.2778 3636 CB 18.4596 -6.2419 2.3264 C.3 229 ASP229 0.0576 3637 HB1 18.2175 -5.2889 1.8538 H 229 ASP229 0.0394 3638 HB2 18.2219 -6.1018 3.3758 H 229 ASP229 0.0394 3639 CG 17.4480 -7.2419 1.7679 C.2 229 ASP229 0.1780 3640 OD1 17.8000 -8.3112 1.2888 O.co2 229 ASP229 -0.6478 3641 OD2 16.2563 -6.9614 1.8248 O.co2 229 ASP229 -0.6478 3642 N 20.6890 -5.1890 3.9380 N.am 230 LEU230 -0.2456 3643 H 20.1150 -5.8200 4.4970 H 230 LEU230 0.1312 3644 CA 21.4430 -4.1390 4.6290 C.3 230 LEU230 0.0880 3645 HA 21.0394 -3.1967 4.2602 H 230 LEU230 0.0557 3646 C 22.9440 -4.0980 4.3290 C.2 230 LEU230 0.2187 3647 O 23.4810 -3.0320 4.0630 O.2 230 LEU230 -0.2778 3648 CB 21.1585 -4.2637 6.1356 C.3 230 LEU230 -0.0266 3649 HB1 21.8470 -3.6477 6.7171 H 230 LEU230 0.0287 3650 HB2 21.3487 -5.2918 6.4436 H 230 LEU230 0.0287 3651 CG 19.7074 -3.8724 6.4790 C.3 230 LEU230 -0.0449 3652 HG 19.0504 -4.2403 5.6908 H 230 LEU230 0.0296 3653 CD1 19.2227 -4.5346 7.7718 C.3 230 LEU230 -0.0626 3654 HD11 18.1681 -4.3199 7.9415 H 230 LEU230 0.0232 3655 HD12 19.7770 -4.1766 8.6357 H 230 LEU230 0.0232 3656 HD13 19.3299 -5.6180 7.7206 H 230 LEU230 0.0232 3657 CD2 19.5615 -2.3460 6.5615 C.3 230 LEU230 -0.0626 3658 HD21 18.5636 -2.0528 6.8845 H 230 LEU230 0.0232 3659 HD22 19.7540 -1.8694 5.6006 H 230 LEU230 0.0232 3660 HD23 20.2645 -1.9357 7.2815 H 230 LEU230 0.0232 3661 N 23.6350 -5.2290 4.3720 N.am 231 ARG231 -0.2457 3662 H 23.2000 -6.0910 4.7000 H 231 ARG231 0.1312 3663 CA 25.0280 -5.2170 3.9410 C.3 231 ARG231 0.0879 3664 HA 25.5994 -4.5585 4.5995 H 231 ARG231 0.0557 3665 C 25.1520 -4.7260 2.4810 C.2 231 ARG231 0.2187 3666 O 26.1130 -4.0190 2.1580 O.2 231 ARG231 -0.2778 3667 CB 25.5429 -6.6652 3.9676 C.3 231 ARG231 -0.0258 3668 HB1 26.3666 -6.8083 3.2653 H 231 ARG231 0.0286 3669 HB2 24.7502 -7.3215 3.6101 H 231 ARG231 0.0286 3670 CG 26.0060 -7.1269 5.3491 C.3 231 ARG231 -0.0154 3671 HG1 25.8660 -8.2060 5.4198 H 231 ARG231 0.0299 3672 HG2 25.3858 -6.6864 6.1304 H 231 ARG231 0.0299 3673 CD 27.4939 -6.8219 5.5737 C.3 231 ARG231 0.1045 3674 HD1 27.7300 -5.7648 5.6345 H 231 ARG231 0.0711 3675 HD2 28.0936 -7.2154 4.7504 H 231 ARG231 0.0711 3676 NE 27.9830 -7.5099 6.7525 N.pl3 231 ARG231 -0.4450 3677 HE 28.7378 -8.1716 6.6467 H 231 ARG231 0.3153 3678 CZ 27.5710 -7.3759 7.9966 C.cat 231 ARG231 0.5062 3679 NH1 26.8582 -6.3627 8.3940 N.pl3 231 ARG231 -0.4573 3680 HH11 26.4883 -6.2931 9.3117 H 231 ARG231 0.3114 3681 HH12 26.6942 -5.5869 7.7712 H 231 ARG231 0.3114 3682 NH2 27.9137 -8.3055 8.8327 N.pl3 231 ARG231 -0.4573 3683 HH21 27.5575 -8.3596 9.7576 H 231 ARG231 0.3114 3684 HH22 28.5895 -8.9696 8.4913 H 231 ARG231 0.3114 3685 N 24.1900 -5.0500 1.6110 N.am 232 MET232 -0.2456 3686 H 23.3780 -5.5840 1.9190 H 232 MET232 0.1312 3687 CA 24.3100 -4.6320 0.2070 C.3 232 MET232 0.0885 3688 HA 25.3285 -4.8621 -0.1117 H 232 MET232 0.0557 3689 C 24.1480 -3.1480 0.0980 C.2 232 MET232 0.2187 3690 O 24.9580 -2.4950 -0.5780 O.2 232 MET232 -0.2778 3691 CB 23.3200 -5.3890 -0.6960 C.3 232 MET232 -0.0199 3692 HB1 23.2497 -4.8852 -1.6611 H 232 MET232 0.0293 3693 HB2 22.3182 -5.3685 -0.2680 H 232 MET232 0.0293 3694 CG 23.7559 -6.8373 -0.9580 C.3 232 MET232 -0.0047 3695 HG1 23.7279 -7.4189 -0.0390 H 232 MET232 0.0377 3696 HG2 24.7893 -6.8742 -1.3028 H 232 MET232 0.0377 3697 SD 22.7212 -7.6399 -2.1993 S.3 232 MET232 -0.1641 3698 CE 21.2398 -7.9226 -1.2123 C.3 232 MET232 -0.0181 3699 HE1 20.6176 -8.6892 -1.6733 H 232 MET232 0.0340 3700 HE2 20.6670 -7.0010 -1.1152 H 232 MET232 0.0340 3701 HE3 21.5071 -8.2729 -0.2163 H 232 MET232 0.0340 3702 N 23.1250 -2.6170 0.7840 N.am 233 ILE233 -0.2454 3703 H 22.4280 -3.2430 1.1870 H 233 ILE233 0.1312 3704 CA 22.9700 -1.1660 0.9770 C.3 233 ILE233 0.0903 3705 HA 22.7624 -0.7574 -0.0126 H 233 ILE233 0.0560 3706 C 24.2540 -0.4840 1.4780 C.2 233 ILE233 0.2187 3707 O 24.7050 0.4790 0.8560 O.2 233 ILE233 -0.2778 3708 CB 21.7609 -0.8907 1.9070 C.3 233 ILE233 -0.0201 3709 HB 21.9200 -1.4499 2.8293 H 233 ILE233 0.0318 3710 CG1 20.4485 -1.3922 1.2673 C.3 233 ILE233 -0.0514 3711 HG11 20.5689 -2.4136 0.9086 H 233 ILE233 0.0266 3712 HG12 20.2252 -0.7903 0.3875 H 233 ILE233 0.0266 3713 CG2 21.6303 0.5990 2.2826 C.3 233 ILE233 -0.0605 3714 HG21 20.8062 0.7560 2.9739 H 233 ILE233 0.0233 3715 HG22 21.4451 1.2148 1.4033 H 233 ILE233 0.0233 3716 HG23 22.5211 0.9809 2.7812 H 233 ILE233 0.0233 3717 CD1 19.2430 -1.3728 2.2154 C.3 233 ILE233 -0.0650 3718 HD11 18.3719 -1.8281 1.7428 H 233 ILE233 0.0230 3719 HD12 18.9622 -0.3594 2.4962 H 233 ILE233 0.0230 3720 HD13 19.4569 -1.9296 3.1266 H 233 ILE233 0.0230 3721 N 24.8440 -0.9740 2.5770 N.am 234 GLY234 -0.2485 3722 H 24.3920 -1.7360 3.0830 H 234 GLY234 0.1309 3723 CA 26.0970 -0.4570 3.0650 C.3 234 GLY234 0.0765 3724 HA1 26.4198 -1.1053 3.8799 H 234 GLY234 0.0521 3725 HA2 25.9237 0.5474 3.4513 H 234 GLY234 0.0521 3726 C 27.1680 -0.4250 1.9780 C.2 234 GLY234 0.2155 3727 O 27.9120 0.5480 1.8680 O.2 234 GLY234 -0.2781 3728 N 27.2450 -1.4790 1.1610 N.am 235 ALA235 -0.2462 3729 H 26.5490 -2.2200 1.2430 H 235 ALA235 0.1311 3730 CA 28.2990 -1.6010 0.1520 C.3 235 ALA235 0.0850 3731 HA 29.2400 -1.3241 0.6315 H 235 ALA235 0.0554 3732 C 28.0970 -0.6820 -1.0640 C.2 235 ALA235 0.2184 3733 O 29.0380 -0.0550 -1.5160 O.2 235 ALA235 -0.2778 3734 CB 28.3622 -3.0660 -0.2945 C.3 235 ALA235 -0.0411 3735 HB1 29.1706 -3.2298 -1.0077 H 235 ALA235 0.0249 3736 HB2 27.4292 -3.3815 -0.7623 H 235 ALA235 0.0249 3737 HB3 28.5369 -3.7206 0.5597 H 235 ALA235 0.0249 3738 N 26.8780 -0.5990 -1.5790 N.am 236 CAS236 -0.2449 3739 H 26.1580 -1.2450 -1.2540 H 236 CAS236 0.1312 3740 CA 26.5370 0.3880 -2.5950 C.3 236 CAS236 0.0965 3741 HA 27.1553 0.1683 -3.4666 H 236 CAS236 0.0565 3742 CB 25.0518 0.2386 -2.9490 C.3 236 CAS236 0.0147 3743 HB1 24.7695 0.9769 -3.6998 H 236 CAS236 0.0394 3744 HB2 24.4382 0.4256 -2.0662 H 236 CAS236 0.0394 3745 C 26.8470 1.8120 -2.1380 C.2 236 CAS236 0.2195 3746 O 27.3540 2.6630 -2.8850 O.2 236 CAS236 -0.2778 3747 SG 24.6378 -1.4037 -3.5925 S.3 236 CAS236 -0.1762 3748 HG 23.3116 -1.5373 -3.6726 H 236 CAS236 0.1017 3749 N 26.4850 2.0800 -0.8850 N.am 237 HIS237 -0.2453 3750 H 26.0340 1.3470 -0.3370 H 237 HIS237 0.1312 3751 CA 26.7050 3.3600 -0.2760 C.3 237 HIS237 0.0932 3752 HA 26.2496 4.0892 -0.9465 H 237 HIS237 0.0561 3753 C 28.1570 3.7590 -0.1120 C.2 237 HIS237 0.2190 3754 O 28.4950 4.9220 -0.3270 O.2 237 HIS237 -0.2778 3755 CB 26.0101 3.4209 1.0906 C.3 237 HIS237 0.0146 3756 HB1 26.4485 2.6882 1.7688 H 237 HIS237 0.0348 3757 HB2 24.9536 3.1763 1.0057 H 237 HIS237 0.0348 3758 CG 26.1625 4.8120 1.6743 C.ar 237 HIS237 0.0551 3759 ND1 26.8534 5.0744 2.8026 N.ar 237 HIS237 -0.2469 3760 CD2 25.8320 6.0374 1.0713 C.ar 237 HIS237 0.0047 3761 HD2 25.3366 6.1644 0.1211 H 237 HIS237 0.0764 3762 CE1 26.9355 6.4110 2.8896 C.ar 237 HIS237 0.0737 3763 HE1 27.4616 6.9255 3.6813 H 237 HIS237 0.0963 3764 NE2 26.3150 7.0204 1.8627 N.ar 237 HIS237 -0.2539 3765 HE2 26.2575 7.9862 1.7027 H 237 HIS237 0.1339 3766 N 29.0120 2.8040 0.2520 N.am 238 ALA238 -0.2459 3767 H 28.6430 1.8790 0.4700 H 238 ALA238 0.1312 3768 CA 30.4840 3.0250 0.3550 C.3 238 ALA238 0.0850 3769 HA 30.6414 3.8258 1.0792 H 238 ALA238 0.0554 3770 C 31.0500 3.4630 -0.9860 C.2 238 ALA238 0.2185 3771 O 31.9490 4.3180 -1.0470 O.2 238 ALA238 -0.2778 3772 CB 31.1463 1.7279 0.8308 C.3 238 ALA238 -0.0411 3773 HB1 32.2237 1.8529 0.9473 H 238 ALA238 0.0249 3774 HB2 30.9752 0.9115 0.1280 H 238 ALA238 0.0249 3775 HB3 30.7421 1.4210 1.7956 H 238 ALA238 0.0249 3776 N 30.4970 2.8640 -2.0450 N.am 239 SER239 -0.2436 3777 H 29.7750 2.1650 -1.8700 H 239 SER239 0.1312 3778 CA 30.8490 3.1360 -3.4200 C.3 239 SER239 0.1109 3779 HA 31.9394 3.1390 -3.4677 H 239 SER239 0.0580 3780 C 30.3640 4.4810 -3.8690 C.2 239 SER239 0.2209 3781 O 31.0540 5.1560 -4.6210 O.2 239 SER239 -0.2777 3782 CB 30.3055 2.0305 -4.3369 C.3 239 SER239 0.0681 3783 HB1 30.5851 2.2454 -5.3740 H 239 SER239 0.0577 3784 HB2 29.2131 2.0033 -4.2816 H 239 SER239 0.0577 3785 OG 30.8520 0.7772 -3.9481 O.3 239 SER239 -0.3930 3786 HG 30.4845 0.0588 -4.4559 H 239 SER239 0.2095 3787 N 29.1530 4.8630 -3.4560 N.am 240 ARG240 -0.2456 3788 H 28.6220 4.2710 -2.8170 H 240 ARG240 0.1312 3789 CA 28.5920 6.1230 -3.9170 C.3 240 ARG240 0.0879 3790 HA 28.9447 6.2774 -4.9401 H 240 ARG240 0.0557 3791 C 29.1620 7.2000 -3.0780 C.2 240 ARG240 0.2187 3792 O 29.2630 8.3250 -3.5190 O.2 240 ARG240 -0.2778 3793 CB 27.0565 6.1074 -3.9239 C.3 240 ARG240 -0.0258 3794 HB1 26.6490 6.1265 -2.9119 H 240 ARG240 0.0286 3795 HB2 26.7338 5.1648 -4.3678 H 240 ARG240 0.0286 3796 CG 26.5127 7.2722 -4.7709 C.3 240 ARG240 -0.0154 3797 HG1 27.1458 7.3592 -5.6559 H 240 ARG240 0.0299 3798 HG2 26.6254 8.2200 -4.2442 H 240 ARG240 0.0299 3799 CD 25.0639 7.0987 -5.2466 C.3 240 ARG240 0.1045 3800 HD1 24.3531 7.6405 -4.6227 H 240 ARG240 0.0711 3801 HD2 24.7659 6.0482 -5.2654 H 240 ARG240 0.0711 3802 NE 24.9946 7.5556 -6.6284 N.pl3 240 ARG240 -0.4450 3803 HE 25.3718 7.0188 -7.3970 H 240 ARG240 0.3153 3804 CZ 24.4853 8.6807 -7.0996 C.cat 240 ARG240 0.5062 3805 NH1 23.8333 9.5454 -6.3751 N.pl3 240 ARG240 -0.4573 3806 HH11 23.4209 10.3254 -6.8427 H 240 ARG240 0.3114 3807 HH12 23.7470 9.4230 -5.3912 H 240 ARG240 0.3114 3808 NH2 24.6523 8.9239 -8.3488 N.pl3 240 ARG240 -0.4573 3809 HH21 24.3068 9.7422 -8.7987 H 240 ARG240 0.3114 3810 HH22 25.1458 8.2500 -8.9214 H 240 ARG240 0.3114 3811 N 29.5370 6.8580 -1.8520 N.am 241 PHE241 -0.2453 3812 H 29.3550 5.9170 -1.5030 H 241 PHE241 0.1312 3813 CA 30.2060 7.8290 -1.0130 C.3 241 PHE241 0.0917 3814 HA 29.5643 8.7074 -0.9558 H 241 PHE241 0.0560 3815 C 31.5550 8.2690 -1.5940 C.2 241 PHE241 0.2190 3816 O 31.8400 9.4380 -1.5500 O.2 241 PHE241 -0.2778 3817 CB 30.3765 7.2424 0.3984 C.3 241 PHE241 -0.0036 3818 HB1 30.8925 6.2825 0.3499 H 241 PHE241 0.0333 3819 HB2 29.4004 7.0427 0.8410 H 241 PHE241 0.0333 3820 CG 31.1395 8.1735 1.3028 C.ar 241 PHE241 -0.0454 3821 CD1 30.5285 9.3006 1.8460 C.ar 241 PHE241 -0.0585 3822 HD1 29.4832 9.4934 1.6565 H 241 PHE241 0.0620 3823 CD2 32.4894 7.9486 1.5527 C.ar 241 PHE241 -0.0585 3824 HD2 32.9825 7.0763 1.1469 H 241 PHE241 0.0620 3825 CE1 31.2621 10.1969 2.6139 C.ar 241 PHE241 -0.0615 3826 HE1 30.7880 11.0715 3.0315 H 241 PHE241 0.0618 3827 CE2 33.2196 8.8395 2.3234 C.ar 241 PHE241 -0.0615 3828 HE2 34.2606 8.6411 2.5294 H 241 PHE241 0.0618 3829 CZ 32.6117 9.9708 2.8443 C.ar 241 PHE241 -0.0617 3830 HZ 33.1951 10.6601 3.4355 H 241 PHE241 0.0618 3831 N 32.3570 7.3500 -2.1550 N.am 242 LEU242 -0.2456 3832 H 32.0790 6.3690 -2.1290 H 242 LEU242 0.1312 3833 CA 33.6220 7.7140 -2.8040 C.3 242 LEU242 0.0880 3834 HA 34.1872 8.2888 -2.0747 H 242 LEU242 0.0557 3835 C 33.3860 8.6160 -4.0070 C.2 242 LEU242 0.2187 3836 O 34.2350 9.4840 -4.3100 O.2 242 LEU242 -0.2778 3837 CB 34.4218 6.4832 -3.2750 C.3 242 LEU242 -0.0266 3838 HB1 35.3394 6.8212 -3.7594 H 242 LEU242 0.0287 3839 HB2 33.8522 5.9547 -4.0417 H 242 LEU242 0.0287 3840 CG 34.8043 5.4798 -2.1778 C.3 242 LEU242 -0.0449 3841 HG 33.8939 5.0363 -1.8051 H 242 LEU242 0.0296 3842 CD1 35.6504 4.3357 -2.7482 C.3 242 LEU242 -0.0626 3843 HD11 35.8784 3.5998 -1.9754 H 242 LEU242 0.0232 3844 HD12 36.5980 4.7037 -3.1417 H 242 LEU242 0.0232 3845 HD13 35.1261 3.8201 -3.5528 H 242 LEU242 0.0232 3846 CD2 35.5074 6.1212 -0.9801 C.3 242 LEU242 -0.0626 3847 HD21 35.7127 5.3673 -0.2205 H 242 LEU242 0.0232 3848 HD22 34.8865 6.8787 -0.5047 H 242 LEU242 0.0232 3849 HD23 36.4580 6.5655 -1.2728 H 242 LEU242 0.0232 3850 N 32.2600 8.4250 -4.6870 N.am 243 HIS243 -0.2453 3851 H 31.6240 7.6830 -4.3960 H 243 HIS243 0.1312 3852 CA 31.9110 9.2490 -5.8380 C.3 243 HIS243 0.0932 3853 HA 32.8229 9.4866 -6.3884 H 243 HIS243 0.0561 3854 C 31.2710 10.5620 -5.4020 C.2 243 HIS243 0.2190 3855 O 31.4220 11.5880 -6.0650 O.2 243 HIS243 -0.2778 3856 CB 30.9190 8.4969 -6.7368 C.3 243 HIS243 0.0146 3857 HB1 30.6402 9.1093 -7.5936 H 243 HIS243 0.0348 3858 HB2 30.0032 8.2671 -6.1915 H 243 HIS243 0.0348 3859 CG 31.5140 7.2039 -7.2449 C.ar 243 HIS243 0.0551 3860 ND1 30.8044 6.0641 -7.3814 N.ar 243 HIS243 -0.2469 3861 CD2 32.8237 6.9636 -7.6948 C.ar 243 HIS243 0.0047 3862 HD2 33.6259 7.6859 -7.7334 H 243 HIS243 0.0764 3863 CE1 31.6580 5.1533 -7.8766 C.ar 243 HIS243 0.0737 3864 HE1 31.3810 4.1317 -8.0943 H 243 HIS243 0.0963 3865 NE2 32.8868 5.6658 -8.0719 N.ar 243 HIS243 -0.2539 3866 HE2 33.6672 5.1958 -8.4314 H 243 HIS243 0.1339 3867 N 30.6160 10.5550 -4.2590 N.am 244 MET244 -0.2456 3868 H 30.3480 9.6640 -3.8400 H 244 MET244 0.1312 3869 CA 30.2730 11.7810 -3.5930 C.3 244 MET244 0.0885 3870 HA 29.7026 12.3651 -4.3190 H 244 MET244 0.0557 3871 C 31.4710 12.6250 -3.2540 C.2 244 MET244 0.2187 3872 O 31.3890 13.8170 -3.1820 O.2 244 MET244 -0.2778 3873 CB 29.3760 11.5388 -2.3633 C.3 244 MET244 -0.0199 3874 HB1 29.3290 12.4485 -1.7634 H 244 MET244 0.0293 3875 HB2 29.8134 10.7813 -1.7179 H 244 MET244 0.0293 3876 CG 27.9317 11.1621 -2.7296 C.3 244 MET244 -0.0047 3877 HG1 27.8774 10.2406 -3.3045 H 244 MET244 0.0377 3878 HG2 27.5192 11.9431 -3.3692 H 244 MET244 0.0377 3879 SD 26.8876 11.0502 -1.2587 S.3 244 MET244 -0.1641 3880 CE 26.4683 9.2971 -1.3018 C.3 244 MET244 -0.0181 3881 HE1 25.9864 8.9999 -0.3703 H 244 MET244 0.0340 3882 HE2 27.3674 8.6971 -1.4253 H 244 MET244 0.0340 3883 HE3 25.8080 9.0830 -2.1410 H 244 MET244 0.0340 3884 N 32.5930 12.0000 -3.0170 N.am 245 LYS245 -0.2457 3885 H 32.6710 11.0010 -3.2070 H 245 LYS245 0.1312 3886 CA 33.7290 12.7300 -2.4830 C.3 245 LYS245 0.0878 3887 HA 33.4054 13.5191 -1.8005 H 245 LYS245 0.0557 3888 C 34.5920 13.2660 -3.5970 C.2 245 LYS245 0.2187 3889 O 35.2810 14.2420 -3.4520 O.2 245 LYS245 -0.2778 3890 CB 34.5141 11.5812 -1.7589 C.3 245 LYS245 -0.0289 3891 HB1 34.9499 10.9195 -2.5067 H 245 LYS245 0.0285 3892 HB2 33.8013 10.9568 -1.2194 H 245 LYS245 0.0285 3893 CG 35.6172 11.9436 -0.7471 C.3 245 LYS245 -0.0496 3894 HG1 35.1424 12.2398 0.1895 H 245 LYS245 0.0266 3895 HG2 36.1538 12.8259 -1.0972 H 245 LYS245 0.0266 3896 CD 36.6584 10.8162 -0.4592 C.3 245 LYS245 -0.0278 3897 HD1 37.2152 11.1044 0.4324 H 245 LYS245 0.0282 3898 HD2 37.3992 10.8126 -1.2588 H 245 LYS245 0.0282 3899 CE 36.1312 9.3621 -0.2943 C.3 245 LYS245 0.1103 3900 HE1 36.1016 8.8952 -1.2775 H 245 LYS245 0.0559 3901 HE2 35.1106 9.3702 0.0917 H 245 LYS245 0.0559 3902 NZ 36.9134 8.4776 0.5929 N.4 245 LYS245 -0.0749 3903 HZ1 36.8366 7.4605 0.3756 H 245 LYS245 0.2742 3904 HZ2 36.6007 8.6331 1.5745 H 245 LYS245 0.2742 3905 HZ3 37.9085 8.7750 0.6577 H 245 LYS245 0.2742 3906 N 34.5430 12.5800 -4.7110 N.am 246 VAL246 -0.2454 3907 H 34.0250 11.7020 -4.7070 H 246 VAL246 0.1312 3908 CA 35.1750 12.9850 -5.9470 C.3 246 VAL246 0.0901 3909 HA 36.2106 13.2422 -5.7205 H 246 VAL246 0.0560 3910 C 34.5100 14.2480 -6.5380 C.2 246 VAL246 0.2189 3911 O 35.1770 15.1350 -7.0800 O.2 246 VAL246 -0.2778 3912 CB 35.1212 11.7960 -6.9365 C.3 246 VAL246 -0.0227 3913 HB 34.1213 11.3640 -6.8772 H 246 VAL246 0.0315 3914 CG1 35.3435 12.1916 -8.4081 C.3 246 VAL246 -0.0608 3915 HG11 35.3584 11.3123 -9.0522 H 246 VAL246 0.0233 3916 HG12 36.2881 12.7196 -8.5392 H 246 VAL246 0.0233 3917 HG13 34.5447 12.8356 -8.7802 H 246 VAL246 0.0233 3918 CG2 36.1361 10.7138 -6.5395 C.3 246 VAL246 -0.0608 3919 HG21 35.9847 9.8042 -7.1208 H 246 VAL246 0.0233 3920 HG22 36.0638 10.4530 -5.4857 H 246 VAL246 0.0233 3921 HG23 37.1559 11.0567 -6.7153 H 246 VAL246 0.0233 3922 N 33.1880 14.3180 -6.4030 N.am 247 GLU247 -0.2456 3923 H 32.7230 13.6840 -5.7540 H 247 GLU247 0.1312 3924 CA 32.3920 15.2640 -7.1470 C.3 247 GLU247 0.0883 3925 HA 32.9401 15.5654 -8.0432 H 247 GLU247 0.0557 3926 C 32.1320 16.4960 -6.3270 C.2 247 GLU247 0.2187 3927 O 31.8440 17.5650 -6.8690 O.2 247 GLU247 -0.2778 3928 CB 31.0723 14.5960 -7.5770 C.3 247 GLU247 -0.0193 3929 HB1 30.4135 15.3298 -8.0444 H 247 GLU247 0.0290 3930 HB2 30.5482 14.2449 -6.6876 H 247 GLU247 0.0290 3931 CG 31.2536 13.4030 -8.5411 C.3 247 GLU247 0.0356 3932 HG1 30.3068 12.8776 -8.6479 H 247 GLU247 0.0374 3933 HG2 31.9673 12.6863 -8.1401 H 247 GLU247 0.0374 3934 CD 31.7181 13.7698 -9.9618 C.2 247 GLU247 0.1760 3935 OE1 31.5935 14.9265 -10.3631 O.co2 247 GLU247 -0.6478 3936 OE2 32.2020 12.8764 -10.6577 O.co2 247 GLU247 -0.6478 3937 N 32.2700 16.3650 -5.0150 N.am 248 CAS248 -0.2449 3938 H 32.6250 15.4940 -4.6210 H 248 CAS248 0.1312 3939 CA 31.9130 17.4670 -4.1420 C.3 248 CAS248 0.0967 3940 HA 31.6358 18.2927 -4.7869 H 248 CAS248 0.0565 3941 CB 30.6372 17.0431 -3.3904 C.3 248 CAS248 0.0147 3942 HB1 30.3608 17.7755 -2.6315 H 248 CAS248 0.0394 3943 HB2 30.8277 16.1160 -2.8570 H 248 CAS248 0.0394 3944 C 32.9070 17.9370 -3.1630 C.2 248 CAS248 0.2221 3945 O 33.6720 17.1630 -2.6160 O.2 248 CAS248 -0.2775 3946 SG 29.1939 16.7903 -4.4590 S.3 248 CAS248 -0.1762 3947 HG 28.1835 16.3086 -3.7329 H 248 CAS248 0.1017 3948 N 32.8430 19.2430 -2.9150 N.am 249 PRO249 -0.2315 3949 CA 33.7820 19.9210 -2.0200 C.3 249 PRO249 0.0907 3950 HA 34.7934 19.7228 -2.3775 H 249 PRO249 0.0559 3951 C 33.6480 19.4320 -0.5800 C.2 249 PRO249 0.2190 3952 O 32.5270 19.2000 -0.1230 O.2 249 PRO249 -0.2778 3953 CB 33.4379 21.4081 -2.1414 C.3 249 PRO249 -0.0276 3954 HB1 34.1049 21.8846 -2.8602 H 249 PRO249 0.0285 3955 HB2 33.5312 21.9470 -1.2034 H 249 PRO249 0.0285 3956 CG 32.0093 21.4488 -2.6523 C.3 249 PRO249 -0.0379 3957 HG1 31.7840 22.3592 -3.2076 H 249 PRO249 0.0278 3958 HG2 31.3328 21.4027 -1.8023 H 249 PRO249 0.0278 3959 CD 31.8667 20.1840 -3.4883 C.3 249 PRO249 0.0071 3960 HD1 30.8550 19.7843 -3.4378 H 249 PRO249 0.0431 3961 HD2 32.1600 20.3645 -4.5242 H 249 PRO249 0.0431 3962 N 34.7830 19.2520 0.0900 N.am 250 THR250 -0.2434 3963 H 35.6610 19.4420 -0.3930 H 250 THR250 0.1313 3964 CA 34.8450 18.8000 1.4720 C.3 250 THR250 0.1135 3965 HA 34.3730 17.8179 1.4652 H 250 THR250 0.0583 3966 C 34.0150 19.6640 2.4300 C.2 250 THR250 0.2212 3967 O 33.5800 19.1690 3.4820 O.2 250 THR250 -0.2777 3968 CB 36.2940 18.6230 1.9629 C.3 250 THR250 0.0763 3969 HB 36.2425 18.1748 2.9615 H 250 THR250 0.0611 3970 OG1 36.9257 19.8855 2.0660 O.3 250 THR250 -0.3900 3971 HG1 37.8384 19.7979 2.3132 H 250 THR250 0.2098 3972 CG2 37.0850 17.6799 1.0398 C.3 250 THR250 -0.0370 3973 HG21 38.0605 17.4299 1.4570 H 250 THR250 0.0255 3974 HG22 37.2478 18.1294 0.0599 H 250 THR250 0.0255 3975 HG23 36.5479 16.7431 0.8905 H 250 THR250 0.0255 3976 N 33.8190 20.9410 2.0740 N.am 251 GLU251 -0.2456 3977 H 34.2610 21.2700 1.2150 H 251 GLU251 0.1312 3978 CA 33.0050 21.9040 2.8440 C.3 251 GLU251 0.0883 3979 HA 33.5494 22.0673 3.7740 H 251 GLU251 0.0557 3980 C 31.6030 21.3790 3.2180 C.2 251 GLU251 0.2187 3981 O 31.0210 21.8070 4.1910 O.2 251 GLU251 -0.2778 3982 CB 32.8779 23.2362 2.0839 C.3 251 GLU251 -0.0193 3983 HB1 32.2857 23.9205 2.6924 H 251 GLU251 0.0290 3984 HB2 32.3091 23.0970 1.1622 H 251 GLU251 0.0290 3985 CG 34.2265 23.9222 1.7897 C.3 251 GLU251 0.0356 3986 HG1 34.9870 23.6429 2.5184 H 251 GLU251 0.0374 3987 HG2 34.1142 25.0041 1.8550 H 251 GLU251 0.0374 3988 CD 34.7348 23.6070 0.3786 C.2 251 GLU251 0.1760 3989 OE1 34.3375 24.3031 -0.5532 O.co2 251 GLU251 -0.6478 3990 OE2 35.5159 22.6723 0.2218 O.co2 251 GLU251 -0.6478 3991 N 31.0880 20.4480 2.4280 N.am 252 LEU252 -0.2456 3992 H 31.7010 20.0230 1.7320 H 252 LEU252 0.1312 3993 CA 29.6980 19.9880 2.4860 C.3 252 LEU252 0.0880 3994 HA 29.0983 20.7534 2.9794 H 252 LEU252 0.0557 3995 C 29.5810 18.7190 3.2930 C.2 252 LEU252 0.2187 3996 O 28.4880 18.2730 3.6100 O.2 252 LEU252 -0.2778 3997 CB 29.1768 19.7173 1.0654 C.3 252 LEU252 -0.0266 3998 HB1 28.1572 19.3328 1.1184 H 252 LEU252 0.0287 3999 HB2 29.7798 18.9282 0.6120 H 252 LEU252 0.0287 4000 CG 29.1878 20.9397 0.1355 C.3 252 LEU252 -0.0449 4001 HG 30.2059 21.3269 0.0878 H 252 LEU252 0.0296 4002 CD1 28.7761 20.5196 -1.2808 C.3 252 LEU252 -0.0626 4003 HD11 28.8416 21.3577 -1.9748 H 252 LEU252 0.0232 4004 HD12 27.7526 20.1445 -1.2987 H 252 LEU252 0.0232 4005 HD13 29.4251 19.7283 -1.6539 H 252 LEU252 0.0232 4006 CD2 28.2786 22.0653 0.6461 C.3 252 LEU252 -0.0626 4007 HD21 28.2672 22.9018 -0.0529 H 252 LEU252 0.0232 4008 HD22 28.6229 22.4525 1.6047 H 252 LEU252 0.0232 4009 HD23 27.2518 21.7201 0.7697 H 252 LEU252 0.0232 4010 N 30.7160 18.1120 3.5890 N.am 253 PHE253 -0.2453 4011 H 31.5950 18.5230 3.2760 H 253 PHE253 0.1312 4012 CA 30.7450 16.8780 4.3460 C.3 253 PHE253 0.0920 4013 HA 29.7954 16.3588 4.2377 H 253 PHE253 0.0560 4014 C 31.1000 17.2450 5.7540 C.2 253 PHE253 0.2217 4015 O 32.1570 17.8200 5.9850 O.2 253 PHE253 -0.2776 4016 CB 31.8346 15.9653 3.7710 C.3 253 PHE253 -0.0036 4017 HB1 31.9004 15.0742 4.3889 H 253 PHE253 0.0333 4018 HB2 32.8065 16.4610 3.7874 H 253 PHE253 0.0333 4019 CG 31.5305 15.5182 2.3686 C.ar 253 PHE253 -0.0454 4020 CD1 31.6838 16.3934 1.3012 C.ar 253 PHE253 -0.0585 4021 HD1 32.0594 17.3914 1.4674 H 253 PHE253 0.0620 4022 CD2 31.0950 14.2208 2.1198 C.ar 253 PHE253 -0.0585 4023 HD2 31.0286 13.5080 2.9270 H 253 PHE253 0.0620 4024 CE1 31.3127 16.0157 0.0233 C.ar 253 PHE253 -0.0615 4025 HE1 31.4161 16.7252 -0.7829 H 253 PHE253 0.0618 4026 CE2 30.7259 13.8337 0.8404 C.ar 253 PHE253 -0.0615 4027 HE2 30.3618 12.8327 0.6600 H 253 PHE253 0.0618 4028 CZ 30.8028 14.7459 -0.2003 C.ar 253 PHE253 -0.0617 4029 HZ 30.4614 14.4696 -1.1818 H 253 PHE253 0.0618 4030 N 30.2000 16.9530 6.6870 N.am 254 PRO254 -0.2316 4031 CA 30.4770 17.0970 8.1170 C.3 254 PRO254 0.0909 4032 HA 30.6821 18.1545 8.2657 H 254 PRO254 0.0560 4033 C 31.6150 16.1670 8.5290 C.2 254 PRO254 0.2216 4034 O 31.6230 15.0220 8.0940 O.2 254 PRO254 -0.2776 4035 CB 29.1686 16.6840 8.8084 C.3 254 PRO254 -0.0275 4036 HB1 28.9499 17.3237 9.6620 H 254 PRO254 0.0285 4037 HB2 29.2066 15.6531 9.1669 H 254 PRO254 0.0285 4038 CG 28.0963 16.7818 7.7328 C.3 254 PRO254 -0.0379 4039 HG1 27.6863 17.7924 7.7182 H 254 PRO254 0.0278 4040 HG2 27.2683 16.0916 7.8952 H 254 PRO254 0.0278 4041 CD 28.8341 16.5176 6.4242 C.3 254 PRO254 0.0071 4042 HD1 28.8544 15.4625 6.1674 H 254 PRO254 0.0431 4043 HD2 28.4222 17.1156 5.6191 H 254 PRO254 0.0431 4044 N 32.5700 16.6690 9.3300 N.am 255 PRO255 -0.2316 4045 CA 33.7500 15.8940 9.7790 C.3 255 PRO255 0.0907 4046 HA 34.4520 15.9035 8.9445 H 255 PRO255 0.0559 4047 C 33.4590 14.4440 10.1650 C.2 255 PRO255 0.2189 4048 O 34.2320 13.5690 9.7420 O.2 255 PRO255 -0.2778 4049 CB 34.2797 16.7193 10.9542 C.3 255 PRO255 -0.0276 4050 HB1 35.3546 16.6037 11.0945 H 255 PRO255 0.0285 4051 HB2 33.7906 16.4271 11.8848 H 255 PRO255 0.0285 4052 CG 33.8800 18.1532 10.6173 C.3 255 PRO255 -0.0379 4053 HG1 34.6397 18.5929 9.9698 H 255 PRO255 0.0278 4054 HG2 33.7938 18.7858 11.5009 H 255 PRO255 0.0278 4055 CD 32.5638 18.0388 9.8429 C.3 255 PRO255 0.0071 4056 HD1 31.6887 18.1532 10.4846 H 255 PRO255 0.0431 4057 HD2 32.5379 18.7447 9.0110 H 255 PRO255 0.0431 4058 N 32.3960 14.2040 10.9390 N.am 256 LEU256 -0.2456 4059 H 31.8270 14.9930 11.2450 H 256 LEU256 0.1312 4060 CA 32.0130 12.8570 11.3670 C.3 256 LEU256 0.0880 4061 HA 32.9053 12.4185 11.8163 H 256 LEU256 0.0557 4062 C 31.5810 11.9360 10.1930 C.2 256 LEU256 0.2187 4063 O 31.9550 10.7680 10.1340 O.2 256 LEU256 -0.2778 4064 CB 30.8833 12.9450 12.4133 C.3 256 LEU256 -0.0266 4065 HB1 30.0375 13.4775 11.9760 H 256 LEU256 0.0287 4066 HB2 31.2234 13.5568 13.2493 H 256 LEU256 0.0287 4067 CG 30.3938 11.5801 12.9496 C.3 256 LEU256 -0.0449 4068 HG 30.0033 11.0045 12.1116 H 256 LEU256 0.0296 4069 CD1 31.5285 10.7625 13.5824 C.3 256 LEU256 -0.0626 4070 HD11 31.1534 9.8168 13.9747 H 256 LEU256 0.0232 4071 HD12 31.9948 11.3044 14.4053 H 256 LEU256 0.0232 4072 HD13 32.3037 10.5193 12.8558 H 256 LEU256 0.0232 4073 CD2 29.2377 11.7490 13.9453 C.3 256 LEU256 -0.0626 4074 HD21 28.9400 10.7937 14.3773 H 256 LEU256 0.0232 4075 HD22 28.3582 12.1638 13.4558 H 256 LEU256 0.0232 4076 HD23 29.5133 12.4084 14.7684 H 256 LEU256 0.0232 4077 N 30.7990 12.4940 9.2780 N.am 257 PHE257 -0.2453 4078 H 30.4930 13.4540 9.4350 H 257 PHE257 0.1312 4079 CA 30.3500 11.8290 8.0670 C.3 257 PHE257 0.0917 4080 HA 29.7931 10.9440 8.3724 H 257 PHE257 0.0560 4081 C 31.5830 11.3820 7.2850 C.2 257 PHE257 0.2190 4082 O 31.7140 10.2110 6.9270 O.2 257 PHE257 -0.2778 4083 CB 29.4657 12.8153 7.2767 C.3 257 PHE257 -0.0036 4084 HB1 30.0359 13.7082 7.0351 H 257 PHE257 0.0333 4085 HB2 28.6412 13.1478 7.9077 H 257 PHE257 0.0333 4086 CG 28.8794 12.2730 5.9977 C.ar 257 PHE257 -0.0454 4087 CD1 28.1653 11.0817 5.9876 C.ar 257 PHE257 -0.0585 4088 HD1 28.0604 10.5063 6.8944 H 257 PHE257 0.0620 4089 CD2 28.9752 13.0023 4.8150 C.ar 257 PHE257 -0.0585 4090 HD2 29.5283 13.9285 4.7891 H 257 PHE257 0.0620 4091 CE1 27.5759 10.6197 4.8175 C.ar 257 PHE257 -0.0615 4092 HE1 27.0263 9.6910 4.8251 H 257 PHE257 0.0618 4093 CE2 28.3572 12.5613 3.6527 C.ar 257 PHE257 -0.0615 4094 HE2 28.4231 13.1462 2.7470 H 257 PHE257 0.0618 4095 CZ 27.6636 11.3627 3.6503 C.ar 257 PHE257 -0.0617 4096 HZ 27.1911 11.0144 2.7436 H 257 PHE257 0.0618 4097 N 32.5120 12.3040 7.0640 N.am 258 LEU258 -0.2456 4098 H 32.3340 13.2670 7.3490 H 258 LEU258 0.1312 4099 CA 33.8040 11.9690 6.4130 C.3 258 LEU258 0.0880 4100 HA 33.5764 11.6339 5.4029 H 258 LEU258 0.0557 4101 C 34.5130 10.8230 7.1190 C.2 258 LEU258 0.2187 4102 O 34.9160 9.8540 6.4940 O.2 258 LEU258 -0.2778 4103 CB 34.7605 13.1788 6.4002 C.3 258 LEU258 -0.0266 4104 HB1 35.7576 12.8594 6.0898 H 258 LEU258 0.0287 4105 HB2 34.8743 13.5623 7.4127 H 258 LEU258 0.0287 4106 CG 34.3259 14.3220 5.4794 C.3 258 LEU258 -0.0449 4107 HG 33.3220 14.6127 5.7799 H 258 LEU258 0.0296 4108 CD1 35.2200 15.5534 5.6702 C.3 258 LEU258 -0.0626 4109 HD11 34.8838 16.3828 5.0467 H 258 LEU258 0.0232 4110 HD12 36.2545 15.3338 5.4055 H 258 LEU258 0.0232 4111 HD13 35.2032 15.8947 6.7050 H 258 LEU258 0.0232 4112 CD2 34.3368 13.8752 4.0074 C.3 258 LEU258 -0.0626 4113 HD21 34.2041 14.7169 3.3294 H 258 LEU258 0.0232 4114 HD22 33.5431 13.1586 3.7982 H 258 LEU258 0.0232 4115 HD23 35.2853 13.4035 3.7472 H 258 LEU258 0.0232 4116 N 34.6460 10.9470 8.4300 N.am 259 GLU259 -0.2456 4117 H 34.2910 11.7960 8.8690 H 259 GLU259 0.1312 4118 CA 35.2700 9.9420 9.2840 C.3 259 GLU259 0.0883 4119 HA 36.2780 9.8451 8.8756 H 259 GLU259 0.0557 4120 C 34.6550 8.5180 9.2630 C.2 259 GLU259 0.2187 4121 O 35.3880 7.5540 9.1250 O.2 259 GLU259 -0.2778 4122 CB 35.3648 10.4637 10.7373 C.3 259 GLU259 -0.0193 4123 HB1 34.6658 9.9387 11.3907 H 259 GLU259 0.0290 4124 HB2 35.0487 11.5043 10.7744 H 259 GLU259 0.0290 4125 CG 36.7831 10.3886 11.3354 C.3 259 GLU259 0.0356 4126 HG1 36.7719 10.6804 12.3848 H 259 GLU259 0.0374 4127 HG2 37.4424 11.0866 10.8192 H 259 GLU259 0.0374 4128 CD 37.3898 8.9819 11.2286 C.2 259 GLU259 0.1760 4129 OE1 37.0114 8.0876 11.9772 O.co2 259 GLU259 -0.6478 4130 OE2 38.2480 8.7557 10.3823 O.co2 259 GLU259 -0.6478 4131 N 33.3280 8.3880 9.4320 N.am 260 VAL260 -0.2454 4132 H 32.7530 9.2200 9.5670 H 260 VAL260 0.1312 4133 CA 32.6920 7.0560 9.4240 C.3 260 VAL260 0.0901 4134 HA 33.3000 6.4607 10.1042 H 260 VAL260 0.0560 4135 C 32.8530 6.3670 8.0870 C.2 260 VAL260 0.2189 4136 O 32.9270 5.1380 8.0110 O.2 260 VAL260 -0.2778 4137 CB 31.2563 7.0316 9.9802 C.3 260 VAL260 -0.0227 4138 HB 30.8556 6.0339 9.7905 H 260 VAL260 0.0315 4139 CG1 31.2675 7.2173 11.5034 C.3 260 VAL260 -0.0608 4140 HG11 30.2942 6.9883 11.9297 H 260 VAL260 0.0233 4141 HG12 31.5334 8.2389 11.7782 H 260 VAL260 0.0233 4142 HG13 31.9838 6.5470 11.9791 H 260 VAL260 0.0233 4143 CG2 30.3186 8.0366 9.3048 C.3 260 VAL260 -0.0608 4144 HG21 29.2736 7.7876 9.4892 H 260 VAL260 0.0233 4145 HG22 30.4818 8.0590 8.2319 H 260 VAL260 0.0233 4146 HG23 30.4791 9.0436 9.6749 H 260 VAL260 0.0233 4147 N 32.9380 7.1560 7.0330 N.am 261 PHE261 -0.2453 4148 H 33.0550 8.1620 7.1490 H 261 PHE261 0.1312 4149 CA 32.8630 6.5740 5.7090 C.3 261 PHE261 0.0917 4150 HA 32.7061 5.5002 5.7966 H 261 PHE261 0.0560 4151 C 34.1310 6.5930 4.8720 C.2 261 PHE261 0.2190 4152 O 34.0950 6.1370 3.7450 O.2 261 PHE261 -0.2778 4153 CB 31.6388 7.1283 4.9572 C.3 261 PHE261 -0.0036 4154 HB1 31.6052 6.7373 3.9407 H 261 PHE261 0.0333 4155 HB2 31.7243 8.2119 4.8802 H 261 PHE261 0.0333 4156 CG 30.3271 6.7646 5.6173 C.ar 261 PHE261 -0.0454 4157 CD1 29.3761 7.7462 5.8715 C.ar 261 PHE261 -0.0585 4158 HD1 29.5945 8.7664 5.5967 H 261 PHE261 0.0620 4159 CD2 30.0346 5.4490 5.9740 C.ar 261 PHE261 -0.0585 4160 HD2 30.7347 4.6543 5.7638 H 261 PHE261 0.0620 4161 CE1 28.1831 7.4343 6.5152 C.ar 261 PHE261 -0.0615 4162 HE1 27.4617 8.2074 6.7322 H 261 PHE261 0.0618 4163 CE2 28.8502 5.1348 6.6257 C.ar 261 PHE261 -0.0615 4164 HE2 28.6530 4.1130 6.9148 H 261 PHE261 0.0618 4165 CZ 27.9226 6.1281 6.9014 C.ar 261 PHE261 -0.0617 4166 HZ 27.0010 5.8829 7.4100 H 261 PHE261 0.0618 4167 N 35.2400 7.1200 5.4070 N.am 262 GLU262 -0.2456 4168 H 35.2040 7.5470 6.3330 H 262 GLU262 0.1312 4169 CA 36.5120 7.0850 4.6630 C.3 262 GLU262 0.0883 4170 HA 36.3079 7.1835 3.5947 H 262 GLU262 0.0557 4171 C 37.1580 5.7330 4.9240 C.2 262 GLU262 0.2186 4172 O 37.0600 5.2250 6.0460 O.2 262 GLU262 -0.2778 4173 CB 37.5174 8.1763 5.1275 C.3 262 GLU262 -0.0193 4174 HB1 38.5251 7.8780 4.8307 H 262 GLU262 0.0290 4175 HB2 37.5320 8.2021 6.2175 H 262 GLU262 0.0290 4176 CG 37.3427 9.6199 4.6008 C.3 262 GLU262 0.0356 4177 HG1 38.1632 10.2390 4.9607 H 262 GLU262 0.0374 4178 HG2 36.4420 10.0882 4.9642 H 262 GLU262 0.0374 4179 CD 37.3103 9.7447 3.0776 C.2 262 GLU262 0.1760 4180 OE1 36.2694 10.0903 2.5289 O.co2 262 GLU262 -0.6478 4181 OE2 38.3102 9.4951 2.4119 O.co2 262 GLU262 -0.6478 4182 N 37.7930 5.1590 3.8860 N.am 263 ASP263 -0.2468 4183 H 37.8570 5.6900 3.0170 H 263 ASP263 0.1311 4184 CA 38.4070 3.8060 3.9170 C.3 263 ASP263 0.0795 4185 HA 37.6120 3.0949 4.1429 H 263 ASP263 0.0545 4186 C 39.6200 3.6000 4.8570 C.2 263 ASP263 0.1380 4187 H 39.5350 2.8960 5.7020 H 263 ASP263 0.1043 4188 O 40.6880 4.2120 4.6780 O.2 263 ASP263 -0.2994 4189 CB 38.9097 3.6338 2.4514 C.3 263 ASP263 0.0560 4190 HB1 39.1404 2.5890 2.2480 H 263 ASP263 0.0393 4191 HB2 39.8350 4.1894 2.2973 H 263 ASP263 0.0393 4192 CG 37.9242 4.1404 1.3564 C.2 263 ASP263 0.1779 4193 OD1 37.1338 3.3383 0.8731 O.co2 263 ASP263 -0.6478 4194 OD2 37.9572 5.3276 0.9945 O.co2 263 ASP263 -0.6478 @BOND 1 1 5 1 2 1 2 1 3 1 3 1 4 1 4 1 5 5 7 1 6 5 9 1 7 5 6 1 8 7 14 am 9 7 8 2 10 9 12 1 11 9 10 1 12 9 11 1 13 12 13 1 14 14 16 1 15 14 15 1 16 16 18 1 17 16 20 1 18 16 17 1 19 18 31 am 20 18 19 2 21 20 23 1 22 20 21 1 23 20 22 1 24 23 24 ar 25 23 25 ar 26 24 27 ar 27 25 29 ar 28 25 26 1 29 27 29 ar 30 27 28 1 31 29 30 1 32 31 33 1 33 31 32 1 34 33 35 1 35 33 37 1 36 33 34 1 37 35 48 am 38 35 36 2 39 37 40 1 40 37 38 1 41 37 39 1 42 40 43 1 43 40 41 1 44 40 42 1 45 43 44 1 46 44 45 1 47 44 46 1 48 44 47 1 49 48 50 1 50 48 49 1 51 50 52 1 52 50 54 1 53 50 51 1 54 52 63 am 55 52 53 2 56 54 57 1 57 54 55 1 58 54 56 1 59 57 60 1 60 57 58 1 61 57 59 1 62 60 61 ar 63 60 62 ar 64 63 65 1 65 63 64 1 66 65 67 1 67 65 69 1 68 65 66 1 69 67 78 am 70 67 68 2 71 69 72 1 72 69 70 1 73 69 71 1 74 72 75 1 75 72 73 1 76 72 74 1 77 75 76 ar 78 75 77 ar 79 78 80 1 80 78 79 1 81 80 82 1 82 80 84 1 83 80 81 1 84 82 95 am 85 82 83 2 86 84 87 1 87 84 85 1 88 84 86 1 89 87 90 1 90 87 88 1 91 87 89 1 92 90 91 1 93 91 92 1 94 91 93 1 95 91 94 1 96 95 97 1 97 95 96 1 98 97 99 1 99 97 101 1 100 97 98 1 101 99 114 am 102 99 100 2 103 101 103 1 104 101 106 1 105 101 102 1 106 103 110 1 107 103 104 1 108 103 105 1 109 106 107 1 110 106 108 1 111 106 109 1 112 110 111 1 113 110 112 1 114 110 113 1 115 114 116 1 116 114 115 1 117 116 118 1 118 116 120 1 119 116 117 1 120 118 138 am 121 118 119 2 122 120 123 1 123 120 121 1 124 120 122 1 125 123 126 1 126 123 124 1 127 123 125 1 128 126 129 1 129 126 127 1 130 126 128 1 131 129 131 ar 132 129 130 1 133 131 132 ar 134 131 135 ar 135 132 133 1 136 132 134 1 137 135 136 1 138 135 137 1 139 138 140 1 140 138 139 1 141 140 142 1 142 140 144 1 143 140 141 1 144 142 149 am 145 142 143 2 146 144 147 1 147 144 145 1 148 144 146 1 149 147 148 1 150 149 151 1 151 149 150 1 152 151 153 1 153 151 155 1 154 151 152 1 155 153 168 am 156 153 154 2 157 155 158 1 158 155 156 1 159 155 157 1 160 158 160 1 161 158 164 1 162 158 159 1 163 160 161 1 164 160 162 1 165 160 163 1 166 164 165 1 167 164 166 1 168 164 167 1 169 168 170 1 170 168 169 1 171 170 172 1 172 170 174 1 173 170 171 1 174 172 185 am 175 172 173 2 176 174 177 1 177 174 175 1 178 174 176 1 179 177 180 1 180 177 178 1 181 177 179 1 182 180 181 2 183 180 182 am 184 182 183 1 185 182 184 1 186 185 187 1 187 185 186 1 188 187 189 1 189 187 191 1 190 187 188 1 191 189 202 am 192 189 190 2 193 191 194 1 194 191 192 1 195 191 193 1 196 194 197 1 197 194 195 1 198 194 196 1 199 197 198 2 200 197 199 am 201 199 200 1 202 199 201 1 203 202 204 1 204 202 203 1 205 204 206 1 206 204 208 1 207 204 205 1 208 206 226 am 209 206 207 2 210 208 211 1 211 208 209 1 212 208 210 1 213 211 214 1 214 211 212 1 215 211 213 1 216 214 217 1 217 214 215 1 218 214 216 1 219 217 219 ar 220 217 218 1 221 219 220 ar 222 219 223 ar 223 220 221 1 224 220 222 1 225 223 224 1 226 223 225 1 227 226 227 1 228 226 237 1 229 227 229 1 230 227 231 1 231 227 228 1 232 229 240 am 233 229 230 2 234 231 234 1 235 231 232 1 236 231 233 1 237 234 237 1 238 234 235 1 239 234 236 1 240 237 238 1 241 237 239 1 242 240 242 1 243 240 241 1 244 242 244 1 245 242 246 1 246 242 243 1 247 244 255 am 248 244 245 2 249 246 249 1 250 246 247 1 251 246 248 1 252 249 252 1 253 249 250 1 254 249 251 1 255 252 253 ar 256 252 254 ar 257 255 256 1 258 255 266 1 259 256 258 1 260 256 260 1 261 256 257 1 262 258 269 am 263 258 259 2 264 260 263 1 265 260 261 1 266 260 262 1 267 263 266 1 268 263 264 1 269 263 265 1 270 266 267 1 271 266 268 1 272 269 271 1 273 269 270 1 274 271 273 1 275 271 275 1 276 271 272 1 277 273 283 am 278 273 274 2 279 275 277 1 280 275 279 1 281 275 276 1 282 277 278 1 283 279 280 1 284 279 281 1 285 279 282 1 286 283 284 1 287 283 294 1 288 284 286 1 289 284 288 1 290 284 285 1 291 286 297 am 292 286 287 2 293 288 291 1 294 288 289 1 295 288 290 1 296 291 294 1 297 291 292 1 298 291 293 1 299 294 295 1 300 294 296 1 301 297 299 1 302 297 298 1 303 299 301 1 304 299 303 1 305 299 300 1 306 301 312 am 307 301 302 2 308 303 306 1 309 303 304 1 310 303 305 1 311 306 309 1 312 306 307 1 313 306 308 1 314 309 310 ar 315 309 311 ar 316 312 314 1 317 312 313 1 318 314 316 1 319 314 318 1 320 314 315 1 321 316 327 am 322 316 317 2 323 318 321 1 324 318 319 1 325 318 320 1 326 321 324 1 327 321 322 1 328 321 323 1 329 324 325 ar 330 324 326 ar 331 327 329 1 332 327 328 1 333 329 331 1 334 329 333 1 335 329 330 1 336 331 351 am 337 331 332 2 338 333 336 1 339 333 334 1 340 333 335 1 341 336 337 ar 342 336 339 ar 343 337 340 ar 344 337 338 1 345 339 342 ar 346 339 343 ar 347 340 342 ar 348 340 341 1 349 342 345 ar 350 343 347 ar 351 343 344 1 352 345 349 ar 353 345 346 1 354 347 349 ar 355 347 348 1 356 349 350 1 357 351 353 1 358 351 352 1 359 353 355 1 360 353 357 1 361 353 354 1 362 355 363 am 363 355 356 2 364 357 360 1 365 357 358 1 366 357 359 1 367 360 361 ar 368 360 362 ar 369 363 365 1 370 363 364 1 371 365 367 1 372 365 369 1 373 365 366 1 374 367 382 am 375 367 368 2 376 369 372 1 377 369 370 1 378 369 371 1 379 372 374 1 380 372 378 1 381 372 373 1 382 374 375 1 383 374 376 1 384 374 377 1 385 378 379 1 386 378 380 1 387 378 381 1 388 382 384 1 389 382 383 1 390 384 386 1 391 384 388 1 392 384 385 1 393 386 401 am 394 386 387 2 395 388 390 1 396 388 393 1 397 388 389 1 398 390 397 1 399 390 391 1 400 390 392 1 401 393 394 1 402 393 395 1 403 393 396 1 404 397 398 1 405 397 399 1 406 397 400 1 407 401 403 1 408 401 402 1 409 403 405 1 410 403 407 1 411 403 404 1 412 405 418 am 413 405 406 2 414 407 410 1 415 407 408 1 416 407 409 1 417 410 411 ar 418 410 412 ar 419 411 414 ar 420 412 416 ar 421 412 413 1 422 414 416 ar 423 414 415 1 424 416 417 1 425 418 420 1 426 418 419 1 427 420 422 1 428 420 424 1 429 420 421 1 430 422 437 am 431 422 423 2 432 424 426 1 433 424 429 1 434 424 425 1 435 426 433 1 436 426 427 1 437 426 428 1 438 429 430 1 439 429 431 1 440 429 432 1 441 433 434 1 442 433 435 1 443 433 436 1 444 437 439 1 445 437 438 1 446 439 441 1 447 439 443 1 448 439 440 1 449 441 447 am 450 441 442 2 451 443 444 1 452 443 445 1 453 443 446 1 454 447 449 1 455 447 448 1 456 449 451 1 457 449 453 1 458 449 450 1 459 451 461 am 460 451 452 2 461 453 455 1 462 453 457 1 463 453 454 1 464 455 456 1 465 457 458 1 466 457 459 1 467 457 460 1 468 461 463 1 469 461 462 1 470 463 465 1 471 463 467 1 472 463 464 1 473 465 476 am 474 465 466 2 475 467 470 1 476 467 468 1 477 467 469 1 478 470 473 1 479 470 471 1 480 470 472 1 481 473 474 ar 482 473 475 ar 483 476 478 1 484 476 477 1 485 478 480 1 486 478 482 1 487 478 479 1 488 480 486 am 489 480 481 2 490 482 483 1 491 482 484 1 492 482 485 1 493 486 488 1 494 486 487 1 495 488 490 1 496 488 492 1 497 488 489 1 498 490 503 am 499 490 491 2 500 492 495 1 501 492 493 1 502 492 494 1 503 495 496 ar 504 495 497 ar 505 496 499 ar 506 497 501 ar 507 497 498 1 508 499 501 ar 509 499 500 1 510 501 502 1 511 503 505 1 512 503 504 1 513 505 507 1 514 505 509 1 515 505 506 1 516 507 527 am 517 507 508 2 518 509 512 1 519 509 510 1 520 509 511 1 521 512 515 1 522 512 513 1 523 512 514 1 524 515 518 1 525 515 516 1 526 515 517 1 527 518 520 ar 528 518 519 1 529 520 521 ar 530 520 524 ar 531 521 522 1 532 521 523 1 533 524 525 1 534 524 526 1 535 527 529 1 536 527 528 1 537 529 531 1 538 529 533 1 539 529 530 1 540 531 538 am 541 531 532 2 542 533 536 1 543 533 534 1 544 533 535 1 545 536 537 1 546 538 540 1 547 538 539 1 548 540 542 1 549 540 544 1 550 540 541 1 551 542 552 am 552 542 543 2 553 544 546 1 554 544 548 1 555 544 545 1 556 546 547 1 557 548 549 1 558 548 550 1 559 548 551 1 560 552 554 1 561 552 553 1 562 554 556 1 563 554 558 1 564 554 555 1 565 556 566 am 566 556 557 2 567 558 561 1 568 558 559 1 569 558 560 1 570 561 562 2 571 561 563 am 572 563 564 1 573 563 565 1 574 566 568 1 575 566 567 1 576 568 570 1 577 568 572 1 578 568 569 1 579 570 576 am 580 570 571 2 581 572 573 1 582 572 574 1 583 572 575 1 584 576 578 1 585 576 577 1 586 578 580 1 587 578 582 1 588 578 579 1 589 580 593 am 590 580 581 2 591 582 585 1 592 582 583 1 593 582 584 1 594 585 588 1 595 585 586 1 596 585 587 1 597 588 589 2 598 588 590 am 599 590 591 1 600 590 592 1 601 593 595 1 602 593 594 1 603 595 598 1 604 595 596 1 605 595 597 1 606 598 600 am 607 598 599 2 608 600 602 1 609 600 601 1 610 602 604 1 611 602 606 1 612 602 603 1 613 604 611 am 614 604 605 2 615 606 609 1 616 606 607 1 617 606 608 1 618 609 610 1 619 611 613 1 620 611 612 1 621 613 615 1 622 613 617 1 623 613 614 1 624 615 628 am 625 615 616 2 626 617 620 1 627 617 618 1 628 617 619 1 629 620 621 ar 630 620 622 ar 631 621 624 ar 632 622 626 ar 633 622 623 1 634 624 626 ar 635 624 625 1 636 626 627 1 637 628 630 1 638 628 629 1 639 630 632 1 640 630 634 1 641 630 631 1 642 632 652 am 643 632 633 2 644 634 637 1 645 634 635 1 646 634 636 1 647 637 638 ar 648 637 640 ar 649 638 641 ar 650 638 639 1 651 640 643 ar 652 640 644 ar 653 641 643 ar 654 641 642 1 655 643 646 ar 656 644 648 ar 657 644 645 1 658 646 650 ar 659 646 647 1 660 648 650 ar 661 648 649 1 662 650 651 1 663 652 654 1 664 652 653 1 665 654 656 1 666 654 658 1 667 654 655 1 668 656 674 am 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3763 3723 3725 1 3764 3726 3728 am 3765 3726 3727 2 3766 3728 3730 1 3767 3728 3729 1 3768 3730 3732 1 3769 3730 3734 1 3770 3730 3731 1 3771 3732 3738 am 3772 3732 3733 2 3773 3734 3735 1 3774 3734 3736 1 3775 3734 3737 1 3776 3738 3740 1 3777 3738 3739 1 3778 3740 3742 1 3779 3740 3745 1 3780 3740 3741 1 3781 3742 3747 1 3782 3742 3743 1 3783 3742 3744 1 3784 3745 3749 am 3785 3745 3746 2 3786 3747 3748 1 3787 3749 3751 1 3788 3749 3750 1 3789 3751 3753 1 3790 3751 3755 1 3791 3751 3752 1 3792 3753 3766 am 3793 3753 3754 2 3794 3755 3758 1 3795 3755 3756 1 3796 3755 3757 1 3797 3758 3759 ar 3798 3758 3760 ar 3799 3759 3762 ar 3800 3760 3764 ar 3801 3760 3761 1 3802 3762 3764 ar 3803 3762 3763 1 3804 3764 3765 1 3805 3766 3768 1 3806 3766 3767 1 3807 3768 3770 1 3808 3768 3772 1 3809 3768 3769 1 3810 3770 3776 am 3811 3770 3771 2 3812 3772 3773 1 3813 3772 3774 1 3814 3772 3775 1 3815 3776 3778 1 3816 3776 3777 1 3817 3778 3780 1 3818 3778 3782 1 3819 3778 3779 1 3820 3780 3787 am 3821 3780 3781 2 3822 3782 3785 1 3823 3782 3783 1 3824 3782 3784 1 3825 3785 3786 1 3826 3787 3789 1 3827 3787 3788 1 3828 3789 3791 1 3829 3789 3793 1 3830 3789 3790 1 3831 3791 3811 am 3832 3791 3792 2 3833 3793 3796 1 3834 3793 3794 1 3835 3793 3795 1 3836 3796 3799 1 3837 3796 3797 1 3838 3796 3798 1 3839 3799 3802 1 3840 3799 3800 1 3841 3799 3801 1 3842 3802 3804 ar 3843 3802 3803 1 3844 3804 3805 ar 3845 3804 3808 ar 3846 3805 3806 1 3847 3805 3807 1 3848 3808 3809 1 3849 3808 3810 1 3850 3811 3813 1 3851 3811 3812 1 3852 3813 3815 1 3853 3813 3817 1 3854 3813 3814 1 3855 3815 3831 am 3856 3815 3816 2 3857 3817 3820 1 3858 3817 3818 1 3859 3817 3819 1 3860 3820 3821 ar 3861 3820 3823 ar 3862 3821 3825 ar 3863 3821 3822 1 3864 3823 3827 ar 3865 3823 3824 1 3866 3825 3829 ar 3867 3825 3826 1 3868 3827 3829 ar 3869 3827 3828 1 3870 3829 3830 1 3871 3831 3833 1 3872 3831 3832 1 3873 3833 3835 1 3874 3833 3837 1 3875 3833 3834 1 3876 3835 3850 am 3877 3835 3836 2 3878 3837 3840 1 3879 3837 3838 1 3880 3837 3839 1 3881 3840 3842 1 3882 3840 3846 1 3883 3840 3841 1 3884 3842 3843 1 3885 3842 3844 1 3886 3842 3845 1 3887 3846 3847 1 3888 3846 3848 1 3889 3846 3849 1 3890 3850 3852 1 3891 3850 3851 1 3892 3852 3854 1 3893 3852 3856 1 3894 3852 3853 1 3895 3854 3867 am 3896 3854 3855 2 3897 3856 3859 1 3898 3856 3857 1 3899 3856 3858 1 3900 3859 3860 ar 3901 3859 3861 ar 3902 3860 3863 ar 3903 3861 3865 ar 3904 3861 3862 1 3905 3863 3865 ar 3906 3863 3864 1 3907 3865 3866 1 3908 3867 3869 1 3909 3867 3868 1 3910 3869 3871 1 3911 3869 3873 1 3912 3869 3870 1 3913 3871 3884 am 3914 3871 3872 2 3915 3873 3876 1 3916 3873 3874 1 3917 3873 3875 1 3918 3876 3879 1 3919 3876 3877 1 3920 3876 3878 1 3921 3879 3880 1 3922 3880 3881 1 3923 3880 3882 1 3924 3880 3883 1 3925 3884 3886 1 3926 3884 3885 1 3927 3886 3888 1 3928 3886 3890 1 3929 3886 3887 1 3930 3888 3906 am 3931 3888 3889 2 3932 3890 3893 1 3933 3890 3891 1 3934 3890 3892 1 3935 3893 3896 1 3936 3893 3894 1 3937 3893 3895 1 3938 3896 3899 1 3939 3896 3897 1 3940 3896 3898 1 3941 3899 3902 1 3942 3899 3900 1 3943 3899 3901 1 3944 3902 3903 1 3945 3902 3904 1 3946 3902 3905 1 3947 3906 3908 1 3948 3906 3907 1 3949 3908 3910 1 3950 3908 3912 1 3951 3908 3909 1 3952 3910 3922 am 3953 3910 3911 2 3954 3912 3914 1 3955 3912 3918 1 3956 3912 3913 1 3957 3914 3915 1 3958 3914 3916 1 3959 3914 3917 1 3960 3918 3919 1 3961 3918 3920 1 3962 3918 3921 1 3963 3922 3924 1 3964 3922 3923 1 3965 3924 3926 1 3966 3924 3928 1 3967 3924 3925 1 3968 3926 3937 am 3969 3926 3927 2 3970 3928 3931 1 3971 3928 3929 1 3972 3928 3930 1 3973 3931 3934 1 3974 3931 3932 1 3975 3931 3933 1 3976 3934 3935 ar 3977 3934 3936 ar 3978 3937 3939 1 3979 3937 3938 1 3980 3939 3941 1 3981 3939 3944 1 3982 3939 3940 1 3983 3941 3946 1 3984 3941 3942 1 3985 3941 3943 1 3986 3944 3948 am 3987 3944 3945 2 3988 3946 3947 1 3989 3948 3949 1 3990 3948 3959 1 3991 3949 3951 1 3992 3949 3953 1 3993 3949 3950 1 3994 3951 3962 am 3995 3951 3952 2 3996 3953 3956 1 3997 3953 3954 1 3998 3953 3955 1 3999 3956 3959 1 4000 3956 3957 1 4001 3956 3958 1 4002 3959 3960 1 4003 3959 3961 1 4004 3962 3964 1 4005 3962 3963 1 4006 3964 3966 1 4007 3964 3968 1 4008 3964 3965 1 4009 3966 3976 am 4010 3966 3967 2 4011 3968 3970 1 4012 3968 3972 1 4013 3968 3969 1 4014 3970 3971 1 4015 3972 3973 1 4016 3972 3974 1 4017 3972 3975 1 4018 3976 3978 1 4019 3976 3977 1 4020 3978 3980 1 4021 3978 3982 1 4022 3978 3979 1 4023 3980 3991 am 4024 3980 3981 2 4025 3982 3985 1 4026 3982 3983 1 4027 3982 3984 1 4028 3985 3988 1 4029 3985 3986 1 4030 3985 3987 1 4031 3988 3989 ar 4032 3988 3990 ar 4033 3991 3993 1 4034 3991 3992 1 4035 3993 3995 1 4036 3993 3997 1 4037 3993 3994 1 4038 3995 4010 am 4039 3995 3996 2 4040 3997 4000 1 4041 3997 3998 1 4042 3997 3999 1 4043 4000 4002 1 4044 4000 4006 1 4045 4000 4001 1 4046 4002 4003 1 4047 4002 4004 1 4048 4002 4005 1 4049 4006 4007 1 4050 4006 4008 1 4051 4006 4009 1 4052 4010 4012 1 4053 4010 4011 1 4054 4012 4014 1 4055 4012 4016 1 4056 4012 4013 1 4057 4014 4030 am 4058 4014 4015 2 4059 4016 4019 1 4060 4016 4017 1 4061 4016 4018 1 4062 4019 4020 ar 4063 4019 4022 ar 4064 4020 4024 ar 4065 4020 4021 1 4066 4022 4026 ar 4067 4022 4023 1 4068 4024 4028 ar 4069 4024 4025 1 4070 4026 4028 ar 4071 4026 4027 1 4072 4028 4029 1 4073 4030 4031 1 4074 4030 4041 1 4075 4031 4033 1 4076 4031 4035 1 4077 4031 4032 1 4078 4033 4044 am 4079 4033 4034 2 4080 4035 4038 1 4081 4035 4036 1 4082 4035 4037 1 4083 4038 4041 1 4084 4038 4039 1 4085 4038 4040 1 4086 4041 4042 1 4087 4041 4043 1 4088 4044 4045 1 4089 4044 4055 1 4090 4045 4047 1 4091 4045 4049 1 4092 4045 4046 1 4093 4047 4058 am 4094 4047 4048 2 4095 4049 4052 1 4096 4049 4050 1 4097 4049 4051 1 4098 4052 4055 1 4099 4052 4053 1 4100 4052 4054 1 4101 4055 4056 1 4102 4055 4057 1 4103 4058 4060 1 4104 4058 4059 1 4105 4060 4062 1 4106 4060 4064 1 4107 4060 4061 1 4108 4062 4077 am 4109 4062 4063 2 4110 4064 4067 1 4111 4064 4065 1 4112 4064 4066 1 4113 4067 4069 1 4114 4067 4073 1 4115 4067 4068 1 4116 4069 4070 1 4117 4069 4071 1 4118 4069 4072 1 4119 4073 4074 1 4120 4073 4075 1 4121 4073 4076 1 4122 4077 4079 1 4123 4077 4078 1 4124 4079 4081 1 4125 4079 4083 1 4126 4079 4080 1 4127 4081 4097 am 4128 4081 4082 2 4129 4083 4086 1 4130 4083 4084 1 4131 4083 4085 1 4132 4086 4087 ar 4133 4086 4089 ar 4134 4087 4091 ar 4135 4087 4088 1 4136 4089 4093 ar 4137 4089 4090 1 4138 4091 4095 ar 4139 4091 4092 1 4140 4093 4095 ar 4141 4093 4094 1 4142 4095 4096 1 4143 4097 4099 1 4144 4097 4098 1 4145 4099 4101 1 4146 4099 4103 1 4147 4099 4100 1 4148 4101 4116 am 4149 4101 4102 2 4150 4103 4106 1 4151 4103 4104 1 4152 4103 4105 1 4153 4106 4108 1 4154 4106 4112 1 4155 4106 4107 1 4156 4108 4109 1 4157 4108 4110 1 4158 4108 4111 1 4159 4112 4113 1 4160 4112 4114 1 4161 4112 4115 1 4162 4116 4118 1 4163 4116 4117 1 4164 4118 4120 1 4165 4118 4122 1 4166 4118 4119 1 4167 4120 4131 am 4168 4120 4121 2 4169 4122 4125 1 4170 4122 4123 1 4171 4122 4124 1 4172 4125 4128 1 4173 4125 4126 1 4174 4125 4127 1 4175 4128 4129 ar 4176 4128 4130 ar 4177 4131 4133 1 4178 4131 4132 1 4179 4133 4135 1 4180 4133 4137 1 4181 4133 4134 1 4182 4135 4147 am 4183 4135 4136 2 4184 4137 4139 1 4185 4137 4143 1 4186 4137 4138 1 4187 4139 4140 1 4188 4139 4141 1 4189 4139 4142 1 4190 4143 4144 1 4191 4143 4145 1 4192 4143 4146 1 4193 4147 4149 1 4194 4147 4148 1 4195 4149 4151 1 4196 4149 4153 1 4197 4149 4150 1 4198 4151 4167 am 4199 4151 4152 2 4200 4153 4156 1 4201 4153 4154 1 4202 4153 4155 1 4203 4156 4157 ar 4204 4156 4159 ar 4205 4157 4161 ar 4206 4157 4158 1 4207 4159 4163 ar 4208 4159 4160 1 4209 4161 4165 ar 4210 4161 4162 1 4211 4163 4165 ar 4212 4163 4164 1 4213 4165 4166 1 4214 4167 4169 1 4215 4167 4168 1 4216 4169 4171 1 4217 4169 4173 1 4218 4169 4170 1 4219 4171 4182 am 4220 4171 4172 2 4221 4173 4176 1 4222 4173 4174 1 4223 4173 4175 1 4224 4176 4179 1 4225 4176 4177 1 4226 4176 4178 1 4227 4179 4180 ar 4228 4179 4181 ar 4229 4182 4184 1 4230 4182 4183 1 4231 4184 4186 1 4232 4184 4189 1 4233 4184 4185 1 4234 4186 4188 2 4235 4186 4187 1 4236 4189 4192 1 4237 4189 4190 1 4238 4189 4191 1 4239 4192 4193 ar 4240 4192 4194 ar @SUBSTRUCTURE 1 SER1 5 RESIDUE 1 A SER 1 ROOT 2 HIS2 16 RESIDUE 1 A HIS 2 3 MET3 33 RESIDUE 1 A MET 2 4 GLU4 50 RESIDUE 1 A GLU 2 5 GLU5 65 RESIDUE 1 A GLU 2 6 MET6 80 RESIDUE 1 A MET 2 7 ILE7 97 RESIDUE 1 A ILE 2 8 ARG8 116 RESIDUE 1 A ARG 2 9 SER9 140 RESIDUE 1 A SER 2 10 LEU10 151 RESIDUE 1 A LEU 2 11 GLN11 170 RESIDUE 1 A GLN 2 12 GLN12 187 RESIDUE 1 A GLN 2 13 ARG13 204 RESIDUE 1 A ARG 2 14 PRO14 227 RESIDUE 1 A PRO 2 15 GLU15 242 RESIDUE 1 A GLU 2 16 PRO16 256 RESIDUE 1 A PRO 2 17 THR17 271 RESIDUE 1 A THR 2 18 PRO18 284 RESIDUE 1 A PRO 2 19 GLU19 299 RESIDUE 1 A GLU 2 20 GLU20 314 RESIDUE 1 A GLU 2 21 TRP21 329 RESIDUE 1 A TRP 2 22 ASP22 353 RESIDUE 1 A ASP 2 23 LEU23 365 RESIDUE 1 A LEU 2 24 ILE24 384 RESIDUE 1 A ILE 2 25 HIS25 403 RESIDUE 1 A HIS 2 26 ILE26 420 RESIDUE 1 A ILE 2 27 ALA27 439 RESIDUE 1 A ALA 2 28 THR28 449 RESIDUE 1 A THR 2 29 GLU29 463 RESIDUE 1 A GLU 2 30 ALA30 478 RESIDUE 1 A ALA 2 31 HIS31 488 RESIDUE 1 A HIS 2 32 ARG32 505 RESIDUE 1 A ARG 2 33 SER33 529 RESIDUE 1 A SER 2 34 THR34 540 RESIDUE 1 A THR 2 35 ASN35 554 RESIDUE 1 A ASN 2 36 ALA36 568 RESIDUE 1 A ALA 2 37 GLN37 578 RESIDUE 1 A GLN 2 38 GLY38 595 RESIDUE 1 A GLY 2 39 SER39 602 RESIDUE 1 A SER 2 40 HIS40 613 RESIDUE 1 A HIS 2 41 TRP41 630 RESIDUE 1 A TRP 2 42 LYS42 654 RESIDUE 1 A LYS 2 43 GLN43 676 RESIDUE 1 A GLN 2 44 ARG44 693 RESIDUE 1 A ARG 2 45 ARG45 717 RESIDUE 1 A ARG 2 46 LYS46 741 RESIDUE 1 A LYS 2 47 PHE47 763 RESIDUE 1 A PHE 2 48 LEU48 783 RESIDUE 1 A LEU 2 49 PRO49 801 RESIDUE 1 A PRO 2 50 ASP50 816 RESIDUE 1 A ASP 2 51 ASP51 828 RESIDUE 1 A ASP 2 52 ILE52 840 RESIDUE 1 A ILE 2 53 GLY53 859 RESIDUE 1 A GLY 2 54 GLN54 866 RESIDUE 1 A GLN 2 55 SER55 883 RESIDUE 1 A SER 2 56 PRO56 893 RESIDUE 1 A PRO 2 57 ILE57 908 RESIDUE 1 A ILE 2 58 VAL58 927 RESIDUE 1 A VAL 2 59 SER59 943 RESIDUE 1 A SER 2 60 MET60 954 RESIDUE 1 A MET 2 61 PRO61 970 RESIDUE 1 A PRO 2 62 ASP62 985 RESIDUE 1 A ASP 2 63 GLY63 997 RESIDUE 1 A GLY 2 64 ASP64 1004 RESIDUE 1 A ASP 2 65 LYS65 1016 RESIDUE 1 A LYS 2 66 VAL66 1038 RESIDUE 1 A VAL 2 67 ASP67 1054 RESIDUE 1 A ASP 2 68 LEU68 1066 RESIDUE 1 A LEU 2 69 GLU69 1085 RESIDUE 1 A GLU 2 70 ALA70 1100 RESIDUE 1 A ALA 2 71 PHE71 1110 RESIDUE 1 A PHE 2 72 SER72 1130 RESIDUE 1 A SER 2 73 GLU73 1141 RESIDUE 1 A GLU 2 74 PHE74 1156 RESIDUE 1 A PHE 2 75 THR75 1176 RESIDUE 1 A THR 2 76 LYS76 1190 RESIDUE 1 A LYS 2 77 ILE77 1212 RESIDUE 1 A ILE 2 78 ILE78 1231 RESIDUE 1 A ILE 2 79 THR79 1250 RESIDUE 1 A THR 2 80 PRO80 1263 RESIDUE 1 A PRO 2 81 ALA81 1278 RESIDUE 1 A ALA 2 82 ILE82 1288 RESIDUE 1 A ILE 2 83 THR83 1307 RESIDUE 1 A THR 2 84 ARG84 1321 RESIDUE 1 A ARG 2 85 VAL85 1345 RESIDUE 1 A VAL 2 86 VAL86 1361 RESIDUE 1 A VAL 2 87 ASP87 1377 RESIDUE 1 A ASP 2 88 PHE88 1389 RESIDUE 1 A PHE 2 89 ALA89 1409 RESIDUE 1 A ALA 2 90 LYS90 1419 RESIDUE 1 A LYS 2 91 LYS91 1441 RESIDUE 1 A LYS 2 92 LEU92 1463 RESIDUE 1 A LEU 2 93 PRO93 1481 RESIDUE 1 A PRO 2 94 MET94 1496 RESIDUE 1 A MET 2 95 PHE95 1513 RESIDUE 1 A PHE 2 96 SER96 1533 RESIDUE 1 A SER 2 97 GLU97 1544 RESIDUE 1 A GLU 2 98 LEU98 1559 RESIDUE 1 A LEU 2 99 PRO99 1577 RESIDUE 1 A PRO 2 100 CAS100 1592 RESIDUE 1 A CAS 2 101 GLU101 1603 RESIDUE 1 A GLU 2 102 ASP102 1618 RESIDUE 1 A ASP 2 103 GLN103 1630 RESIDUE 1 A GLN 2 104 ILE104 1647 RESIDUE 1 A ILE 2 105 ILE105 1666 RESIDUE 1 A ILE 2 106 LEU106 1685 RESIDUE 1 A LEU 2 107 LEU107 1704 RESIDUE 1 A LEU 2 108 LYS108 1723 RESIDUE 1 A LYS 2 109 GLY109 1745 RESIDUE 1 A GLY 2 110 CYS110 1752 RESIDUE 1 A CYS 2 111 CYS111 1763 RESIDUE 1 A CYS 2 112 MET112 1774 RESIDUE 1 A MET 2 113 GLU113 1791 RESIDUE 1 A GLU 2 114 ILE114 1806 RESIDUE 1 A ILE 2 115 MET115 1825 RESIDUE 1 A MET 2 116 SER116 1842 RESIDUE 1 A SER 2 117 LEU117 1853 RESIDUE 1 A LEU 2 118 ARG118 1872 RESIDUE 1 A ARG 2 119 ALA119 1896 RESIDUE 1 A ALA 2 120 ALA120 1906 RESIDUE 1 A ALA 2 121 VAL121 1916 RESIDUE 1 A VAL 2 122 ARG122 1932 RESIDUE 1 A ARG 2 123 TYR123 1956 RESIDUE 1 A TYR 2 124 ASP124 1977 RESIDUE 1 A ASP 2 125 PRO125 1988 RESIDUE 1 A PRO 2 126 GLU126 2003 RESIDUE 1 A GLU 2 127 SER127 2018 RESIDUE 1 A SER 2 128 ASP128 2029 RESIDUE 1 A ASP 2 129 THR129 2041 RESIDUE 1 A THR 2 130 LEU130 2055 RESIDUE 1 A LEU 2 131 THR131 2074 RESIDUE 1 A THR 2 132 LEU132 2088 RESIDUE 1 A LEU 2 133 SER133 2107 RESIDUE 1 A SER 2 134 GLY134 2118 RESIDUE 1 A GLY 2 135 GLU135 2125 RESIDUE 1 A GLU 2 136 MET136 2140 RESIDUE 1 A MET 2 137 ALA137 2157 RESIDUE 1 A ALA 2 138 VAL138 2167 RESIDUE 1 A VAL 2 139 LYS139 2183 RESIDUE 1 A LYS 2 140 ARG140 2205 RESIDUE 1 A ARG 2 141 GLU141 2229 RESIDUE 1 A GLU 2 142 GLN142 2244 RESIDUE 1 A GLN 2 143 LEU143 2261 RESIDUE 1 A LEU 2 144 LYS144 2280 RESIDUE 1 A LYS 2 145 ASN145 2302 RESIDUE 1 A ASN 2 146 GLY146 2316 RESIDUE 1 A GLY 2 147 GLY147 2323 RESIDUE 1 A GLY 2 148 LEU148 2330 RESIDUE 1 A LEU 2 149 GLY149 2349 RESIDUE 1 A GLY 2 150 VAL150 2356 RESIDUE 1 A VAL 2 151 VAL151 2372 RESIDUE 1 A VAL 2 152 SER152 2388 RESIDUE 1 A SER 2 153 ASP153 2399 RESIDUE 1 A ASP 2 154 ALA154 2411 RESIDUE 1 A ALA 2 155 ILE155 2421 RESIDUE 1 A ILE 2 156 PHE156 2440 RESIDUE 1 A PHE 2 157 GLU157 2460 RESIDUE 1 A GLU 2 158 LEU158 2475 RESIDUE 1 A LEU 2 159 GLY159 2494 RESIDUE 1 A GLY 2 160 LYS160 2501 RESIDUE 1 A LYS 2 161 SER161 2523 RESIDUE 1 A SER 2 162 LEU162 2534 RESIDUE 1 A LEU 2 163 SER163 2553 RESIDUE 1 A SER 2 164 ALA164 2564 RESIDUE 1 A ALA 2 165 PHE165 2574 RESIDUE 1 A PHE 2 166 ASN166 2594 RESIDUE 1 A ASN 2 167 LEU167 2608 RESIDUE 1 A LEU 2 168 ASP168 2627 RESIDUE 1 A ASP 2 169 ASP169 2639 RESIDUE 1 A ASP 2 170 THR170 2651 RESIDUE 1 A THR 2 171 GLU171 2665 RESIDUE 1 A GLU 2 172 VAL172 2680 RESIDUE 1 A VAL 2 173 ALA173 2696 RESIDUE 1 A ALA 2 174 LEU174 2706 RESIDUE 1 A LEU 2 175 LEU175 2725 RESIDUE 1 A LEU 2 176 GLN176 2744 RESIDUE 1 A GLN 2 177 ALA177 2761 RESIDUE 1 A ALA 2 178 VAL178 2771 RESIDUE 1 A VAL 2 179 LEU179 2787 RESIDUE 1 A LEU 2 180 LEU180 2806 RESIDUE 1 A LEU 2 181 MET181 2825 RESIDUE 1 A MET 2 182 SER182 2842 RESIDUE 1 A SER 2 183 THR183 2853 RESIDUE 1 A THR 2 184 ASP184 2867 RESIDUE 1 A ASP 2 185 ARG185 2879 RESIDUE 1 A ARG 2 186 SER186 2903 RESIDUE 1 A SER 2 187 GLY187 2914 RESIDUE 1 A GLY 2 188 LEU188 2921 RESIDUE 1 A LEU 2 189 LEU189 2940 RESIDUE 1 A LEU 2 190 CAS190 2959 RESIDUE 1 A CAS 2 191 VAL191 2970 RESIDUE 1 A VAL 2 192 ASP192 2986 RESIDUE 1 A ASP 2 193 LYS193 2998 RESIDUE 1 A LYS 2 194 ILE194 3020 RESIDUE 1 A ILE 2 195 GLU195 3039 RESIDUE 1 A GLU 2 196 LYS196 3054 RESIDUE 1 A LYS 2 197 SER197 3076 RESIDUE 1 A SER 2 198 GLN198 3087 RESIDUE 1 A GLN 2 199 GLU199 3104 RESIDUE 1 A GLU 2 200 ALA200 3119 RESIDUE 1 A ALA 2 201 TYR201 3129 RESIDUE 1 A TYR 2 202 LEU202 3150 RESIDUE 1 A LEU 2 203 LEU203 3169 RESIDUE 1 A LEU 2 204 ALA204 3188 RESIDUE 1 A ALA 2 205 PHE205 3198 RESIDUE 1 A PHE 2 206 GLU206 3218 RESIDUE 1 A GLU 2 207 HIS207 3233 RESIDUE 1 A HIS 2 208 TYR208 3250 RESIDUE 1 A TYR 2 209 VAL209 3271 RESIDUE 1 A VAL 2 210 ASN210 3287 RESIDUE 1 A ASN 2 211 HIS211 3301 RESIDUE 1 A HIS 2 212 ARG212 3318 RESIDUE 1 A ARG 2 213 LYS213 3342 RESIDUE 1 A LYS 2 214 HIS214 3364 RESIDUE 1 A HIS 2 215 ASN215 3381 RESIDUE 1 A ASN 2 216 ILE216 3395 RESIDUE 1 A ILE 2 217 PRO217 3413 RESIDUE 1 A PRO 2 218 HIS218 3428 RESIDUE 1 A HIS 2 219 PHE219 3445 RESIDUE 1 A PHE 2 220 TRP220 3465 RESIDUE 1 A TRP 2 221 PRO221 3488 RESIDUE 1 A PRO 2 222 LYS222 3503 RESIDUE 1 A LYS 2 223 LEU223 3525 RESIDUE 1 A LEU 2 224 LEU224 3544 RESIDUE 1 A LEU 2 225 MET225 3563 RESIDUE 1 A MET 2 226 LYS226 3580 RESIDUE 1 A LYS 2 227 VAL227 3602 RESIDUE 1 A VAL 2 228 THR228 3618 RESIDUE 1 A THR 2 229 ASP229 3632 RESIDUE 1 A ASP 2 230 LEU230 3644 RESIDUE 1 A LEU 2 231 ARG231 3663 RESIDUE 1 A ARG 2 232 MET232 3687 RESIDUE 1 A MET 2 233 ILE233 3704 RESIDUE 1 A ILE 2 234 GLY234 3723 RESIDUE 1 A GLY 2 235 ALA235 3730 RESIDUE 1 A ALA 2 236 CAS236 3740 RESIDUE 1 A CAS 2 237 HIS237 3751 RESIDUE 1 A HIS 2 238 ALA238 3768 RESIDUE 1 A ALA 2 239 SER239 3778 RESIDUE 1 A SER 2 240 ARG240 3789 RESIDUE 1 A ARG 2 241 PHE241 3813 RESIDUE 1 A PHE 2 242 LEU242 3833 RESIDUE 1 A LEU 2 243 HIS243 3852 RESIDUE 1 A HIS 2 244 MET244 3869 RESIDUE 1 A MET 2 245 LYS245 3886 RESIDUE 1 A LYS 2 246 VAL246 3908 RESIDUE 1 A VAL 2 247 GLU247 3924 RESIDUE 1 A GLU 2 248 CAS248 3939 RESIDUE 1 A CAS 2 249 PRO249 3949 RESIDUE 1 A PRO 2 250 THR250 3964 RESIDUE 1 A THR 2 251 GLU251 3978 RESIDUE 1 A GLU 2 252 LEU252 3993 RESIDUE 1 A LEU 2 253 PHE253 4012 RESIDUE 1 A PHE 2 254 PRO254 4031 RESIDUE 1 A PRO 2 255 PRO255 4045 RESIDUE 1 A PRO 2 256 LEU256 4060 RESIDUE 1 A LEU 2 257 PHE257 4079 RESIDUE 1 A PHE 2 258 LEU258 4099 RESIDUE 1 A LEU 2 259 GLU259 4118 RESIDUE 1 A GLU 2 260 VAL260 4133 RESIDUE 1 A VAL 2 261 PHE261 4149 RESIDUE 1 A PHE 2 262 GLU262 4169 RESIDUE 1 A GLU 2 263 ASP263 4184 RESIDUE 1 A ASP 1