#################################################################### # DELTA # # Database for Extended Ligand-Target Analyses # # 2025 # #################################################################### @MOLECULE 6B1K_min 1725 1745 114 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.4 @ATOM 1 N -22.2210 -14.7820 18.2490 N.4 1 PRO1 -0.0556 2 H1 -21.2533 -14.7438 17.8666 H 1 PRO1 0.2783 3 H2 -22.2455 -14.2836 19.1697 H 1 PRO1 0.2783 4 CA -23.1330 -14.1180 17.3090 C.3 1 PRO1 0.1955 5 HA -22.5910 -13.9160 16.3871 H 1 PRO1 0.0693 6 C -23.6880 -12.8120 17.8700 C.2 1 PRO1 0.2318 7 O -23.6130 -12.5340 19.0720 O.2 1 PRO1 -0.2773 8 CB -24.2599 -15.1226 17.0280 C.3 1 PRO1 -0.0146 9 HB1 -24.6544 -15.0411 16.0137 H 1 PRO1 0.0290 10 HB2 -25.0962 -14.9836 17.7170 H 1 PRO1 0.0290 11 CG -23.6180 -16.4732 17.2987 C.3 1 PRO1 -0.0252 12 HG1 -23.0723 -16.8056 16.4152 H 1 PRO1 0.0283 13 HG2 -24.3462 -17.2428 17.5593 H 1 PRO1 0.0283 14 CD -22.6366 -16.1765 18.4275 C.3 1 PRO1 0.1137 15 HD1 -23.1102 -16.2539 19.4036 H 1 PRO1 0.0562 16 HD2 -21.7674 -16.8351 18.4316 H 1 PRO1 0.0562 17 N -24.2450 -12.0040 16.9760 N.am 2 MET2 -0.2452 18 H -24.2580 -12.2930 15.9980 H 2 MET2 0.1312 19 CA -24.8390 -10.7200 17.3320 C.3 2 MET2 0.0886 20 HA -24.9622 -10.6626 18.4145 H 2 MET2 0.0557 21 C -26.2130 -10.6400 16.6910 C.2 2 MET2 0.2187 22 O -26.3260 -10.7560 15.4650 O.2 2 MET2 -0.2778 23 CB -23.9233 -9.5846 16.8520 C.3 2 MET2 -0.0199 24 HB1 -23.7122 -9.6976 15.7891 H 2 MET2 0.0293 25 HB2 -22.9635 -9.6740 17.3601 H 2 MET2 0.0293 26 CG -24.4958 -8.1841 17.1107 C.3 2 MET2 -0.0047 27 HG1 -24.7991 -8.0712 18.1522 H 2 MET2 0.0377 28 HG2 -25.3942 -8.0124 16.5170 H 2 MET2 0.0377 29 SD -23.2948 -6.9068 16.6992 S.3 2 MET2 -0.1641 30 CE -22.4734 -6.7761 18.2971 C.3 2 MET2 -0.0181 31 HE1 -21.6163 -6.1060 18.2309 H 2 MET2 0.0340 32 HE2 -22.1262 -7.7569 18.6213 H 2 MET2 0.0340 33 HE3 -23.1692 -6.4035 19.0491 H 2 MET2 0.0340 34 N -27.2450 -10.3990 17.5020 N.am 3 PHE3 -0.2453 35 H -27.0750 -10.3270 18.5050 H 3 PHE3 0.1312 36 CA -28.6080 -10.2340 17.0070 C.3 3 PHE3 0.0917 37 HA -28.5880 -10.2505 15.9197 H 3 PHE3 0.0560 38 C -29.1570 -8.8890 17.4560 C.2 3 PHE3 0.2190 39 O -29.1470 -8.5800 18.6520 O.2 3 PHE3 -0.2778 40 CB -29.5011 -11.3747 17.5192 C.3 3 PHE3 -0.0036 41 HB1 -29.4612 -11.4183 18.6063 H 3 PHE3 0.0333 42 HB2 -29.1266 -12.3321 17.1602 H 3 PHE3 0.0333 43 CG -30.9319 -11.2080 17.0714 C.ar 3 PHE3 -0.0454 44 CD1 -31.2708 -11.3534 15.7294 C.ar 3 PHE3 -0.0585 45 HD1 -30.5150 -11.6290 15.0086 H 3 PHE3 0.0620 46 CD2 -31.9160 -10.8214 17.9777 C.ar 3 PHE3 -0.0585 47 HD2 -31.6671 -10.6841 19.0202 H 3 PHE3 0.0620 48 CE1 -32.5650 -11.0983 15.2963 C.ar 3 PHE3 -0.0615 49 HE1 -32.8104 -11.1934 14.2486 H 3 PHE3 0.0618 50 CE2 -33.2134 -10.5733 17.5484 C.ar 3 PHE3 -0.0615 51 HE2 -33.9660 -10.2634 18.2589 H 3 PHE3 0.0618 52 CZ -33.5375 -10.7060 16.2054 C.ar 3 PHE3 -0.0617 53 HZ -34.5434 -10.5028 15.8683 H 3 PHE3 0.0618 54 N -29.6540 -8.1130 16.4990 N.am 4 ILE4 -0.2454 55 H -29.6540 -8.4590 15.5400 H 4 ILE4 0.1312 56 CA -30.1990 -6.7870 16.7640 C.3 4 ILE4 0.0903 57 HA -30.2429 -6.6375 17.8410 H 4 ILE4 0.0560 58 C -31.6150 -6.7240 16.2070 C.2 4 ILE4 0.2189 59 O -31.8450 -7.1240 15.0610 O.2 4 ILE4 -0.2778 60 CB -29.2947 -5.7028 16.1324 C.3 4 ILE4 -0.0201 61 HB -29.3575 -5.7978 15.0474 H 4 ILE4 0.0318 62 CG1 -27.8133 -5.9085 16.5225 C.3 4 ILE4 -0.0514 63 HG11 -27.4733 -6.8823 16.1704 H 4 ILE4 0.0266 64 HG12 -27.7121 -5.9263 17.6073 H 4 ILE4 0.0266 65 CG2 -29.7884 -4.2932 16.5126 C.3 4 ILE4 -0.0605 66 HG21 -29.1989 -3.5147 16.0303 H 4 ILE4 0.0233 67 HG22 -29.7349 -4.1362 17.5899 H 4 ILE4 0.0233 68 HG23 -30.8222 -4.1310 16.2082 H 4 ILE4 0.0233 69 CD1 -26.8572 -4.8602 15.9428 C.3 4 ILE4 -0.0650 70 HD11 -25.8213 -5.1295 16.1505 H 4 ILE4 0.0230 71 HD12 -27.0294 -3.8763 16.3784 H 4 ILE4 0.0230 72 HD13 -26.9686 -4.7782 14.8623 H 4 ILE4 0.0230 73 N -32.5510 -6.1680 16.9710 N.am 5 VAL5 -0.2454 74 H -32.3330 -5.9260 17.9380 H 5 VAL5 0.1312 75 CA -33.8880 -5.8990 16.4440 C.3 5 VAL5 0.0901 76 HA -33.8592 -5.9630 15.3541 H 5 VAL5 0.0560 77 C -34.2710 -4.4640 16.7780 C.2 5 VAL5 0.2189 78 O -34.3260 -4.0870 17.9570 O.2 5 VAL5 -0.2778 79 CB -34.9242 -6.9199 16.9598 C.3 5 VAL5 -0.0227 80 HB -34.6935 -7.8681 16.4729 H 5 VAL5 0.0315 81 CG1 -34.8481 -7.1643 18.4725 C.3 5 VAL5 -0.0608 82 HG11 -35.5660 -7.9256 18.7789 H 5 VAL5 0.0233 83 HG12 -35.0761 -6.2565 19.0285 H 5 VAL5 0.0233 84 HG13 -33.8604 -7.5100 18.7788 H 5 VAL5 0.0233 85 CG2 -36.3521 -6.5215 16.5499 C.3 5 VAL5 -0.0608 86 HG21 -37.0521 -7.3385 16.7044 H 5 VAL5 0.0233 87 HG22 -36.3903 -6.2415 15.4990 H 5 VAL5 0.0233 88 HG23 -36.7122 -5.6680 17.1257 H 5 VAL5 0.0233 89 N -34.5360 -3.6770 15.7410 N.am 6 ASN6 -0.2452 90 H -34.3210 -4.0240 14.8070 H 6 ASN6 0.1312 91 CA -35.1150 -2.3500 15.8620 C.3 6 ASN6 0.0957 92 HA -34.9933 -1.9989 16.8860 H 6 ASN6 0.0562 93 C -36.5980 -2.4390 15.5360 C.2 6 ASN6 0.2192 94 O -36.9980 -3.1260 14.5910 O.2 6 ASN6 -0.2778 95 CB -34.4269 -1.4068 14.8641 C.3 6 ASN6 0.0446 96 HB1 -34.8225 -0.3953 14.9518 H 6 ASN6 0.0375 97 HB2 -34.5976 -1.7334 13.8372 H 6 ASN6 0.0375 98 CG -32.9151 -1.3484 15.1166 C.2 6 ASN6 0.2000 99 OD1 -32.4282 -0.5549 15.9078 O.2 6 ASN6 -0.2797 100 ND2 -32.2043 -2.2310 14.3963 N.am 6 ASN6 -0.2723 101 HD21 -31.2107 -2.2512 14.5009 H 6 ASN6 0.1266 102 HD22 -32.6472 -2.8679 13.7654 H 6 ASN6 0.1266 103 N -37.4160 -1.7410 16.3210 N.am 7 THR7 -0.2434 104 H -37.0300 -1.1500 17.0570 H 7 THR7 0.1313 105 CA -38.8580 -1.8160 16.1360 C.3 7 THR7 0.1135 106 HA -39.0650 -1.9366 15.0704 H 7 THR7 0.0583 107 C -39.5410 -0.5350 16.5810 C.2 7 THR7 0.2212 108 O -39.0470 0.1820 17.4460 O.2 7 THR7 -0.2777 109 CB -39.4063 -3.0269 16.9142 C.3 7 THR7 0.0763 110 HB -38.8988 -3.9139 16.5171 H 7 THR7 0.0611 111 OG1 -40.7925 -3.1265 16.6499 O.3 7 THR7 -0.3900 112 HG1 -41.1584 -3.8784 17.0929 H 7 THR7 0.2098 113 CG2 -39.1607 -2.9401 18.4331 C.3 7 THR7 -0.0370 114 HG21 -39.4389 -3.8645 18.9392 H 7 THR7 0.0255 115 HG22 -39.7482 -2.1360 18.8775 H 7 THR7 0.0255 116 HG23 -38.1109 -2.7561 18.6613 H 7 THR7 0.0255 117 N -40.6920 -0.2660 15.9710 N.am 8 ASN8 -0.2451 118 H -40.9740 -0.8430 15.1790 H 8 ASN8 0.1312 119 CA -41.5640 0.8220 16.3930 C.3 8 ASN8 0.0957 120 HA -40.9286 1.6223 16.7700 H 8 ASN8 0.0562 121 C -42.4890 0.4480 17.5390 C.2 8 ASN8 0.2191 122 O -43.2050 1.3220 18.0270 O.2 8 ASN8 -0.2778 123 CB -42.3522 1.3821 15.1969 C.3 8 ASN8 0.0446 124 HB1 -41.6643 1.8102 14.4718 H 8 ASN8 0.0375 125 HB2 -43.0140 2.1895 15.5115 H 8 ASN8 0.0375 126 CG -43.1843 0.3113 14.4825 C.2 8 ASN8 0.2000 127 OD1 -43.2333 -0.8416 14.8847 O.2 8 ASN8 -0.2797 128 ND2 -43.8316 0.7644 13.3996 N.am 8 ASN8 -0.2723 129 HD21 -44.3989 0.1332 12.8702 H 8 ASN8 0.1266 130 HD22 -43.7687 1.7167 13.1052 H 8 ASN8 0.1266 131 N -42.4850 -0.8050 17.9840 N.am 9 VAL9 -0.2454 132 H -41.9260 -1.5090 17.5020 H 9 VAL9 0.1312 133 CA -43.2740 -1.1860 19.1580 C.3 9 VAL9 0.0903 134 HA -44.2976 -0.9134 18.9199 H 9 VAL9 0.0560 135 C -42.7560 -0.4290 20.3830 C.2 9 VAL9 0.2216 136 O -41.5310 -0.2230 20.5180 O.2 9 VAL9 -0.2776 137 CB -43.1612 -2.7219 19.3102 C.3 9 VAL9 -0.0227 138 HB -42.1020 -2.9749 19.2662 H 9 VAL9 0.0315 139 CG1 -43.6787 -3.2623 20.6509 C.3 9 VAL9 -0.0608 140 HG11 -43.5781 -4.3470 20.6992 H 9 VAL9 0.0233 141 HG12 -44.7315 -3.0232 20.7956 H 9 VAL9 0.0233 142 HG13 -43.1112 -2.8518 21.4854 H 9 VAL9 0.0233 143 CG2 -43.8835 -3.4407 18.1569 C.3 9 VAL9 -0.0608 144 HG21 -43.7100 -4.5160 18.1954 H 9 VAL9 0.0233 145 HG22 -43.5622 -3.0846 17.1781 H 9 VAL9 0.0233 146 HG23 -44.9603 -3.2814 18.2167 H 9 VAL9 0.0233 147 N -43.6150 0.0150 21.3000 N.am 10 PRO10 -0.2316 148 CA -43.1120 0.7520 22.4700 C.3 10 PRO10 0.0907 149 HA -42.4797 1.5537 22.0916 H 10 PRO10 0.0559 150 C -42.3490 -0.1200 23.4610 C.2 10 PRO10 0.2189 151 O -42.5790 -1.3300 23.5880 O.2 10 PRO10 -0.2778 152 CB -44.3878 1.2930 23.1383 C.3 10 PRO10 -0.0276 153 HB1 -44.2765 2.3392 23.4257 H 10 PRO10 0.0285 154 HB2 -44.6382 0.7363 24.0435 H 10 PRO10 0.0285 155 CG -45.5100 1.0901 22.1235 C.3 10 PRO10 -0.0379 156 HG1 -45.5902 1.9836 21.5031 H 10 PRO10 0.0278 157 HG2 -46.4794 0.9242 22.5931 H 10 PRO10 0.0278 158 CD -45.0686 -0.0838 21.2519 C.3 10 PRO10 0.0071 159 HD1 -45.3423 -1.0478 21.6745 H 10 PRO10 0.0431 160 HD2 -45.4559 0.0313 20.2422 H 10 PRO10 0.0431 161 N -41.4580 0.5380 24.2090 N.am 11 ARG11 -0.2456 162 H -41.3620 1.5470 24.0990 H 11 ARG11 0.1312 163 CA -40.6190 -0.1580 25.1800 C.3 11 ARG11 0.0879 164 HA -40.0194 -0.8602 24.5999 H 11 ARG11 0.0557 165 C -41.4490 -0.9810 26.1550 C.2 11 ARG11 0.2187 166 O -41.0890 -2.1180 26.4820 O.2 11 ARG11 -0.2778 167 CB -39.6710 0.7615 25.9878 C.3 11 ARG11 -0.0258 168 HB1 -40.1895 1.7032 26.1735 H 11 ARG11 0.0286 169 HB2 -38.8167 1.0260 25.3649 H 11 ARG11 0.0286 170 CG -39.1745 0.2009 27.3616 C.3 11 ARG11 -0.0154 171 HG1 -40.0236 0.0991 28.0379 H 11 ARG11 0.0299 172 HG2 -38.5414 0.9563 27.8272 H 11 ARG11 0.0299 173 CD -38.3931 -1.1379 27.3353 C.3 11 ARG11 0.1045 174 HD1 -37.4098 -0.9732 26.8909 H 11 ARG11 0.0711 175 HD2 -38.8562 -1.9130 26.7291 H 11 ARG11 0.0711 176 NE -38.1598 -1.6601 28.6990 N.pl3 11 ARG11 -0.4450 177 HE -37.5272 -1.1850 29.3036 H 11 ARG11 0.3153 178 CZ -38.6900 -2.7532 29.2831 C.cat 11 ARG11 0.5062 179 NH1 -39.6127 -3.4937 28.7403 N.pl3 11 ARG11 -0.4573 180 HH11 -39.8853 -4.3210 29.2539 H 11 ARG11 0.3114 181 HH12 -40.0424 -3.2741 27.8696 H 11 ARG11 0.3114 182 NH2 -38.2713 -3.1182 30.4625 N.pl3 11 ARG11 -0.4573 183 HH21 -38.6566 -3.9622 30.8813 H 11 ARG11 0.3114 184 HH22 -37.5890 -2.6316 30.9900 H 11 ARG11 0.3114 185 N -42.5670 -0.4280 26.6280 N.am 12 ALA12 -0.2459 186 H -42.8810 0.4750 26.2720 H 12 ALA12 0.1312 187 CA -43.3390 -1.1160 27.6540 C.3 12 ALA12 0.0850 188 HA -42.6647 -1.3271 28.4857 H 12 ALA12 0.0554 189 C -43.9110 -2.4330 27.1580 C.2 12 ALA12 0.2185 190 O -44.3140 -3.2660 27.9790 O.2 12 ALA12 -0.2778 191 CB -44.4693 -0.1896 28.1147 C.3 12 ALA12 -0.0411 192 HB1 -45.0549 -0.6443 28.9146 H 12 ALA12 0.0249 193 HB2 -45.1471 0.0466 27.2932 H 12 ALA12 0.0249 194 HB3 -44.0680 0.7507 28.4925 H 12 ALA12 0.0249 195 N -43.9670 -2.6360 25.8470 N.am 13 SER13 -0.2436 196 H -43.6330 -1.9090 25.2140 H 13 SER13 0.1312 197 CA -44.4940 -3.8730 25.2960 C.3 13 SER13 0.1109 198 HA -45.2916 -4.2273 25.9513 H 13 SER13 0.0580 199 C -43.4490 -4.9800 25.2140 C.2 13 SER13 0.2209 200 O -43.8200 -6.1380 24.9840 O.2 13 SER13 -0.2777 201 CB -45.0956 -3.5954 23.9127 C.3 13 SER13 0.0681 202 HB1 -45.3534 -4.5399 23.4199 H 13 SER13 0.0577 203 HB2 -44.3549 -3.0791 23.2969 H 13 SER13 0.0577 204 OG -46.2615 -2.7920 24.0559 O.3 13 SER13 -0.3930 205 HG -46.6670 -2.6124 23.2122 H 13 SER13 0.2095 206 N -42.1690 -4.6670 25.3970 N.am 14 VAL14 -0.2453 207 H -41.9220 -3.6950 25.5820 H 14 VAL14 0.1312 208 CA -41.1050 -5.6670 25.3420 C.3 14 VAL14 0.0903 209 HA -41.3167 -6.3130 24.4959 H 14 VAL14 0.0560 210 C -41.0930 -6.4160 26.6710 C.2 14 VAL14 0.2216 211 O -40.9150 -5.7840 27.7210 O.2 14 VAL14 -0.2776 212 CB -39.7551 -4.9596 25.0909 C.3 14 VAL14 -0.0227 213 HB -39.5326 -4.3209 25.9465 H 14 VAL14 0.0315 214 CG1 -38.6118 -5.9767 24.9498 C.3 14 VAL14 -0.0608 215 HG11 -37.6602 -5.4781 24.7653 H 14 VAL14 0.0233 216 HG12 -38.8027 -6.6538 24.1178 H 14 VAL14 0.0233 217 HG13 -38.4945 -6.5808 25.8502 H 14 VAL14 0.0233 218 CG2 -39.8060 -4.0520 23.8489 C.3 14 VAL14 -0.0608 219 HG21 -38.8399 -3.5791 23.6701 H 14 VAL14 0.0233 220 HG22 -40.5367 -3.2497 23.9579 H 14 VAL14 0.0233 221 HG23 -40.0670 -4.6204 22.9558 H 14 VAL14 0.0233 222 N -41.2450 -7.7400 26.6770 N.am 15 PRO15 -0.2316 223 CA -41.2470 -8.4650 27.9550 C.3 15 PRO15 0.0907 224 HA -42.0333 -8.0409 28.5822 H 15 PRO15 0.0559 225 C -39.8930 -8.4040 28.6450 C.2 15 PRO15 0.2189 226 O -38.8450 -8.3380 28.0030 O.2 15 PRO15 -0.2778 227 CB -41.5404 -9.9190 27.5393 C.3 15 PRO15 -0.0276 228 HB1 -42.2450 -10.4028 28.2157 H 15 PRO15 0.0285 229 HB2 -40.6335 -10.5280 27.5354 H 15 PRO15 0.0285 230 CG -42.0677 -9.8560 26.1078 C.3 15 PRO15 -0.0379 231 HG1 -43.1551 -9.7740 26.1298 H 15 PRO15 0.0278 232 HG2 -41.8148 -10.7454 25.5311 H 15 PRO15 0.0278 233 CD -41.4833 -8.5798 25.5059 C.3 15 PRO15 0.0071 234 HD1 -40.5275 -8.7353 25.0050 H 15 PRO15 0.0431 235 HD2 -42.2068 -8.1186 24.8344 H 15 PRO15 0.0431 236 N -39.9290 -8.4230 29.9820 N.am 16 ASP16 -0.2451 237 H -40.8210 -8.5440 30.4610 H 16 ASP16 0.1312 238 CA -38.7010 -8.2720 30.7650 C.3 16 ASP16 0.0974 239 HA -38.1931 -7.5117 30.1650 H 16 ASP16 0.0563 240 C -37.6450 -9.3110 30.3860 C.2 16 ASP16 0.2190 241 O -36.4420 -9.0130 30.3650 O.2 16 ASP16 -0.2778 242 CB -38.8029 -7.4605 32.0762 C.3 16 ASP16 0.0576 243 HB1 -37.9143 -7.6135 32.6878 H 16 ASP16 0.0394 244 HB2 -39.6666 -7.7677 32.6628 H 16 ASP16 0.0394 245 CG -38.9214 -5.9246 31.7581 C.2 16 ASP16 0.1780 246 OD1 -38.2422 -5.1175 32.3813 O.co2 16 ASP16 -0.6478 247 OD2 -39.6748 -5.5235 30.8680 O.co2 16 ASP16 -0.6478 248 N -38.0690 -10.5390 30.1250 N.am 17 GLY17 -0.2485 249 H -39.0720 -10.7250 30.1320 H 17 GLY17 0.1309 250 CA -37.1520 -11.6310 29.8290 C.3 17 GLY17 0.0765 251 HA1 -37.6324 -12.5403 30.1879 H 17 GLY17 0.0521 252 HA2 -36.2335 -11.4944 30.4020 H 17 GLY17 0.0521 253 C -36.8070 -11.8200 28.3640 C.2 17 GLY17 0.2155 254 O -36.2500 -12.8500 27.9770 O.2 17 GLY17 -0.2781 255 N -37.1000 -10.8190 27.5420 N.am 18 PHE18 -0.2456 256 H -37.4480 -9.9390 27.9240 H 18 PHE18 0.1312 257 CA -36.9300 -10.9610 26.0930 C.3 18 PHE18 0.0917 258 HA -37.4739 -11.8700 25.8300 H 18 PHE18 0.0560 259 C -35.4680 -11.1860 25.6940 C.2 18 PHE18 0.2190 260 O -35.1690 -12.0480 24.8590 O.2 18 PHE18 -0.2778 261 CB -37.5745 -9.7505 25.3963 C.3 18 PHE18 -0.0036 262 HB1 -37.0175 -8.8438 25.6357 H 18 PHE18 0.0333 263 HB2 -38.5752 -9.6035 25.8012 H 18 PHE18 0.0333 264 CG -37.7127 -9.8966 23.8989 C.ar 18 PHE18 -0.0454 265 CD1 -38.2909 -11.0323 23.3325 C.ar 18 PHE18 -0.0585 266 HD1 -38.6262 -11.8521 23.9527 H 18 PHE18 0.0620 267 CD2 -37.3189 -8.8597 23.0584 C.ar 18 PHE18 -0.0585 268 HD2 -36.8892 -7.9630 23.4788 H 18 PHE18 0.0620 269 CE1 -38.4474 -11.1365 21.9564 C.ar 18 PHE18 -0.0615 270 HE1 -38.8830 -12.0304 21.5332 H 18 PHE18 0.0618 271 CE2 -37.4854 -8.9547 21.6829 C.ar 18 PHE18 -0.0615 272 HE2 -37.1698 -8.1429 21.0439 H 18 PHE18 0.0618 273 CZ -38.0459 -10.0973 21.1296 C.ar 18 PHE18 -0.0617 274 HZ -38.1665 -10.1823 20.0599 H 18 PHE18 0.0618 275 N -34.5390 -10.4080 26.2590 N.am 19 LEU19 -0.2456 276 H -34.8110 -9.6960 26.9360 H 19 LEU19 0.1312 277 CA -33.1310 -10.5810 25.9030 C.3 19 LEU19 0.0880 278 HA -33.0567 -10.4927 24.8187 H 19 LEU19 0.0557 279 C -32.6280 -11.9650 26.2780 C.2 19 LEU19 0.2187 280 O -31.8940 -12.6000 25.5130 O.2 19 LEU19 -0.2778 281 CB -32.2821 -9.4981 26.5939 C.3 19 LEU19 -0.0266 282 HB1 -31.2301 -9.6406 26.3417 H 19 LEU19 0.0287 283 HB2 -32.3535 -9.6303 27.6748 H 19 LEU19 0.0287 284 CG -32.6893 -8.0534 26.2458 C.3 19 LEU19 -0.0449 285 HG -33.7457 -7.9206 26.4820 H 19 LEU19 0.0296 286 CD1 -31.9061 -7.0519 27.1033 C.3 19 LEU19 -0.0626 287 HD11 -32.2120 -6.0276 26.8891 H 19 LEU19 0.0232 288 HD12 -30.8345 -7.1266 26.9153 H 19 LEU19 0.0232 289 HD13 -32.0721 -7.2306 28.1660 H 19 LEU19 0.0232 290 CD2 -32.4954 -7.7403 24.7568 C.3 19 LEU19 -0.0626 291 HD21 -32.8085 -6.7207 24.5319 H 19 LEU19 0.0232 292 HD22 -33.0831 -8.4095 24.1304 H 19 LEU19 0.0232 293 HD23 -31.4510 -7.8346 24.4611 H 19 LEU19 0.0232 294 N -33.0050 -12.4460 27.4600 N.am 20 SER20 -0.2436 295 H -33.5870 -11.8800 28.0780 H 20 SER20 0.1312 296 CA -32.5870 -13.7820 27.8730 C.3 20 SER20 0.1109 297 HA -31.4995 -13.8265 27.7961 H 20 SER20 0.0580 298 C -33.1860 -14.8600 26.9820 C.2 20 SER20 0.2209 299 O -32.5100 -15.8400 26.6490 O.2 20 SER20 -0.2777 300 CB -33.0257 -14.0151 29.3249 C.3 20 SER20 0.0681 301 HB1 -32.7573 -15.0313 29.6349 H 20 SER20 0.0577 302 HB2 -34.1152 -13.9124 29.3976 H 20 SER20 0.0577 303 OG -32.3825 -13.0691 30.1696 O.3 20 SER20 -0.3930 304 HG -32.6679 -13.1594 31.0758 H 20 SER20 0.2095 305 N -34.4510 -14.7040 26.5820 N.am 21 GLU21 -0.2456 306 H -34.9890 -13.8970 26.8970 H 21 GLU21 0.1312 307 CA -35.0630 -15.6880 25.6950 C.3 21 GLU21 0.0883 308 HA -34.9594 -16.6708 26.1569 H 21 GLU21 0.0557 309 C -34.3780 -15.7020 24.3370 C.2 21 GLU21 0.2187 310 O -34.0860 -16.7720 23.7880 O.2 21 GLU21 -0.2778 311 CB -36.5446 -15.3118 25.5555 C.3 21 GLU21 -0.0193 312 HB1 -36.6316 -14.2937 25.1706 H 21 GLU21 0.0290 313 HB2 -36.9939 -15.2918 26.5494 H 21 GLU21 0.0290 314 CG -37.3447 -16.2687 24.6593 C.3 21 GLU21 0.0356 315 HG1 -37.2537 -17.2958 25.0120 H 21 GLU21 0.0374 316 HG2 -36.9836 -16.2421 23.6318 H 21 GLU21 0.0374 317 CD -38.8229 -15.8690 24.6487 C.2 21 GLU21 0.1760 318 OE1 -39.1436 -14.7864 24.1741 O.co2 21 GLU21 -0.6478 319 OE2 -39.6586 -16.6380 25.1117 O.co2 21 GLU21 -0.6478 320 N -34.1050 -14.5280 23.7750 N.am 22 LEU22 -0.2456 321 H -34.3890 -13.6610 24.2320 H 22 LEU22 0.1312 322 CA -33.3970 -14.4890 22.5010 C.3 22 LEU22 0.0880 323 HA -33.9996 -15.0261 21.7680 H 22 LEU22 0.0557 324 C -32.0450 -15.1760 22.6060 C.2 22 LEU22 0.2187 325 O -31.6360 -15.9000 21.6900 O.2 22 LEU22 -0.2778 326 CB -33.1700 -13.0220 22.0834 C.3 22 LEU22 -0.0266 327 HB1 -32.4517 -12.9713 21.2628 H 22 LEU22 0.0287 328 HB2 -32.7059 -12.4931 22.9180 H 22 LEU22 0.0287 329 CG -34.4387 -12.2662 21.6512 C.3 22 LEU22 -0.0449 330 HG -35.2179 -12.4196 22.3982 H 22 LEU22 0.0296 331 CD1 -34.1527 -10.7595 21.5789 C.3 22 LEU22 -0.0626 332 HD11 -35.0254 -10.2077 21.2345 H 22 LEU22 0.0232 333 HD12 -33.3347 -10.5450 20.8908 H 22 LEU22 0.0232 334 HD13 -33.8779 -10.3649 22.5574 H 22 LEU22 0.0232 335 CD2 -34.9710 -12.7752 20.3037 C.3 22 LEU22 -0.0626 336 HD21 -35.8626 -12.2244 20.0029 H 22 LEU22 0.0232 337 HD22 -35.2426 -13.8285 20.3530 H 22 LEU22 0.0232 338 HD23 -34.2264 -12.6608 19.5156 H 22 LEU22 0.0232 339 N -31.3220 -14.9420 23.7080 N.am 23 THR23 -0.2434 340 H -31.6960 -14.3330 24.4360 H 23 THR23 0.1313 341 CA -30.0030 -15.5490 23.8800 C.3 23 THR23 0.1135 342 HA -29.4177 -15.2555 23.0083 H 23 THR23 0.0583 343 C -30.1100 -17.0690 23.8730 C.2 23 THR23 0.2212 344 O -29.3890 -17.7600 23.1360 O.2 23 THR23 -0.2777 345 CB -29.3198 -14.9964 25.1425 C.3 23 THR23 0.0763 346 HB -29.9705 -15.2023 26.0008 H 23 THR23 0.0611 347 OG1 -29.1949 -13.5952 24.9570 O.3 23 THR23 -0.3900 348 HG1 -28.8429 -13.1776 25.7370 H 23 THR23 0.2098 349 CG2 -27.9240 -15.6056 25.3754 C.3 23 THR23 -0.0370 350 HG21 -27.4578 -15.2164 26.2808 H 23 THR23 0.0255 351 HG22 -27.2597 -15.3825 24.5407 H 23 THR23 0.0255 352 HG23 -27.9698 -16.6891 25.4835 H 23 THR23 0.0255 353 N -31.0330 -17.6070 24.6760 N.am 24 GLN24 -0.2456 354 H -31.6520 -16.9980 25.2110 H 24 GLN24 0.1312 355 CA -31.1670 -19.0550 24.7970 C.3 24 GLN24 0.0882 356 HA -30.1812 -19.4649 25.0239 H 24 GLN24 0.0557 357 C -31.6510 -19.6660 23.4930 C.2 24 GLN24 0.2187 358 O -31.1470 -20.7080 23.0550 O.2 24 GLN24 -0.2778 359 CB -32.1555 -19.3519 25.9339 C.3 24 GLN24 -0.0210 360 HB1 -32.3774 -20.4202 25.9659 H 24 GLN24 0.0289 361 HB2 -33.1003 -18.8457 25.7242 H 24 GLN24 0.0289 362 CG -31.6136 -18.9108 27.3038 C.3 24 GLN24 0.0225 363 HG1 -31.2999 -17.8682 27.2980 H 24 GLN24 0.0356 364 HG2 -30.7381 -19.5017 27.5719 H 24 GLN24 0.0356 365 CD -32.6689 -19.0906 28.3993 C.2 24 GLN24 0.1981 366 OE1 -32.6140 -20.0152 29.1969 O.2 24 GLN24 -0.2798 367 NE2 -33.6272 -18.1521 28.3887 N.am 24 GLN24 -0.2724 368 HE21 -34.3644 -18.1980 29.0619 H 24 GLN24 0.1266 369 HE22 -33.6172 -17.4108 27.7178 H 24 GLN24 0.1266 370 N -32.6330 -19.0310 22.8580 N.am 25 GLN25 -0.2456 371 H -32.9990 -18.1560 23.2340 H 25 GLN25 0.1312 372 CA -33.1870 -19.5810 21.6270 C.3 25 GLN25 0.0882 373 HA -33.4599 -20.6216 21.8031 H 25 GLN25 0.0557 374 C -32.1830 -19.5290 20.4790 C.2 25 GLN25 0.2187 375 O -32.1010 -20.4700 19.6820 O.2 25 GLN25 -0.2778 376 CB -34.4208 -18.7337 21.2504 C.3 25 GLN25 -0.0210 377 HB1 -34.7551 -18.9709 20.2407 H 25 GLN25 0.0289 378 HB2 -34.1272 -17.6828 21.2211 H 25 GLN25 0.0289 379 CG -35.6137 -18.8796 22.2124 C.3 25 GLN25 0.0225 380 HG1 -36.3336 -18.0813 22.0294 H 25 GLN25 0.0356 381 HG2 -35.3045 -18.7980 23.2532 H 25 GLN25 0.0356 382 CD -36.3387 -20.2183 22.0299 C.2 25 GLN25 0.1981 383 OE1 -35.8968 -21.1061 21.3132 O.2 25 GLN25 -0.2798 384 NE2 -37.4820 -20.3015 22.7252 N.am 25 GLN25 -0.2724 385 HE21 -38.0262 -21.1378 22.6748 H 25 GLN25 0.1266 386 HE22 -37.8026 -19.5432 23.2931 H 25 GLN25 0.1266 387 N -31.4070 -18.4480 20.3780 N.am 26 LEU26 -0.2456 388 H -31.5270 -17.6680 21.0240 H 26 LEU26 0.1312 389 CA -30.3870 -18.3890 19.3390 C.3 26 LEU26 0.0880 390 HA -30.8616 -18.6127 18.3827 H 26 LEU26 0.0557 391 C -29.2690 -19.4030 19.5730 C.2 26 LEU26 0.2187 392 O -28.7280 -19.9550 18.6100 O.2 26 LEU26 -0.2778 393 CB -29.7630 -16.9779 19.3361 C.3 26 LEU26 -0.0266 394 HB1 -28.8139 -16.9780 18.7973 H 26 LEU26 0.0287 395 HB2 -29.5171 -16.7130 20.3659 H 26 LEU26 0.0287 396 CG -30.6534 -15.8815 18.7248 C.3 26 LEU26 -0.0449 397 HG -31.6673 -15.9921 19.1119 H 26 LEU26 0.0296 398 CD1 -30.1550 -14.4888 19.1385 C.3 26 LEU26 -0.0626 399 HD11 -30.8160 -13.7100 18.7582 H 26 LEU26 0.0232 400 HD12 -29.1525 -14.2958 18.7560 H 26 LEU26 0.0232 401 HD13 -30.1212 -14.3853 20.2235 H 26 LEU26 0.0232 402 CD2 -30.7034 -15.9944 17.1935 C.3 26 LEU26 -0.0626 403 HD21 -31.2585 -15.1652 16.7558 H 26 LEU26 0.0232 404 HD22 -31.1854 -16.9188 16.8758 H 26 LEU26 0.0232 405 HD23 -29.7017 -15.9738 16.7635 H 26 LEU26 0.0232 406 N -28.8900 -19.6540 20.8330 N.am 27 ALA27 -0.2459 407 H -29.3100 -19.1410 21.6080 H 27 ALA27 0.1312 408 CA -27.8690 -20.6700 21.0880 C.3 27 ALA27 0.0850 409 HA -26.9663 -20.4055 20.5417 H 27 ALA27 0.0554 410 C -28.3410 -22.0310 20.6050 C.2 27 ALA27 0.2184 411 O -27.5920 -22.7610 19.9510 O.2 27 ALA27 -0.2778 412 CB -27.5953 -20.7312 22.5982 C.3 27 ALA27 -0.0411 413 HB1 -26.7799 -21.4191 22.8251 H 27 ALA27 0.0249 414 HB2 -28.4760 -21.0592 23.1518 H 27 ALA27 0.0249 415 HB3 -27.3217 -19.7561 22.9949 H 27 ALA27 0.0249 416 N -29.5980 -22.3730 20.8900 N.am 28 GLN28 -0.2456 417 H -30.1890 -21.7290 21.4160 H 28 GLN28 0.1312 418 CA -30.1360 -23.6560 20.4590 C.3 28 GLN28 0.0882 419 HA -29.4603 -24.4377 20.8111 H 28 GLN28 0.0557 420 C -30.2070 -23.7270 18.9400 C.2 28 GLN28 0.2187 421 O -29.8560 -24.7500 18.3440 O.2 28 GLN28 -0.2778 422 CB -31.5336 -23.8290 21.0748 C.3 28 GLN28 -0.0210 423 HB1 -32.0195 -24.7101 20.6517 H 28 GLN28 0.0289 424 HB2 -32.1546 -22.9733 20.8017 H 28 GLN28 0.0289 425 CG -31.4869 -23.9752 22.6045 C.3 28 GLN28 0.0225 426 HG1 -30.9435 -23.1547 23.0704 H 28 GLN28 0.0356 427 HG2 -30.9700 -24.8937 22.8813 H 28 GLN28 0.0356 428 CD -32.9022 -24.0252 23.1918 C.2 28 GLN28 0.1981 429 OE1 -33.4726 -25.0854 23.4035 O.2 28 GLN28 -0.2798 430 NE2 -33.4298 -22.8176 23.4403 N.am 28 GLN28 -0.2724 431 HE21 -34.3571 -22.7551 23.8077 H 28 GLN28 0.1266 432 HE22 -32.9114 -21.9825 23.2598 H 28 GLN28 0.1266 433 N -30.6450 -22.6430 18.2910 N.am 29 ALA29 -0.2459 434 H -30.8190 -21.7790 18.8050 H 29 ALA29 0.1312 435 CA -30.8750 -22.6920 16.8510 C.3 29 ALA29 0.0850 436 HA -31.4324 -23.6053 16.6338 H 29 ALA29 0.0554 437 C -29.5670 -22.7070 16.0680 C.2 29 ALA29 0.2185 438 O -29.4550 -23.4050 15.0550 O.2 29 ALA29 -0.2778 439 CB -31.7079 -21.4660 16.4723 C.3 29 ALA29 -0.0411 440 HB1 -32.0064 -21.4910 15.4250 H 29 ALA29 0.0249 441 HB2 -31.1683 -20.5358 16.6566 H 29 ALA29 0.0249 442 HB3 -32.6128 -21.4414 17.0750 H 29 ALA29 0.0249 443 N -28.5870 -21.9040 16.4870 N.am 30 THR30 -0.2434 444 H -28.7270 -21.3400 17.3250 H 30 THR30 0.1313 445 CA -27.3180 -21.8150 15.7710 C.3 30 THR30 0.1135 446 HA -27.5182 -21.9860 14.7151 H 30 THR30 0.0583 447 C -26.2960 -22.8400 16.2320 C.2 30 THR30 0.2210 448 O -25.3170 -23.0850 15.5150 O.2 30 THR30 -0.2777 449 CB -26.7275 -20.3919 15.9075 C.3 30 THR30 0.0763 450 HB -25.8708 -20.3230 15.2341 H 30 THR30 0.0611 451 OG1 -26.2180 -20.1337 17.1993 O.3 30 THR30 -0.3900 452 HG1 -26.9271 -20.2265 17.8313 H 30 THR30 0.2098 453 CG2 -27.7087 -19.2811 15.4952 C.3 30 THR30 -0.0370 454 HG21 -27.2438 -18.3001 15.5938 H 30 THR30 0.0255 455 HG22 -28.6141 -19.2746 16.1029 H 30 THR30 0.0255 456 HG23 -28.0124 -19.3943 14.4556 H 30 THR30 0.0255 457 N -26.5020 -23.4490 17.3940 N.am 31 GLY31 -0.2484 458 H -27.3890 -23.3070 17.8780 H 31 GLY31 0.1309 459 CA -25.5040 -24.3070 17.9920 C.3 31 GLY31 0.0765 460 HA1 -25.1472 -25.0156 17.2441 H 31 GLY31 0.0521 461 HA2 -26.0125 -24.8696 18.7754 H 31 GLY31 0.0521 462 C -24.3350 -23.5780 18.6120 C.2 31 GLY31 0.2155 463 O -23.4210 -24.2350 19.1130 O.2 31 GLY31 -0.2781 464 N -24.3360 -22.2440 18.6060 N.am 32 LYS32 -0.2459 465 H -25.1420 -21.7600 18.2100 H 32 LYS32 0.1312 466 CA -23.2410 -21.4460 19.1370 C.3 32 LYS32 0.0880 467 HA -22.3371 -21.9837 18.8606 H 32 LYS32 0.0557 468 C -23.3380 -21.3550 20.6620 C.2 32 LYS32 0.2213 469 O -24.4260 -21.4800 21.2230 O.2 32 LYS32 -0.2776 470 CB -23.2582 -20.0605 18.4590 C.3 32 LYS32 -0.0289 471 HB1 -22.4838 -19.4219 18.8846 H 32 LYS32 0.0285 472 HB2 -24.2055 -19.5753 18.6983 H 32 LYS32 0.0285 473 CG -23.0948 -20.1108 16.9209 C.3 32 LYS32 -0.0496 474 HG1 -23.4346 -19.1643 16.5023 H 32 LYS32 0.0266 475 HG2 -23.7545 -20.8670 16.4942 H 32 LYS32 0.0266 476 CD -21.6488 -20.3579 16.4555 C.3 32 LYS32 -0.0278 477 HD1 -21.2940 -21.2928 16.8891 H 32 LYS32 0.0282 478 HD2 -21.0148 -19.5664 16.8531 H 32 LYS32 0.0282 479 CE -21.5028 -20.4135 14.9210 C.3 32 LYS32 0.1103 480 HE1 -21.9476 -19.5288 14.4670 H 32 LYS32 0.0559 481 HE2 -22.0423 -21.2795 14.5341 H 32 LYS32 0.0559 482 NZ -20.1227 -20.4916 14.4331 N.4 32 LYS32 -0.0749 483 HZ1 -20.1066 -20.5116 13.3895 H 32 LYS32 0.2742 484 HZ2 -19.6451 -21.3346 14.8145 H 32 LYS32 0.2742 485 HZ3 -19.5884 -19.6491 14.7241 H 32 LYS32 0.2742 486 N -22.2240 -21.1490 21.3610 N.am 33 PRO33 -0.2316 487 CA -22.2810 -21.1480 22.8280 C.3 33 PRO33 0.0909 488 HA -22.7442 -22.0892 23.1252 H 33 PRO33 0.0560 489 C -23.0320 -19.9290 23.3310 C.2 33 PRO33 0.2216 490 O -22.7990 -18.8050 22.8540 O.2 33 PRO33 -0.2776 491 CB -20.8051 -21.0832 23.2496 C.3 33 PRO33 -0.0275 492 HB1 -20.5786 -21.7955 24.0434 H 33 PRO33 0.0285 493 HB2 -20.5505 -20.0949 23.6279 H 33 PRO33 0.0285 494 CG -19.9852 -21.3509 21.9888 C.3 33 PRO33 -0.0379 495 HG1 -19.7707 -22.4183 21.9225 H 33 PRO33 0.0278 496 HG2 -19.0322 -20.8222 21.9909 H 33 PRO33 0.0278 497 CD -20.8816 -20.9469 20.8204 C.3 33 PRO33 0.0071 498 HD1 -20.7876 -19.8893 20.5722 H 33 PRO33 0.0431 499 HD2 -20.6866 -21.5698 19.9499 H 33 PRO33 0.0431 500 N -23.9190 -20.0990 24.3120 N.am 34 PRO34 -0.2316 501 CA -24.7400 -18.9560 24.7550 C.3 34 PRO34 0.0907 502 HA -25.3064 -18.5936 23.8970 H 34 PRO34 0.0559 503 C -23.9240 -17.8080 25.3110 C.2 34 PRO34 0.2189 504 O -24.3250 -16.6430 25.1710 O.2 34 PRO34 -0.2778 505 CB -25.6684 -19.5871 25.8011 C.3 34 PRO34 -0.0276 506 HB1 -26.6105 -19.8568 25.3226 H 34 PRO34 0.0285 507 HB2 -25.9106 -18.9242 26.6330 H 34 PRO34 0.0285 508 CG -24.9593 -20.8653 26.2528 C.3 34 PRO34 -0.0379 509 HG1 -25.6499 -21.6226 26.6241 H 34 PRO34 0.0278 510 HG2 -24.2662 -20.6238 27.0597 H 34 PRO34 0.0278 511 CD -24.1651 -21.3393 25.0346 C.3 34 PRO34 0.0071 512 HD1 -23.2189 -21.8085 25.3103 H 34 PRO34 0.0431 513 HD2 -24.7491 -21.9893 24.3805 H 34 PRO34 0.0431 514 N -22.7810 -18.1000 25.9300 N.am 35 GLN35 -0.2456 515 H -22.4860 -19.0740 25.9960 H 35 GLN35 0.1312 516 CA -21.9420 -17.0640 26.5140 C.3 35 GLN35 0.0882 517 HA -22.6170 -16.4469 27.1109 H 35 GLN35 0.0557 518 C -21.3310 -16.1390 25.4660 C.2 35 GLN35 0.2187 519 O -20.8380 -15.0670 25.8310 O.2 35 GLN35 -0.2778 520 CB -20.8900 -17.6585 27.4745 C.3 35 GLN35 -0.0210 521 HB1 -21.3729 -18.3502 28.1661 H 35 GLN35 0.0289 522 HB2 -20.5307 -16.8393 28.0992 H 35 GLN35 0.0289 523 CG -19.6482 -18.3198 26.8404 C.3 35 GLN35 0.0225 524 HG1 -18.8642 -18.3804 27.5954 H 35 GLN35 0.0356 525 HG2 -19.2437 -17.7106 26.0342 H 35 GLN35 0.0356 526 CD -19.8764 -19.7503 26.3257 C.2 35 GLN35 0.1981 527 OE1 -20.9794 -20.2754 26.2917 O.2 35 GLN35 -0.2798 528 NE2 -18.7466 -20.3529 25.9276 N.am 35 GLN35 -0.2724 529 HE21 -18.7930 -21.2901 25.5836 H 35 GLN35 0.1266 530 HE22 -17.8640 -19.8876 25.9758 H 35 GLN35 0.1266 531 N -21.3720 -16.5100 24.1860 N.am 36 TYR36 -0.2453 532 H -21.7620 -17.4240 23.9560 H 36 TYR36 0.1312 533 CA -20.8840 -15.6660 23.0980 C.3 36 TYR36 0.0917 534 HA -20.2731 -14.8635 23.5166 H 36 TYR36 0.0560 535 C -21.9940 -14.9920 22.2980 C.2 36 TYR36 0.2190 536 O -21.7020 -14.3000 21.3170 O.2 36 TYR36 -0.2778 537 CB -20.0310 -16.5319 22.1502 C.3 36 TYR36 -0.0036 538 HB1 -19.9478 -16.0773 21.1622 H 36 TYR36 0.0333 539 HB2 -20.5030 -17.5039 21.9958 H 36 TYR36 0.0333 540 CG -18.6271 -16.7174 22.6580 C.ar 36 TYR36 -0.0453 541 CD1 -17.6653 -15.7398 22.4194 C.ar 36 TYR36 -0.0561 542 HD1 -17.9281 -14.8327 21.8952 H 36 TYR36 0.0621 543 CD2 -18.2605 -17.8690 23.3461 C.ar 36 TYR36 -0.0561 544 HD2 -18.9939 -18.6319 23.5493 H 36 TYR36 0.0621 545 CE1 -16.3569 -15.9200 22.8456 C.ar 36 TYR36 -0.0317 546 HE1 -15.6101 -15.1667 22.6453 H 36 TYR36 0.0643 547 CE2 -16.9542 -18.0462 23.7838 C.ar 36 TYR36 -0.0317 548 HE2 -16.6759 -18.9432 24.3164 H 36 TYR36 0.0643 549 CZ -16.0004 -17.0727 23.5273 C.ar 36 TYR36 0.0726 550 OH -14.6964 -17.2480 23.9378 O.3 36 TYR36 -0.3598 551 HH -14.6178 -18.0401 24.4527 H 36 TYR36 0.2173 552 N -23.2500 -15.1590 22.6790 N.am 37 ILE37 -0.2454 553 H -23.4550 -15.7290 23.5000 H 37 ILE37 0.1312 554 CA -24.3490 -14.5390 21.9410 C.3 37 ILE37 0.0903 555 HA -24.0312 -14.3610 20.9136 H 37 ILE37 0.0560 556 C -24.6750 -13.1810 22.5460 C.2 37 ILE37 0.2189 557 O -24.9300 -13.0710 23.7530 O.2 37 ILE37 -0.2778 558 CB -25.5569 -15.5019 21.9008 C.3 37 ILE37 -0.0201 559 HB -25.6859 -15.9281 22.8971 H 37 ILE37 0.0318 560 CG1 -25.2445 -16.6418 20.9161 C.3 37 ILE37 -0.0514 561 HG11 -24.2694 -17.0710 21.1492 H 37 ILE37 0.0266 562 HG12 -25.1914 -16.2376 19.9063 H 37 ILE37 0.0266 563 CG2 -26.8756 -14.8000 21.5174 C.3 37 ILE37 -0.0605 564 HG21 -27.7047 -15.5033 21.4586 H 37 ILE37 0.0233 565 HG22 -26.7967 -14.2956 20.5540 H 37 ILE37 0.0233 566 HG23 -27.1597 -14.0582 22.2634 H 37 ILE37 0.0233 567 CD1 -26.2572 -17.7778 20.9203 C.3 37 ILE37 -0.0650 568 HD11 -25.9258 -18.5688 20.2494 H 37 ILE37 0.0230 569 HD12 -27.2387 -17.4494 20.5852 H 37 ILE37 0.0230 570 HD13 -26.3594 -18.1934 21.9189 H 37 ILE37 0.0230 571 N -24.6630 -12.1420 21.7050 N.am 38 ALA38 -0.2459 572 H -24.3730 -12.3030 20.7400 H 38 ALA38 0.1312 573 CA -25.0430 -10.7920 22.0960 C.3 38 ALA38 0.0850 574 HA -25.1530 -10.7425 23.1815 H 38 ALA38 0.0554 575 C -26.3720 -10.4520 21.4390 C.2 38 ALA38 0.2184 576 O -26.5920 -10.7690 20.2650 O.2 38 ALA38 -0.2778 577 CB -23.9561 -9.8197 21.6233 C.3 38 ALA38 -0.0411 578 HB1 -24.2012 -8.7910 21.8904 H 38 ALA38 0.0249 579 HB2 -23.8241 -9.8634 20.5412 H 38 ALA38 0.0249 580 HB3 -22.9980 -10.0606 22.0838 H 38 ALA38 0.0249 581 N -27.2540 -9.8070 22.1990 N.am 39 VAL39 -0.2454 582 H -26.9910 -9.5630 23.1540 H 39 VAL39 0.1312 583 CA -28.5800 -9.4350 21.7220 C.3 39 VAL39 0.0901 584 HA -28.5884 -9.5124 20.6392 H 39 VAL39 0.0560 585 C -28.8720 -7.9910 22.1050 C.2 39 VAL39 0.2189 586 O -28.4740 -7.5140 23.1730 O.2 39 VAL39 -0.2778 587 CB -29.6422 -10.3936 22.3182 C.3 39 VAL39 -0.0227 588 HB -30.6226 -10.0615 21.9720 H 39 VAL39 0.0315 589 CG1 -29.4606 -11.8349 21.8189 C.3 39 VAL39 -0.0608 590 HG11 -30.2552 -12.4817 22.1915 H 39 VAL39 0.0233 591 HG12 -28.5161 -12.2558 22.1603 H 39 VAL39 0.0233 592 HG13 -29.4763 -11.8852 20.7324 H 39 VAL39 0.0233 593 CG2 -29.6679 -10.3853 23.8559 C.3 39 VAL39 -0.0608 594 HG21 -30.4613 -11.0312 24.2285 H 39 VAL39 0.0233 595 HG22 -29.8478 -9.3901 24.2577 H 39 VAL39 0.0233 596 HG23 -28.7283 -10.7473 24.2731 H 39 VAL39 0.0233 597 N -29.6310 -7.3130 21.2470 N.am 40 HIS40 -0.2453 598 H -30.0680 -7.8140 20.4730 H 40 HIS40 0.1312 599 CA -29.8600 -5.8790 21.3750 C.3 40 HIS40 0.0932 600 HA -29.8331 -5.6170 22.4343 H 40 HIS40 0.0561 601 C -31.2470 -5.5860 20.8220 C.2 40 HIS40 0.2190 602 O -31.5280 -5.9290 19.6720 O.2 40 HIS40 -0.2778 603 CB -28.7659 -5.1522 20.5756 C.3 40 HIS40 0.0146 604 HB1 -28.8115 -5.4417 19.5258 H 40 HIS40 0.0348 605 HB2 -27.7809 -5.4444 20.9391 H 40 HIS40 0.0348 606 CG -28.8819 -3.6467 20.6787 C.ar 40 HIS40 0.0551 607 ND1 -28.5361 -2.8104 19.6777 N.ar 40 HIS40 -0.2469 608 CD2 -29.2790 -2.8700 21.7811 C.ar 40 HIS40 0.0047 609 HD2 -29.6019 -3.2386 22.7432 H 40 HIS40 0.0764 610 CE1 -28.7302 -1.5674 20.1464 C.ar 40 HIS40 0.0737 611 HE1 -28.5568 -0.6731 19.5643 H 40 HIS40 0.0963 612 NE2 -29.1827 -1.5720 21.4135 N.ar 40 HIS40 -0.2539 613 HE2 -29.4016 -0.7876 21.9584 H 40 HIS40 0.1339 614 N -32.0790 -4.9130 21.6160 N.am 41 VAL41 -0.2454 615 H -31.7430 -4.6050 22.5280 H 41 VAL41 0.1312 616 CA -33.4510 -4.6000 21.2320 C.3 41 VAL41 0.0901 617 HA -33.6055 -4.8850 20.1908 H 41 VAL41 0.0560 618 C -33.6610 -3.0970 21.3520 C.2 41 VAL41 0.2189 619 O -33.3800 -2.5130 22.4080 O.2 41 VAL41 -0.2778 620 CB -34.4251 -5.3829 22.1432 C.3 41 VAL41 -0.0227 621 HB -34.2057 -5.1081 23.1762 H 41 VAL41 0.0315 622 CG1 -35.9003 -5.0345 21.8733 C.3 41 VAL41 -0.0608 623 HG11 -36.5638 -5.6222 22.5082 H 41 VAL41 0.0233 624 HG12 -36.1705 -5.2359 20.8366 H 41 VAL41 0.0233 625 HG13 -36.1117 -3.9836 22.0732 H 41 VAL41 0.0233 626 CG2 -34.2205 -6.9030 22.0243 C.3 41 VAL41 -0.0608 627 HG21 -34.7937 -7.4303 22.7847 H 41 VAL41 0.0233 628 HG22 -33.1788 -7.1937 22.1506 H 41 VAL41 0.0233 629 HG23 -34.5454 -7.2773 21.0568 H 41 VAL41 0.0233 630 N -34.1530 -2.4800 20.2830 N.am 42 VAL42 -0.2454 631 H -34.4450 -3.0470 19.4870 H 42 VAL42 0.1312 632 CA -34.2960 -1.0310 20.1940 C.3 42 VAL42 0.0903 633 HA -33.9953 -0.5815 21.1392 H 42 VAL42 0.0560 634 C -35.7530 -0.7110 19.8860 C.2 42 VAL42 0.2216 635 O -36.1700 -0.7470 18.7240 O.2 42 VAL42 -0.2776 636 CB -33.3515 -0.4920 19.0980 C.3 42 VAL42 -0.0227 637 HB -33.7031 -0.8348 18.1274 H 42 VAL42 0.0315 638 CG1 -33.3497 1.0411 19.0802 C.3 42 VAL42 -0.0608 639 HG11 -32.7827 1.4262 18.2322 H 42 VAL42 0.0233 640 HG12 -32.9117 1.4464 19.9924 H 42 VAL42 0.0233 641 HG13 -34.3635 1.4267 19.0066 H 42 VAL42 0.0233 642 CG2 -31.9167 -1.0142 19.2601 C.3 42 VAL42 -0.0608 643 HG21 -31.2548 -0.5715 18.5155 H 42 VAL42 0.0233 644 HG22 -31.8571 -2.0959 19.1354 H 42 VAL42 0.0233 645 HG23 -31.5260 -0.7661 20.2466 H 42 VAL42 0.0233 646 N -36.5510 -0.3880 20.9030 N.am 43 PRO43 -0.2316 647 CA -37.9670 -0.0700 20.6810 C.3 43 PRO43 0.0907 648 HA -38.3747 -0.6788 19.8763 H 43 PRO43 0.0559 649 C -38.1950 1.4080 20.3710 C.2 43 PRO43 0.2189 650 O -37.2520 2.2110 20.3120 O.2 43 PRO43 -0.2778 651 CB -38.5718 -0.4332 22.0421 C.3 43 PRO43 -0.0276 652 HB1 -38.7808 -1.5027 22.0661 H 43 PRO43 0.0285 653 HB2 -39.5082 0.0802 22.2641 H 43 PRO43 0.0285 654 CG -37.4680 -0.1109 23.0508 C.3 43 PRO43 -0.0379 655 HG1 -37.5576 -0.6908 23.9688 H 43 PRO43 0.0278 656 HG2 -37.5213 0.9438 23.3197 H 43 PRO43 0.0278 657 CD -36.1543 -0.3672 22.3086 C.3 43 PRO43 0.0071 658 HD1 -35.4268 0.4307 22.4648 H 43 PRO43 0.0431 659 HD2 -35.7313 -1.3409 22.5574 H 43 PRO43 0.0431 660 N -39.4600 1.7720 20.1770 N.am 44 ASP44 -0.2451 661 H -40.1700 1.0420 20.1180 H 44 ASP44 0.1312 662 CA -39.8850 3.1700 20.0440 C.3 44 ASP44 0.0974 663 HA -40.9663 3.1176 19.9164 H 44 ASP44 0.0563 664 C -39.3220 3.8600 18.8060 C.2 44 ASP44 0.2192 665 O -39.2040 5.0840 18.7680 O.2 44 ASP44 -0.2778 666 CB -39.5818 3.9483 21.3491 C.3 44 ASP44 0.0576 667 HB1 -39.9924 4.9556 21.2934 H 44 ASP44 0.0394 668 HB2 -38.5083 4.0587 21.4957 H 44 ASP44 0.0394 669 CG -40.1730 3.2709 22.6105 C.2 44 ASP44 0.1780 670 OD1 -41.3486 3.4746 22.9034 O.co2 44 ASP44 -0.6478 671 OD2 -39.4584 2.5466 23.3024 O.co2 44 ASP44 -0.6478 672 N -39.0020 3.1090 17.7670 N.am 45 GLN45 -0.2456 673 H -39.2140 2.1120 17.7850 H 45 GLN45 0.1312 674 CA -38.3530 3.6800 16.6000 C.3 45 GLN45 0.0882 675 HA -37.6886 4.4793 16.9338 H 45 GLN45 0.0557 676 C -39.3500 4.2730 15.6140 C.2 45 GLN45 0.2187 677 O -40.5010 3.8480 15.5210 O.2 45 GLN45 -0.2778 678 CB -37.5458 2.5655 15.9143 C.3 45 GLN45 -0.0210 679 HB1 -37.1043 2.9314 14.9855 H 45 GLN45 0.0289 680 HB2 -38.2290 1.7687 15.6247 H 45 GLN45 0.0289 681 CG -36.4377 1.9820 16.8070 C.3 45 GLN45 0.0225 682 HG1 -35.9672 1.1300 16.3188 H 45 GLN45 0.0356 683 HG2 -36.8307 1.6187 17.7565 H 45 GLN45 0.0356 684 CD -35.3559 3.0374 17.0653 C.2 45 GLN45 0.1981 685 OE1 -34.4761 3.2641 16.2463 O.2 45 GLN45 -0.2798 686 NE2 -35.4771 3.6665 18.2439 N.am 45 GLN45 -0.2724 687 HE21 -34.8250 4.3769 18.5028 H 45 GLN45 0.1266 688 HE22 -36.2154 3.4317 18.8790 H 45 GLN45 0.1266 689 N -38.8650 5.2510 14.8550 N.am 46 LEU46 -0.2456 690 H -37.9060 5.5550 15.0190 H 46 LEU46 0.1312 691 CA -39.6260 5.9150 13.8000 C.3 46 LEU46 0.0880 692 HA -40.6855 5.8414 14.0514 H 46 LEU46 0.0557 693 C -39.3580 5.1730 12.4960 C.2 46 LEU46 0.2187 694 O -38.3300 5.3800 11.8450 O.2 46 LEU46 -0.2778 695 CB -39.1959 7.3897 13.7243 C.3 46 LEU46 -0.0266 696 HB1 -38.1188 7.4399 13.5573 H 46 LEU46 0.0287 697 HB2 -39.3670 7.8540 14.6962 H 46 LEU46 0.0287 698 CG -39.9158 8.2132 12.6384 C.3 46 LEU46 -0.0449 699 HG -39.7151 7.7594 11.6672 H 46 LEU46 0.0296 700 CD1 -41.4371 8.2346 12.8431 C.3 46 LEU46 -0.0626 701 HD11 -41.9223 8.8612 12.0942 H 46 LEU46 0.0232 702 HD12 -41.6971 8.6288 13.8258 H 46 LEU46 0.0232 703 HD13 -41.8676 7.2373 12.7552 H 46 LEU46 0.0232 704 CD2 -39.3604 9.6422 12.5928 C.3 46 LEU46 -0.0626 705 HD21 -39.8339 10.2228 11.8007 H 46 LEU46 0.0232 706 HD22 -38.2867 9.6400 12.4033 H 46 LEU46 0.0232 707 HD23 -39.5320 10.1622 13.5358 H 46 LEU46 0.0232 708 N -40.2600 4.2880 12.1250 N.am 47 MET47 -0.2456 709 H -41.1060 4.1690 12.6820 H 47 MET47 0.1312 710 CA -40.0670 3.4860 10.9430 C.3 47 MET47 0.0885 711 HA -39.4821 4.0778 10.2349 H 47 MET47 0.0557 712 C -41.3800 3.2120 10.2170 C.2 47 MET47 0.2187 713 O -42.4280 3.3620 10.7820 O.2 47 MET47 -0.2778 714 CB -39.2796 2.1974 11.2570 C.3 47 MET47 -0.0199 715 HB1 -38.2568 2.4703 11.5159 H 47 MET47 0.0293 716 HB2 -39.1988 1.5915 10.3534 H 47 MET47 0.0293 717 CG -39.8610 1.3397 12.3889 C.3 47 MET47 -0.0047 718 HG1 -40.9408 1.2292 12.2862 H 47 MET47 0.0377 719 HG2 -39.6877 1.8194 13.3530 H 47 MET47 0.0377 720 SD -39.1238 -0.3094 12.4073 S.3 47 MET47 -0.1641 721 CE -37.5465 0.0535 13.1992 C.3 47 MET47 -0.0181 722 HE1 -36.8184 -0.7162 12.9429 H 47 MET47 0.0340 723 HE2 -37.6627 0.0949 14.2799 H 47 MET47 0.0340 724 HE3 -37.1515 1.0084 12.8551 H 47 MET47 0.0340 725 N -41.2320 2.8200 8.9660 N.am 48 ALA48 -0.2459 726 H -40.2930 2.7830 8.5700 H 48 ALA48 0.1312 727 CA -42.3590 2.4400 8.1340 C.3 48 ALA48 0.0850 728 HA -43.1859 2.1492 8.7853 H 48 ALA48 0.0554 729 C -41.9630 1.2250 7.3140 C.2 48 ALA48 0.2184 730 O -40.7850 0.9960 7.0390 O.2 48 ALA48 -0.2778 731 CB -42.7718 3.6098 7.2335 C.3 48 ALA48 -0.0411 732 HB1 -43.6292 3.3472 6.6123 H 48 ALA48 0.0249 733 HB2 -41.9570 3.9138 6.5756 H 48 ALA48 0.0249 734 HB3 -43.0551 4.4745 7.8339 H 48 ALA48 0.0249 735 N -42.9700 0.4470 6.9350 N.am 49 PHE49 -0.2453 736 H -43.9150 0.6930 7.2300 H 49 PHE49 0.1312 737 CA -42.7830 -0.7360 6.1200 C.3 49 PHE49 0.0917 738 HA -41.8102 -0.7021 5.6250 H 49 PHE49 0.0560 739 C -43.9070 -0.6770 5.0960 C.2 49 PHE49 0.2188 740 O -45.0820 -0.6480 5.4680 O.2 49 PHE49 -0.2778 741 CB -42.9190 -1.9481 7.0621 C.3 49 PHE49 -0.0036 742 HB1 -43.9418 -2.0426 7.4304 H 49 PHE49 0.0333 743 HB2 -42.3068 -1.7784 7.9490 H 49 PHE49 0.0333 744 CG -42.4974 -3.2519 6.4393 C.ar 49 PHE49 -0.0454 745 CD1 -41.3331 -3.8862 6.8652 C.ar 49 PHE49 -0.0585 746 HD1 -40.7160 -3.4395 7.6314 H 49 PHE49 0.0620 747 CD2 -43.2926 -3.8748 5.4810 C.ar 49 PHE49 -0.0585 748 HD2 -44.2200 -3.4234 5.1615 H 49 PHE49 0.0620 749 CE1 -40.9682 -5.1178 6.3401 C.ar 49 PHE49 -0.0615 750 HE1 -40.0841 -5.6211 6.7031 H 49 PHE49 0.0618 751 CE2 -42.9158 -5.0943 4.9359 C.ar 49 PHE49 -0.0615 752 HE2 -43.5456 -5.5822 4.2059 H 49 PHE49 0.0618 753 CZ -41.7537 -5.7170 5.3663 C.ar 49 PHE49 -0.0617 754 HZ -41.4852 -6.6862 4.9718 H 49 PHE49 0.0618 755 N -43.5490 -0.5710 3.8170 N.am 50 GLY50 -0.2485 756 H -42.5650 -0.6460 3.5600 H 50 GLY50 0.1309 757 CA -44.5480 -0.3490 2.7850 C.3 50 GLY50 0.0765 758 HA1 -45.2708 -1.1655 2.8267 H 50 GLY50 0.0521 759 HA2 -44.0356 -0.3889 1.8244 H 50 GLY50 0.0521 760 C -45.2670 0.9780 2.9150 C.2 50 GLY50 0.2153 761 O -46.4010 1.1140 2.4410 O.2 50 GLY50 -0.2781 762 N -44.6350 1.9670 3.5390 N.am 51 GLY51 -0.2487 763 H -43.6850 1.8100 3.8760 H 51 GLY51 0.1309 764 CA -45.2500 3.2590 3.7560 C.3 51 GLY51 0.0765 765 HA1 -45.7579 3.5661 2.8402 H 51 GLY51 0.0521 766 HA2 -44.4418 3.9646 3.9451 H 51 GLY51 0.0521 767 C -46.2230 3.3130 4.9160 C.2 51 GLY51 0.2156 768 O -46.8250 4.3720 5.1450 O.2 51 GLY51 -0.2781 769 N -46.4070 2.2060 5.6410 N.am 52 SER52 -0.2439 770 H -45.8670 1.3780 5.3880 H 52 SER52 0.1312 771 CA -47.3250 2.0980 6.7690 C.3 52 SER52 0.1109 772 HA -47.9662 2.9812 6.7856 H 52 SER52 0.0580 773 C -46.5460 2.0500 8.0770 C.2 52 SER52 0.2210 774 O -45.4730 1.4600 8.1390 O.2 52 SER52 -0.2777 775 CB -48.2004 0.8479 6.6281 C.3 52 SER52 0.0681 776 HB1 -47.5725 -0.0435 6.5446 H 52 SER52 0.0577 777 HB2 -48.7995 0.9313 5.7143 H 52 SER52 0.0577 778 OG -49.0324 0.7443 7.7748 O.3 52 SER52 -0.3930 779 HG -49.7122 0.0752 7.6699 H 52 SER52 0.2095 780 N -47.1160 2.6170 9.1440 N.am 53 SER53 -0.2435 781 H -48.0350 3.0480 9.0440 H 53 SER53 0.1312 782 CA -46.4610 2.6380 10.4490 C.3 53 SER53 0.1109 783 HA -45.4113 2.3638 10.3324 H 53 SER53 0.0580 784 C -47.0700 1.6460 11.4390 C.2 53 SER53 0.2209 785 O -46.8570 1.7810 12.6480 O.2 53 SER53 -0.2777 786 CB -46.5332 4.0668 11.0072 C.3 53 SER53 0.0681 787 HB1 -45.9741 4.7298 10.3392 H 53 SER53 0.0577 788 HB2 -46.0517 4.1089 11.9912 H 53 SER53 0.0577 789 OG -47.8863 4.5006 11.0878 O.3 53 SER53 -0.3930 790 HG -47.9517 5.3700 11.4744 H 53 SER53 0.2095 791 N -47.7930 0.6320 10.9590 N.am 54 GLU54 -0.2456 792 H -48.0800 0.6310 9.9800 H 54 GLU54 0.1312 793 CA -48.1740 -0.4720 11.8270 C.3 54 GLU54 0.0885 794 HA -48.7507 -0.0483 12.6493 H 54 GLU54 0.0557 795 C -46.9130 -1.1610 12.3660 C.2 54 GLU54 0.2214 796 O -45.8110 -0.9610 11.8390 O.2 54 GLU54 -0.2776 797 CB -49.0287 -1.4112 10.9686 C.3 54 GLU54 -0.0192 798 HB1 -49.2173 -2.3577 11.4720 H 54 GLU54 0.0290 799 HB2 -48.4546 -1.6573 10.0759 H 54 GLU54 0.0290 800 CG -50.3783 -0.7868 10.5677 C.3 54 GLU54 0.0356 801 HG1 -50.2631 0.2244 10.1802 H 54 GLU54 0.0374 802 HG2 -51.0454 -0.7224 11.4266 H 54 GLU54 0.0374 803 CD -51.0370 -1.6563 9.4935 C.2 54 GLU54 0.1760 804 OE1 -50.9348 -1.3410 8.3131 O.co2 54 GLU54 -0.6478 805 OE2 -51.6349 -2.6669 9.8354 O.co2 54 GLU54 -0.6478 806 N -47.0390 -1.9880 13.4120 N.am 55 PRO55 -0.2316 807 CA -45.8410 -2.6150 13.9870 C.3 55 PRO55 0.0907 808 HA -45.2904 -1.8192 14.4813 H 55 PRO55 0.0559 809 C -44.9930 -3.3190 12.9350 C.2 55 PRO55 0.2189 810 O -45.5000 -4.0250 12.0590 O.2 55 PRO55 -0.2778 811 CB -46.4261 -3.6026 15.0053 C.3 55 PRO55 -0.0276 812 HB1 -45.7791 -3.7422 15.8713 H 55 PRO55 0.0285 813 HB2 -46.5823 -4.5824 14.5507 H 55 PRO55 0.0285 814 CG -47.7884 -3.0154 15.3725 C.3 55 PRO55 -0.0379 815 HG1 -47.6586 -2.2660 16.1540 H 55 PRO55 0.0278 816 HG2 -48.4845 -3.7678 15.7438 H 55 PRO55 0.0278 817 CD -48.2819 -2.3352 14.0933 C.3 55 PRO55 0.0071 818 HD1 -48.8277 -3.0320 13.4577 H 55 PRO55 0.0431 819 HD2 -48.8755 -1.4433 14.2946 H 55 PRO55 0.0431 820 N -43.7010 -3.1090 13.0410 N.am 56 CYS56 -0.2449 821 H -43.3650 -2.4920 13.7810 H 56 CYS56 0.1312 822 CA -42.7170 -3.7260 12.1380 C.3 56 CYS56 0.0965 823 HA -43.0704 -4.7285 11.8938 H 56 CYS56 0.0565 824 C -41.3510 -3.8770 12.8600 C.2 56 CYS56 0.2195 825 O -41.1690 -3.3300 13.9130 O.2 56 CYS56 -0.2778 826 CB -42.5959 -2.8910 10.8527 C.3 56 CYS56 0.0147 827 HB1 -43.5648 -2.8688 10.3533 H 56 CYS56 0.0394 828 HB2 -41.9085 -3.3693 10.1547 H 56 CYS56 0.0394 829 SG -42.0563 -1.1799 11.1114 S.3 56 CYS56 -0.1762 830 HG -42.0787 -0.5214 9.9506 H 56 CYS56 0.1017 831 N -40.4590 -4.6100 12.2480 N.am 57 ALA57 -0.2459 832 H -40.6900 -5.0710 11.3680 H 57 ALA57 0.1312 833 CA -39.1310 -4.7660 12.8300 C.3 57 ALA57 0.0850 834 HA -38.8860 -3.8524 13.3726 H 57 ALA57 0.0554 835 C -38.1010 -4.9420 11.7310 C.2 57 ALA57 0.2184 836 O -38.3540 -5.6210 10.7300 O.2 57 ALA57 -0.2778 837 CB -39.1057 -5.9794 13.7651 C.3 57 ALA57 -0.0411 838 HB1 -38.1021 -6.1687 14.1413 H 57 ALA57 0.0249 839 HB2 -39.4472 -6.8817 13.2581 H 57 ALA57 0.0249 840 HB3 -39.7458 -5.8113 14.6271 H 57 ALA57 0.0249 841 N -36.9280 -4.3680 11.9700 N.am 58 LEU58 -0.2457 842 H -36.8340 -3.8100 12.8190 H 58 LEU58 0.1312 843 CA -35.7670 -4.4840 11.0980 C.3 58 LEU58 0.0880 844 HA -35.9884 -5.1855 10.2914 H 58 LEU58 0.0557 845 C -34.6350 -5.0480 11.9440 C.2 58 LEU58 0.2187 846 O -34.2980 -4.4770 12.9870 O.2 58 LEU58 -0.2778 847 CB -35.4159 -3.0903 10.5487 C.3 58 LEU58 -0.0266 848 HB1 -34.5368 -3.1603 9.9069 H 58 LEU58 0.0287 849 HB2 -35.1347 -2.4423 11.3807 H 58 LEU58 0.0287 850 CG -36.5651 -2.4167 9.7713 C.3 58 LEU58 -0.0449 851 HG -37.4425 -2.3583 10.4167 H 58 LEU58 0.0296 852 CD1 -36.1958 -0.9746 9.4029 C.3 58 LEU58 -0.0626 853 HD11 -37.0186 -0.4793 8.8866 H 58 LEU58 0.0232 854 HD12 -35.3238 -0.9448 8.7491 H 58 LEU58 0.0232 855 HD13 -35.9677 -0.3888 10.2940 H 58 LEU58 0.0232 856 CD2 -36.9565 -3.2118 8.5172 C.3 58 LEU58 -0.0626 857 HD21 -37.7430 -2.7017 7.9603 H 58 LEU58 0.0232 858 HD22 -37.3355 -4.2015 8.7700 H 58 LEU58 0.0232 859 HD23 -36.1038 -3.3388 7.8503 H 58 LEU58 0.0232 860 N -34.0690 -6.1710 11.5060 N.am 59 CYS59 -0.2449 861 H -34.2660 -6.4880 10.5570 H 59 CYS59 0.1312 862 CA -33.1770 -6.9580 12.3440 C.3 59 CYS59 0.0965 863 HA -32.8642 -6.3371 13.1803 H 59 CYS59 0.0565 864 C -31.9290 -7.3700 11.5820 C.2 59 CYS59 0.2195 865 O -31.8900 -7.3650 10.3480 O.2 59 CYS59 -0.2778 866 CB -33.9196 -8.2119 12.8294 C.3 59 CYS59 0.0147 867 HB1 -33.2970 -8.7736 13.5265 H 59 CYS59 0.0394 868 HB2 -34.1072 -8.8677 11.9811 H 59 CYS59 0.0394 869 SG -35.5095 -7.8746 13.6274 S.3 59 CYS59 -0.1762 870 HG -36.1400 -9.0254 13.8740 H 59 CYS59 0.1017 871 N -30.9280 -7.8060 12.3420 N.am 60 SER60 -0.2436 872 H -30.9930 -7.7100 13.3550 H 60 SER60 0.1312 873 CA -29.7420 -8.4180 11.7580 C.3 60 SER60 0.1109 874 HA -30.0394 -8.8616 10.8110 H 60 SER60 0.0580 875 C -29.2530 -9.5450 12.6490 C.2 60 SER60 0.2209 876 O -29.3600 -9.4750 13.8690 O.2 60 SER60 -0.2777 877 CB -28.6568 -7.3554 11.5372 C.3 60 SER60 0.0681 878 HB1 -28.9812 -6.7071 10.7152 H 60 SER60 0.0577 879 HB2 -27.7199 -7.8361 11.2387 H 60 SER60 0.0577 880 OG -28.4490 -6.5900 12.7177 O.3 60 SER60 -0.3930 881 HG -27.8757 -5.8456 12.5539 H 60 SER60 0.2095 882 N -28.6670 -10.5590 12.0160 N.am 61 LEU61 -0.2456 883 H -28.7240 -10.5920 10.9980 H 61 LEU61 0.1312 884 CA -27.9470 -11.6250 12.7040 C.3 61 LEU61 0.0880 885 HA -27.8063 -11.3239 13.7394 H 61 LEU61 0.0557 886 C -26.5910 -11.7650 12.0340 C.2 61 LEU61 0.2187 887 O -26.5180 -12.0540 10.8350 O.2 61 LEU61 -0.2778 888 CB -28.7431 -12.9412 12.6305 C.3 61 LEU61 -0.0266 889 HB1 -28.8403 -13.2329 11.5848 H 61 LEU61 0.0287 890 HB2 -29.7609 -12.7677 12.9819 H 61 LEU61 0.0287 891 CG -28.1176 -14.1009 13.4376 C.3 61 LEU61 -0.0449 892 HG -27.0651 -14.1885 13.1651 H 61 LEU61 0.0296 893 CD1 -28.1973 -13.8523 14.9507 C.3 61 LEU61 -0.0626 894 HD11 -27.7515 -14.6765 15.5077 H 61 LEU61 0.0232 895 HD12 -29.2337 -13.7571 15.2762 H 61 LEU61 0.0232 896 HD13 -27.6702 -12.9446 15.2400 H 61 LEU61 0.0232 897 CD2 -28.7826 -15.4397 13.0907 C.3 61 LEU61 -0.0626 898 HD21 -28.3556 -16.2555 13.6746 H 61 LEU61 0.0232 899 HD22 -28.6410 -15.6862 12.0388 H 61 LEU61 0.0232 900 HD23 -29.8545 -15.4126 13.2907 H 61 LEU61 0.0232 901 N -25.5230 -11.5660 12.8070 N.am 62 HIS62 -0.2453 902 H -25.6690 -11.2290 13.7590 H 62 HIS62 0.1312 903 CA -24.1560 -11.8060 12.3590 C.3 62 HIS62 0.0932 904 HA -24.1553 -11.9558 11.2783 H 62 HIS62 0.0561 905 C -23.6240 -13.0530 13.0590 C.2 62 HIS62 0.2191 906 O -23.7880 -13.2050 14.2730 O.2 62 HIS62 -0.2778 907 CB -23.2561 -10.6147 12.7425 C.3 62 HIS62 0.0146 908 HB1 -22.3498 -10.6037 12.1373 H 62 HIS62 0.0348 909 HB2 -22.9430 -10.6826 13.7840 H 62 HIS62 0.0348 910 CG -23.9818 -9.2972 12.6001 C.ar 62 HIS62 0.0551 911 ND1 -24.7762 -8.7888 13.5651 N.ar 62 HIS62 -0.2469 912 CD2 -23.8932 -8.3577 11.5613 C.ar 62 HIS62 0.0047 913 HD2 -23.3033 -8.4553 10.6615 H 62 HIS62 0.0764 914 CE1 -25.1847 -7.5916 13.1197 C.ar 62 HIS62 0.0737 915 HE1 -25.8237 -6.9360 13.6945 H 62 HIS62 0.0963 916 NE2 -24.6797 -7.3098 11.9035 N.ar 62 HIS62 -0.2539 917 HE2 -24.8226 -6.4896 11.3867 H 62 HIS62 0.1339 918 N -22.9400 -13.9130 12.3090 N.am 63 SER63 -0.2436 919 H -22.8310 -13.7280 11.3120 H 63 SER63 0.1312 920 CA -22.3450 -15.1110 12.8790 C.3 63 SER63 0.1109 921 HA -21.9802 -14.8727 13.8773 H 63 SER63 0.0580 922 C -21.1730 -15.5300 12.0070 C.2 63 SER63 0.2209 923 O -21.1930 -15.3120 10.7950 O.2 63 SER63 -0.2777 924 CB -23.4170 -16.2128 12.9197 C.3 63 SER63 0.0681 925 HB1 -23.5367 -16.6373 11.9142 H 63 SER63 0.0577 926 HB2 -24.3776 -15.7543 13.1799 H 63 SER63 0.0577 927 OG -23.1119 -17.2225 13.8823 O.3 63 SER63 -0.3930 928 HG -23.7534 -17.9269 13.8107 H 63 SER63 0.2095 929 N -20.1420 -16.1050 12.6340 N.am 64 ILE64 -0.2453 930 H -20.1200 -16.0870 13.6540 H 64 ILE64 0.1312 931 CA -19.0420 -16.7600 11.9190 C.3 64 ILE64 0.0903 932 HA -18.8792 -16.2209 10.9831 H 64 ILE64 0.0560 933 C -19.5180 -18.1700 11.5920 C.2 64 ILE64 0.2187 934 O -19.4950 -19.0640 12.4390 O.2 64 ILE64 -0.2778 935 CB -17.7596 -16.7302 12.7843 C.3 64 ILE64 -0.0201 936 HB -17.9619 -17.2852 13.7009 H 64 ILE64 0.0318 937 CG1 -17.3729 -15.2886 13.1871 C.3 64 ILE64 -0.0514 938 HG11 -18.2409 -14.7489 13.5644 H 64 ILE64 0.0266 939 HG12 -17.0408 -14.7385 12.3046 H 64 ILE64 0.0266 940 CG2 -16.5878 -17.4140 12.0571 C.3 64 ILE64 -0.0605 941 HG21 -15.6993 -17.4653 12.6848 H 64 ILE64 0.0233 942 HG22 -16.3221 -16.8708 11.1490 H 64 ILE64 0.0233 943 HG23 -16.8310 -18.4363 11.7685 H 64 ILE64 0.0233 944 CD1 -16.2903 -15.2265 14.2737 C.3 64 ILE64 -0.0650 945 HD11 -16.0770 -14.1936 14.5488 H 64 ILE64 0.0230 946 HD12 -15.3539 -15.6732 13.9417 H 64 ILE64 0.0230 947 HD13 -16.6043 -15.7514 15.1751 H 64 ILE64 0.0230 948 N -19.9550 -18.3750 10.3590 N.am 65 GLY65 -0.2485 949 H -19.8520 -17.6410 9.6590 H 65 GLY65 0.1309 950 CA -20.5790 -19.6330 9.9930 C.3 65 GLY65 0.0765 951 HA1 -19.9422 -20.4525 10.3243 H 65 GLY65 0.0521 952 HA2 -20.6115 -19.6598 8.9053 H 65 GLY65 0.0521 953 C -21.9880 -19.7740 10.5550 C.2 65 GLY65 0.2155 954 O -22.5580 -18.8670 11.1640 O.2 65 GLY65 -0.2781 955 N -22.5600 -20.9560 10.3150 N.am 66 LYS66 -0.2459 956 H -22.0090 -21.6680 9.8360 H 66 LYS66 0.1312 957 CA -23.9310 -21.2890 10.6990 C.3 66 LYS66 0.0878 958 HA -24.0653 -22.2608 10.2280 H 66 LYS66 0.0557 959 C -24.9470 -20.4070 9.9670 C.2 66 LYS66 0.2187 960 O -26.0720 -20.2100 10.4280 O.2 66 LYS66 -0.2778 961 CB -24.1165 -21.4319 12.2209 C.3 66 LYS66 -0.0289 962 HB1 -25.0497 -20.9753 12.5534 H 66 LYS66 0.0285 963 HB2 -23.3276 -20.8917 12.7404 H 66 LYS66 0.0285 964 CG -24.1141 -22.9168 12.6269 C.3 66 LYS66 -0.0496 965 HG1 -24.0742 -23.0031 13.7030 H 66 LYS66 0.0266 966 HG2 -23.1865 -23.3785 12.2850 H 66 LYS66 0.0266 967 CD -25.3147 -23.6700 12.0138 C.3 66 LYS66 -0.0278 968 HD1 -24.9265 -24.3056 11.2174 H 66 LYS66 0.0282 969 HD2 -25.9548 -22.9467 11.5091 H 66 LYS66 0.0282 970 CE -26.1911 -24.5412 12.9397 C.3 66 LYS66 0.1103 971 HE1 -25.8012 -24.6053 13.9500 H 66 LYS66 0.0559 972 HE2 -26.1964 -25.5703 12.5740 H 66 LYS66 0.0559 973 NZ -27.5916 -24.0929 12.9789 N.4 66 LYS66 -0.0749 974 HZ1 -28.1256 -24.5907 13.7226 H 66 LYS66 0.2742 975 HZ2 -28.0329 -24.2714 12.0523 H 66 LYS66 0.2742 976 HZ3 -27.6431 -23.0680 13.1552 H 66 LYS66 0.2742 977 N -24.5610 -19.8940 8.8010 N.am 67 ILE67 -0.2454 978 H -23.6200 -20.1090 8.4720 H 67 ILE67 0.1312 979 CA -25.4010 -19.0420 7.9630 C.3 67 ILE67 0.0903 980 HA -26.4034 -19.0142 8.3918 H 67 ILE67 0.0560 981 C -25.5100 -19.7170 6.6050 C.2 67 ILE67 0.2187 982 O -24.4960 -20.1160 6.0220 O.2 67 ILE67 -0.2778 983 CB -24.8673 -17.5950 7.8614 C.3 67 ILE67 -0.0201 984 HB -23.8950 -17.6580 7.3896 H 67 ILE67 0.0318 985 CG1 -24.6530 -16.9188 9.2289 C.3 67 ILE67 -0.0514 986 HG11 -24.1688 -15.9541 9.0737 H 67 ILE67 0.0266 987 HG12 -23.9440 -17.5013 9.8095 H 67 ILE67 0.0266 988 CG2 -25.7272 -16.6992 6.9555 C.3 67 ILE67 -0.0605 989 HG21 -25.3152 -15.6907 6.9034 H 67 ILE67 0.0233 990 HG22 -26.7445 -16.6235 7.3333 H 67 ILE67 0.0233 991 HG23 -25.7726 -17.0826 5.9365 H 67 ILE67 0.0233 992 CD1 -25.9377 -16.7024 10.0420 C.3 67 ILE67 -0.0650 993 HD11 -25.7157 -16.2217 10.9943 H 67 ILE67 0.0230 994 HD12 -26.4410 -17.6439 10.2558 H 67 ILE67 0.0230 995 HD13 -26.6385 -16.0587 9.5119 H 67 ILE67 0.0230 996 N -26.7270 -19.8750 6.1100 N.am 68 GLY68 -0.2485 997 H -27.5400 -19.5260 6.6180 H 68 GLY68 0.1309 998 CA -26.8930 -20.5490 4.8380 C.3 68 GLY68 0.0765 999 HA1 -26.4230 -21.5318 4.8994 H 68 GLY68 0.0521 1000 HA2 -26.3978 -19.9506 4.0711 H 68 GLY68 0.0521 1001 C -28.3580 -20.6940 4.5170 C.2 68 GLY68 0.2153 1002 O -29.2310 -20.3030 5.2920 O.2 68 GLY68 -0.2781 1003 N -28.6150 -21.2670 3.3490 N.am 69 GLY69 -0.2487 1004 H -27.8490 -21.6590 2.8020 H 69 GLY69 0.1309 1005 CA -29.9660 -21.3440 2.8400 C.3 69 GLY69 0.0765 1006 HA1 -29.9374 -21.9803 1.9559 H 69 GLY69 0.0521 1007 HA2 -30.2534 -20.3380 2.5318 H 69 GLY69 0.0521 1008 C -30.9880 -21.8820 3.8210 C.2 69 GLY69 0.2155 1009 O -31.8940 -21.1570 4.2470 O.2 69 GLY69 -0.2781 1010 N -30.8570 -23.1510 4.1950 N.am 70 ALA70 -0.2462 1011 H -30.0560 -23.6970 3.8760 H 70 ALA70 0.1311 1012 CA -31.8590 -23.7630 5.0620 C.3 70 ALA70 0.0850 1013 HA -32.8447 -23.5221 4.6602 H 70 ALA70 0.0554 1014 C -31.7730 -23.2200 6.4800 C.2 70 ALA70 0.2184 1015 O -32.7970 -23.0420 7.1540 O.2 70 ALA70 -0.2778 1016 CB -31.6527 -25.2821 5.0616 C.3 70 ALA70 -0.0411 1017 HB1 -32.4004 -25.7850 5.6764 H 70 ALA70 0.0249 1018 HB2 -30.6676 -25.5520 5.4444 H 70 ALA70 0.0249 1019 HB3 -31.7344 -25.6838 4.0515 H 70 ALA70 0.0249 1020 N -30.5600 -22.9740 6.9630 N.am 71 GLN71 -0.2456 1021 H -29.7340 -23.1370 6.3880 H 71 GLN71 0.1312 1022 CA -30.4220 -22.4700 8.3190 C.3 71 GLN71 0.0882 1023 HA -30.9219 -23.1860 8.9744 H 71 GLN71 0.0557 1024 C -31.1200 -21.1320 8.4750 C.2 71 GLN71 0.2187 1025 O -31.8100 -20.8950 9.4720 O.2 71 GLN71 -0.2778 1026 CB -28.9323 -22.4128 8.6624 C.3 71 GLN71 -0.0210 1027 HB1 -28.8372 -22.2227 9.7313 H 71 GLN71 0.0289 1028 HB2 -28.4419 -21.5786 8.1560 H 71 GLN71 0.0289 1029 CG -28.2423 -23.7306 8.2667 C.3 71 GLN71 0.0225 1030 HG1 -27.8821 -23.6945 7.2375 H 71 GLN71 0.0356 1031 HG2 -28.9359 -24.5696 8.3327 H 71 GLN71 0.0356 1032 CD -27.0962 -24.0581 9.2099 C.2 71 GLN71 0.1981 1033 OE1 -27.3116 -24.5702 10.3021 O.2 71 GLN71 -0.2798 1034 NE2 -25.8851 -23.7405 8.7286 N.am 71 GLN71 -0.2724 1035 HE21 -25.0542 -23.9491 9.2419 H 71 GLN71 0.1266 1036 HE22 -25.7826 -23.2906 7.8402 H 71 GLN71 0.1266 1037 N -30.9480 -20.2330 7.5010 N.am 72 ASN72 -0.2452 1038 H -30.4010 -20.4740 6.6740 H 72 ASN72 0.1312 1039 CA -31.5430 -18.9090 7.6230 C.3 72 ASN72 0.0957 1040 HA -31.2797 -18.5238 8.6085 H 72 ASN72 0.0562 1041 C -33.0620 -18.9810 7.5860 C.2 72 ASN72 0.2191 1042 O -33.7380 -18.1990 8.2610 O.2 72 ASN72 -0.2778 1043 CB -30.9930 -17.9605 6.5493 C.3 72 ASN72 0.0446 1044 HB1 -31.4950 -16.9937 6.5971 H 72 ASN72 0.0375 1045 HB2 -31.1552 -18.3704 5.5523 H 72 ASN72 0.0375 1046 CG -29.4890 -17.7163 6.7494 C.2 72 ASN72 0.2000 1047 OD1 -28.8830 -18.1431 7.7240 O.2 72 ASN72 -0.2797 1048 ND2 -28.9284 -17.0054 5.7605 N.am 72 ASN72 -0.2723 1049 HD21 -27.9486 -16.8093 5.7991 H 72 ASN72 0.1266 1050 HD22 -29.4587 -16.6652 4.9858 H 72 ASN72 0.1266 1051 N -33.6280 -19.9020 6.8000 N.am 73 ARG73 -0.2456 1052 H -33.0540 -20.4740 6.1800 H 73 ARG73 0.1312 1053 CA -35.0740 -20.0810 6.8380 C.3 73 ARG73 0.0879 1054 HA -35.5312 -19.1147 6.6160 H 73 ARG73 0.0557 1055 C -35.5190 -20.4970 8.2370 C.2 73 ARG73 0.2187 1056 O -36.5390 -20.0180 8.7490 O.2 73 ARG73 -0.2778 1057 CB -35.5002 -21.1320 5.8007 C.3 73 ARG73 -0.0258 1058 HB1 -36.5489 -21.3896 5.9584 H 73 ARG73 0.0286 1059 HB2 -34.9322 -22.0512 5.9516 H 73 ARG73 0.0286 1060 CG -35.3319 -20.6447 4.3545 C.3 73 ARG73 -0.0154 1061 HG1 -34.2870 -20.4042 4.1601 H 73 ARG73 0.0299 1062 HG2 -35.8898 -19.7164 4.2250 H 73 ARG73 0.0299 1063 CD -35.8241 -21.6775 3.3331 C.3 73 ARG73 0.1045 1064 HD1 -36.8671 -21.9383 3.5324 H 73 ARG73 0.0711 1065 HD2 -35.2162 -22.5851 3.3758 H 73 ARG73 0.0711 1066 NE -35.7334 -21.1199 1.9815 N.pl3 73 ARG73 -0.4450 1067 HE -35.2922 -20.2311 1.8623 H 73 ARG73 0.3153 1068 CZ -36.2078 -21.7216 0.8919 C.cat 73 ARG73 0.5062 1069 NH1 -36.7933 -22.8888 0.9587 N.pl3 73 ARG73 -0.4573 1070 HH11 -37.1441 -23.3282 0.1343 H 73 ARG73 0.3114 1071 HH12 -36.8909 -23.3420 1.8407 H 73 ARG73 0.3114 1072 NH2 -36.0879 -21.1356 -0.2694 N.pl3 73 ARG73 -0.4573 1073 HH21 -36.4379 -21.5764 -1.0933 H 73 ARG73 0.3114 1074 HH22 -35.6476 -20.2434 -0.3403 H 73 ARG73 0.3114 1075 N -34.7630 -21.3930 8.8710 N.am 74 SER74 -0.2436 1076 H -33.9420 -21.7830 8.4080 H 74 SER74 0.1312 1077 CA -35.1030 -21.8180 10.2220 C.3 74 SER74 0.1109 1078 HA -36.1426 -22.1485 10.2103 H 74 SER74 0.0580 1079 C -34.9760 -20.6710 11.2200 C.2 74 SER74 0.2209 1080 O -35.8360 -20.5010 12.0930 O.2 74 SER74 -0.2777 1081 CB -34.1977 -22.9887 10.6266 C.3 74 SER74 0.0681 1082 HB1 -33.1543 -22.6596 10.6641 H 74 SER74 0.0577 1083 HB2 -34.2735 -23.7702 9.8625 H 74 SER74 0.0577 1084 OG -34.5967 -23.4991 11.8928 O.3 74 SER74 -0.3930 1085 HG -34.0827 -24.2631 12.1419 H 74 SER74 0.2095 1086 N -33.9210 -19.8630 11.1060 N.am 75 TYR75 -0.2453 1087 H -33.2150 -20.0410 10.3910 H 75 TYR75 0.1312 1088 CA -33.7800 -18.7220 12.0080 C.3 75 TYR75 0.0918 1089 HA -33.8588 -19.0985 13.0281 H 75 TYR75 0.0560 1090 C -34.9340 -17.7520 11.8240 C.2 75 TYR75 0.2191 1091 O -35.4310 -17.1700 12.7950 O.2 75 TYR75 -0.2778 1092 CB -32.4320 -18.0173 11.7910 C.3 75 TYR75 -0.0036 1093 HB1 -32.3221 -17.1829 12.4851 H 75 TYR75 0.0333 1094 HB2 -32.4125 -17.5947 10.7858 H 75 TYR75 0.0333 1095 CG -31.2405 -18.9308 11.9446 C.ar 75 TYR75 -0.0453 1096 CD1 -31.2374 -19.9979 12.8411 C.ar 75 TYR75 -0.0561 1097 HD1 -32.0854 -20.1880 13.4804 H 75 TYR75 0.0621 1098 CD2 -30.1144 -18.7231 11.1577 C.ar 75 TYR75 -0.0561 1099 HD2 -30.0832 -17.9005 10.4584 H 75 TYR75 0.0621 1100 CE1 -30.1578 -20.8657 12.9060 C.ar 75 TYR75 -0.0317 1101 HE1 -30.1975 -21.7019 13.5802 H 75 TYR75 0.0643 1102 CE2 -29.0331 -19.5863 11.2258 C.ar 75 TYR75 -0.0317 1103 HE2 -28.2011 -19.4030 10.5682 H 75 TYR75 0.0643 1104 CZ -29.0498 -20.6666 12.0992 C.ar 75 TYR75 0.0726 1105 OH -27.9753 -21.5370 12.1632 O.3 75 TYR75 -0.3598 1106 HH -27.3194 -21.2051 11.5570 H 75 TYR75 0.2173 1107 N -35.3720 -17.5540 10.5770 N.am 76 SER76 -0.2436 1108 H -34.9540 -18.0670 9.8000 H 76 SER76 0.1312 1109 CA -36.4470 -16.6040 10.3310 C.3 76 SER76 0.1109 1110 HA -36.1702 -15.6648 10.8132 H 76 SER76 0.0580 1111 C -37.7440 -17.0880 10.9430 C.2 76 SER76 0.2209 1112 O -38.5300 -16.2800 11.4560 O.2 76 SER76 -0.2777 1113 CB -36.6157 -16.3753 8.8226 C.3 76 SER76 0.0681 1114 HB1 -37.4987 -15.7502 8.6454 H 76 SER76 0.0577 1115 HB2 -36.7711 -17.3382 8.3234 H 76 SER76 0.0577 1116 OG -35.4625 -15.7290 8.2978 O.3 76 SER76 -0.3930 1117 HG -35.5437 -15.5812 7.3588 H 76 SER76 0.2095 1118 N -38.0170 -18.3950 10.8440 N.am 77 LYS77 -0.2456 1119 H -37.3900 -19.0140 10.3300 H 77 LYS77 0.1312 1120 CA -39.2170 -18.9240 11.4770 C.3 77 LYS77 0.0878 1121 HA -40.0608 -18.3465 11.0957 H 77 LYS77 0.0557 1122 C -39.1580 -18.7230 12.9850 C.2 77 LYS77 0.2187 1123 O -40.1370 -18.2970 13.6080 O.2 77 LYS77 -0.2778 1124 CB -39.4360 -20.4190 11.1782 C.3 77 LYS77 -0.0289 1125 HB1 -38.4675 -20.9179 11.2501 H 77 LYS77 0.0285 1126 HB2 -39.7453 -20.5384 10.1395 H 77 LYS77 0.0285 1127 CG -40.4236 -21.1709 12.1195 C.3 77 LYS77 -0.0496 1128 HG1 -40.0986 -21.1292 13.1589 H 77 LYS77 0.0266 1129 HG2 -40.3262 -22.2258 11.8577 H 77 LYS77 0.0266 1130 CD -41.9310 -20.8310 12.0088 C.3 77 LYS77 -0.0278 1131 HD1 -42.4861 -21.7261 12.2938 H 77 LYS77 0.0282 1132 HD2 -42.1820 -20.6654 10.9602 H 77 LYS77 0.0282 1133 CE -42.4933 -19.6663 12.8623 C.3 77 LYS77 0.1103 1134 HE1 -43.5772 -19.6419 12.7322 H 77 LYS77 0.0559 1135 HE2 -42.1395 -18.7078 12.4806 H 77 LYS77 0.0559 1136 NZ -42.2410 -19.7172 14.3140 N.4 77 LYS77 -0.0749 1137 HZ1 -42.7902 -18.9797 14.8067 H 77 LYS77 0.2742 1138 HZ2 -41.2309 -19.5435 14.5024 H 77 LYS77 0.2742 1139 HZ3 -42.5187 -20.6400 14.7051 H 77 LYS77 0.2742 1140 N -38.0080 -19.0140 13.5890 N.am 78 LEU78 -0.2456 1141 H -37.2260 -19.3700 13.0400 H 78 LEU78 0.1312 1142 CA -37.8550 -18.8300 15.0240 C.3 78 LEU78 0.0880 1143 HA -38.6181 -19.4283 15.5224 H 78 LEU78 0.0557 1144 C -38.0500 -17.3740 15.4100 C.2 78 LEU78 0.2187 1145 O -38.8030 -17.0630 16.3430 O.2 78 LEU78 -0.2778 1146 CB -36.4486 -19.3154 15.4210 C.3 78 LEU78 -0.0266 1147 HB1 -35.7164 -18.8684 14.7470 H 78 LEU78 0.0287 1148 HB2 -36.3876 -20.3900 15.2458 H 78 LEU78 0.0287 1149 CG -36.0241 -19.0072 16.8724 C.3 78 LEU78 -0.0449 1150 HG -35.9828 -17.9250 17.0057 H 78 LEU78 0.0296 1151 CD1 -37.0098 -19.5729 17.9052 C.3 78 LEU78 -0.0626 1152 HD11 -36.6726 -19.3667 18.9213 H 78 LEU78 0.0232 1153 HD12 -37.1109 -20.6536 17.8042 H 78 LEU78 0.0232 1154 HD13 -38.0001 -19.1304 17.8016 H 78 LEU78 0.0232 1155 CD2 -34.6134 -19.5455 17.1270 C.3 78 LEU78 -0.0626 1156 HD21 -34.2472 -19.2625 18.1127 H 78 LEU78 0.0232 1157 HD22 -33.9035 -19.1650 16.3919 H 78 LEU78 0.0232 1158 HD23 -34.6121 -20.6332 17.0694 H 78 LEU78 0.0232 1159 N -37.3310 -16.4740 14.7340 N.am 79 LEU79 -0.2456 1160 H -36.7990 -16.7700 13.9160 H 79 LEU79 0.1312 1161 CA -37.2930 -15.0740 15.1450 C.3 79 LEU79 0.0880 1162 HA -37.1796 -15.0500 16.2296 H 79 LEU79 0.0557 1163 C -38.5980 -14.3520 14.8120 C.2 79 LEU79 0.2187 1164 O -39.1010 -13.5790 15.6350 O.2 79 LEU79 -0.2778 1165 CB -36.0886 -14.4018 14.4632 C.3 79 LEU79 -0.0266 1166 HB1 -36.1093 -13.3237 14.6317 H 79 LEU79 0.0287 1167 HB2 -36.1777 -14.5404 13.3843 H 79 LEU79 0.0287 1168 CG -34.7313 -14.9590 14.9395 C.3 79 LEU79 -0.0449 1169 HG -34.7671 -16.0484 14.9277 H 79 LEU79 0.0296 1170 CD1 -33.6038 -14.5437 13.9846 C.3 79 LEU79 -0.0626 1171 HD11 -32.6416 -14.9356 14.3155 H 79 LEU79 0.0232 1172 HD12 -33.5198 -13.4597 13.9210 H 79 LEU79 0.0232 1173 HD13 -33.7834 -14.9215 12.9771 H 79 LEU79 0.0232 1174 CD2 -34.4178 -14.5266 16.3795 C.3 79 LEU79 -0.0626 1175 HD21 -33.4541 -14.9148 16.7038 H 79 LEU79 0.0232 1176 HD22 -35.1615 -14.8965 17.0840 H 79 LEU79 0.0232 1177 HD23 -34.3858 -13.4414 16.4692 H 79 LEU79 0.0232 1178 N -39.1680 -14.5860 13.6250 N.am 80 CYS80 -0.2449 1179 H -38.6880 -15.1510 12.9250 H 80 CYS80 0.1312 1180 CA -40.4890 -14.0220 13.3420 C.3 80 CYS80 0.0965 1181 HA -40.4107 -12.9447 13.5010 H 80 CYS80 0.0565 1182 C -41.5320 -14.5530 14.3170 C.2 80 CYS80 0.2192 1183 O -42.4340 -13.8200 14.7320 O.2 80 CYS80 -0.2778 1184 CB -40.8956 -14.2721 11.8865 C.3 80 CYS80 0.0147 1185 HB1 -41.8927 -13.8647 11.7200 H 80 CYS80 0.0394 1186 HB2 -40.9490 -15.3404 11.6762 H 80 CYS80 0.0394 1187 SG -39.7692 -13.4903 10.7007 S.3 80 CYS80 -0.1762 1188 HG -40.4137 -13.2443 9.5556 H 80 CYS80 0.1017 1189 N -41.4330 -15.8280 14.6960 N.am 81 GLY81 -0.2484 1190 H -40.7030 -16.4240 14.3060 H 81 GLY81 0.1309 1191 CA -42.3730 -16.3630 15.6690 C.3 81 GLY81 0.0765 1192 HA1 -42.1147 -17.4040 15.8492 H 81 GLY81 0.0521 1193 HA2 -43.3838 -16.2988 15.2643 H 81 GLY81 0.0521 1194 C -42.2990 -15.6160 16.9840 C.2 81 GLY81 0.2155 1195 O -43.3210 -15.2560 17.5730 O.2 81 GLY81 -0.2781 1196 N -41.0790 -15.3870 17.4700 N.am 82 LEU82 -0.2459 1197 H -40.2620 -15.7340 16.9680 H 82 LEU82 0.1312 1198 CA -40.9000 -14.6440 18.7140 C.3 82 LEU82 0.0880 1199 HA -41.5065 -15.1357 19.4762 H 82 LEU82 0.0557 1200 C -41.3860 -13.2060 18.5880 C.2 82 LEU82 0.2187 1201 O -42.0270 -12.6780 19.5020 O.2 82 LEU82 -0.2778 1202 CB -39.4087 -14.6558 19.1091 C.3 82 LEU82 -0.0266 1203 HB1 -39.2443 -13.9918 19.9598 H 82 LEU82 0.0287 1204 HB2 -38.8263 -14.2395 18.2857 H 82 LEU82 0.0287 1205 CG -38.8503 -16.0477 19.4659 C.3 82 LEU82 -0.0449 1206 HG -39.1030 -16.7464 18.6717 H 82 LEU82 0.0296 1207 CD1 -37.3203 -16.0133 19.5760 C.3 82 LEU82 -0.0626 1208 HD11 -36.9183 -17.0067 19.7774 H 82 LEU82 0.0232 1209 HD12 -37.0026 -15.3558 20.3856 H 82 LEU82 0.0232 1210 HD13 -36.8669 -15.6557 18.6516 H 82 LEU82 0.0232 1211 CD2 -39.4633 -16.5912 20.7601 C.3 82 LEU82 -0.0626 1212 HD21 -39.0115 -17.5428 21.0415 H 82 LEU82 0.0232 1213 HD22 -40.5317 -16.7628 20.6394 H 82 LEU82 0.0232 1214 HD23 -39.3199 -15.8974 21.5898 H 82 LEU82 0.0232 1215 N -41.0810 -12.5400 17.4750 N.am 83 LEU83 -0.2456 1216 H -40.5290 -12.9870 16.7430 H 83 LEU83 0.1312 1217 CA -41.5440 -11.1620 17.3120 C.3 83 LEU83 0.0880 1218 HA -41.2374 -10.6003 18.1949 H 83 LEU83 0.0557 1219 C -43.0700 -11.0850 17.2230 C.2 83 LEU83 0.2187 1220 O -43.6850 -10.1320 17.7300 O.2 83 LEU83 -0.2778 1221 CB -40.8937 -10.5896 16.0405 C.3 83 LEU83 -0.0266 1222 HB1 -41.3310 -9.6251 15.7858 H 83 LEU83 0.0287 1223 HB2 -41.1312 -11.2504 15.2049 H 83 LEU83 0.0287 1224 CG -39.3633 -10.4388 16.1480 C.3 83 LEU83 -0.0449 1225 HG -38.9415 -11.3665 16.5308 H 83 LEU83 0.0296 1226 CD1 -38.7424 -10.1961 14.7678 C.3 83 LEU83 -0.0626 1227 HD11 -37.6591 -10.0934 14.8345 H 83 LEU83 0.0232 1228 HD12 -39.1387 -9.2900 14.3077 H 83 LEU83 0.0232 1229 HD13 -38.9526 -11.0330 14.1021 H 83 LEU83 0.0232 1230 CD2 -38.9557 -9.3308 17.1246 C.3 83 LEU83 -0.0626 1231 HD21 -37.8717 -9.2978 17.2302 H 83 LEU83 0.0232 1232 HD22 -39.3635 -9.5015 18.1192 H 83 LEU83 0.0232 1233 HD23 -39.2953 -8.3539 16.7793 H 83 LEU83 0.0232 1234 N -43.6970 -12.0810 16.5960 N.am 84 ALA84 -0.2459 1235 H -43.1510 -12.8230 16.1580 H 84 ALA84 0.1312 1236 CA -45.1510 -12.1230 16.5290 C.3 84 ALA84 0.0850 1237 HA -45.4945 -11.1440 16.1996 H 84 ALA84 0.0554 1238 C -45.7530 -12.3880 17.9060 C.2 84 ALA84 0.2184 1239 O -46.6680 -11.6820 18.3390 O.2 84 ALA84 -0.2778 1240 CB -45.5631 -13.1996 15.5191 C.3 84 ALA84 -0.0411 1241 HB1 -46.6466 -13.2554 15.4142 H 84 ALA84 0.0249 1242 HB2 -45.1971 -14.1841 15.8146 H 84 ALA84 0.0249 1243 HB3 -45.1489 -12.9773 14.5349 H 84 ALA84 0.0249 1244 N -45.2490 -13.4030 18.6100 N.am 85 GLU85 -0.2456 1245 H -44.4310 -13.9010 18.2590 H 85 GLU85 0.1312 1246 CA -45.8540 -13.8130 19.8790 C.3 85 GLU85 0.0883 1247 HA -46.9307 -13.8994 19.7510 H 85 GLU85 0.0557 1248 C -45.5510 -12.8220 20.9970 C.2 85 GLU85 0.2187 1249 O -46.4100 -12.5570 21.8490 O.2 85 GLU85 -0.2778 1250 CB -45.2365 -15.2009 20.1485 C.3 85 GLU85 -0.0193 1251 HB1 -45.5044 -15.5580 21.1433 H 85 GLU85 0.0290 1252 HB2 -44.1538 -15.0687 20.1357 H 85 GLU85 0.0290 1253 CG -45.6095 -16.2876 19.1014 C.3 85 GLU85 0.0356 1254 HG1 -45.7217 -15.8565 18.1076 H 85 GLU85 0.0374 1255 HG2 -46.5678 -16.7405 19.3495 H 85 GLU85 0.0374 1256 CD -44.5598 -17.4205 18.9864 C.2 85 GLU85 0.1760 1257 OE1 -43.9394 -17.7544 19.9945 O.co2 85 GLU85 -0.6478 1258 OE2 -44.3691 -17.9524 17.8857 O.co2 85 GLU85 -0.6478 1259 N -44.3220 -12.2900 21.0350 N.am 86 ARG86 -0.2457 1260 H -43.6700 -12.4890 20.2760 H 86 ARG86 0.1312 1261 CA -43.8930 -11.4320 22.1370 C.3 86 ARG86 0.0879 1262 HA -44.4300 -11.7372 23.0369 H 86 ARG86 0.0557 1263 C -44.1980 -9.9630 21.8890 C.2 86 ARG86 0.2187 1264 O -44.5660 -9.2500 22.8260 O.2 86 ARG86 -0.2778 1265 CB -42.3791 -11.6268 22.3736 C.3 86 ARG86 -0.0258 1266 HB1 -42.0765 -11.0824 23.2684 H 86 ARG86 0.0286 1267 HB2 -41.8255 -11.1670 21.5534 H 86 ARG86 0.0286 1268 CG -41.9071 -13.0928 22.4903 C.3 86 ARG86 -0.0154 1269 HG1 -40.8196 -13.0967 22.5760 H 86 ARG86 0.0299 1270 HG2 -42.1245 -13.6476 21.5819 H 86 ARG86 0.0299 1271 CD -42.4792 -13.8823 23.6717 C.3 86 ARG86 0.1045 1272 HD1 -43.5607 -14.0158 23.6126 H 86 ARG86 0.0711 1273 HD2 -42.2431 -13.3894 24.6168 H 86 ARG86 0.0711 1274 NE -41.8343 -15.1890 23.7186 N.pl3 86 ARG86 -0.4450 1275 HE -41.0443 -15.3483 24.3313 H 86 ARG86 0.3153 1276 CZ -42.1140 -16.2537 22.9828 C.cat 86 ARG86 0.5062 1277 NH1 -41.4346 -17.3430 23.1605 N.pl3 86 ARG86 -0.4573 1278 HH11 -41.6285 -18.1632 22.6356 H 86 ARG86 0.3114 1279 HH12 -40.7015 -17.3060 23.8494 H 86 ARG86 0.3114 1280 NH2 -43.0476 -16.2281 22.0815 N.pl3 86 ARG86 -0.4573 1281 HH21 -43.2394 -17.0222 21.4905 H 86 ARG86 0.3114 1282 HH22 -43.5759 -15.4007 21.9637 H 86 ARG86 0.3114 1283 N -44.0350 -9.4890 20.6570 N.am 87 LEU87 -0.2456 1284 H -43.8020 -10.1370 19.9050 H 87 LEU87 0.1312 1285 CA -44.1800 -8.0670 20.3490 C.3 87 LEU87 0.0880 1286 HA -44.3418 -7.5115 21.2739 H 87 LEU87 0.0557 1287 C -45.3890 -7.7650 19.4700 C.2 87 LEU87 0.2187 1288 O -45.6390 -6.5930 19.1670 O.2 87 LEU87 -0.2778 1289 CB -42.8979 -7.5383 19.6805 C.3 87 LEU87 -0.0266 1290 HB1 -43.0179 -6.4744 19.4700 H 87 LEU87 0.0287 1291 HB2 -42.7702 -8.0264 18.7147 H 87 LEU87 0.0287 1292 CG -41.6045 -7.7306 20.4947 C.3 87 LEU87 -0.0449 1293 HG -41.4165 -8.8003 20.5990 H 87 LEU87 0.0296 1294 CD1 -40.4180 -7.1202 19.7378 C.3 87 LEU87 -0.0626 1295 HD11 -39.4772 -7.3160 20.2515 H 87 LEU87 0.0232 1296 HD12 -40.5273 -6.0392 19.6431 H 87 LEU87 0.0232 1297 HD13 -40.3421 -7.5306 18.7325 H 87 LEU87 0.0232 1298 CD2 -41.6929 -7.1243 21.9025 C.3 87 LEU87 -0.0626 1299 HD21 -40.7464 -7.2397 22.4317 H 87 LEU87 0.0232 1300 HD22 -42.4581 -7.6112 22.5058 H 87 LEU87 0.0232 1301 HD23 -41.9250 -6.0595 21.8633 H 87 LEU87 0.0232 1302 N -46.1380 -8.7830 19.0500 N.am 88 ARG88 -0.2457 1303 H -45.8610 -9.7310 19.3040 H 88 ARG88 0.1312 1304 CA -47.3430 -8.5970 18.2380 C.3 88 ARG88 0.0879 1305 HA -47.7019 -9.5920 17.9993 H 88 ARG88 0.0557 1306 C -47.0360 -7.9530 16.8830 C.2 88 ARG88 0.2187 1307 O -47.8140 -7.1480 16.3720 O.2 88 ARG88 -0.2778 1308 CB -48.4249 -7.8305 19.0293 C.3 88 ARG88 -0.0258 1309 HB1 -49.3459 -7.7742 18.4476 H 88 ARG88 0.0286 1310 HB2 -48.1014 -6.7962 19.1537 H 88 ARG88 0.0286 1311 CG -48.7306 -8.4079 20.4283 C.3 88 ARG88 -0.0154 1312 HG1 -49.2027 -7.6181 21.0140 H 88 ARG88 0.0299 1313 HG2 -47.8155 -8.6506 20.9691 H 88 ARG88 0.0299 1314 CD -49.6854 -9.6114 20.4326 C.3 88 ARG88 0.1045 1315 HD1 -50.6089 -9.3547 19.9074 H 88 ARG88 0.0711 1316 HD2 -49.9348 -9.8906 21.4596 H 88 ARG88 0.0711 1317 NE -49.0813 -10.7812 19.7915 N.pl3 88 ARG88 -0.4450 1318 HE -48.1014 -10.7865 19.5808 H 88 ARG88 0.3153 1319 CZ -49.7577 -11.8759 19.4551 C.cat 88 ARG88 0.5062 1320 NH1 -51.0215 -12.0140 19.7560 N.pl3 88 ARG88 -0.4573 1321 HH11 -51.5147 -12.8384 19.4897 H 88 ARG88 0.3114 1322 HH12 -51.4859 -11.2883 20.2554 H 88 ARG88 0.3114 1323 NH2 -49.1506 -12.8321 18.8102 N.pl3 88 ARG88 -0.4573 1324 HH21 -49.6270 -13.6704 18.5580 H 88 ARG88 0.3114 1325 HH22 -48.1879 -12.7111 18.5663 H 88 ARG88 0.3114 1326 N -45.9020 -8.3250 16.2900 N.am 89 ILE89 -0.2454 1327 H -45.2850 -8.9700 16.7830 H 89 ILE89 0.1312 1328 CA -45.5010 -7.8520 14.9660 C.3 89 ILE89 0.0903 1329 HA -46.0610 -6.9477 14.7200 H 89 ILE89 0.0560 1330 C -45.8050 -8.9430 13.9460 C.2 89 ILE89 0.2190 1331 O -45.3700 -10.0900 14.1070 O.2 89 ILE89 -0.2778 1332 CB -43.9860 -7.5484 14.9921 C.3 89 ILE89 -0.0201 1333 HB -43.4618 -8.4920 15.1566 H 89 ILE89 0.0318 1334 CG1 -43.6072 -6.6105 16.1567 C.3 89 ILE89 -0.0514 1335 HG11 -44.0722 -6.9348 17.0842 H 89 ILE89 0.0266 1336 HG12 -43.9830 -5.6035 15.9707 H 89 ILE89 0.0266 1337 CG2 -43.5091 -6.9665 13.6502 C.3 89 ILE89 -0.0605 1338 HG21 -42.4433 -6.7397 13.6624 H 89 ILE89 0.0233 1339 HG22 -44.0449 -6.0461 13.4232 H 89 ILE89 0.0233 1340 HG23 -43.6784 -7.6583 12.8252 H 89 ILE89 0.0233 1341 CD1 -42.1020 -6.5738 16.4181 C.3 89 ILE89 -0.0650 1342 HD11 -41.8945 -6.1337 17.3905 H 89 ILE89 0.0230 1343 HD12 -41.5922 -5.9950 15.6521 H 89 ILE89 0.0230 1344 HD13 -41.6751 -7.5744 16.4329 H 89 ILE89 0.0230 1345 N -46.5240 -8.5880 12.8860 N.am 90 SER90 -0.2436 1346 H -46.8800 -7.6350 12.8120 H 90 SER90 0.1312 1347 CA -46.8070 -9.5470 11.8330 C.3 90 SER90 0.1111 1348 HA -47.2808 -10.3733 12.3550 H 90 SER90 0.0580 1349 C -45.5020 -9.9880 11.1670 C.2 90 SER90 0.2236 1350 O -44.6590 -9.1440 10.8380 O.2 90 SER90 -0.2775 1351 CB -47.8409 -8.9982 10.8422 C.3 90 SER90 0.0681 1352 HB1 -47.3673 -8.5158 9.9802 H 90 SER90 0.0577 1353 HB2 -48.4356 -8.2220 11.3246 H 90 SER90 0.0577 1354 OG -48.7494 -10.0365 10.4908 O.3 90 SER90 -0.3930 1355 HG -48.6589 -10.2723 9.5628 H 90 SER90 0.2095 1356 N -45.3230 -11.2880 10.9060 N.am 91 PRO91 -0.2315 1357 CA -44.0940 -11.7290 10.2250 C.3 91 PRO91 0.0907 1358 HA -43.2604 -11.5329 10.9005 H 91 PRO91 0.0559 1359 C -43.8420 -11.0760 8.8810 C.2 91 PRO91 0.2189 1360 O -42.6760 -10.9530 8.4810 O.2 91 PRO91 -0.2778 1361 CB -44.3412 -13.2339 10.0301 C.3 91 PRO91 -0.0276 1362 HB1 -43.4265 -13.8217 10.0880 H 91 PRO91 0.0285 1363 HB2 -44.7888 -13.4324 9.0539 H 91 PRO91 0.0285 1364 CG -45.3640 -13.6150 11.0954 C.3 91 PRO91 -0.0379 1365 HG1 -44.8461 -13.8243 12.0323 H 91 PRO91 0.0278 1366 HG2 -45.9452 -14.4975 10.8283 H 91 PRO91 0.0278 1367 CD -46.2333 -12.3700 11.2655 C.3 91 PRO91 0.0071 1368 HD1 -47.0740 -12.3348 10.5699 H 91 PRO91 0.0431 1369 HD2 -46.5672 -12.2730 12.2979 H 91 PRO91 0.0431 1370 N -44.8870 -10.6720 8.1570 N.am 92 ASP92 -0.2451 1371 H -45.8340 -10.8110 8.5110 H 92 ASP92 0.1312 1372 CA -44.6830 -10.0330 6.8630 C.3 92 ASP92 0.0974 1373 HA -43.9293 -10.5866 6.3028 H 92 ASP92 0.0563 1374 C -44.2580 -8.5770 6.9860 C.2 92 ASP92 0.2192 1375 O -44.0650 -7.9190 5.9580 O.2 92 ASP92 -0.2778 1376 CB -46.0464 -10.0651 6.1362 C.3 92 ASP92 0.0576 1377 HB1 -46.3232 -11.0952 5.9160 H 92 ASP92 0.0394 1378 HB2 -46.0053 -9.5428 5.1804 H 92 ASP92 0.0394 1379 CG -47.1760 -9.4506 6.9969 C.2 92 ASP92 0.1780 1380 OD1 -47.7257 -10.1582 7.8368 O.co2 92 ASP92 -0.6478 1381 OD2 -47.4928 -8.2755 6.8271 O.co2 92 ASP92 -0.6478 1382 N -44.0540 -8.0870 8.2080 N.am 93 ARG93 -0.2456 1383 H -44.2960 -8.6710 9.0090 H 93 ARG93 0.1312 1384 CA -43.5030 -6.7600 8.4610 C.3 93 ARG93 0.0879 1385 HA -43.2868 -6.2875 7.5075 H 93 ARG93 0.0557 1386 C -42.1990 -6.8500 9.2480 C.2 93 ARG93 0.2187 1387 O -41.8290 -5.9210 9.9740 O.2 93 ARG93 -0.2778 1388 CB -44.6192 -5.9632 9.1729 C.3 93 ARG93 -0.0258 1389 HB1 -44.4160 -4.8940 9.1105 H 93 ARG93 0.0286 1390 HB2 -44.6468 -6.2183 10.2337 H 93 ARG93 0.0286 1391 CG -45.9915 -6.3008 8.5485 C.3 93 ARG93 -0.0154 1392 HG1 -46.2110 -7.3458 8.7405 H 93 ARG93 0.0299 1393 HG2 -45.9515 -6.2006 7.4625 H 93 ARG93 0.0299 1394 CD -47.2080 -5.5628 9.0821 C.3 93 ARG93 0.1045 1395 HD1 -47.1107 -5.3046 10.1391 H 93 ARG93 0.0711 1396 HD2 -48.0785 -6.2134 8.9501 H 93 ARG93 0.0711 1397 NE -47.4100 -4.3477 8.3039 N.pl3 93 ARG93 -0.4450 1398 HE -46.6436 -3.9599 7.8037 H 93 ARG93 0.3153 1399 CZ -48.5824 -3.7357 8.2268 C.cat 93 ARG93 0.5062 1400 NH1 -49.6431 -4.2082 8.8115 N.pl3 93 ARG93 -0.4573 1401 HH11 -50.4776 -3.6371 8.8403 H 93 ARG93 0.3114 1402 HH12 -49.6466 -5.1062 9.2333 H 93 ARG93 0.3114 1403 NH2 -48.6807 -2.6303 7.5551 N.pl3 93 ARG93 -0.4573 1404 HH21 -49.5790 -2.1756 7.5877 H 93 ARG93 0.3114 1405 HH22 -47.9236 -2.2455 7.0467 H 93 ARG93 0.3114 1406 N -41.4800 -7.9580 9.0590 N.am 94 VAL94 -0.2454 1407 H -41.8730 -8.6960 8.4740 H 94 VAL94 0.1312 1408 CA -40.1620 -8.1680 9.6450 C.3 94 VAL94 0.0901 1409 HA -39.8676 -7.2673 10.1765 H 94 VAL94 0.0560 1410 C -39.1720 -8.4360 8.5260 C.2 94 VAL94 0.2189 1411 O -39.4110 -9.2960 7.6750 O.2 94 VAL94 -0.2778 1412 CB -40.2081 -9.3606 10.6281 C.3 94 VAL94 -0.0227 1413 HB -40.5156 -10.2476 10.0711 H 94 VAL94 0.0315 1414 CG1 -38.8307 -9.6533 11.2497 C.3 94 VAL94 -0.0608 1415 HG11 -38.8824 -10.5150 11.9135 H 94 VAL94 0.0233 1416 HG12 -38.4690 -8.8017 11.8270 H 94 VAL94 0.0233 1417 HG13 -38.0821 -9.8849 10.4924 H 94 VAL94 0.0233 1418 CG2 -41.2456 -9.1418 11.7402 C.3 94 VAL94 -0.0608 1419 HG21 -41.2514 -9.9744 12.4442 H 94 VAL94 0.0233 1420 HG22 -42.2519 -9.0572 11.3342 H 94 VAL94 0.0233 1421 HG23 -41.0375 -8.2314 12.3011 H 94 VAL94 0.0233 1422 N -38.0290 -7.7500 8.5680 N.am 95 TYR95 -0.2453 1423 H -37.9590 -6.9580 9.2070 H 95 TYR95 0.1312 1424 CA -36.8740 -8.0820 7.7410 C.3 95 TYR95 0.0917 1425 HA -37.0919 -8.9704 7.1480 H 95 TYR95 0.0560 1426 C -35.6900 -8.4180 8.6390 C.2 95 TYR95 0.2190 1427 O -35.4790 -7.7600 9.6640 O.2 95 TYR95 -0.2778 1428 CB -36.4565 -6.8833 6.8633 C.3 95 TYR95 -0.0036 1429 HB1 -35.4792 -7.0725 6.4160 H 95 TYR95 0.0333 1430 HB2 -36.3330 -6.0034 7.4965 H 95 TYR95 0.0333 1431 CG -37.3817 -6.5404 5.7209 C.ar 95 TYR95 -0.0453 1432 CD1 -38.0429 -7.5217 4.9826 C.ar 95 TYR95 -0.0561 1433 HD1 -37.9716 -8.5648 5.2486 H 95 TYR95 0.0621 1434 CD2 -37.4895 -5.2134 5.3108 C.ar 95 TYR95 -0.0561 1435 HD2 -36.9687 -4.4365 5.8506 H 95 TYR95 0.0621 1436 CE1 -38.7963 -7.1807 3.8664 C.ar 95 TYR95 -0.0317 1437 HE1 -39.3084 -7.9451 3.3012 H 95 TYR95 0.0643 1438 CE2 -38.2406 -4.8710 4.1941 C.ar 95 TYR95 -0.0317 1439 HE2 -38.3143 -3.8391 3.8866 H 95 TYR95 0.0643 1440 CZ -38.8914 -5.8565 3.4681 C.ar 95 TYR95 0.0726 1441 OH -39.6354 -5.5227 2.3555 O.3 95 TYR95 -0.3598 1442 HH -39.6272 -4.5830 2.2386 H 95 TYR95 0.2173 1443 N -34.9150 -9.4230 8.2280 N.am 96 ILE96 -0.2454 1444 H -35.1830 -9.9290 7.3840 H 96 ILE96 0.1312 1445 CA -33.7000 -9.8330 8.9300 C.3 96 ILE96 0.0903 1446 HA -33.4539 -9.0659 9.6630 H 96 ILE96 0.0560 1447 C -32.5670 -9.9200 7.9140 C.2 96 ILE96 0.2189 1448 O -32.6320 -10.7250 6.9860 O.2 96 ILE96 -0.2778 1449 CB -33.8915 -11.1951 9.6475 C.3 96 ILE96 -0.0201 1450 HB -33.9291 -11.9764 8.8870 H 96 ILE96 0.0318 1451 CG1 -35.2248 -11.2883 10.4245 C.3 96 ILE96 -0.0514 1452 HG11 -36.0593 -11.0902 9.7521 H 96 ILE96 0.0266 1453 HG12 -35.2726 -10.5217 11.1958 H 96 ILE96 0.0266 1454 CG2 -32.6866 -11.4853 10.5654 C.3 96 ILE96 -0.0605 1455 HG21 -32.7550 -12.4708 11.0243 H 96 ILE96 0.0233 1456 HG22 -32.6154 -10.7497 11.3672 H 96 ILE96 0.0233 1457 HG23 -31.7465 -11.4624 10.0133 H 96 ILE96 0.0233 1458 CD1 -35.4743 -12.6653 11.0559 C.3 96 ILE96 -0.0650 1459 HD11 -36.4727 -12.7166 11.4912 H 96 ILE96 0.0230 1460 HD12 -34.7633 -12.8790 11.8528 H 96 ILE96 0.0230 1461 HD13 -35.3951 -13.4579 10.3114 H 96 ILE96 0.0230 1462 N -31.5180 -9.1260 8.0940 N.am 97 ASN97 -0.2452 1463 H -31.5620 -8.3870 8.7960 H 97 ASN97 0.1312 1464 CA -30.3000 -9.2930 7.3020 C.3 97 ASN97 0.0957 1465 HA -30.5663 -9.6675 6.3105 H 97 ASN97 0.0562 1466 C -29.3780 -10.2830 7.9950 C.2 97 ASN97 0.2191 1467 O -29.0350 -10.0910 9.1620 O.2 97 ASN97 -0.2778 1468 CB -29.6051 -7.9307 7.1762 C.3 97 ASN97 0.0446 1469 HB1 -28.7149 -8.0130 6.5534 H 97 ASN97 0.0375 1470 HB2 -29.2966 -7.5576 8.1528 H 97 ASN97 0.0375 1471 CG -30.5369 -6.8990 6.5294 C.2 97 ASN97 0.2000 1472 OD1 -30.6688 -6.8294 5.3168 O.2 97 ASN97 -0.2797 1473 ND2 -31.1714 -6.1033 7.4058 N.am 97 ASN97 -0.2723 1474 HD21 -31.7766 -5.3904 7.0532 H 97 ASN97 0.1266 1475 HD22 -31.0603 -6.2067 8.3938 H 97 ASN97 0.1266 1476 N -28.9950 -11.3410 7.2780 N.am 98 TYR98 -0.2453 1477 H -29.3820 -11.4570 6.3410 H 98 TYR98 0.1312 1478 CA -28.0500 -12.3420 7.7660 C.3 98 TYR98 0.0917 1479 HA -27.9995 -12.2767 8.8541 H 98 TYR98 0.0560 1480 C -26.6680 -12.0620 7.1940 C.2 98 TYR98 0.2190 1481 O -26.5330 -11.8000 5.9920 O.2 98 TYR98 -0.2778 1482 CB -28.5267 -13.7449 7.3534 C.3 98 TYR98 -0.0036 1483 HB1 -27.7548 -14.4837 7.5745 H 98 TYR98 0.0333 1484 HB2 -28.6954 -13.7909 6.2767 H 98 TYR98 0.0333 1485 CG -29.7841 -14.1480 8.0805 C.ar 98 TYR98 -0.0453 1486 CD1 -29.7005 -14.7542 9.3296 C.ar 98 TYR98 -0.0561 1487 HD1 -28.7332 -14.9360 9.7744 H 98 TYR98 0.0621 1488 CD2 -31.0416 -13.9180 7.5274 C.ar 98 TYR98 -0.0561 1489 HD2 -31.1294 -13.4355 6.5648 H 98 TYR98 0.0621 1490 CE1 -30.8506 -15.1132 10.0196 C.ar 98 TYR98 -0.0317 1491 HE1 -30.7850 -15.5713 10.9942 H 98 TYR98 0.0643 1492 CE2 -32.1931 -14.2921 8.2109 C.ar 98 TYR98 -0.0317 1493 HE2 -33.1654 -14.1033 7.7816 H 98 TYR98 0.0643 1494 CZ -32.0968 -14.8899 9.4589 C.ar 98 TYR98 0.0726 1495 OH -33.2309 -15.2554 10.1536 O.3 98 TYR98 -0.3598 1496 HH -33.9834 -15.2260 9.5746 H 98 TYR98 0.2173 1497 N -25.6490 -12.1300 8.0490 N.am 99 TYR99 -0.2453 1498 H -25.8470 -12.3500 9.0250 H 99 TYR99 0.1312 1499 CA -24.2600 -11.9040 7.6520 C.3 99 TYR99 0.0917 1500 HA -24.1981 -11.8323 6.5643 H 99 TYR99 0.0560 1501 C -23.4080 -13.0740 8.1190 C.2 99 TYR99 0.2190 1502 O -23.3070 -13.3220 9.3250 O.2 99 TYR99 -0.2778 1503 CB -23.7442 -10.6132 8.3091 C.3 99 TYR99 -0.0036 1504 HB1 -22.7089 -10.4303 8.0171 H 99 TYR99 0.0333 1505 HB2 -23.7412 -10.7123 9.3949 H 99 TYR99 0.0333 1506 CG -24.5742 -9.4129 7.9409 C.ar 99 TYR99 -0.0453 1507 CD1 -24.3032 -8.6971 6.7789 C.ar 99 TYR99 -0.0561 1508 HD1 -23.5016 -9.0112 6.1262 H 99 TYR99 0.0621 1509 CD2 -25.6213 -9.0006 8.7607 C.ar 99 TYR99 -0.0561 1510 HD2 -25.8582 -9.5560 9.6575 H 99 TYR99 0.0621 1511 CE1 -25.0578 -7.5785 6.4484 C.ar 99 TYR99 -0.0317 1512 HE1 -24.8474 -7.0257 5.5449 H 99 TYR99 0.0643 1513 CE2 -26.3645 -7.8744 8.4389 C.ar 99 TYR99 -0.0317 1514 HE2 -27.1691 -7.5559 9.0807 H 99 TYR99 0.0643 1515 CZ -26.0830 -7.1620 7.2837 C.ar 99 TYR99 0.0726 1516 OH -26.8319 -6.0507 6.9567 O.3 99 TYR99 -0.3598 1517 HH -27.4060 -5.8231 7.6746 H 99 TYR99 0.2173 1518 N -22.7490 -13.7350 7.1720 N.am 100 ASP100 -0.2451 1519 H -22.9480 -13.5140 6.1970 H 100 ASP100 0.1312 1520 CA -21.7530 -14.7640 7.4640 C.3 100 ASP100 0.0974 1521 HA -21.9813 -15.1482 8.4599 H 100 ASP100 0.0563 1522 C -20.4160 -14.0350 7.5270 C.2 100 ASP100 0.2192 1523 O -19.8440 -13.6600 6.4990 O.2 100 ASP100 -0.2778 1524 CB -21.7164 -15.9653 6.5033 C.3 100 ASP100 0.0576 1525 HB1 -21.1755 -15.7424 5.5848 H 100 ASP100 0.0394 1526 HB2 -22.7266 -16.2483 6.2164 H 100 ASP100 0.0394 1527 CG -21.0407 -17.1701 7.2085 C.2 100 ASP100 0.1780 1528 OD1 -19.9269 -17.0228 7.7061 O.co2 100 ASP100 -0.6478 1529 OD2 -21.6322 -18.2454 7.2673 O.co2 100 ASP100 -0.6478 1530 N -19.9410 -13.7820 8.7330 N.am 101 MET101 -0.2456 1531 H -20.4260 -14.1550 9.5490 H 101 MET101 0.1312 1532 CA -18.7420 -12.9830 8.9230 C.3 101 MET101 0.0885 1533 HA -18.6796 -12.2364 8.1288 H 101 MET101 0.0557 1534 C -17.4930 -13.8480 8.9190 C.2 101 MET101 0.2187 1535 O -17.4690 -14.9420 9.4890 O.2 101 MET101 -0.2778 1536 CB -18.8451 -12.3072 10.3010 C.3 101 MET101 -0.0199 1537 HB1 -17.9004 -11.8248 10.5515 H 101 MET101 0.0293 1538 HB2 -19.0035 -13.0722 11.0633 H 101 MET101 0.0293 1539 CG -19.9722 -11.2711 10.3939 C.3 101 MET101 -0.0047 1540 HG1 -20.0660 -10.9391 11.4277 H 101 MET101 0.0377 1541 HG2 -20.9390 -11.6982 10.1232 H 101 MET101 0.0377 1542 SD -19.6444 -9.8266 9.3638 S.3 101 MET101 -0.1641 1543 CE -18.3308 -9.0657 10.3398 C.3 101 MET101 -0.0181 1544 HE1 -18.1788 -8.0319 10.0300 H 101 MET101 0.0340 1545 HE2 -17.3977 -9.6182 10.2303 H 101 MET101 0.0340 1546 HE3 -18.5994 -9.0605 11.3960 H 101 MET101 0.0340 1547 N -16.4540 -13.3470 8.2660 N.am 102 ASN102 -0.2452 1548 H -16.5790 -12.5330 7.6640 H 102 ASN102 0.1312 1549 CA -15.1410 -13.9480 8.4020 C.3 102 ASN102 0.0957 1550 HA -15.2724 -15.0240 8.2592 H 102 ASN102 0.0562 1551 C -14.6160 -13.6860 9.8100 C.2 102 ASN102 0.2191 1552 O -14.7720 -12.5860 10.3480 O.2 102 ASN102 -0.2778 1553 CB -14.2013 -13.3774 7.3320 C.3 102 ASN102 0.0446 1554 HB1 -13.9579 -12.3358 7.5377 H 102 ASN102 0.0375 1555 HB2 -14.6781 -13.4104 6.3523 H 102 ASN102 0.0375 1556 CG -12.8989 -14.1820 7.2630 C.2 102 ASN102 0.2000 1557 OD1 -11.8747 -13.7905 7.8008 O.2 102 ASN102 -0.2797 1558 ND2 -13.0021 -15.3273 6.5730 N.am 102 ASN102 -0.2723 1559 HD21 -12.1970 -15.9125 6.4824 H 102 ASN102 0.1266 1560 HD22 -13.8623 -15.6117 6.1499 H 102 ASN102 0.1266 1561 N -13.9770 -14.6980 10.4090 N.am 103 ALA103 -0.2459 1562 H -13.8410 -15.5770 9.9100 H 103 ALA103 0.1312 1563 CA -13.4730 -14.5520 11.7740 C.3 103 ALA103 0.0850 1564 HA -14.3349 -14.3388 12.4058 H 103 ALA103 0.0554 1565 C -12.5000 -13.3870 11.9030 C.2 103 ALA103 0.2184 1566 O -12.4330 -12.7480 12.9580 O.2 103 ALA103 -0.2778 1567 CB -12.8040 -15.8603 12.2085 C.3 103 ALA103 -0.0411 1568 HB1 -12.4928 -15.8180 13.2519 H 103 ALA103 0.0249 1569 HB2 -11.9207 -16.0775 11.6064 H 103 ALA103 0.0249 1570 HB3 -13.4900 -16.7004 12.1058 H 103 ALA103 0.0249 1571 N -11.7440 -13.0990 10.8410 N.am 104 ALA104 -0.2459 1572 H -11.8290 -13.6710 10.0010 H 104 ALA104 0.1312 1573 CA -10.8000 -11.9870 10.8510 C.3 104 ALA104 0.0850 1574 HA -10.2034 -12.0806 11.7598 H 104 ALA104 0.0554 1575 C -11.4900 -10.6330 10.8900 C.2 104 ALA104 0.2184 1576 O -10.8390 -9.6280 11.2010 O.2 104 ALA104 -0.2778 1577 CB -9.8892 -12.0839 9.6232 C.3 104 ALA104 -0.0411 1578 HB1 -9.0979 -11.3345 9.6605 H 104 ALA104 0.0249 1579 HB2 -10.4470 -11.9325 8.6990 H 104 ALA104 0.0249 1580 HB3 -9.4130 -13.0632 9.5706 H 104 ALA104 0.0249 1581 N -12.7880 -10.5860 10.5860 N.am 105 ASN105 -0.2452 1582 H -13.2640 -11.4590 10.3590 H 105 ASN105 0.1312 1583 CA -13.5590 -9.3520 10.5620 C.3 105 ASN105 0.0957 1584 HA -12.8759 -8.5003 10.5573 H 105 ASN105 0.0562 1585 C -14.4760 -9.2120 11.7690 C.2 105 ASN105 0.2191 1586 O -15.3910 -8.3800 11.7550 O.2 105 ASN105 -0.2778 1587 CB -14.4328 -9.3393 9.2933 C.3 105 ASN105 0.0446 1588 HB1 -15.0364 -8.4325 9.2450 H 105 ASN105 0.0375 1589 HB2 -15.1209 -10.1857 9.2979 H 105 ASN105 0.0375 1590 CG -13.6006 -9.4020 8.0057 C.2 105 ASN105 0.2000 1591 OD1 -12.3941 -9.2066 7.9962 O.2 105 ASN105 -0.2797 1592 ND2 -14.3268 -9.6870 6.9144 N.am 105 ASN105 -0.2723 1593 HD21 -13.8616 -9.7449 6.0316 H 105 ASN105 0.1266 1594 HD22 -15.3133 -9.8377 6.9612 H 105 ASN105 0.1266 1595 N -14.2290 -9.9800 12.8280 N.am 106 VAL106 -0.2454 1596 H -13.4850 -10.6750 12.7690 H 106 VAL106 0.1312 1597 CA -14.9850 -9.8630 14.0710 C.3 106 VAL106 0.0901 1598 HA -15.6498 -8.9991 14.0116 H 106 VAL106 0.0560 1599 C -13.9990 -9.6270 15.2090 C.2 106 VAL106 0.2187 1600 O -13.2580 -10.5430 15.6040 O.2 106 VAL106 -0.2778 1601 CB -15.8221 -11.1413 14.2844 C.3 106 VAL106 -0.0227 1602 HB -15.1350 -11.9811 14.3990 H 106 VAL106 0.0315 1603 CG1 -16.6896 -11.0381 15.5460 C.3 106 VAL106 -0.0608 1604 HG11 -17.1993 -11.9820 15.7313 H 106 VAL106 0.0233 1605 HG12 -17.4443 -10.2593 15.4364 H 106 VAL106 0.0233 1606 HG13 -16.1005 -10.7994 16.4310 H 106 VAL106 0.0233 1607 CG2 -16.7192 -11.4550 13.0764 C.3 106 VAL106 -0.0608 1608 HG21 -17.3316 -12.3378 13.2593 H 106 VAL106 0.0233 1609 HG22 -16.1335 -11.6538 12.1808 H 106 VAL106 0.0233 1610 HG23 -17.3905 -10.6245 12.8576 H 106 VAL106 0.0233 1611 N -14.0030 -8.4060 15.7350 N.am 107 GLY107 -0.2485 1612 H -14.6000 -7.6880 15.3240 H 107 GLY107 0.1309 1613 CA -13.1800 -8.0720 16.8780 C.3 107 GLY107 0.0765 1614 HA1 -13.0070 -6.9972 16.8437 H 107 GLY107 0.0521 1615 HA2 -12.2219 -8.5746 16.7853 H 107 GLY107 0.0521 1616 C -13.8630 -8.4270 18.1850 C.2 107 GLY107 0.2155 1617 O -15.0830 -8.3280 18.3310 O.2 107 GLY107 -0.2781 1618 N -13.0380 -8.8230 19.1520 N.am 108 TRP108 -0.2456 1619 H -12.0350 -8.8220 18.9650 H 108 TRP108 0.1312 1620 CA -13.4970 -9.2570 20.4630 C.3 108 TRP108 0.0918 1621 HA -14.1740 -8.4913 20.8455 H 108 TRP108 0.0560 1622 C -12.2820 -9.3580 21.3800 C.2 108 TRP108 0.2190 1623 O -11.2500 -9.9050 20.9840 O.2 108 TRP108 -0.2778 1624 CB -14.2044 -10.6140 20.3175 C.3 108 TRP108 -0.0021 1625 HB1 -13.5530 -11.3285 19.8113 H 108 TRP108 0.0334 1626 HB2 -15.0908 -10.4965 19.6971 H 108 TRP108 0.0334 1627 CG -14.6337 -11.1636 21.6611 C.ar 108 TRP108 -0.0260 1628 CD1 -15.7032 -10.7078 22.4361 C.ar 108 TRP108 -0.0136 1629 HD1 -16.3652 -9.8965 22.1694 H 108 TRP108 0.0748 1630 CD2 -14.0235 -12.2441 22.3948 C.ar 108 TRP108 -0.0028 1631 NE1 -15.7644 -11.4336 23.5797 N.ar 108 TRP108 -0.2641 1632 HE1 -16.4184 -11.3029 24.2985 H 108 TRP108 0.1331 1633 CE2 -14.7476 -12.3799 23.6019 C.ar 108 TRP108 0.0269 1634 CE3 -12.9551 -13.0617 22.1382 C.ar 108 TRP108 -0.0528 1635 HE3 -12.4002 -12.9538 21.2168 H 108 TRP108 0.0624 1636 CZ2 -14.3732 -13.3223 24.5211 C.ar 108 TRP108 -0.0430 1637 HZ2 -14.9268 -13.4228 25.4429 H 108 TRP108 0.0633 1638 CZ3 -12.5748 -14.0266 23.0705 C.ar 108 TRP108 -0.0611 1639 HZ3 -11.7322 -14.6716 22.8658 H 108 TRP108 0.0618 1640 CH2 -13.2826 -14.1550 24.2657 C.ar 108 TRP108 -0.0602 1641 HH2 -12.9934 -14.9053 24.9871 H 108 TRP108 0.0618 1642 N -12.3960 -8.8350 22.5960 N.am 109 ASN109 -0.2452 1643 H -13.2160 -8.2670 22.8090 H 109 ASN109 0.1312 1644 CA -11.3950 -9.0400 23.6410 C.3 109 ASN109 0.0957 1645 HA -11.6503 -8.3209 24.4202 H 109 ASN109 0.0562 1646 C -9.9880 -8.7140 23.1570 C.2 109 ASN109 0.2191 1647 O -9.0520 -9.5060 23.3070 O.2 109 ASN109 -0.2778 1648 CB -11.5045 -10.4755 24.1872 C.3 109 ASN109 0.0446 1649 HB1 -11.1497 -11.1992 23.4528 H 109 ASN109 0.0375 1650 HB2 -12.5466 -10.7092 24.3963 H 109 ASN109 0.0375 1651 CG -10.7300 -10.6597 25.4991 C.2 109 ASN109 0.2000 1652 OD1 -10.4478 -9.7128 26.2204 O.2 109 ASN109 -0.2797 1653 ND2 -10.4069 -11.9348 25.7594 N.am 109 ASN109 -0.2723 1654 HD21 -9.9028 -12.1472 26.5955 H 109 ASN109 0.1266 1655 HD22 -10.6581 -12.6724 25.1336 H 109 ASN109 0.1266 1656 N -9.8370 -7.5230 22.5820 N.am 110 ASN110 -0.2452 1657 H -10.6760 -6.9770 22.3880 H 110 ASN110 0.1312 1658 CA -8.5520 -6.9500 22.2120 C.3 110 ASN110 0.0957 1659 HA -8.7763 -5.9147 21.9540 H 110 ASN110 0.0562 1660 C -7.9550 -7.5830 20.9570 C.2 110 ASN110 0.2192 1661 O -6.8210 -7.2320 20.6130 O.2 110 ASN110 -0.2778 1662 CB -7.5355 -6.9636 23.3725 C.3 110 ASN110 0.0446 1663 HB1 -6.6429 -6.3996 23.1018 H 110 ASN110 0.0375 1664 HB2 -7.2036 -7.9735 23.6122 H 110 ASN110 0.0375 1665 CG -8.1334 -6.3091 24.6244 C.2 110 ASN110 0.2000 1666 OD1 -8.2841 -5.0982 24.7004 O.2 110 ASN110 -0.2797 1667 ND2 -8.4633 -7.1744 25.5960 N.am 110 ASN110 -0.2723 1668 HD21 -8.8356 -6.8292 26.4565 H 110 ASN110 0.1266 1669 HD22 -8.3499 -8.1611 25.4778 H 110 ASN110 0.1266 1670 N -8.6660 -8.4610 20.2570 N.am 111 SER111 -0.2436 1671 H -9.6090 -8.6910 20.5700 H 111 SER111 0.1312 1672 CA -8.1440 -9.1090 19.0540 C.3 111 SER111 0.1109 1673 HA -7.4989 -8.3991 18.5344 H 111 SER111 0.0580 1674 C -9.3210 -9.4240 18.1380 C.2 111 SER111 0.2210 1675 O -10.3590 -8.7630 18.2060 O.2 111 SER111 -0.2777 1676 CB -7.3548 -10.3734 19.4379 C.3 111 SER111 0.0681 1677 HB1 -8.0449 -11.1694 19.7478 H 111 SER111 0.0577 1678 HB2 -6.7062 -10.1525 20.2897 H 111 SER111 0.0577 1679 OG -6.5350 -10.7671 18.3439 O.3 111 SER111 -0.3930 1680 HG -6.2484 -11.6759 18.4225 H 111 SER111 0.2095 1681 N -9.1620 -10.4160 17.2670 N.am 112 THR112 -0.2433 1682 H -8.2370 -10.8320 17.1560 H 112 THR112 0.1313 1683 CA -10.2670 -10.9290 16.4640 C.3 112 THR112 0.1135 1684 HA -11.1977 -10.4836 16.8040 H 112 THR112 0.0583 1685 C -10.3930 -12.4220 16.7140 C.2 112 THR112 0.2212 1686 O -9.5800 -13.0270 17.4140 O.2 112 THR112 -0.2777 1687 CB -10.0216 -10.6366 14.9654 C.3 112 THR112 0.0763 1688 HB -10.7709 -11.1753 14.3722 H 112 THR112 0.0611 1689 OG1 -8.7220 -11.0914 14.6278 O.3 112 THR112 -0.3900 1690 HG1 -8.5571 -11.0251 13.6934 H 112 THR112 0.2098 1691 CG2 -10.1414 -9.1401 14.6422 C.3 112 THR112 -0.0370 1692 HG21 -9.9741 -8.9420 13.5838 H 112 THR112 0.0255 1693 HG22 -9.4173 -8.5544 15.2083 H 112 THR112 0.0255 1694 HG23 -11.1359 -8.7686 14.8790 H 112 THR112 0.0255 1695 N -11.4230 -13.0240 16.1330 N.am 113 PHE113 -0.2453 1696 H -12.0730 -12.4750 15.5700 H 113 PHE113 0.1312 1697 CA -11.6400 -14.4570 16.2860 C.3 113 PHE113 0.0918 1698 HA -11.3667 -14.7324 17.3066 H 113 PHE113 0.0560 1699 C -10.7600 -15.3060 15.3730 C.2 113 PHE113 0.2190 1700 O -10.7290 -16.5270 15.5340 O.2 113 PHE113 -0.2778 1701 CB -13.1193 -14.7960 16.0326 C.3 113 PHE113 -0.0036 1702 HB1 -13.2416 -15.8573 15.8095 H 113 PHE113 0.0333 1703 HB2 -13.4867 -14.2578 15.1577 H 113 PHE113 0.0333 1704 CG -13.9739 -14.4942 17.2346 C.ar 113 PHE113 -0.0454 1705 CD1 -14.0143 -15.3823 18.3052 C.ar 113 PHE113 -0.0585 1706 HD1 -13.4211 -16.2857 18.2722 H 113 PHE113 0.0620 1707 CD2 -14.7073 -13.3180 17.3081 C.ar 113 PHE113 -0.0585 1708 HD2 -14.6464 -12.6068 16.4999 H 113 PHE113 0.0620 1709 CE1 -14.7695 -15.0954 19.4345 C.ar 113 PHE113 -0.0615 1710 HE1 -14.7593 -15.7763 20.2730 H 113 PHE113 0.0618 1711 CE2 -15.4843 -13.0393 18.4236 C.ar 113 PHE113 -0.0615 1712 HE2 -16.0417 -12.1162 18.4687 H 113 PHE113 0.0618 1713 CZ -15.5093 -13.9231 19.4937 C.ar 113 PHE113 -0.0617 1714 HZ -16.0788 -13.6868 20.3804 H 113 PHE113 0.0618 1715 N -10.0340 -14.7080 14.4380 N.am 114 ALA114 -0.2442 1716 H -10.0920 -13.6950 14.3330 H 114 ALA114 0.1312 1717 CA -9.1530 -15.4680 13.5550 C.3 114 ALA114 0.0977 1718 HA -9.7484 -16.2651 13.1099 H 114 ALA114 0.0573 1719 C -8.0100 -16.1150 14.3200 C.2 114 ALA114 0.1940 1720 O -7.4900 -17.1450 13.8890 O.co2 114 ALA114 -0.6467 1721 CB -8.6060 -14.5458 12.4629 C.3 114 ALA114 -0.0393 1722 HB1 -7.9140 -15.0777 11.8095 H 114 ALA114 0.0250 1723 HB2 -8.0763 -13.6968 12.8954 H 114 ALA114 0.0250 1724 HB3 -9.4156 -14.1683 11.8447 H 114 ALA114 0.0250 1725 OXT -7.6040 -15.5882 15.3562 O.co2 114 ALA114 -0.6467 @BOND 1 1 14 1 2 1 4 1 3 1 2 1 4 1 3 1 5 4 8 1 6 4 6 1 7 4 5 1 8 6 7 2 9 6 17 am 10 8 11 1 11 8 9 1 12 8 10 1 13 11 14 1 14 11 12 1 15 11 13 1 16 14 15 1 17 14 16 1 18 17 19 1 19 17 18 1 20 19 23 1 21 19 21 1 22 19 20 1 23 21 22 2 24 21 34 am 25 23 26 1 26 23 24 1 27 23 25 1 28 26 29 1 29 26 27 1 30 26 28 1 31 29 30 1 32 30 31 1 33 30 32 1 34 30 33 1 35 34 36 1 36 34 35 1 37 36 40 1 38 36 38 1 39 36 37 1 40 38 39 2 41 38 54 am 42 40 43 1 43 40 41 1 44 40 42 1 45 43 44 ar 46 43 46 ar 47 44 48 ar 48 44 45 1 49 46 50 ar 50 46 47 1 51 48 52 ar 52 48 49 1 53 50 52 ar 54 50 51 1 55 52 53 1 56 54 56 1 57 54 55 1 58 56 60 1 59 56 58 1 60 56 57 1 61 58 59 2 62 58 73 am 63 60 65 1 64 60 62 1 65 60 61 1 66 62 69 1 67 62 63 1 68 62 64 1 69 65 66 1 70 65 67 1 71 65 68 1 72 69 70 1 73 69 71 1 74 69 72 1 75 73 75 1 76 73 74 1 77 75 79 1 78 75 77 1 79 75 76 1 80 77 78 2 81 77 89 am 82 79 81 1 83 79 85 1 84 79 80 1 85 81 82 1 86 81 83 1 87 81 84 1 88 85 86 1 89 85 87 1 90 85 88 1 91 89 91 1 92 89 90 1 93 91 95 1 94 91 93 1 95 91 92 1 96 93 94 2 97 93 103 am 98 95 98 1 99 95 96 1 100 95 97 1 101 98 99 2 102 98 100 am 103 100 101 1 104 100 102 1 105 103 105 1 106 103 104 1 107 105 109 1 108 105 107 1 109 105 106 1 110 107 108 2 111 107 117 am 112 109 113 1 113 109 111 1 114 109 110 1 115 111 112 1 116 113 114 1 117 113 115 1 118 113 116 1 119 117 119 1 120 117 118 1 121 119 123 1 122 119 121 1 123 119 120 1 124 121 122 2 125 121 131 am 126 123 126 1 127 123 124 1 128 123 125 1 129 126 127 2 130 126 128 am 131 128 129 1 132 128 130 1 133 131 133 1 134 131 132 1 135 133 137 1 136 133 135 1 137 133 134 1 138 135 136 2 139 135 147 am 140 137 139 1 141 137 143 1 142 137 138 1 143 139 140 1 144 139 141 1 145 139 142 1 146 143 144 1 147 143 145 1 148 143 146 1 149 147 158 1 150 147 148 1 151 148 152 1 152 148 150 1 153 148 149 1 154 150 161 am 155 150 151 2 156 152 155 1 157 152 153 1 158 152 154 1 159 155 158 1 160 155 156 1 161 155 157 1 162 158 159 1 163 158 160 1 164 161 163 1 165 161 162 1 166 163 165 1 167 163 167 1 168 163 164 1 169 165 166 2 170 165 185 am 171 167 170 1 172 167 168 1 173 167 169 1 174 170 173 1 175 170 171 1 176 170 172 1 177 173 176 1 178 173 174 1 179 173 175 1 180 176 178 ar 181 176 177 1 182 178 179 ar 183 178 182 ar 184 179 180 1 185 179 181 1 186 182 183 1 187 182 184 1 188 185 187 1 189 185 186 1 190 187 191 1 191 187 189 1 192 187 188 1 193 189 190 2 194 189 195 am 195 191 192 1 196 191 193 1 197 191 194 1 198 195 197 1 199 195 196 1 200 197 201 1 201 197 199 1 202 197 198 1 203 199 200 2 204 199 206 am 205 201 204 1 206 201 202 1 207 201 203 1 208 204 205 1 209 206 208 1 210 206 207 1 211 208 212 1 212 208 210 1 213 208 209 1 214 210 211 2 215 210 222 am 216 212 214 1 217 212 218 1 218 212 213 1 219 214 215 1 220 214 216 1 221 214 217 1 222 218 219 1 223 218 220 1 224 218 221 1 225 222 233 1 226 222 223 1 227 223 227 1 228 223 225 1 229 223 224 1 230 225 226 2 231 225 236 am 232 227 230 1 233 227 228 1 234 227 229 1 235 230 233 1 236 230 231 1 237 230 232 1 238 233 234 1 239 233 235 1 240 236 238 1 241 236 237 1 242 238 242 1 243 238 240 1 244 238 239 1 245 240 241 2 246 240 248 am 247 242 245 1 248 242 243 1 249 242 244 1 250 245 246 ar 251 245 247 ar 252 248 250 1 253 248 249 1 254 250 253 1 255 250 251 1 256 250 252 1 257 253 254 2 258 253 255 am 259 255 257 1 260 255 256 1 261 257 261 1 262 257 259 1 263 257 258 1 264 259 260 2 265 259 275 am 266 261 264 1 267 261 262 1 268 261 263 1 269 264 265 ar 270 264 267 ar 271 265 269 ar 272 265 266 1 273 267 271 ar 274 267 268 1 275 269 273 ar 276 269 270 1 277 271 273 ar 278 271 272 1 279 273 274 1 280 275 277 1 281 275 276 1 282 277 281 1 283 277 279 1 284 277 278 1 285 279 280 2 286 279 294 am 287 281 284 1 288 281 282 1 289 281 283 1 290 284 286 1 291 284 290 1 292 284 285 1 293 286 287 1 294 286 288 1 295 286 289 1 296 290 291 1 297 290 292 1 298 290 293 1 299 294 296 1 300 294 295 1 301 296 300 1 302 296 298 1 303 296 297 1 304 298 299 2 305 298 305 am 306 300 303 1 307 300 301 1 308 300 302 1 309 303 304 1 310 305 307 1 311 305 306 1 312 307 311 1 313 307 309 1 314 307 308 1 315 309 310 2 316 309 320 am 317 311 314 1 318 311 312 1 319 311 313 1 320 314 317 1 321 314 315 1 322 314 316 1 323 317 318 ar 324 317 319 ar 325 320 322 1 326 320 321 1 327 322 326 1 328 322 324 1 329 322 323 1 330 324 325 2 331 324 339 am 332 326 329 1 333 326 327 1 334 326 328 1 335 329 331 1 336 329 335 1 337 329 330 1 338 331 332 1 339 331 333 1 340 331 334 1 341 335 336 1 342 335 337 1 343 335 338 1 344 339 341 1 345 339 340 1 346 341 345 1 347 341 343 1 348 341 342 1 349 343 353 am 350 343 344 2 351 345 349 1 352 345 347 1 353 345 346 1 354 347 348 1 355 349 350 1 356 349 351 1 357 349 352 1 358 353 355 1 359 353 354 1 360 355 357 1 361 355 359 1 362 355 356 1 363 357 358 2 364 357 370 am 365 359 362 1 366 359 360 1 367 359 361 1 368 362 365 1 369 362 363 1 370 362 364 1 371 365 366 2 372 365 367 am 373 367 368 1 374 367 369 1 375 370 372 1 376 370 371 1 377 372 376 1 378 372 374 1 379 372 373 1 380 374 375 2 381 374 387 am 382 376 379 1 383 376 377 1 384 376 378 1 385 379 382 1 386 379 380 1 387 379 381 1 388 382 383 2 389 382 384 am 390 384 385 1 391 384 386 1 392 387 389 1 393 387 388 1 394 389 393 1 395 389 391 1 396 389 390 1 397 391 392 2 398 391 406 am 399 393 396 1 400 393 394 1 401 393 395 1 402 396 398 1 403 396 402 1 404 396 397 1 405 398 399 1 406 398 400 1 407 398 401 1 408 402 403 1 409 402 404 1 410 402 405 1 411 406 408 1 412 406 407 1 413 408 412 1 414 408 410 1 415 408 409 1 416 410 416 am 417 410 411 2 418 412 413 1 419 412 414 1 420 412 415 1 421 416 418 1 422 416 417 1 423 418 420 1 424 418 422 1 425 418 419 1 426 420 421 2 427 420 433 am 428 422 425 1 429 422 423 1 430 422 424 1 431 425 428 1 432 425 426 1 433 425 427 1 434 428 429 2 435 428 430 am 436 430 431 1 437 430 432 1 438 433 435 1 439 433 434 1 440 435 439 1 441 435 437 1 442 435 436 1 443 437 438 2 444 437 443 am 445 439 440 1 446 439 441 1 447 439 442 1 448 443 445 1 449 443 444 1 450 445 449 1 451 445 447 1 452 445 446 1 453 447 448 2 454 447 457 am 455 449 453 1 456 449 451 1 457 449 450 1 458 451 452 1 459 453 454 1 460 453 455 1 461 453 456 1 462 457 459 1 463 457 458 1 464 459 462 1 465 459 460 1 466 459 461 1 467 462 463 2 468 462 464 am 469 464 466 1 470 464 465 1 471 466 470 1 472 466 468 1 473 466 467 1 474 468 469 2 475 468 486 am 476 470 473 1 477 470 471 1 478 470 472 1 479 473 476 1 480 473 474 1 481 473 475 1 482 476 479 1 483 476 477 1 484 476 478 1 485 479 482 1 486 479 480 1 487 479 481 1 488 482 483 1 489 482 484 1 490 482 485 1 491 486 497 1 492 486 487 1 493 487 491 1 494 487 489 1 495 487 488 1 496 489 490 2 497 489 500 am 498 491 494 1 499 491 492 1 500 491 493 1 501 494 497 1 502 494 495 1 503 494 496 1 504 497 498 1 505 497 499 1 506 500 511 1 507 500 501 1 508 501 505 1 509 501 503 1 510 501 502 1 511 503 504 2 512 503 514 am 513 505 508 1 514 505 506 1 515 505 507 1 516 508 511 1 517 508 509 1 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1631 1632 1 1654 1633 1636 ar 1655 1634 1638 ar 1656 1634 1635 1 1657 1636 1640 ar 1658 1636 1637 1 1659 1638 1640 ar 1660 1638 1639 1 1661 1640 1641 1 1662 1642 1644 1 1663 1642 1643 1 1664 1644 1648 1 1665 1644 1646 1 1666 1644 1645 1 1667 1646 1647 2 1668 1646 1656 am 1669 1648 1651 1 1670 1648 1649 1 1671 1648 1650 1 1672 1651 1652 2 1673 1651 1653 am 1674 1653 1654 1 1675 1653 1655 1 1676 1656 1658 1 1677 1656 1657 1 1678 1658 1662 1 1679 1658 1660 1 1680 1658 1659 1 1681 1660 1661 2 1682 1660 1670 am 1683 1662 1665 1 1684 1662 1663 1 1685 1662 1664 1 1686 1665 1666 2 1687 1665 1667 am 1688 1667 1668 1 1689 1667 1669 1 1690 1670 1672 1 1691 1670 1671 1 1692 1672 1676 1 1693 1672 1674 1 1694 1672 1673 1 1695 1674 1675 2 1696 1674 1681 am 1697 1676 1679 1 1698 1676 1677 1 1699 1676 1678 1 1700 1679 1680 1 1701 1681 1683 1 1702 1681 1682 1 1703 1683 1687 1 1704 1683 1685 1 1705 1683 1684 1 1706 1685 1686 2 1707 1685 1695 am 1708 1687 1691 1 1709 1687 1689 1 1710 1687 1688 1 1711 1689 1690 1 1712 1691 1692 1 1713 1691 1693 1 1714 1691 1694 1 1715 1695 1697 1 1716 1695 1696 1 1717 1697 1701 1 1718 1697 1699 1 1719 1697 1698 1 1720 1699 1700 2 1721 1699 1715 am 1722 1701 1704 1 1723 1701 1702 1 1724 1701 1703 1 1725 1704 1705 ar 1726 1704 1707 ar 1727 1705 1709 ar 1728 1705 1706 1 1729 1707 1711 ar 1730 1707 1708 1 1731 1709 1713 ar 1732 1709 1710 1 1733 1711 1713 ar 1734 1711 1712 1 1735 1713 1714 1 1736 1715 1717 1 1737 1715 1716 1 1738 1717 1721 1 1739 1717 1719 1 1740 1717 1718 1 1741 1719 1720 ar 1742 1719 1725 ar 1743 1721 1722 1 1744 1721 1723 1 1745 1721 1724 1 @SUBSTRUCTURE 1 PRO1 4 RESIDUE 1 A PRO 1 ROOT 2 MET2 19 RESIDUE 1 A MET 2 3 PHE3 36 RESIDUE 1 A PHE 2 4 ILE4 56 RESIDUE 1 A ILE 2 5 VAL5 75 RESIDUE 1 A VAL 2 6 ASN6 91 RESIDUE 1 A ASN 2 7 THR7 105 RESIDUE 1 A THR 2 8 ASN8 119 RESIDUE 1 A ASN 2 9 VAL9 133 RESIDUE 1 A VAL 2 10 PRO10 148 RESIDUE 1 A PRO 2 11 ARG11 163 RESIDUE 1 A ARG 2 12 ALA12 187 RESIDUE 1 A ALA 2 13 SER13 197 RESIDUE 1 A SER 2 14 VAL14 208 RESIDUE 1 A VAL 2 15 PRO15 223 RESIDUE 1 A PRO 2 16 ASP16 238 RESIDUE 1 A ASP 2 17 GLY17 250 RESIDUE 1 A GLY 2 18 PHE18 257 RESIDUE 1 A PHE 2 19 LEU19 277 RESIDUE 1 A LEU 2 20 SER20 296 RESIDUE 1 A SER 2 21 GLU21 307 RESIDUE 1 A GLU 2 22 LEU22 322 RESIDUE 1 A LEU 2 23 THR23 341 RESIDUE 1 A THR 2 24 GLN24 355 RESIDUE 1 A GLN 2 25 GLN25 372 RESIDUE 1 A GLN 2 26 LEU26 389 RESIDUE 1 A LEU 2 27 ALA27 408 RESIDUE 1 A ALA 2 28 GLN28 418 RESIDUE 1 A GLN 2 29 ALA29 435 RESIDUE 1 A ALA 2 30 THR30 445 RESIDUE 1 A THR 2 31 GLY31 459 RESIDUE 1 A GLY 2 32 LYS32 466 RESIDUE 1 A LYS 2 33 PRO33 487 RESIDUE 1 A PRO 2 34 PRO34 501 RESIDUE 1 A PRO 2 35 GLN35 516 RESIDUE 1 A GLN 2 36 TYR36 533 RESIDUE 1 A TYR 2 37 ILE37 554 RESIDUE 1 A ILE 2 38 ALA38 573 RESIDUE 1 A ALA 2 39 VAL39 583 RESIDUE 1 A VAL 2 40 HIS40 599 RESIDUE 1 A HIS 2 41 VAL41 616 RESIDUE 1 A VAL 2 42 VAL42 632 RESIDUE 1 A VAL 2 43 PRO43 647 RESIDUE 1 A PRO 2 44 ASP44 662 RESIDUE 1 A ASP 2 45 GLN45 674 RESIDUE 1 A GLN 2 46 LEU46 691 RESIDUE 1 A LEU 2 47 MET47 710 RESIDUE 1 A MET 2 48 ALA48 727 RESIDUE 1 A ALA 2 49 PHE49 737 RESIDUE 1 A PHE 2 50 GLY50 757 RESIDUE 1 A GLY 2 51 GLY51 764 RESIDUE 1 A GLY 2 52 SER52 771 RESIDUE 1 A SER 2 53 SER53 782 RESIDUE 1 A SER 2 54 GLU54 793 RESIDUE 1 A GLU 2 55 PRO55 807 RESIDUE 1 A PRO 2 56 CYS56 822 RESIDUE 1 A CYS 2 57 ALA57 833 RESIDUE 1 A ALA 2 58 LEU58 843 RESIDUE 1 A LEU 2 59 CYS59 862 RESIDUE 1 A CYS 2 60 SER60 873 RESIDUE 1 A SER 2 61 LEU61 884 RESIDUE 1 A LEU 2 62 HIS62 903 RESIDUE 1 A HIS 2 63 SER63 920 RESIDUE 1 A SER 2 64 ILE64 931 RESIDUE 1 A ILE 2 65 GLY65 950 RESIDUE 1 A GLY 2 66 LYS66 957 RESIDUE 1 A LYS 2 67 ILE67 979 RESIDUE 1 A ILE 2 68 GLY68 998 RESIDUE 1 A GLY 2 69 GLY69 1005 RESIDUE 1 A GLY 2 70 ALA70 1012 RESIDUE 1 A ALA 2 71 GLN71 1022 RESIDUE 1 A GLN 2 72 ASN72 1039 RESIDUE 1 A ASN 2 73 ARG73 1053 RESIDUE 1 A ARG 2 74 SER74 1077 RESIDUE 1 A SER 2 75 TYR75 1088 RESIDUE 1 A TYR 2 76 SER76 1109 RESIDUE 1 A SER 2 77 LYS77 1120 RESIDUE 1 A LYS 2 78 LEU78 1142 RESIDUE 1 A LEU 2 79 LEU79 1161 RESIDUE 1 A LEU 2 80 CYS80 1180 RESIDUE 1 A CYS 2 81 GLY81 1191 RESIDUE 1 A GLY 2 82 LEU82 1198 RESIDUE 1 A LEU 2 83 LEU83 1217 RESIDUE 1 A LEU 2 84 ALA84 1236 RESIDUE 1 A ALA 2 85 GLU85 1246 RESIDUE 1 A GLU 2 86 ARG86 1261 RESIDUE 1 A ARG 2 87 LEU87 1285 RESIDUE 1 A LEU 2 88 ARG88 1304 RESIDUE 1 A ARG 2 89 ILE89 1328 RESIDUE 1 A ILE 2 90 SER90 1347 RESIDUE 1 A SER 2 91 PRO91 1357 RESIDUE 1 A PRO 2 92 ASP92 1372 RESIDUE 1 A ASP 2 93 ARG93 1384 RESIDUE 1 A ARG 2 94 VAL94 1408 RESIDUE 1 A VAL 2 95 TYR95 1424 RESIDUE 1 A TYR 2 96 ILE96 1445 RESIDUE 1 A ILE 2 97 ASN97 1464 RESIDUE 1 A ASN 2 98 TYR98 1478 RESIDUE 1 A TYR 2 99 TYR99 1499 RESIDUE 1 A TYR 2 100 ASP100 1520 RESIDUE 1 A ASP 2 101 MET101 1532 RESIDUE 1 A MET 2 102 ASN102 1549 RESIDUE 1 A ASN 2 103 ALA103 1563 RESIDUE 1 A ALA 2 104 ALA104 1573 RESIDUE 1 A ALA 2 105 ASN105 1583 RESIDUE 1 A ASN 2 106 VAL106 1597 RESIDUE 1 A VAL 2 107 GLY107 1613 RESIDUE 1 A GLY 2 108 TRP108 1620 RESIDUE 1 A TRP 2 109 ASN109 1644 RESIDUE 1 A ASN 2 110 ASN110 1658 RESIDUE 1 A ASN 2 111 SER111 1672 RESIDUE 1 A SER 2 112 THR112 1683 RESIDUE 1 A THR 2 113 PHE113 1697 RESIDUE 1 A PHE 2 114 ALA114 1717 RESIDUE 1 A ALA 1