# Name: 8Q3U_min # Creating user name: Agnese Pozzi # Creation time: Fri Apr 10 17:02:11 2026 # Modifying user name: Agnese Pozzi # Modification time: Fri Apr 10 17:02:11 2026 @MOLECULE 8Q3U_min 4030 4094 260 0 0 SMALL USER_CHARGES File created by VEGA ZZ 3.2.5 @ATOM 1 N 22.4480 11.6240 8.0630 N.4 1 GLY1 -0.0668 2 CA 23.2580 11.4020 9.3070 C.3 1 GLY1 0.1826 3 C 22.8440 12.2930 10.4650 C.2 1 GLY1 0.2284 4 O 23.5220 12.2390 11.5280 O.2 1 GLY1 -0.2776 5 H1 22.7684 10.9868 7.3068 H 1 GLY1 0.2747 6 H2 22.5281 12.6151 7.7577 H 1 GLY1 0.2747 7 H3 21.4459 11.4224 8.2757 H 1 GLY1 0.2747 8 HA1 24.3115 11.5821 9.0891 H 1 GLY1 0.0654 9 HA2 23.1476 10.3630 9.6238 H 1 GLY1 0.0654 10 N 21.7170 13.0030 10.3690 N.am 2 TRP2 -0.2452 11 CA 21.1990 13.8520 11.4580 C.3 2 TRP2 0.0918 12 C 19.6730 13.7800 11.5140 C.2 2 TRP2 0.2188 13 O 18.9860 13.4340 10.5460 O.2 2 TRP2 -0.2778 14 CB 21.6835 15.2977 11.2755 C.3 2 TRP2 -0.0021 15 CG 21.2244 15.8637 9.9471 C.ar 2 TRP2 -0.0260 16 CD1 21.9483 15.8551 8.7511 C.ar 2 TRP2 -0.0136 17 CD2 20.0078 16.5942 9.6867 C.ar 2 TRP2 -0.0028 18 NE1 21.2282 16.4829 7.7893 N.ar 2 TRP2 -0.2641 19 CE2 20.0390 16.9678 8.3233 C.ar 2 TRP2 0.0269 20 CE3 18.9526 16.9665 10.4777 C.ar 2 TRP2 -0.0528 21 CZ2 19.0106 17.6989 7.7925 C.ar 2 TRP2 -0.0430 22 CZ3 17.9043 17.7117 9.9398 C.ar 2 TRP2 -0.0611 23 CH2 17.9318 18.0759 8.5935 C.ar 2 TRP2 -0.0602 24 H 21.1880 12.9560 9.4980 H 2 TRP2 0.1312 25 HA 21.5623 13.4494 12.4063 H 2 TRP2 0.0560 26 HB1 22.7707 15.3368 11.3244 H 2 TRP2 0.0334 27 HB2 21.3139 15.9275 12.0832 H 2 TRP2 0.0334 28 HD1 22.9337 15.4322 8.6269 H 2 TRP2 0.0748 29 HE1 21.5104 16.6301 6.8623 H 2 TRP2 0.1331 30 HE3 18.9314 16.6901 11.5223 H 2 TRP2 0.0624 31 HZ2 19.0402 17.9945 6.7544 H 2 TRP2 0.0633 32 HZ3 17.0709 17.9986 10.5651 H 2 TRP2 0.0618 33 HH2 17.1198 18.6516 8.1745 H 2 TRP2 0.0618 34 N 19.1540 14.1180 12.6610 N.am 3 GLY3 -0.2485 35 CA 17.7110 14.1540 12.8640 C.3 3 GLY3 0.0765 36 C 17.4330 14.8250 14.1640 C.2 3 GLY3 0.2155 37 O 18.1690 15.7470 14.5830 O.2 3 GLY3 -0.2781 38 H 19.7720 14.3630 13.4350 H 3 GLY3 0.1309 39 HA1 17.3578 13.1208 12.8785 H 3 GLY3 0.0521 40 HA2 17.2426 14.7079 12.0505 H 3 GLY3 0.0521 41 N 16.3850 14.3490 14.8240 N.am 4 TYR4 -0.2456 42 CA 15.8680 14.9310 16.0810 C.3 4 TYR4 0.0917 43 C 15.7140 13.8470 17.1520 C.2 4 TYR4 0.2188 44 O 14.9750 14.0400 18.1210 O.2 4 TYR4 -0.2778 45 CB 14.5345 15.6457 15.8225 C.3 4 TYR4 -0.0036 46 CG 14.6526 16.6675 14.7240 C.ar 4 TYR4 -0.0453 47 CD1 15.1344 17.9480 14.9873 C.ar 4 TYR4 -0.0561 48 CD2 14.2612 16.3450 13.4291 C.ar 4 TYR4 -0.0561 49 CE1 15.2072 18.8946 13.9718 C.ar 4 TYR4 -0.0317 50 CE2 14.3483 17.2837 12.4138 C.ar 4 TYR4 -0.0317 51 CZ 14.8195 18.5592 12.6827 C.ar 4 TYR4 0.0726 52 OH 14.9025 19.4853 11.6641 O.3 4 TYR4 -0.3598 53 H 15.9070 13.5330 14.4420 H 4 TYR4 0.1312 54 HA 16.6031 15.6431 16.4543 H 4 TYR4 0.0560 55 HB1 14.1890 16.1441 16.7289 H 4 TYR4 0.0333 56 HB2 13.7638 14.9220 15.5543 H 4 TYR4 0.0333 57 HD1 15.4369 18.2172 15.9892 H 4 TYR4 0.0621 58 HD2 13.8970 15.3529 13.2052 H 4 TYR4 0.0621 59 HE1 15.5618 19.8924 14.1824 H 4 TYR4 0.0643 60 HE2 14.0437 17.0162 11.4159 H 4 TYR4 0.0643 61 HH 14.7041 19.0547 10.8448 H 4 TYR4 0.2173 62 N 16.3380 12.7030 16.9530 N.am 5 GLY5 -0.2485 63 CA 16.2180 11.6090 17.9150 C.3 5 GLY5 0.0765 64 C 17.2960 11.6860 18.9770 C.2 5 GLY5 0.2155 65 O 18.1640 12.6080 18.9990 O.2 5 GLY5 -0.2781 66 H 16.9110 12.5800 16.1180 H 5 GLY5 0.1309 67 HA1 16.3447 10.6893 17.3436 H 5 GLY5 0.0521 68 HA2 15.2255 11.6113 18.3667 H 5 GLY5 0.0521 69 N 17.2930 10.6830 19.8300 N.am 6 GLN6 -0.2459 70 CA 18.1810 10.6560 21.0000 C.3 6 GLN6 0.0882 71 C 19.6410 10.6290 20.5440 C.2 6 GLN6 0.2187 72 O 20.5170 11.1710 21.2840 O.2 6 GLN6 -0.2778 73 CB 17.8839 9.4161 21.8644 C.3 6 GLN6 -0.0210 74 CG 16.3992 9.2135 22.2243 C.3 6 GLN6 0.0225 75 CD 15.7473 10.4108 22.9337 C.2 6 GLN6 0.1981 76 OE1 14.6163 10.7798 22.6463 O.2 6 GLN6 -0.2798 77 NE2 16.5118 10.9898 23.8719 N.am 6 GLN6 -0.2724 78 H 16.6550 9.9020 19.6740 H 6 GLN6 0.1312 79 HA 18.0097 11.5785 21.5566 H 6 GLN6 0.0557 80 HB1 18.4837 9.4588 22.7747 H 6 GLN6 0.0289 81 HB2 18.2189 8.5213 21.3371 H 6 GLN6 0.0289 82 HG1 16.2933 8.3438 22.8721 H 6 GLN6 0.0356 83 HG2 15.8178 9.0011 21.3275 H 6 GLN6 0.0356 84 HE21 16.1558 11.7749 24.3771 H 6 GLN6 0.1266 85 HE22 17.4316 10.6565 24.0763 H 6 GLN6 0.1266 86 N 19.9290 9.9390 19.4460 N.am 7 ASP7 -0.2451 87 CA 21.3390 9.7380 19.0650 C.3 7 ASP7 0.0974 88 C 21.7960 10.6650 17.9500 C.2 7 ASP7 0.2192 89 O 23.0000 10.7600 17.7500 O.2 7 ASP7 -0.2778 90 CB 21.9665 8.3252 18.9621 C.3 7 ASP7 0.0576 91 CG 23.5425 8.4205 18.9840 C.2 7 ASP7 0.1780 92 OD1 24.1981 7.8714 18.1027 O.co2 7 ASP7 -0.6478 93 OD2 24.1125 9.0676 19.8713 O.co2 7 ASP7 -0.6478 94 H 19.1810 9.5510 18.8710 H 7 ASP7 0.1312 95 HA 21.9146 10.1489 19.8941 H 7 ASP7 0.0563 96 HB1 21.6466 7.8205 18.0511 H 7 ASP7 0.0394 97 HB2 21.6597 7.7103 19.8059 H 7 ASP7 0.0394 98 N 20.8960 11.3160 17.2290 N.am 8 ASP8 -0.2451 99 CA 21.2830 12.0920 16.0290 C.3 8 ASP8 0.0974 100 C 20.7690 13.5280 16.1310 C.2 8 ASP8 0.2190 101 O 20.8510 14.2490 15.1290 O.2 8 ASP8 -0.2778 102 CB 21.0345 11.3310 14.7122 C.3 8 ASP8 0.0576 103 CG 19.6294 11.3776 14.1021 C.2 8 ASP8 0.1780 104 OD1 18.6642 11.6785 14.8025 O.co2 8 ASP8 -0.6478 105 OD2 19.5300 11.1072 12.9027 O.co2 8 ASP8 -0.6478 106 H 19.9150 11.2820 17.5060 H 8 ASP8 0.1312 107 HA 22.3629 12.2248 16.0777 H 8 ASP8 0.0563 108 HB1 21.2974 10.2826 14.8437 H 8 ASP8 0.0394 109 HB2 21.7139 11.7193 13.9551 H 8 ASP8 0.0394 110 N 20.3220 13.9530 17.3030 N.am 9 GLY9 -0.2484 111 CA 19.6470 15.2450 17.4500 C.3 9 GLY9 0.0767 112 C 20.5950 16.4160 17.6380 C.2 9 GLY9 0.2182 113 O 21.8230 16.2930 17.5920 O.2 9 GLY9 -0.2779 114 H 20.4510 13.3650 18.1260 H 9 GLY9 0.1309 115 HA1 19.0073 15.1448 18.3260 H 9 GLY9 0.0521 116 HA2 19.0120 15.3931 16.5899 H 9 GLY9 0.0521 117 N 20.0100 17.6130 17.8440 N.am 10 PRO10 -0.2318 118 CA 20.7530 18.8600 17.8560 C.3 10 PRO10 0.0907 119 C 21.9920 18.9290 18.7350 C.2 10 PRO10 0.2190 120 O 22.9440 19.5890 18.3320 O.2 10 PRO10 -0.2778 121 CB 19.7045 19.8908 18.2996 C.3 10 PRO10 -0.0276 122 CG 18.3637 19.2922 17.8880 C.3 10 PRO10 -0.0379 123 CD 18.5648 17.7822 18.0099 C.3 10 PRO10 0.0071 124 HA 21.0497 19.0415 16.8323 H 10 PRO10 0.0559 125 HB1 19.8754 20.8720 17.8591 H 10 PRO10 0.0285 126 HB2 19.7099 20.0098 19.3846 H 10 PRO10 0.0285 127 HG1 18.1551 19.5472 16.8484 H 10 PRO10 0.0278 128 HG2 17.5306 19.6576 18.4892 H 10 PRO10 0.0278 129 HD1 18.2969 17.4012 18.9965 H 10 PRO10 0.0431 130 HD2 18.0232 17.2471 17.2292 H 10 PRO10 0.0431 131 N 21.9940 18.2310 19.8660 N.am 11 SER11 -0.2436 132 CA 23.1630 18.2440 20.7720 C.3 11 SER11 0.1109 133 C 24.3860 17.5760 20.1470 C.2 11 SER11 0.2209 134 O 25.4870 17.7300 20.6870 O.2 11 SER11 -0.2777 135 CB 22.7892 17.5261 22.0755 C.3 11 SER11 0.0681 136 OG 21.6521 18.1606 22.6473 O.3 11 SER11 -0.3930 137 H 21.1750 17.6760 20.1140 H 11 SER11 0.1312 138 HA 23.4030 19.2879 20.9784 H 11 SER11 0.0580 139 HB1 23.6336 17.5637 22.7734 H 11 SER11 0.0577 140 HB2 22.5663 16.4734 21.8657 H 11 SER11 0.0577 141 HG 21.3949 17.7415 23.4656 H 11 SER11 0.2095 142 N 24.1970 16.8530 19.0480 N.am 12 HIS12 -0.2452 143 CA 25.2510 16.0740 18.3970 C.3 12 HIS12 0.0932 144 C 25.6040 16.6070 17.0140 C.2 12 HIS12 0.2190 145 O 26.5450 16.0790 16.3970 O.2 12 HIS12 -0.2778 146 CB 24.6440 14.6864 18.0938 C.3 12 HIS12 0.0146 147 CG 24.1857 13.9448 19.3270 C.ar 12 HIS12 0.0551 148 ND1 24.8927 12.9402 19.8903 N.ar 12 HIS12 -0.2469 149 CD2 22.8904 13.9293 19.8705 C.ar 12 HIS12 0.0047 150 CE1 24.0471 12.3231 20.7374 C.ar 12 HIS12 0.0737 151 NE2 22.8469 12.9265 20.7740 N.ar 12 HIS12 -0.2539 152 H 23.2640 16.8400 18.6350 H 12 HIS12 0.1312 153 HA 26.1395 16.0178 19.0274 H 12 HIS12 0.0561 154 HB1 25.3483 14.0566 17.5571 H 12 HIS12 0.0348 155 HB2 23.7779 14.7806 17.4360 H 12 HIS12 0.0348 156 HD2 22.0592 14.5462 19.5618 H 12 HIS12 0.0764 157 HE1 24.2721 11.4107 21.2761 H 12 HIS12 0.0963 158 HE2 22.0602 12.6161 21.2718 H 12 HIS12 0.1339 159 N 24.8670 17.5750 16.4860 N.am 13 TRP13 -0.2453 160 CA 25.0570 18.0170 15.0940 C.3 13 TRP13 0.0918 161 C 26.4500 18.5610 14.8690 C.2 13 TRP13 0.2190 162 O 26.9480 18.4640 13.7220 O.2 13 TRP13 -0.2778 163 CB 24.0248 19.0876 14.7029 C.3 13 TRP13 -0.0021 164 CG 22.6287 18.5239 14.5181 C.ar 13 TRP13 -0.0260 165 CD1 22.2290 17.1813 14.5091 C.ar 13 TRP13 -0.0136 166 CD2 21.4302 19.2998 14.3215 C.ar 13 TRP13 -0.0028 167 NE1 20.8903 17.1151 14.3110 N.ar 13 TRP13 -0.2641 168 CE2 20.3577 18.3883 14.1854 C.ar 13 TRP13 0.0269 169 CE3 21.1921 20.6465 14.2998 C.ar 13 TRP13 -0.0528 170 CZ2 19.0828 18.8504 14.0023 C.ar 13 TRP13 -0.0430 171 CZ3 19.8910 21.1175 14.1385 C.ar 13 TRP13 -0.0611 172 CH2 18.8355 20.2224 13.9755 C.ar 13 TRP13 -0.0602 173 H 24.1510 18.0240 17.0580 H 13 TRP13 0.1312 174 HA 24.9642 17.1357 14.4577 H 13 TRP13 0.0560 175 HB1 24.3048 19.5575 13.7583 H 13 TRP13 0.0334 176 HB2 23.9994 19.8786 15.4539 H 13 TRP13 0.0334 177 HD1 22.8574 16.3152 14.6588 H 13 TRP13 0.0748 178 HE1 20.3610 16.2861 14.2949 H 13 TRP13 0.1331 179 HE3 22.0091 21.3419 14.4184 H 13 TRP13 0.0624 180 HZ2 18.2666 18.1510 13.8967 H 13 TRP13 0.0633 181 HZ3 19.7017 22.1750 14.1189 H 13 TRP13 0.0618 182 HH2 17.8296 20.5919 13.8366 H 13 TRP13 0.0618 183 N 27.0700 19.1170 15.8960 N.am 14 HIS14 -0.2453 184 CA 28.4220 19.6830 15.7570 C.3 14 HIS14 0.0932 185 C 29.4340 18.6280 15.3230 C.2 14 HIS14 0.2190 186 O 30.4650 18.9970 14.7890 O.2 14 HIS14 -0.2778 187 CB 28.8482 20.3489 17.0744 C.3 14 HIS14 0.0146 188 CG 28.9988 19.3220 18.1744 C.ar 14 HIS14 0.0551 189 ND1 27.9614 18.7613 18.8309 N.ar 14 HIS14 -0.2469 190 CD2 30.1894 18.7643 18.6680 C.ar 14 HIS14 0.0047 191 CE1 28.5052 17.9092 19.7167 C.ar 14 HIS14 0.0737 192 NE2 29.8475 17.8801 19.6323 N.ar 14 HIS14 -0.2539 193 H 26.6020 19.1540 16.8020 H 14 HIS14 0.1312 194 HA 28.3649 20.4315 14.9704 H 14 HIS14 0.0561 195 HB1 28.1049 21.0819 17.3851 H 14 HIS14 0.0348 196 HB2 29.7909 20.8822 16.9480 H 14 HIS14 0.0348 197 HD2 31.1890 19.0026 18.3343 H 14 HIS14 0.0764 198 HE1 27.9306 17.3221 20.4192 H 14 HIS14 0.0963 199 HE2 30.4582 17.3423 20.1784 H 14 HIS14 0.1339 200 N 29.1620 17.3540 15.5500 N.am 15 LYS15 -0.2456 201 CA 30.1110 16.2800 15.1640 C.3 15 LYS15 0.0878 202 C 30.1710 16.1760 13.6450 C.2 15 LYS15 0.2187 203 O 31.1690 15.6710 13.1330 O.2 15 LYS15 -0.2778 204 CB 29.4364 14.8744 15.4983 C.3 15 LYS15 -0.0289 205 CG 28.9650 14.4064 16.9163 C.3 15 LYS15 -0.0496 206 CD 27.9648 13.1855 16.8126 C.3 15 LYS15 -0.0278 207 CE 27.4527 12.5128 18.1317 C.3 15 LYS15 0.1103 208 NZ 26.3368 11.5150 18.0508 N.4 15 LYS15 -0.0749 209 H 28.2810 17.1040 16.0000 H 15 LYS15 0.1312 210 HA 31.0906 16.4446 15.6144 H 15 LYS15 0.0557 211 HB1 30.0872 14.0816 15.1225 H 15 LYS15 0.0285 212 HB2 28.5294 14.8025 14.8925 H 15 LYS15 0.0285 213 HG1 28.4957 15.2305 17.4519 H 15 LYS15 0.0266 214 HG2 29.8360 14.1264 17.5092 H 15 LYS15 0.0266 215 HD1 28.4312 12.4119 16.2016 H 15 LYS15 0.0282 216 HD2 27.0978 13.5143 16.2395 H 15 LYS15 0.0282 217 HE1 27.1368 13.2997 18.8172 H 15 LYS15 0.0559 218 HE2 28.2908 12.0171 18.6246 H 15 LYS15 0.0559 219 HZ1 26.0611 11.1672 18.9979 H 15 LYS15 0.2742 220 HZ2 26.5921 10.6775 17.4886 H 15 LYS15 0.2742 221 HZ3 25.4705 11.9316 17.6522 H 15 LYS15 0.2742 222 N 29.1280 16.6350 12.9590 N.am 16 LEU16 -0.2456 223 CA 29.0620 16.6560 11.4830 C.3 16 LEU16 0.0880 224 C 29.3900 18.0520 10.9440 C.2 16 LEU16 0.2187 225 O 30.1540 18.1830 9.9850 O.2 16 LEU16 -0.2778 226 CB 27.6294 16.2689 11.0732 C.3 16 LEU16 -0.0266 227 CG 27.1388 14.9323 11.6579 C.3 16 LEU16 -0.0449 228 CD1 25.6420 14.7485 11.3896 C.3 16 LEU16 -0.0626 229 CD2 27.9446 13.7415 11.1237 C.3 16 LEU16 -0.0626 230 H 28.3280 16.9930 13.4820 H 16 LEU16 0.1312 231 HA 29.7925 15.9507 11.0837 H 16 LEU16 0.0557 232 HB1 27.5471 16.2478 9.9857 H 16 LEU16 0.0287 233 HB2 26.9472 17.0465 11.4176 H 16 LEU16 0.0287 234 HG 27.2536 14.9544 12.7420 H 16 LEU16 0.0296 235 HD11 25.2781 13.8480 11.8804 H 16 LEU16 0.0232 236 HD12 25.4313 14.6675 10.3233 H 16 LEU16 0.0232 237 HD13 25.0690 15.5884 11.7841 H 16 LEU16 0.0232 238 HD21 27.5693 12.8021 11.5302 H 16 LEU16 0.0232 239 HD22 28.9960 13.8185 11.4017 H 16 LEU16 0.0232 240 HD23 27.8889 13.6828 10.0366 H 16 LEU16 0.0232 241 N 28.7840 19.0800 11.5380 N.am 17 TYR17 -0.2453 242 CA 28.8680 20.4710 11.0680 C.3 17 TYR17 0.0920 243 C 29.4150 21.3130 12.2010 C.2 17 TYR17 0.2217 244 O 28.6490 21.7820 13.0500 O.2 17 TYR17 -0.2776 245 CB 27.4730 20.9614 10.6446 C.3 17 TYR17 -0.0036 246 CG 27.0770 20.3581 9.3244 C.ar 17 TYR17 -0.0453 247 CD1 27.4719 20.9603 8.1332 C.ar 17 TYR17 -0.0561 248 CD2 26.3645 19.1652 9.2739 C.ar 17 TYR17 -0.0561 249 CE1 27.1589 20.3791 6.9112 C.ar 17 TYR17 -0.0317 250 CE2 26.0616 18.5759 8.0534 C.ar 17 TYR17 -0.0317 251 CZ 26.4482 19.1894 6.8712 C.ar 17 TYR17 0.0726 252 OH 26.1182 18.6250 5.6571 O.3 17 TYR17 -0.3598 253 H 28.2270 18.8900 12.3710 H 17 TYR17 0.1312 254 HA 29.5362 20.5277 10.2087 H 17 TYR17 0.0560 255 HB1 27.4605 22.0474 10.5389 H 17 TYR17 0.0333 256 HB2 26.7304 20.7161 11.4054 H 17 TYR17 0.0333 257 HD1 28.0302 21.8854 8.1535 H 17 TYR17 0.0621 258 HD2 26.0511 18.6887 10.1903 H 17 TYR17 0.0621 259 HE1 27.4604 20.8534 5.9891 H 17 TYR17 0.0643 260 HE2 25.5071 17.6508 8.0236 H 17 TYR17 0.0643 261 HH 25.6301 17.8265 5.7967 H 17 TYR17 0.2173 262 N 30.7400 21.5440 12.2500 N.am 18 PRO18 -0.2316 263 CA 31.3040 22.2870 13.3650 C.3 18 PRO18 0.0907 264 C 30.7700 23.7140 13.5010 C.2 18 PRO18 0.2189 265 O 30.8440 24.2670 14.5950 O.2 18 PRO18 -0.2778 266 CB 32.8094 22.3020 13.0529 C.3 18 PRO18 -0.0276 267 CG 33.0306 21.1505 12.0756 C.3 18 PRO18 -0.0379 268 CD 31.7235 21.0467 11.2940 C.3 18 PRO18 0.0071 269 HA 31.0911 21.7188 14.2721 H 18 PRO18 0.0559 270 HB1 33.4195 22.2088 13.9515 H 18 PRO18 0.0285 271 HB2 33.0996 23.2307 12.5577 H 18 PRO18 0.0285 272 HG1 33.1873 20.2279 12.6362 H 18 PRO18 0.0278 273 HG2 33.8970 21.2994 11.4310 H 18 PRO18 0.0278 274 HD1 31.6971 21.7007 10.4214 H 18 PRO18 0.0431 275 HD2 31.5068 20.0154 11.0166 H 18 PRO18 0.0431 276 N 30.2260 24.2810 12.4200 N.am 19 ILE19 -0.2454 277 CA 29.6290 25.6420 12.5150 C.3 19 ILE19 0.0903 278 C 28.4310 25.6290 13.4650 C.2 19 ILE19 0.2189 279 O 27.9810 26.7270 13.8670 O.2 19 ILE19 -0.2778 280 CB 29.2681 26.1482 11.0990 C.3 19 ILE19 -0.0201 281 CG1 28.9267 27.6514 11.0524 C.3 19 ILE19 -0.0514 282 CG2 28.1325 25.3327 10.4622 C.3 19 ILE19 -0.0605 283 CD1 30.0689 28.5623 11.5161 C.3 19 ILE19 -0.0650 284 H 30.2200 23.7820 11.5310 H 19 ILE19 0.1312 285 HA 30.3962 26.2787 12.9565 H 19 ILE19 0.0560 286 HB 30.1528 26.0075 10.4770 H 19 ILE19 0.0318 287 HG11 28.0362 27.8625 11.6423 H 19 ILE19 0.0266 288 HG12 28.6698 27.9233 10.0282 H 19 ILE19 0.0266 289 HG21 27.9661 25.6303 9.4265 H 19 ILE19 0.0233 290 HG22 27.2020 25.5014 11.0005 H 19 ILE19 0.0233 291 HG23 28.3429 24.2636 10.4700 H 19 ILE19 0.0233 292 HD11 29.8112 29.6101 11.3614 H 19 ILE19 0.0230 293 HD12 30.9859 28.3618 10.9628 H 19 ILE19 0.0230 294 HD13 30.2769 28.4388 12.5780 H 19 ILE19 0.0230 295 N 27.9430 24.4540 13.8610 N.am 20 ALA20 -0.2459 296 CA 26.9030 24.3770 14.9040 C.3 20 ALA20 0.0850 297 C 27.2780 25.1940 16.1330 C.2 20 ALA20 0.2184 298 O 26.3800 25.5960 16.8710 O.2 20 ALA20 -0.2778 299 CB 26.7164 22.9090 15.3020 C.3 20 ALA20 -0.0411 300 H 28.2940 23.5950 13.4360 H 20 ALA20 0.1312 301 HA 25.9971 24.7997 14.4721 H 20 ALA20 0.0554 302 HB1 25.9198 22.7885 16.0366 H 20 ALA20 0.0249 303 HB2 27.6361 22.5142 15.7308 H 20 ALA20 0.0249 304 HB3 26.4732 22.2884 14.4412 H 20 ALA20 0.0249 305 N 28.5720 25.3050 16.4080 N.am 21 GLN21 -0.2456 306 CA 29.1150 26.0690 17.5740 C.3 21 GLN21 0.0882 307 C 29.6580 27.4530 17.1540 C.2 21 GLN21 0.2185 308 O 30.4280 28.0560 17.9260 O.2 21 GLN21 -0.2778 309 CB 30.2301 25.2281 18.2246 C.3 21 GLN21 -0.0210 310 CG 29.8050 23.7969 18.6065 C.3 21 GLN21 0.0225 311 CD 28.6998 23.7737 19.6732 C.2 21 GLN21 0.1981 312 OE1 28.3498 24.7825 20.2695 O.2 21 GLN21 -0.2798 313 NE2 28.1741 22.5565 19.8758 N.am 21 GLN21 -0.2724 314 H 29.2350 24.8420 15.7870 H 21 GLN21 0.1312 315 HA 28.3016 26.2409 18.2793 H 21 GLN21 0.0557 316 HB1 30.6123 25.7398 19.1093 H 21 GLN21 0.0289 317 HB2 31.0697 25.1586 17.5311 H 21 GLN21 0.0289 318 HG1 30.6616 23.2529 19.0038 H 21 GLN21 0.0356 319 HG2 29.4624 23.2445 17.7318 H 21 GLN21 0.0356 320 HE21 27.4460 22.4522 20.5527 H 21 GLN21 0.1266 321 HE22 28.4896 21.7501 19.3777 H 21 GLN21 0.1266 322 N 29.1790 28.0010 16.0370 N.am 22 GLY22 -0.2485 323 CA 29.6090 29.3080 15.5280 C.3 22 GLY22 0.0765 324 C 29.0440 30.4860 16.2860 C.2 22 GLY22 0.2155 325 O 28.3100 30.3190 17.2810 O.2 22 GLY22 -0.2781 326 H 28.4760 27.4840 15.5080 H 22 GLY22 0.1309 327 HA1 29.2703 29.3664 14.4921 H 22 GLY22 0.0521 328 HA2 30.6991 29.3455 15.5368 H 22 GLY22 0.0521 329 N 29.3510 31.6630 15.7600 N.am 23 ASP23 -0.2454 330 CA 29.0110 32.9430 16.4050 C.3 23 ASP23 0.0974 331 C 27.6780 33.5150 15.9580 C.2 23 ASP23 0.2192 332 O 27.2660 34.5230 16.5410 O.2 23 ASP23 -0.2778 333 CB 30.2218 33.8936 16.3354 C.3 23 ASP23 0.0576 334 CG 31.3191 33.3261 17.2625 C.2 23 ASP23 0.1780 335 OD1 31.8845 32.2755 16.9813 O.co2 23 ASP23 -0.6478 336 OD2 31.6037 33.8966 18.3111 O.co2 23 ASP23 -0.6478 337 H 29.8450 31.6840 14.8680 H 23 ASP23 0.1312 338 HA 28.8060 32.7037 17.4343 H 23 ASP23 0.0563 339 HB1 29.9629 34.8959 16.6758 H 23 ASP23 0.0394 340 HB2 30.6095 33.9717 15.3202 H 23 ASP23 0.0394 341 N 27.0310 32.8850 14.9790 N.am 24 ARG24 -0.2456 342 CA 25.8290 33.4550 14.3300 C.3 24 ARG24 0.0879 343 C 24.7510 32.3650 14.2290 C.2 24 ARG24 0.2187 344 O 24.0420 32.3230 13.2380 O.2 24 ARG24 -0.2778 345 CB 26.2331 34.1983 13.0304 C.3 24 ARG24 -0.0258 346 CG 25.0939 34.8545 12.2352 C.3 24 ARG24 -0.0154 347 CD 25.5217 35.5158 10.9181 C.3 24 ARG24 0.1045 348 NE 24.3401 35.5707 10.0495 N.pl3 24 ARG24 -0.4450 349 CZ 24.2939 36.0501 8.8149 C.cat 24 ARG24 0.5062 350 NH1 25.3646 36.5122 8.2417 N.pl3 24 ARG24 -0.4573 351 NH2 23.1635 36.0584 8.1614 N.pl3 24 ARG24 -0.4573 352 H 27.3760 31.9780 14.6650 H 24 ARG24 0.1312 353 HA 25.4297 34.2023 15.0059 H 24 ARG24 0.0557 354 HB1 26.7490 33.5253 12.3664 H 24 ARG24 0.0286 355 HB2 26.9702 34.9596 13.2867 H 24 ARG24 0.0286 356 HG1 24.5641 35.5690 12.8610 H 24 ARG24 0.0299 357 HG2 24.3843 34.0893 11.9505 H 24 ARG24 0.0299 358 HD1 26.2909 34.9285 10.4100 H 24 ARG24 0.0711 359 HD2 25.9048 36.5252 11.0810 H 24 ARG24 0.0711 360 HE 23.4803 35.1872 10.3831 H 24 ARG24 0.3153 361 HH11 25.3006 36.9060 7.3286 H 24 ARG24 0.3114 362 HH12 26.2386 36.4546 8.7168 H 24 ARG24 0.3114 363 HH21 23.1241 36.4147 7.2260 H 24 ARG24 0.3114 364 HH22 22.3281 35.7032 8.5781 H 24 ARG24 0.3114 365 N 24.5850 31.5310 15.2610 N.am 25 GLN25 -0.2456 366 CA 23.6710 30.3780 15.1690 C.3 25 GLN25 0.0882 367 C 22.2480 30.7380 15.6150 C.2 25 GLN25 0.2187 368 O 22.0360 31.6270 16.4660 O.2 25 GLN25 -0.2778 369 CB 24.2832 29.2071 15.9561 C.3 25 GLN25 -0.0210 370 CG 25.5301 28.6201 15.2578 C.3 25 GLN25 0.0225 371 CD 25.1354 27.8310 13.9948 C.2 25 GLN25 0.1981 372 OE1 24.3710 26.8789 14.0501 O.2 25 GLN25 -0.2798 373 NE2 25.6831 28.2670 12.8618 N.am 25 GLN25 -0.2724 374 H 25.0990 31.6950 16.1260 H 25 GLN25 0.1312 375 HA 23.6154 30.0907 14.1181 H 25 GLN25 0.0557 376 HB1 23.5446 28.4179 16.1034 H 25 GLN25 0.0289 377 HB2 24.5568 29.5512 16.9540 H 25 GLN25 0.0289 378 HG1 26.0504 27.9362 15.9260 H 25 GLN25 0.0356 379 HG2 26.2483 29.3993 14.9991 H 25 GLN25 0.0356 380 HE21 25.4822 27.8337 11.9858 H 25 GLN25 0.1266 381 HE22 26.3225 29.0368 12.8645 H 25 GLN25 0.1266 382 N 21.2950 30.0410 15.0450 N.am 26 SER26 -0.2436 383 CA 19.8740 30.2050 15.3130 C.3 26 SER26 0.1111 384 C 19.2940 28.8740 15.7150 C.2 26 SER26 0.2236 385 O 19.8040 27.7950 15.3440 O.2 26 SER26 -0.2775 386 CB 19.1586 30.6536 14.0288 C.3 26 SER26 0.0681 387 OG 19.5073 31.9966 13.7211 O.3 26 SER26 -0.3930 388 H 21.5690 29.3330 14.3650 H 26 SER26 0.1312 389 HA 19.7367 30.9312 16.1131 H 26 SER26 0.0580 390 HB1 18.0701 30.5446 14.1360 H 26 SER26 0.0577 391 HB2 19.4522 30.0024 13.2016 H 26 SER26 0.0577 392 HG 18.8957 32.3438 13.0705 H 26 SER26 0.2095 393 N 18.1480 28.8510 16.4010 N.am 27 PRO27 -0.2315 394 CA 17.3920 30.0090 16.8860 C.3 27 PRO27 0.0907 395 C 18.0280 30.6010 18.1510 C.2 27 PRO27 0.2189 396 O 19.0700 30.1300 18.6180 O.2 27 PRO27 -0.2778 397 CB 16.0419 29.3744 17.2389 C.3 27 PRO27 -0.0276 398 CG 16.4192 27.9734 17.7040 C.3 27 PRO27 -0.0379 399 CD 17.5431 27.5670 16.7569 C.3 27 PRO27 0.0071 400 HA 17.2975 30.7688 16.1137 H 27 PRO27 0.0559 401 HB1 15.4258 29.3040 16.3414 H 27 PRO27 0.0285 402 HB2 15.4640 29.9239 17.9808 H 27 PRO27 0.0285 403 HG1 15.5890 27.2769 17.7108 H 27 PRO27 0.0278 404 HG2 16.7953 28.0179 18.7236 H 27 PRO27 0.0278 405 HD1 18.2759 26.9221 17.2435 H 27 PRO27 0.0431 406 HD2 17.1597 27.1061 15.8441 H 27 PRO27 0.0431 407 N 17.3640 31.6030 18.7150 N.am 28 ILE28 -0.2454 408 CA 17.7590 32.2840 19.9690 C.3 28 ILE28 0.0903 409 C 16.5160 32.4260 20.8530 C.2 28 ILE28 0.2189 410 O 15.3600 32.3460 20.3930 O.2 28 ILE28 -0.2778 411 CB 18.4428 33.6441 19.6939 C.3 28 ILE28 -0.0201 412 CG1 17.4955 34.6692 19.0365 C.3 28 ILE28 -0.0514 413 CG2 19.7299 33.4496 18.8725 C.3 28 ILE28 -0.0605 414 CD1 18.0604 36.0941 19.0058 C.3 28 ILE28 -0.0650 415 H 16.5170 31.9280 18.2490 H 28 ILE28 0.1312 416 HA 18.4508 31.6223 20.4941 H 28 ILE28 0.0560 417 HB 18.7411 34.0535 20.6606 H 28 ILE28 0.0318 418 HG11 16.5495 34.7079 19.5767 H 28 ILE28 0.0266 419 HG12 17.2494 34.3454 18.0278 H 28 ILE28 0.0266 420 HG21 20.3045 34.3730 18.8054 H 28 ILE28 0.0233 421 HG22 19.5088 33.1206 17.8567 H 28 ILE28 0.0233 422 HG23 20.3750 32.6988 19.3305 H 28 ILE28 0.0233 423 HD11 17.3400 36.7830 18.5639 H 28 ILE28 0.0230 424 HD12 18.9765 36.1559 18.4203 H 28 ILE28 0.0230 425 HD13 18.2787 36.4482 20.0135 H 28 ILE28 0.0230 426 N 16.8010 32.6780 22.1140 N.am 29 ASN29 -0.2452 427 CA 15.8070 33.2190 23.0650 C.3 29 ASN29 0.0957 428 C 15.8360 34.7510 22.9530 C.2 29 ASN29 0.2191 429 O 16.8780 35.3940 23.1920 O.2 29 ASN29 -0.2778 430 CB 16.2283 32.7829 24.4773 C.3 29 ASN29 0.0446 431 CG 15.1481 33.0011 25.5436 C.2 29 ASN29 0.2000 432 OD1 14.6613 32.0482 26.1315 O.2 29 ASN29 -0.2797 433 ND2 14.8053 34.2797 25.7722 N.am 29 ASN29 -0.2723 434 H 17.7470 32.4920 22.4480 H 29 ASN29 0.1312 435 HA 14.8218 32.8351 22.7939 H 29 ASN29 0.0562 436 HB1 17.1424 33.2849 24.7953 H 29 ASN29 0.0375 437 HB2 16.4504 31.7159 24.4687 H 29 ASN29 0.0375 438 HD21 14.1085 34.4902 26.4579 H 29 ASN29 0.1266 439 HD22 15.2182 35.0457 25.2799 H 29 ASN29 0.1266 440 N 14.7050 35.3160 22.5570 N.am 30 ILE30 -0.2454 441 CA 14.5710 36.7780 22.4140 C.3 30 ILE30 0.0903 442 C 14.1700 37.3220 23.7760 C.2 30 ILE30 0.2189 443 O 13.0650 36.9820 24.2550 O.2 30 ILE30 -0.2778 444 CB 13.5092 37.0783 21.3347 C.3 30 ILE30 -0.0201 445 CG1 13.9218 36.4834 19.9695 C.3 30 ILE30 -0.0514 446 CG2 13.2393 38.5882 21.2313 C.3 30 ILE30 -0.0605 447 CD1 12.8311 36.5773 18.8939 C.3 30 ILE30 -0.0650 448 H 13.9030 34.7230 22.3450 H 30 ILE30 0.1312 449 HA 15.5365 37.1944 22.1208 H 30 ILE30 0.0560 450 HB 12.5776 36.5943 21.6352 H 30 ILE30 0.0318 451 HG11 14.1678 35.4280 20.0872 H 30 ILE30 0.0266 452 HG12 14.8316 36.9676 19.6132 H 30 ILE30 0.0266 453 HG21 12.4972 38.7967 20.4679 H 30 ILE30 0.0233 454 HG22 14.1449 39.1383 20.9811 H 30 ILE30 0.0233 455 HG23 12.8502 38.9954 22.1652 H 30 ILE30 0.0233 456 HD11 13.1306 36.0446 17.9912 H 30 ILE30 0.0230 457 HD12 12.6344 37.6094 18.6091 H 30 ILE30 0.0230 458 HD13 11.8959 36.1370 19.2416 H 30 ILE30 0.0230 459 N 15.0620 38.0660 24.4060 N.am 31 ILE31 -0.2454 460 CA 14.7560 38.7500 25.6720 C.3 31 ILE31 0.0903 461 C 14.1910 40.1040 25.2740 C.2 31 ILE31 0.2190 462 O 14.9290 40.9760 24.7840 O.2 31 ILE31 -0.2778 463 CB 15.9851 38.8446 26.5941 C.3 31 ILE31 -0.0201 464 CG1 16.5690 37.4440 26.8735 C.3 31 ILE31 -0.0514 465 CG2 15.5925 39.5502 27.9054 C.3 31 ILE31 -0.0605 466 CD1 17.9014 37.4744 27.6312 C.3 31 ILE31 -0.0650 467 H 15.9930 38.1690 24.0020 H 31 ILE31 0.1312 468 HA 13.9730 38.1842 26.1844 H 31 ILE31 0.0560 469 HB 16.7517 39.4356 26.0930 H 31 ILE31 0.0318 470 HG11 16.7364 36.9138 25.9360 H 31 ILE31 0.0266 471 HG12 15.8423 36.8498 27.4292 H 31 ILE31 0.0266 472 HG21 16.4332 39.6454 28.5877 H 31 ILE31 0.0233 473 HG22 14.8078 38.9975 28.4237 H 31 ILE31 0.0233 474 HG23 15.2114 40.5547 27.7211 H 31 ILE31 0.0233 475 HD11 18.2992 36.4667 27.7501 H 31 ILE31 0.0230 476 HD12 17.7902 37.9009 28.6273 H 31 ILE31 0.0230 477 HD13 18.6436 38.0628 27.0920 H 31 ILE31 0.0230 478 N 12.8860 40.2460 25.4030 N.am 32 SER32 -0.2436 479 CA 12.1720 41.3680 24.7530 C.3 32 SER32 0.1109 480 C 12.6880 42.7010 25.3310 C.2 32 SER32 0.2210 481 O 12.8900 43.6560 24.5520 O.2 32 SER32 -0.2777 482 CB 10.6549 41.2345 24.9466 C.3 32 SER32 0.0681 483 OG 10.2588 41.3524 26.3031 O.3 32 SER32 -0.3930 484 H 12.3610 39.5720 25.9600 H 32 SER32 0.1312 485 HA 12.4201 41.3280 23.6922 H 32 SER32 0.0580 486 HB1 10.2929 40.2932 24.5141 H 32 SER32 0.0577 487 HB2 10.1483 42.0274 24.3965 H 32 SER32 0.0577 488 HG 10.5492 40.5661 26.7787 H 32 SER32 0.2095 489 N 13.0370 42.7600 26.6230 N.am 33 SER33 -0.2435 490 CA 13.5390 44.0020 27.2690 C.3 33 SER33 0.1109 491 C 14.9420 44.3660 26.7750 C.2 33 SER33 0.2209 492 O 15.3770 45.5070 26.9800 O.2 33 SER33 -0.2777 493 CB 13.5545 43.7851 28.7883 C.3 33 SER33 0.0681 494 OG 14.5387 42.8206 29.1529 O.3 33 SER33 -0.3930 495 H 12.9550 41.9160 27.1890 H 33 SER33 0.1312 496 HA 12.8523 44.8050 27.0006 H 33 SER33 0.0580 497 HB1 12.5526 43.4637 29.0984 H 33 SER33 0.0577 498 HB2 13.7734 44.7311 29.2921 H 33 SER33 0.0577 499 HG 14.4212 42.5232 30.0514 H 33 SER33 0.2095 500 N 15.6460 43.4290 26.1470 N.am 34 GLN34 -0.2456 501 CA 17.0370 43.6440 25.6910 C.3 34 GLN34 0.0882 502 C 17.1090 43.8830 24.1790 C.2 34 GLN34 0.2187 503 O 18.1830 44.1860 23.6620 O.2 34 GLN34 -0.2778 504 CB 17.8858 42.4232 26.0722 C.3 34 GLN34 -0.0210 505 CG 17.9571 42.2149 27.5929 C.3 34 GLN34 0.0225 506 CD 18.8865 41.0488 27.9594 C.2 34 GLN34 0.1981 507 OE1 19.6078 40.5042 27.1348 O.2 34 GLN34 -0.2798 508 NE2 18.8241 40.7027 29.2531 N.am 34 GLN34 -0.2724 509 H 15.2090 42.5240 25.9720 H 34 GLN34 0.1312 510 HA 17.4361 44.5334 26.1808 H 34 GLN34 0.0557 511 HB1 18.8965 42.5519 25.6805 H 34 GLN34 0.0289 512 HB2 17.4797 41.5315 25.5932 H 34 GLN34 0.0289 513 HG1 16.9680 42.0181 28.0050 H 34 GLN34 0.0356 514 HG2 18.3335 43.1144 28.0791 H 34 GLN34 0.0356 515 HE21 19.3990 39.9569 29.5858 H 34 GLN34 0.1266 516 HE22 18.2086 41.1754 29.8823 H 34 GLN34 0.1266 517 N 16.0030 43.7750 23.4600 N.am 35 ALA35 -0.2459 518 CA 15.9640 44.1390 22.0270 C.3 35 ALA35 0.0850 519 C 16.0330 45.6640 21.8850 C.2 35 ALA35 0.2184 520 O 15.5850 46.3810 22.8170 O.2 35 ALA35 -0.2778 521 CB 14.6879 43.5770 21.3916 C.3 35 ALA35 -0.0411 522 H 15.1530 43.4310 23.9070 H 35 ALA35 0.1312 523 HA 16.8430 43.6901 21.5650 H 35 ALA35 0.0554 524 HB1 14.6565 43.7863 20.3220 H 35 ALA35 0.0249 525 HB2 13.7945 44.0027 21.8502 H 35 ALA35 0.0249 526 HB3 14.6391 42.4950 21.5181 H 35 ALA35 0.0249 527 N 16.6740 46.1560 20.8200 N.am 36 VAL36 -0.2454 528 CA 16.9360 47.6070 20.5720 C.3 36 VAL36 0.0901 529 C 15.8510 48.0740 19.6030 C.2 36 VAL36 0.2189 530 O 15.7740 47.5840 18.4950 O.2 36 VAL36 -0.2778 531 CB 18.3433 47.7650 19.9594 C.3 36 VAL36 -0.0227 532 CG1 18.6573 49.2281 19.6071 C.3 36 VAL36 -0.0608 533 CG2 19.4224 47.2003 20.8956 C.3 36 VAL36 -0.0608 534 H 17.0100 45.4910 20.1240 H 36 VAL36 0.1312 535 HA 16.8523 48.1417 21.5205 H 36 VAL36 0.0560 536 HB 18.3815 47.1817 19.0380 H 36 VAL36 0.0315 537 HG11 19.6607 49.3248 19.1927 H 36 VAL36 0.0233 538 HG12 18.6034 49.8612 20.4935 H 36 VAL36 0.0233 539 HG13 17.9582 49.6274 18.8724 H 36 VAL36 0.0233 540 HG21 20.4193 47.3385 20.4772 H 36 VAL36 0.0233 541 HG22 19.2896 46.1315 21.0684 H 36 VAL36 0.0233 542 HG23 19.3993 47.6970 21.8662 H 36 VAL36 0.0233 543 N 15.0240 49.0100 20.0260 N.am 37 TYR37 -0.2453 544 CA 14.0470 49.6430 19.1180 C.3 37 TYR37 0.0917 545 C 14.8150 50.3410 17.9890 C.2 37 TYR37 0.2191 546 O 15.7170 51.1550 18.2660 O.2 37 TYR37 -0.2778 547 CB 13.1895 50.6216 19.9295 C.3 37 TYR37 -0.0036 548 CG 12.2430 51.4206 19.0735 C.ar 37 TYR37 -0.0453 549 CD1 11.2688 50.7870 18.3078 C.ar 37 TYR37 -0.0561 550 CD2 12.3486 52.8061 19.0219 C.ar 37 TYR37 -0.0561 551 CE1 10.3869 51.5294 17.5329 C.ar 37 TYR37 -0.0317 552 CE2 11.4790 53.5475 18.2369 C.ar 37 TYR37 -0.0317 553 CZ 10.4800 52.9130 17.5144 C.ar 37 TYR37 0.0726 554 OH 9.5679 53.6662 16.8029 O.3 37 TYR37 -0.3598 555 H 15.0600 49.3030 21.0020 H 37 TYR37 0.1312 556 HA 13.4318 48.8428 18.7038 H 37 TYR37 0.0560 557 HB1 13.8360 51.2987 20.4897 H 37 TYR37 0.0333 558 HB2 12.6088 50.0705 20.6701 H 37 TYR37 0.0333 559 HD1 11.1966 49.7089 18.3124 H 37 TYR37 0.0621 560 HD2 13.1211 53.3115 19.5838 H 37 TYR37 0.0621 561 HE1 9.6249 51.0307 16.9524 H 37 TYR37 0.0643 562 HE2 11.5780 54.6210 18.1893 H 37 TYR37 0.0643 563 HH 9.3040 53.1793 16.0286 H 37 TYR37 0.2173 564 N 14.5070 50.0250 16.7360 N.am 38 SER38 -0.2436 565 CA 15.2910 50.4820 15.5650 C.3 38 SER38 0.1111 566 C 14.3340 51.1840 14.5990 C.2 38 SER38 0.2236 567 O 13.8600 50.5970 13.6470 O.2 38 SER38 -0.2775 568 CB 15.9848 49.2631 14.9530 C.3 38 SER38 0.0681 569 OG 16.9579 48.7440 15.8534 O.3 38 SER38 -0.3930 570 H 13.6890 49.4380 16.5720 H 38 SER38 0.1312 571 HA 16.0530 51.1884 15.8895 H 38 SER38 0.0580 572 HB1 16.4911 49.5397 14.0266 H 38 SER38 0.0577 573 HB2 15.2530 48.4908 14.6971 H 38 SER38 0.0577 574 HG 16.5152 48.5176 16.6757 H 38 SER38 0.2095 575 N 13.9940 52.4780 14.8290 N.am 39 PRO39 -0.2315 576 CA 13.0230 53.1720 13.9810 C.3 39 PRO39 0.0907 577 C 13.5440 53.4820 12.5660 C.2 39 PRO39 0.2190 578 O 12.7430 53.8290 11.7310 O.2 39 PRO39 -0.2778 579 CB 12.7398 54.4584 14.7649 C.3 39 PRO39 -0.0276 580 CG 13.9884 54.6898 15.6141 C.3 39 PRO39 -0.0379 581 CD 14.5373 53.2934 15.9109 C.3 39 PRO39 0.0071 582 HA 12.1285 52.5528 13.8946 H 39 PRO39 0.0559 583 HB1 11.8855 54.2934 15.4193 H 39 PRO39 0.0285 584 HB2 12.4958 55.3142 14.1335 H 39 PRO39 0.0285 585 HG1 13.7837 55.2626 16.5186 H 39 PRO39 0.0278 586 HG2 14.7195 55.2475 15.0274 H 39 PRO39 0.0278 587 HD1 15.6271 53.2743 15.8891 H 39 PRO39 0.0431 588 HD2 14.1619 52.8900 16.8504 H 39 PRO39 0.0431 589 N 14.8440 53.3130 12.3170 N.am 40 SER40 -0.2436 590 CA 15.4630 53.4580 10.9720 C.3 40 SER40 0.1109 591 C 15.0200 52.3170 10.0350 C.2 40 SER40 0.2209 592 O 14.9760 52.5680 8.8150 O.2 40 SER40 -0.2777 593 CB 16.9914 53.4974 11.0996 C.3 40 SER40 0.0681 594 OG 17.4878 52.3678 11.8180 O.3 40 SER40 -0.3930 595 H 15.4520 53.0690 13.0990 H 40 SER40 0.1312 596 HA 15.0955 54.3946 10.5499 H 40 SER40 0.0580 597 HB1 17.2688 54.4146 11.6291 H 40 SER40 0.0577 598 HB2 17.4321 53.5532 10.0961 H 40 SER40 0.0577 599 HG 18.4413 52.3515 11.7958 H 40 SER40 0.2095 600 N 14.6910 51.1230 10.5590 N.am 41 LEU41 -0.2456 601 CA 14.1570 49.9790 9.7610 C.3 41 LEU41 0.0880 602 C 12.9580 50.4580 8.9290 C.2 41 LEU41 0.2187 603 O 12.1420 51.2320 9.4560 O.2 41 LEU41 -0.2778 604 CB 13.7306 48.8271 10.6885 C.3 41 LEU41 -0.0266 605 CG 14.8811 48.1858 11.4887 C.3 41 LEU41 -0.0449 606 CD1 14.3344 47.2338 12.5618 C.3 41 LEU41 -0.0626 607 CD2 15.8542 47.4281 10.5759 C.3 41 LEU41 -0.0626 608 H 14.8140 50.9900 11.5630 H 41 LEU41 0.1312 609 HA 14.9484 49.6714 9.0778 H 41 LEU41 0.0557 610 HB1 13.2435 48.0546 10.0937 H 41 LEU41 0.0287 611 HB2 12.9740 49.1989 11.3814 H 41 LEU41 0.0287 612 HG 15.4297 48.9775 11.9979 H 41 LEU41 0.0296 613 HD11 15.1392 46.8176 13.1671 H 41 LEU41 0.0232 614 HD12 13.8083 46.3954 12.1108 H 41 LEU41 0.0232 615 HD13 13.6361 47.7424 13.2275 H 41 LEU41 0.0232 616 HD21 16.6588 46.9710 11.1519 H 41 LEU41 0.0232 617 HD22 16.3121 48.0841 9.8364 H 41 LEU41 0.0232 618 HD23 15.3363 46.6312 10.0419 H 41 LEU41 0.0232 619 N 12.8580 49.9910 7.6790 N.am 42 GLN42 -0.2456 620 CA 11.7050 50.2270 6.7520 C.3 42 GLN42 0.0885 621 C 10.5350 49.3360 7.1490 C.2 42 GLN42 0.2214 622 O 10.7460 48.3560 7.8570 O.2 42 GLN42 -0.2776 623 CB 12.1492 49.9262 5.3094 C.3 42 GLN42 -0.0210 624 CG 13.4005 50.7037 4.8633 C.3 42 GLN42 0.0225 625 CD 13.1905 52.2242 4.9190 C.2 42 GLN42 0.1981 626 OE1 12.7046 52.8398 3.9814 O.2 42 GLN42 -0.2798 627 NE2 13.5883 52.7928 6.0675 N.am 42 GLN42 -0.2724 628 H 13.6320 49.4270 7.3280 H 42 GLN42 0.1312 629 HA 11.4316 51.2739 6.8707 H 42 GLN42 0.0557 630 HB1 11.3304 50.1321 4.6183 H 42 GLN42 0.0289 631 HB2 12.3598 48.8602 5.2141 H 42 GLN42 0.0289 632 HG1 13.6492 50.4401 3.8355 H 42 GLN42 0.0356 633 HG2 14.2667 50.4387 5.4697 H 42 GLN42 0.0356 634 HE21 13.4984 53.7815 6.1772 H 42 GLN42 0.1266 635 HE22 13.9698 52.2590 6.8225 H 42 GLN42 0.1266 636 N 9.2670 49.6980 6.8290 N.am 43 PRO43 -0.2316 637 CA 8.1530 48.7850 7.0550 C.3 43 PRO43 0.0907 638 C 8.3720 47.4450 6.3490 C.2 43 PRO43 0.2189 639 O 8.8020 47.3810 5.2430 O.2 43 PRO43 -0.2778 640 CB 6.9591 49.5364 6.4435 C.3 43 PRO43 -0.0276 641 CG 7.3799 51.0044 6.4132 C.3 43 PRO43 -0.0379 642 CD 8.8965 50.9747 6.2306 C.3 43 PRO43 0.0071 643 HA 8.0530 48.6585 8.1335 H 43 PRO43 0.0559 644 HB1 6.0363 49.3764 7.0007 H 43 PRO43 0.0285 645 HB2 6.7772 49.2141 5.4156 H 43 PRO43 0.0285 646 HG1 7.1403 51.4687 7.3702 H 43 PRO43 0.0278 647 HG2 6.8748 51.5713 5.6308 H 43 PRO43 0.0278 648 HD1 9.1888 50.9424 5.1797 H 43 PRO43 0.0431 649 HD2 9.3860 51.8000 6.7479 H 43 PRO43 0.0431 650 N 7.9980 46.3950 7.0450 N.am 44 LEU44 -0.2456 651 CA 8.0720 45.0260 6.5090 C.3 44 LEU44 0.0880 652 C 6.8650 44.7640 5.6180 C.2 44 LEU44 0.2187 653 O 5.7130 44.9220 6.0640 O.2 44 LEU44 -0.2778 654 CB 8.0981 44.0417 7.6929 C.3 44 LEU44 -0.0266 655 CG 8.1564 42.5482 7.3109 C.3 44 LEU44 -0.0449 656 CD1 9.4790 42.1979 6.6167 C.3 44 LEU44 -0.0626 657 CD2 7.9479 41.6623 8.5473 C.3 44 LEU44 -0.0626 658 H 7.6430 46.5340 7.9910 H 44 LEU44 0.1312 659 HA 8.9883 44.9457 5.9189 H 44 LEU44 0.0557 660 HB1 7.2225 44.2193 8.3190 H 44 LEU44 0.0287 661 HB2 8.9615 44.2758 8.3127 H 44 LEU44 0.0287 662 HG 7.3434 42.3246 6.6192 H 44 LEU44 0.0296 663 HD11 9.5474 41.1283 6.4190 H 44 LEU44 0.0232 664 HD12 10.3335 42.4784 7.2328 H 44 LEU44 0.0232 665 HD13 9.5753 42.7124 5.6612 H 44 LEU44 0.0232 666 HD21 7.9391 40.6063 8.2751 H 44 LEU44 0.0232 667 HD22 7.0014 41.8862 9.0403 H 44 LEU44 0.0232 668 HD23 8.7451 41.8096 9.2753 H 44 LEU44 0.0232 669 N 7.1340 44.3140 4.4020 N.am 45 GLU45 -0.2456 670 CA 6.0740 44.0180 3.4300 C.3 45 GLU45 0.0883 671 C 6.2320 42.5810 2.9760 C.2 45 GLU45 0.2187 672 O 7.2870 42.2000 2.4690 O.2 45 GLU45 -0.2778 673 CB 6.1599 44.9971 2.2295 C.3 45 GLU45 -0.0193 674 CG 7.2384 46.0975 2.3542 C.3 45 GLU45 0.0356 675 CD 7.2635 47.0037 1.1138 C.2 45 GLU45 0.1760 676 OE1 8.2843 47.0491 0.4259 O.co2 45 GLU45 -0.6478 677 OE2 6.2571 47.6573 0.8503 O.co2 45 GLU45 -0.6478 678 H 8.1070 44.1690 4.1320 H 45 GLU45 0.1312 679 HA 5.1021 44.1301 3.9122 H 45 GLU45 0.0557 680 HB1 5.1897 45.4798 2.1076 H 45 GLU45 0.0290 681 HB2 6.3125 44.4550 1.2954 H 45 GLU45 0.0290 682 HG1 8.2302 45.6671 2.4852 H 45 GLU45 0.0374 683 HG2 7.0472 46.7321 3.2184 H 45 GLU45 0.0374 684 N 5.1940 41.8090 3.1900 N.am 46 LEU46 -0.2456 685 CA 5.0940 40.4190 2.7180 C.3 46 LEU46 0.0880 686 C 4.1190 40.4620 1.5510 C.2 46 LEU46 0.2187 687 O 2.9080 40.4800 1.7600 O.2 46 LEU46 -0.2778 688 CB 4.6118 39.5369 3.8884 C.3 46 LEU46 -0.0266 689 CG 5.5721 39.5525 5.0996 C.3 46 LEU46 -0.0449 690 CD1 4.9233 38.9492 6.3510 C.3 46 LEU46 -0.0626 691 CD2 6.8856 38.8247 4.7958 C.3 46 LEU46 -0.0626 692 H 4.4090 42.1950 3.7150 H 46 LEU46 0.1312 693 HA 6.0657 40.0904 2.3442 H 46 LEU46 0.0557 694 HB1 4.4690 38.5119 3.5475 H 46 LEU46 0.0287 695 HB2 3.6313 39.8876 4.2122 H 46 LEU46 0.0287 696 HG 5.8182 40.5874 5.3402 H 46 LEU46 0.0296 697 HD11 5.6115 38.9696 7.1971 H 46 LEU46 0.0232 698 HD12 4.6395 37.9109 6.1797 H 46 LEU46 0.0232 699 HD13 4.0327 39.5047 6.6399 H 46 LEU46 0.0232 700 HD21 7.6190 39.0132 5.5798 H 46 LEU46 0.0232 701 HD22 7.3192 39.1515 3.8534 H 46 LEU46 0.0232 702 HD23 6.7362 37.7483 4.7316 H 46 LEU46 0.0232 703 N 4.6470 40.5810 0.3360 N.am 47 SER47 -0.2436 704 CA 3.8590 40.7770 -0.9030 C.3 47 SER47 0.1109 705 C 3.7500 39.4280 -1.6020 C.2 47 SER47 0.2209 706 O 4.6580 39.0600 -2.3790 O.2 47 SER47 -0.2777 707 CB 4.5764 41.8237 -1.7629 C.3 47 SER47 0.0681 708 OG 4.5205 43.0566 -1.0582 O.3 47 SER47 -0.3930 709 H 5.6620 40.5340 0.2520 H 47 SER47 0.1312 710 HA 2.8635 41.1370 -0.6396 H 47 SER47 0.0580 711 HB1 4.0801 41.9318 -2.7323 H 47 SER47 0.0577 712 HB2 5.6148 41.5159 -1.9368 H 47 SER47 0.0577 713 HG 5.0727 43.7247 -1.4625 H 47 SER47 0.2095 714 N 2.6970 38.6970 -1.2590 N.am 48 TYR48 -0.2453 715 CA 2.5000 37.3060 -1.6710 C.3 48 TYR48 0.0917 716 C 1.3140 37.1710 -2.6030 C.2 48 TYR48 0.2190 717 O 0.2090 37.6020 -2.2530 O.2 48 TYR48 -0.2778 718 CB 2.2854 36.4164 -0.4336 C.3 48 TYR48 -0.0036 719 CG 3.4240 36.3579 0.5642 C.ar 48 TYR48 -0.0453 720 CD1 4.7487 36.6480 0.2314 C.ar 48 TYR48 -0.0561 721 CD2 3.1527 35.9075 1.8533 C.ar 48 TYR48 -0.0561 722 CE1 5.7685 36.4702 1.1591 C.ar 48 TYR48 -0.0317 723 CE2 4.1711 35.6950 2.7709 C.ar 48 TYR48 -0.0317 724 CZ 5.4820 35.9704 2.4212 C.ar 48 TYR48 0.0726 725 OH 6.4953 35.7383 3.3265 O.3 48 TYR48 -0.3598 726 H 1.9830 39.1300 -0.6740 H 48 TYR48 0.1312 727 HA 3.3813 36.9827 -2.2262 H 48 TYR48 0.0560 728 HB1 2.0787 35.3942 -0.7539 H 48 TYR48 0.0333 729 HB2 1.3947 36.7577 0.0904 H 48 TYR48 0.0333 730 HD1 5.0176 36.9974 -0.7538 H 48 TYR48 0.0621 731 HD2 2.1404 35.6682 2.1326 H 48 TYR48 0.0621 732 HE1 6.7897 36.6948 0.8872 H 48 TYR48 0.0643 733 HE2 3.9456 35.3066 3.7531 H 48 TYR48 0.0643 734 HH 6.1890 35.1606 4.0133 H 48 TYR48 0.2173 735 N 1.5110 36.4450 -3.6960 N.am 49 GLU49 -0.2456 736 CA 0.4290 36.1130 -4.6410 C.3 49 GLU49 0.0883 737 C -0.2770 34.8460 -4.1670 C.2 49 GLU49 0.2187 738 O 0.2920 34.0590 -3.4000 O.2 49 GLU49 -0.2778 739 CB 0.1297 37.0050 -5.8656 C.3 49 GLU49 -0.0193 740 CG -0.1081 38.5182 -5.5289 C.3 49 GLU49 0.0356 741 CD -1.0889 38.8710 -4.3564 C.2 49 GLU49 0.1760 742 OE1 -0.8479 39.8423 -3.6433 O.co2 49 GLU49 -0.6478 743 OE2 -2.0822 38.1815 -4.1155 O.co2 49 GLU49 -0.6478 744 H 2.4510 36.1020 -3.8910 H 49 GLU49 0.1312 745 HA -0.3943 36.5751 -4.1259 H 49 GLU49 0.0557 746 HB1 -0.7542 36.6299 -6.3819 H 49 GLU49 0.0290 747 HB2 0.9492 36.9195 -6.5786 H 49 GLU49 0.0290 748 HG1 -0.4635 39.0404 -6.4159 H 49 GLU49 0.0374 749 HG2 0.8532 38.9685 -5.2804 H 49 GLU49 0.0374 750 N -1.4610 34.6050 -4.7170 N.am 50 ALA50 -0.2459 751 CA -2.3550 33.5680 -4.2070 C.3 50 ALA50 0.0850 752 C -2.0500 32.2250 -4.8500 C.2 50 ALA50 0.2184 753 O -2.4130 31.2300 -4.2340 O.2 50 ALA50 -0.2778 754 CB -3.8054 33.9831 -4.4732 C.3 50 ALA50 -0.0411 755 H -1.7550 35.1610 -5.5200 H 50 ALA50 0.1312 756 HA -2.1755 33.4647 -3.1412 H 50 ALA50 0.0554 757 HB1 -4.5078 33.2596 -4.0582 H 50 ALA50 0.0249 758 HB2 -4.0040 34.0710 -5.5420 H 50 ALA50 0.0249 759 HB3 -4.0192 34.9513 -4.0201 H 50 ALA50 0.0249 760 N -1.4730 32.1930 -6.0580 N.am 51 CYS51 -0.2448 761 CA -1.3380 30.9270 -6.8140 C.3 51 CYS51 0.0975 762 C 0.0940 30.7360 -7.3120 C.2 51 CYS51 0.2195 763 O 0.3430 30.5320 -8.5080 O.2 51 CYS51 -0.2778 764 CB -2.3647 30.8291 -7.9529 C.3 51 CYS51 0.0279 765 SG -4.1007 30.7077 -7.4338 S.3 51 CYS51 -0.0910 766 H -1.1190 33.0590 -6.4660 H 51 CYS51 0.1312 767 HA -1.4635 30.1038 -6.1256 H 51 CYS51 0.0566 768 HB1 -2.1517 29.9612 -8.5785 H 51 CYS51 0.0405 769 HB2 -2.2639 31.6998 -8.6015 H 51 CYS51 0.0405 770 N 1.0430 30.7330 -6.3820 N.am 52 MET52 -0.2456 771 CA 2.4520 30.4000 -6.7200 C.3 52 MET52 0.0886 772 C 2.8960 29.1070 -5.9920 C.2 52 MET52 0.2188 773 O 4.0460 28.6840 -6.1790 O.2 52 MET52 -0.2778 774 CB 3.3597 31.6029 -6.4582 C.3 52 MET52 -0.0199 775 CG 3.0949 32.6917 -7.5091 C.3 52 MET52 -0.0047 776 SD 4.2026 34.1016 -7.3803 S.3 52 MET52 -0.1641 777 CE 5.7808 33.3071 -7.7446 C.3 52 MET52 -0.0181 778 H 0.8000 30.9630 -5.4180 H 52 MET52 0.1312 779 HA 2.5170 30.1455 -7.7791 H 52 MET52 0.0557 780 HB1 4.4063 31.2990 -6.5057 H 52 MET52 0.0293 781 HB2 3.1841 31.9755 -5.4505 H 52 MET52 0.0293 782 HG1 2.0671 33.0508 -7.4520 H 52 MET52 0.0377 783 HG2 3.2213 32.2582 -8.5008 H 52 MET52 0.0377 784 HE1 6.3731 33.9330 -8.4114 H 52 MET52 0.0340 785 HE2 5.6420 32.3468 -8.2404 H 52 MET52 0.0340 786 HE3 6.3506 33.1757 -6.8252 H 52 MET52 0.0340 787 N 2.0510 28.4690 -5.1850 N.am 53 SER53 -0.2436 788 CA 2.4100 27.2010 -4.5340 C.3 53 SER53 0.1109 789 C 2.4370 26.0640 -5.5460 C.2 53 SER53 0.2209 790 O 1.5990 26.0100 -6.4700 O.2 53 SER53 -0.2777 791 CB 1.5110 26.9420 -3.3149 C.3 53 SER53 0.0681 792 OG 0.1480 26.7832 -3.6565 O.3 53 SER53 -0.3930 793 H 1.1290 28.8710 -5.0140 H 53 SER53 0.1312 794 HA 3.4289 27.3258 -4.1614 H 53 SER53 0.0580 795 HB1 1.5698 27.7966 -2.6402 H 53 SER53 0.0577 796 HB2 1.8707 26.0845 -2.7318 H 53 SER53 0.0577 797 HG 0.0696 25.9951 -4.1817 H 53 SER53 0.2095 798 N 3.3070 25.1050 -5.3110 N.am 54 LEU54 -0.2456 799 CA 3.4800 23.9430 -6.1990 C.3 54 LEU54 0.0880 800 C 3.0470 22.6490 -5.5250 C.2 54 LEU54 0.2187 801 O 2.3030 21.8750 -6.1340 O.2 54 LEU54 -0.2778 802 CB 4.9723 23.8456 -6.5709 C.3 54 LEU54 -0.0266 803 CG 5.5262 25.0830 -7.2998 C.3 54 LEU54 -0.0449 804 CD1 7.0456 24.9618 -7.4714 C.3 54 LEU54 -0.0626 805 CD2 4.8414 25.2925 -8.6566 C.3 54 LEU54 -0.0626 806 H 3.8880 25.1690 -4.4750 H 54 LEU54 0.1312 807 HA 2.8684 24.0695 -7.0931 H 54 LEU54 0.0557 808 HB1 5.1418 22.9629 -7.1894 H 54 LEU54 0.0287 809 HB2 5.5581 23.6923 -5.6629 H 54 LEU54 0.0287 810 HG 5.3425 25.9671 -6.6886 H 54 LEU54 0.0296 811 HD11 7.4560 25.8296 -7.9872 H 54 LEU54 0.0232 812 HD12 7.3076 24.0763 -8.0508 H 54 LEU54 0.0232 813 HD13 7.5429 24.8881 -6.5034 H 54 LEU54 0.0232 814 HD21 5.2980 26.1155 -9.2035 H 54 LEU54 0.0232 815 HD22 3.7843 25.5293 -8.5368 H 54 LEU54 0.0232 816 HD23 4.9194 24.4004 -9.2783 H 54 LEU54 0.0232 817 N 3.5820 22.3680 -4.3590 N.am 55 SER55 -0.2436 818 CA 3.5580 21.0060 -3.8000 C.3 55 SER55 0.1109 819 C 3.6900 21.0790 -2.2930 C.2 55 SER55 0.2209 820 O 4.1500 22.0980 -1.7530 O.2 55 SER55 -0.2777 821 CB 4.5871 20.1446 -4.5277 C.3 55 SER55 0.0681 822 OG 5.8525 20.7652 -4.6695 O.3 55 SER55 -0.3930 823 H 4.0270 23.1150 -3.8250 H 55 SER55 0.1312 824 HA 2.5610 20.6088 -3.9913 H 55 SER55 0.0580 825 HB1 4.2240 19.9516 -5.5382 H 55 SER55 0.0577 826 HB2 4.6729 19.1655 -4.0583 H 55 SER55 0.0577 827 HG 6.0272 21.3143 -3.9031 H 55 SER55 0.2095 828 N 3.3000 20.0000 -1.6500 N.am 56 ILE56 -0.2453 829 CA 3.5190 19.7750 -0.2040 C.3 56 ILE56 0.0903 830 C 4.2690 18.4550 -0.0850 C.2 56 ILE56 0.2190 831 O 3.9180 17.4690 -0.7640 O.2 56 ILE56 -0.2778 832 CB 2.1803 19.8131 0.5636 C.3 56 ILE56 -0.0201 833 CG1 2.4097 19.7643 2.0870 C.3 56 ILE56 -0.0514 834 CG2 1.1913 18.7300 0.0967 C.3 56 ILE56 -0.0605 835 CD1 1.1598 20.1141 2.9061 C.3 56 ILE56 -0.0650 836 H 2.8170 19.2740 -2.1800 H 56 ILE56 0.1312 837 HA 4.1667 20.5722 0.1582 H 56 ILE56 0.0560 838 HB 1.7300 20.7808 0.3382 H 56 ILE56 0.0318 839 HG11 3.1991 20.4700 2.3507 H 56 ILE56 0.0266 840 HG12 2.7744 18.7788 2.3783 H 56 ILE56 0.0266 841 HG21 0.2136 18.8618 0.5588 H 56 ILE56 0.0233 842 HG22 1.5426 17.7305 0.3521 H 56 ILE56 0.0233 843 HG23 1.0399 18.7643 -0.9818 H 56 ILE56 0.0233 844 HD11 1.3902 20.1447 3.9712 H 56 ILE56 0.0230 845 HD12 0.3677 19.3789 2.7644 H 56 ILE56 0.0230 846 HD13 0.7679 21.0919 2.6246 H 56 ILE56 0.0230 847 N 5.3130 18.4240 0.7410 N.am 57 THR57 -0.2434 848 CA 6.2750 17.3040 0.8330 C.3 57 THR57 0.1135 849 C 6.6120 16.9990 2.2870 C.2 57 THR57 0.2212 850 O 6.9590 17.9140 3.0450 O.2 57 THR57 -0.2777 851 CB 7.6155 17.7386 0.1996 C.3 57 THR57 0.0763 852 OG1 7.4035 18.5052 -0.9664 O.3 57 THR57 -0.3900 853 CG2 8.4865 16.5270 -0.1533 C.3 57 THR57 -0.0370 854 H 5.4590 19.2280 1.3520 H 57 THR57 0.1313 855 HA 5.8485 16.4291 0.3438 H 57 THR57 0.0583 856 HB 8.2002 18.3577 0.8953 H 57 THR57 0.0611 857 HG1 6.8809 19.2817 -0.7490 H 57 THR57 0.2098 858 HG21 9.3879 16.8350 -0.6825 H 57 THR57 0.0255 859 HG22 7.9446 15.8234 -0.7842 H 57 THR57 0.0255 860 HG23 8.7972 15.9886 0.7423 H 57 THR57 0.0255 861 N 6.6250 15.7130 2.6190 N.am 58 ASN58 -0.2451 862 CA 7.2410 15.2500 3.8770 C.3 58 ASN58 0.0957 863 C 8.6770 14.8560 3.5580 C.2 58 ASN58 0.2191 864 O 8.8730 13.8850 2.8220 O.2 58 ASN58 -0.2778 865 CB 6.4245 14.0883 4.4557 C.3 58 ASN58 0.0446 866 CG 6.9731 13.5829 5.8005 C.2 58 ASN58 0.2000 867 OD1 8.0681 13.9247 6.2250 O.2 58 ASN58 -0.2797 868 ND2 6.1457 12.7481 6.4400 N.am 58 ASN58 -0.2723 869 H 6.2000 15.0310 1.9910 H 58 ASN58 0.1312 870 HA 7.2481 16.0763 4.5918 H 58 ASN58 0.0562 871 HB1 6.3816 13.2548 3.7580 H 58 ASN58 0.0375 872 HB2 5.4079 14.4385 4.6171 H 58 ASN58 0.0375 873 HD21 6.4129 12.3642 7.3237 H 58 ASN58 0.1266 874 HD22 5.2613 12.4892 6.0514 H 58 ASN58 0.1266 875 N 9.6460 15.6670 3.9790 N.am 59 ASN59 -0.2452 876 CA 11.0670 15.4510 3.6470 C.3 59 ASN59 0.0957 877 C 11.7640 14.6750 4.7670 C.2 59 ASN59 0.2189 878 O 12.9990 14.5480 4.6980 O.2 59 ASN59 -0.2778 879 CB 11.7267 16.8280 3.4300 C.3 59 ASN59 0.0446 880 CG 11.4270 17.8070 4.5836 C.2 59 ASN59 0.2000 881 OD1 12.0011 17.7308 5.6604 O.2 59 ASN59 -0.2797 882 ND2 10.4917 18.7268 4.2950 N.am 59 ASN59 -0.2723 883 H 9.3950 16.4710 4.5550 H 59 ASN59 0.1312 884 HA 11.1337 14.8588 2.7330 H 59 ASN59 0.0562 885 HB1 11.3572 17.2662 2.5029 H 59 ASN59 0.0375 886 HB2 12.8078 16.7383 3.3214 H 59 ASN59 0.0375 887 HD21 10.2275 19.3922 4.9916 H 59 ASN59 0.1266 888 HD22 10.0470 18.7630 3.4008 H 59 ASN59 0.1266 889 N 11.0260 14.1510 5.7410 N.am 60 GLY60 -0.2485 890 CA 11.6630 13.4030 6.8290 C.3 60 GLY60 0.0765 891 C 12.0380 14.2790 8.0040 C.2 60 GLY60 0.2155 892 O 12.3220 13.7340 9.0800 O.2 60 GLY60 -0.2781 893 H 10.0130 14.2700 5.7310 H 60 GLY60 0.1309 894 HA1 12.5435 12.8754 6.4594 H 60 GLY60 0.0521 895 HA2 10.9376 12.6617 7.1648 H 60 GLY60 0.0521 896 N 12.0510 15.5920 7.8430 N.am 61 HIS61 -0.2455 897 CA 12.3710 16.5280 8.9520 C.3 61 HIS61 0.0932 898 C 11.2430 17.5090 9.2230 C.2 61 HIS61 0.2191 899 O 11.2210 18.0580 10.3280 O.2 61 HIS61 -0.2778 900 CB 13.6665 17.2701 8.5945 C.3 61 HIS61 0.0146 901 CG 14.7826 16.2590 8.4775 C.ar 61 HIS61 0.0551 902 ND1 15.3462 15.6532 9.5417 N.ar 61 HIS61 -0.2469 903 CD2 15.3146 15.6870 7.3099 C.ar 61 HIS61 0.0047 904 CE1 16.1984 14.7436 9.0432 C.ar 61 HIS61 0.0737 905 NE2 16.2107 14.7490 7.6965 N.ar 61 HIS61 -0.2539 906 H 11.8330 15.9760 6.9230 H 61 HIS61 0.1312 907 HA 12.5160 15.9569 9.8714 H 61 HIS61 0.0561 908 HB1 13.9302 17.9999 9.3591 H 61 HIS61 0.0348 909 HB2 13.5675 17.8094 7.6530 H 61 HIS61 0.0348 910 HD2 15.0293 15.9312 6.2970 H 61 HIS61 0.0764 911 HE1 16.7894 14.0834 9.6621 H 61 HIS61 0.0963 912 HE2 16.7422 14.1679 7.1158 H 61 HIS61 0.1339 913 N 10.3920 17.7820 8.2480 N.am 62 SER62 -0.2436 914 CA 9.2630 18.7030 8.3790 C.3 62 SER62 0.1109 915 C 8.2940 18.3860 7.2500 C.2 62 SER62 0.2209 916 O 8.5170 17.4700 6.4450 O.2 62 SER62 -0.2777 917 CB 9.7992 20.1434 8.2849 C.3 62 SER62 0.0681 918 OG 8.8066 21.1338 8.4819 O.3 62 SER62 -0.3930 919 H 10.5320 17.3220 7.3490 H 62 SER62 0.1312 920 HA 8.7775 18.4971 9.3350 H 62 SER62 0.0580 921 HB1 10.2329 20.3078 7.2965 H 62 SER62 0.0577 922 HB2 10.6208 20.2952 8.9943 H 62 SER62 0.0577 923 HG 8.4455 21.0588 9.3609 H 62 SER62 0.2095 924 N 7.2020 19.1290 7.2280 N.am 63 VAL63 -0.2453 925 CA 6.3140 19.2290 6.0480 C.3 63 VAL63 0.0901 926 C 6.5450 20.6040 5.4300 C.2 63 VAL63 0.2189 927 O 6.5790 21.6120 6.1440 O.2 63 VAL63 -0.2778 928 CB 4.8415 18.9576 6.4131 C.3 63 VAL63 -0.0227 929 CG1 4.2707 19.9345 7.4546 C.3 63 VAL63 -0.0608 930 CG2 3.9633 18.9150 5.1521 C.3 63 VAL63 -0.0608 931 H 6.9590 19.6590 8.0650 H 63 VAL63 0.1312 932 HA 6.6337 18.4732 5.3317 H 63 VAL63 0.0560 933 HB 4.8110 17.9614 6.8538 H 63 VAL63 0.0315 934 HG11 3.2589 19.6465 7.7414 H 63 VAL63 0.0233 935 HG12 4.2206 20.9498 7.0622 H 63 VAL63 0.0233 936 HG13 4.8734 19.9532 8.3625 H 63 VAL63 0.0233 937 HG21 2.9486 18.6011 5.3875 H 63 VAL63 0.0233 938 HG22 4.3599 18.2124 4.4181 H 63 VAL63 0.0233 939 HG23 3.9027 19.8942 4.6765 H 63 VAL63 0.0233 940 N 6.7300 20.6070 4.1160 N.am 64 GLN64 -0.2456 941 CA 7.2150 21.7840 3.4090 C.3 64 GLN64 0.0882 942 C 6.3550 22.0340 2.1810 C.2 64 GLN64 0.2187 943 O 6.1190 21.1000 1.3780 O.2 64 GLN64 -0.2778 944 CB 8.6752 21.5742 2.9772 C.3 64 GLN64 -0.0210 945 CG 9.2565 22.7881 2.2258 C.3 64 GLN64 0.0225 946 CD 10.6869 22.5109 1.7534 C.2 64 GLN64 0.1981 947 OE1 11.6269 22.4842 2.5362 O.2 64 GLN64 -0.2798 948 NE2 10.7932 22.3086 0.4303 N.am 64 GLN64 -0.2724 949 H 6.5260 19.7600 3.5860 H 64 GLN64 0.1312 950 HA 7.1357 22.6445 4.0700 H 64 GLN64 0.0557 951 HB1 8.7412 20.6830 2.3499 H 64 GLN64 0.0289 952 HB2 9.2799 21.3708 3.8617 H 64 GLN64 0.0289 953 HG1 9.2710 23.6661 2.8710 H 64 GLN64 0.0356 954 HG2 8.6534 23.0431 1.3537 H 64 GLN64 0.0356 955 HE21 11.6870 22.1252 0.0252 H 64 GLN64 0.1266 956 HE22 9.9988 22.3334 -0.1812 H 64 GLN64 0.1266 957 N 5.9610 23.2770 1.9810 N.am 65 VAL65 -0.2454 958 CA 5.2350 23.7350 0.7780 C.3 65 VAL65 0.0901 959 C 6.2350 24.5000 -0.0710 C.2 65 VAL65 0.2189 960 O 6.8440 25.4750 0.4020 O.2 65 VAL65 -0.2778 961 CB 4.0144 24.5898 1.1691 C.3 65 VAL65 -0.0227 962 CG1 3.2808 25.1242 -0.0723 C.3 65 VAL65 -0.0608 963 CG2 3.0407 23.7902 2.0508 C.3 65 VAL65 -0.0608 964 H 6.1710 23.9660 2.7030 H 65 VAL65 0.1312 965 HA 4.9080 22.8522 0.2384 H 65 VAL65 0.0560 966 HB 4.3669 25.4443 1.7482 H 65 VAL65 0.0315 967 HG11 2.4063 25.7116 0.2078 H 65 VAL65 0.0233 968 HG12 2.9507 24.3032 -0.7082 H 65 VAL65 0.0233 969 HG13 3.9230 25.7636 -0.6771 H 65 VAL65 0.0233 970 HG21 2.1662 24.3859 2.3114 H 65 VAL65 0.0233 971 HG22 3.5078 23.4759 2.9843 H 65 VAL65 0.0233 972 HG23 2.6893 22.8957 1.5352 H 65 VAL65 0.0233 973 N 6.4110 24.0690 -1.3120 N.am 66 ASP66 -0.2451 974 CA 7.3330 24.7150 -2.2520 C.3 66 ASP66 0.0974 975 C 6.5960 25.6600 -3.1920 C.2 66 ASP66 0.2192 976 O 5.4230 25.4150 -3.5300 O.2 66 ASP66 -0.2778 977 CB 8.0218 23.6573 -3.1705 C.3 66 ASP66 0.0576 978 CG 8.2391 22.2121 -2.6432 C.2 66 ASP66 0.1780 979 OD1 9.3720 21.7441 -2.5602 O.co2 66 ASP66 -0.6478 980 OD2 7.2851 21.5000 -2.3452 O.co2 66 ASP66 -0.6478 981 H 5.8840 23.2550 -1.6260 H 66 ASP66 0.1312 982 HA 8.0850 25.2624 -1.6818 H 66 ASP66 0.0563 983 HB1 8.9863 24.0479 -3.4943 H 66 ASP66 0.0394 984 HB2 7.4529 23.5175 -4.0905 H 66 ASP66 0.0394 985 N 7.2980 26.7030 -3.6190 N.am 67 PHE67 -0.2453 986 CA 6.7530 27.7680 -4.4890 C.3 67 PHE67 0.0917 987 C 7.5500 27.8830 -5.7790 C.2 67 PHE67 0.2190 988 O 8.7500 27.6390 -5.8220 O.2 67 PHE67 -0.2778 989 CB 6.7954 29.1129 -3.7367 C.3 67 PHE67 -0.0036 990 CG 5.6630 29.2245 -2.7525 C.ar 67 PHE67 -0.0454 991 CD1 5.6981 28.5283 -1.5498 C.ar 67 PHE67 -0.0585 992 CD2 4.5385 29.9837 -3.0597 C.ar 67 PHE67 -0.0585 993 CE1 4.6105 28.5517 -0.6913 C.ar 67 PHE67 -0.0615 994 CE2 3.4538 30.0230 -2.1947 C.ar 67 PHE67 -0.0615 995 CZ 3.4854 29.2973 -1.0123 C.ar 67 PHE67 -0.0617 996 H 8.2730 26.7740 -3.3290 H 67 PHE67 0.1312 997 HA 5.7278 27.5085 -4.7550 H 67 PHE67 0.0560 998 HB1 6.7262 29.9522 -4.4315 H 67 PHE67 0.0333 999 HB2 7.7469 29.2315 -3.2161 H 67 PHE67 0.0333 1000 HD1 6.5596 27.9294 -1.2946 H 67 PHE67 0.0620 1001 HD2 4.4979 30.5294 -3.9902 H 67 PHE67 0.0620 1002 HE1 4.6416 27.9632 0.2122 H 67 PHE67 0.0618 1003 HE2 2.5786 30.6004 -2.4534 H 67 PHE67 0.0618 1004 HZ 2.6347 29.3078 -0.3476 H 67 PHE67 0.0618 1005 N 6.8760 28.3700 -6.8090 N.am 68 ASN68 -0.2452 1006 CA 7.5310 28.8890 -8.0230 C.3 68 ASN68 0.0957 1007 C 8.2740 30.1600 -7.6200 C.2 68 ASN68 0.2191 1008 O 7.6670 31.0780 -7.0400 O.2 68 ASN68 -0.2778 1009 CB 6.3817 29.1832 -9.0029 C.3 68 ASN68 0.0446 1010 CG 6.7971 29.8382 -10.3221 C.2 68 ASN68 0.2000 1011 OD1 6.0905 30.6808 -10.8594 O.2 68 ASN68 -0.2797 1012 ND2 7.9669 29.4094 -10.8119 N.am 68 ASN68 -0.2723 1013 H 5.8570 28.3870 -6.7600 H 68 ASN68 0.1312 1014 HA 8.2238 28.1289 -8.3891 H 68 ASN68 0.0562 1015 HB1 5.6483 29.8367 -8.5290 H 68 ASN68 0.0375 1016 HB2 5.8573 28.2609 -9.2435 H 68 ASN68 0.0375 1017 HD21 8.3118 29.7976 -11.6657 H 68 ASN68 0.1266 1018 HD22 8.5190 28.7137 -10.3538 H 68 ASN68 0.1266 1019 N 9.5750 30.1570 -7.7840 N.am 69 ASP69 -0.2451 1020 CA 10.4150 31.3290 -7.4380 C.3 69 ASP69 0.0974 1021 C 11.1810 31.7780 -8.6740 C.2 69 ASP69 0.2193 1022 O 12.2870 32.2950 -8.5410 O.2 69 ASP69 -0.2778 1023 CB 11.3397 30.9754 -6.2511 C.3 69 ASP69 0.0576 1024 CG 12.2785 29.7620 -6.4642 C.2 69 ASP69 0.1780 1025 OD1 11.9218 28.7882 -7.1215 O.co2 69 ASP69 -0.6478 1026 OD2 13.3946 29.7634 -5.9561 O.co2 69 ASP69 -0.6478 1027 H 10.0230 29.3220 -8.1610 H 69 ASP69 0.1312 1028 HA 9.7726 32.1635 -7.1521 H 69 ASP69 0.0563 1029 HB1 10.7259 30.7462 -5.3815 H 69 ASP69 0.0394 1030 HB2 11.9465 31.8382 -5.9754 H 69 ASP69 0.0394 1031 N 10.5720 31.5890 -9.8410 N.am 70 SER70 -0.2436 1032 CA 11.1570 31.9730 -11.1440 C.3 70 SER70 0.1109 1033 C 11.4030 33.4770 -11.2070 C.2 70 SER70 0.2209 1034 O 12.3230 33.8970 -11.9390 O.2 70 SER70 -0.2777 1035 CB 10.2329 31.5688 -12.3021 C.3 70 SER70 0.0681 1036 OG 10.2080 30.1519 -12.4275 O.3 70 SER70 -0.3930 1037 H 9.6490 31.1550 -9.8370 H 70 SER70 0.1312 1038 HA 12.1161 31.4615 -11.2290 H 70 SER70 0.0580 1039 HB1 10.5980 32.0176 -13.2343 H 70 SER70 0.0577 1040 HB2 9.2233 31.9551 -12.1196 H 70 SER70 0.0577 1041 HG 9.6890 29.8803 -13.1813 H 70 SER70 0.2095 1042 N 10.5650 34.2620 -10.5320 N.am 71 ASP71 -0.2451 1043 CA 10.5610 35.7360 -10.6390 C.3 71 ASP71 0.0974 1044 C 10.2510 36.3310 -9.2620 C.2 71 ASP71 0.2192 1045 O 9.9760 35.5920 -8.3230 O.2 71 ASP71 -0.2778 1046 CB 9.5351 36.1624 -11.7047 C.3 71 ASP71 0.0576 1047 CG 8.1780 35.4561 -11.5450 C.2 71 ASP71 0.1780 1048 OD1 7.7377 35.2012 -10.4315 O.co2 71 ASP71 -0.6478 1049 OD2 7.5346 35.1467 -12.5391 O.co2 71 ASP71 -0.6478 1050 H 9.8890 33.8220 -9.9070 H 71 ASP71 0.1312 1051 HA 11.5565 36.0703 -10.9262 H 71 ASP71 0.0563 1052 HB1 9.9225 35.9104 -12.6914 H 71 ASP71 0.0394 1053 HB2 9.3687 37.2386 -11.6999 H 71 ASP71 0.0394 1054 N 10.2710 37.6550 -9.1610 N.am 72 ASP72 -0.2451 1055 CA 10.1030 38.3520 -7.8640 C.3 72 ASP72 0.0974 1056 C 8.6360 38.7290 -7.6410 C.2 72 ASP72 0.2192 1057 O 8.4250 39.8690 -7.2070 O.2 72 ASP72 -0.2778 1058 CB 11.0248 39.5873 -7.8307 C.3 72 ASP72 0.0576 1059 CG 12.4952 39.1507 -7.8879 C.2 72 ASP72 0.1780 1060 OD1 13.0664 38.8313 -6.8508 O.co2 72 ASP72 -0.6478 1061 OD2 13.0743 39.1128 -8.9678 O.co2 72 ASP72 -0.6478 1062 H 10.4070 38.2110 -10.0050 H 72 ASP72 0.1312 1063 HA 10.3836 37.6689 -7.0634 H 72 ASP72 0.0563 1064 HB1 10.8879 40.1683 -6.9199 H 72 ASP72 0.0394 1065 HB2 10.8188 40.2512 -8.6698 H 72 ASP72 0.0394 1066 N 7.6780 37.8320 -7.9150 N.am 73 ARG73 -0.2456 1067 CA 6.2260 38.0160 -7.6320 C.3 73 ARG73 0.0879 1068 C 5.9130 37.8960 -6.1370 C.2 73 ARG73 0.2187 1069 O 5.1250 38.7120 -5.6340 O.2 73 ARG73 -0.2778 1070 CB 5.3745 37.0425 -8.4602 C.3 73 ARG73 -0.0258 1071 CG 5.0300 37.5865 -9.8550 C.3 73 ARG73 -0.0154 1072 CD 4.1885 36.6008 -10.6759 C.3 73 ARG73 0.1045 1073 NE 5.0481 35.4868 -11.0288 N.pl3 73 ARG73 -0.4450 1074 CZ 4.8071 34.1914 -11.0634 C.cat 73 ARG73 0.5062 1075 NH1 3.6227 33.6984 -10.8367 N.pl3 73 ARG73 -0.4573 1076 NH2 5.8010 33.4038 -11.3314 N.pl3 73 ARG73 -0.4573 1077 H 7.9650 36.9560 -8.3510 H 73 ARG73 0.1312 1078 HA 5.9865 39.0435 -7.9110 H 73 ARG73 0.0557 1079 HB1 4.4342 36.8354 -7.9471 H 73 ARG73 0.0286 1080 HB2 5.8996 36.0921 -8.5389 H 73 ARG73 0.0286 1081 HG1 5.9483 37.8233 -10.3951 H 73 ARG73 0.0299 1082 HG2 4.4833 38.5237 -9.7490 H 73 ARG73 0.0299 1083 HD1 3.8496 37.0529 -11.6100 H 73 ARG73 0.0711 1084 HD2 3.3236 36.2483 -10.1116 H 73 ARG73 0.0711 1085 HE 6.0126 35.6541 -11.2766 H 73 ARG73 0.3153 1086 HH11 3.4932 32.7136 -10.8830 H 73 ARG73 0.3114 1087 HH12 2.8800 34.3222 -10.6220 H 73 ARG73 0.3114 1088 HH21 5.7477 32.4129 -11.3842 H 73 ARG73 0.3114 1089 HH22 6.6825 33.8804 -11.4850 H 73 ARG73 0.3114 1090 N 6.4710 36.9000 -5.4660 N.am 74 THR74 -0.2434 1091 CA 6.1220 36.5350 -4.0720 C.3 74 THR74 0.1135 1092 C 7.3500 36.7550 -3.2000 C.2 74 THR74 0.2212 1093 O 8.2740 35.9400 -3.2340 O.2 74 THR74 -0.2777 1094 CB 5.5901 35.0924 -4.0197 C.3 74 THR74 0.0763 1095 OG1 4.3376 35.1083 -4.6857 O.3 74 THR74 -0.3900 1096 CG2 5.3548 34.5547 -2.5967 C.3 74 THR74 -0.0370 1097 H 7.1870 36.3480 -5.9380 H 74 THR74 0.1313 1098 HA 5.3340 37.2053 -3.7315 H 74 THR74 0.0583 1099 HB 6.3085 34.4524 -4.5480 H 74 THR74 0.0611 1100 HG1 4.0242 34.2242 -4.8343 H 74 THR74 0.2098 1101 HG21 5.1260 33.4891 -2.6118 H 74 THR74 0.0255 1102 HG22 4.5156 35.0593 -2.1229 H 74 THR74 0.0255 1103 HG23 6.2242 34.6900 -1.9566 H 74 THR74 0.0255 1104 N 7.3770 37.9050 -2.5660 N.am 75 VAL75 -0.2453 1105 CA 8.6330 38.4280 -1.9650 C.3 75 VAL75 0.0901 1106 C 8.3660 39.0240 -0.5940 C.2 75 VAL75 0.2189 1107 O 7.2620 39.4650 -0.2900 O.2 75 VAL75 -0.2778 1108 CB 9.2663 39.5009 -2.8863 C.3 75 VAL75 -0.0227 1109 CG1 9.7287 38.9205 -4.2294 C.3 75 VAL75 -0.0608 1110 CG2 8.3364 40.7038 -3.1246 C.3 75 VAL75 -0.0608 1111 H 6.5190 38.4500 -2.4840 H 75 VAL75 0.1312 1112 HA 9.3158 37.5899 -1.8316 H 75 VAL75 0.0560 1113 HB 10.1638 39.8806 -2.3933 H 75 VAL75 0.0315 1114 HG11 10.1814 39.6958 -4.8459 H 75 VAL75 0.0233 1115 HG12 8.8998 38.4955 -4.7942 H 75 VAL75 0.0233 1116 HG13 10.4801 38.1470 -4.0926 H 75 VAL75 0.0233 1117 HG21 8.8192 41.4464 -3.7603 H 75 VAL75 0.0233 1118 HG22 8.0751 41.2041 -2.1917 H 75 VAL75 0.0233 1119 HG23 7.4104 40.4033 -3.6159 H 75 VAL75 0.0233 1120 N 9.4320 39.0590 0.1810 N.am 76 VAL76 -0.2454 1121 CA 9.5240 39.9230 1.3640 C.3 76 VAL76 0.0901 1122 C 10.4560 41.0740 1.0320 C.2 76 VAL76 0.2190 1123 O 11.4890 40.8990 0.3850 O.2 76 VAL76 -0.2778 1124 CB 9.9908 39.1223 2.5989 C.3 76 VAL76 -0.0227 1125 CG1 11.3621 38.4579 2.4086 C.3 76 VAL76 -0.0608 1126 CG2 9.9894 39.9886 3.8699 C.3 76 VAL76 -0.0608 1127 H 10.2250 38.4610 -0.0510 H 76 VAL76 0.1312 1128 HA 8.5337 40.3339 1.5628 H 76 VAL76 0.0560 1129 HB 9.2641 38.3227 2.7472 H 76 VAL76 0.0315 1130 HG11 11.6098 37.8186 3.2566 H 76 VAL76 0.0233 1131 HG12 12.1497 39.2033 2.3177 H 76 VAL76 0.0233 1132 HG13 11.3883 37.8418 1.5121 H 76 VAL76 0.0233 1133 HG21 10.1623 39.3814 4.7586 H 76 VAL76 0.0233 1134 HG22 9.0429 40.5130 3.9977 H 76 VAL76 0.0233 1135 HG23 10.7676 40.7497 3.8341 H 76 VAL76 0.0233 1136 N 10.0410 42.2770 1.4370 N.am 77 THR77 -0.2434 1137 CA 10.8150 43.5420 1.3190 C.3 77 THR77 0.1135 1138 C 10.7910 44.3000 2.6390 C.2 77 THR77 0.2210 1139 O 9.9660 43.9960 3.5230 O.2 77 THR77 -0.2777 1140 CB 10.1825 44.4040 0.2055 C.3 77 THR77 0.0763 1141 OG1 8.7706 44.2859 0.2936 O.3 77 THR77 -0.3900 1142 CG2 10.6054 43.9396 -1.1909 C.3 77 THR77 -0.0370 1143 H 9.1160 42.3330 1.8630 H 77 THR77 0.1313 1144 HA 11.8528 43.2965 1.0896 H 77 THR77 0.0583 1145 HB 10.5065 45.4484 0.3272 H 77 THR77 0.0611 1146 HG1 8.3415 45.0533 -0.0939 H 77 THR77 0.2098 1147 HG21 10.1313 44.5416 -1.9661 H 77 THR77 0.0255 1148 HG22 10.3269 42.8993 -1.3608 H 77 THR77 0.0255 1149 HG23 11.6831 44.0328 -1.3173 H 77 THR77 0.0255 1150 N 11.6730 45.2870 2.7270 N.am 78 GLY78 -0.2484 1151 CA 11.6430 46.2190 3.8450 C.3 78 GLY78 0.0765 1152 C 12.1390 45.5950 5.1220 C.2 78 GLY78 0.2153 1153 O 12.9580 44.6330 5.1030 O.2 78 GLY78 -0.2781 1154 H 12.3820 45.3940 2.0020 H 78 GLY78 0.1309 1155 HA1 10.6217 46.5820 3.9534 H 78 GLY78 0.0521 1156 HA2 12.2836 47.0580 3.5771 H 78 GLY78 0.0521 1157 N 11.7610 46.1950 6.2420 N.am 79 GLY79 -0.2487 1158 CA 12.3560 45.7800 7.5140 C.3 79 GLY79 0.0767 1159 C 13.8690 45.9470 7.4360 C.2 79 GLY79 0.2182 1160 O 14.3550 47.0050 7.0510 O.2 79 GLY79 -0.2779 1161 H 11.0630 46.9380 6.2180 H 79 GLY79 0.1309 1162 HA1 12.0154 44.7696 7.7284 H 79 GLY79 0.0521 1163 HA2 11.9715 46.4512 8.2698 H 79 GLY79 0.0521 1164 N 14.6500 44.9070 7.7930 N.am 80 PRO80 -0.2318 1165 CA 16.1060 44.9770 7.7270 C.3 80 PRO80 0.0907 1166 C 16.6930 44.7630 6.3280 C.2 80 PRO80 0.2189 1167 O 17.8910 44.8290 6.1760 O.2 80 PRO80 -0.2778 1168 CB 16.5062 43.8018 8.6302 C.3 80 PRO80 -0.0276 1169 CG 15.3924 42.7766 8.4243 C.3 80 PRO80 -0.0379 1170 CD 14.1323 43.6199 8.2524 C.3 80 PRO80 0.0071 1171 HA 16.4471 45.9353 8.1187 H 80 PRO80 0.0559 1172 HB1 16.5021 44.1309 9.6691 H 80 PRO80 0.0285 1173 HB2 17.4972 43.3950 8.4229 H 80 PRO80 0.0285 1174 HG1 15.3047 42.0583 9.2351 H 80 PRO80 0.0278 1175 HG2 15.5810 42.2150 7.5086 H 80 PRO80 0.0278 1176 HD1 13.4623 43.2005 7.4995 H 80 PRO80 0.0431 1177 HD2 13.6108 43.7861 9.1955 H 80 PRO80 0.0431 1178 N 15.8780 44.4170 5.3430 N.am 81 LEU81 -0.2456 1179 CA 16.3930 43.8370 4.0710 C.3 81 LEU81 0.0880 1180 C 16.7980 44.9120 3.0760 C.2 81 LEU81 0.2187 1181 O 16.1000 45.9020 2.9610 O.2 81 LEU81 -0.2778 1182 CB 15.2855 42.9640 3.4495 C.3 81 LEU81 -0.0266 1183 CG 14.7491 41.8528 4.3736 C.3 81 LEU81 -0.0449 1184 CD1 13.5680 41.1388 3.7075 C.3 81 LEU81 -0.0626 1185 CD2 15.8375 40.8429 4.7642 C.3 81 LEU81 -0.0626 1186 H 14.8730 44.5510 5.4580 H 81 LEU81 0.1312 1187 HA 17.2675 43.2290 4.3073 H 81 LEU81 0.0557 1188 HB1 15.6450 42.5162 2.5228 H 81 LEU81 0.0287 1189 HB2 14.4499 43.6053 3.1627 H 81 LEU81 0.0287 1190 HG 14.3692 42.3098 5.2879 H 81 LEU81 0.0296 1191 HD11 13.1477 40.3744 4.3617 H 81 LEU81 0.0232 1192 HD12 13.8758 40.6556 2.7803 H 81 LEU81 0.0232 1193 HD13 12.7727 41.8445 3.4643 H 81 LEU81 0.0232 1194 HD21 15.4363 40.0649 5.4140 H 81 LEU81 0.0232 1195 HD22 16.6528 41.3251 5.3012 H 81 LEU81 0.0232 1196 HD23 16.2582 40.3557 3.8851 H 81 LEU81 0.0232 1197 N 17.8810 44.6390 2.3520 N.am 82 GLU82 -0.2456 1198 CA 18.2820 45.3480 1.1140 C.3 82 GLU82 0.0883 1199 C 17.6670 44.5790 -0.0570 C.2 82 GLU82 0.2185 1200 O 18.1940 43.5070 -0.5250 O.2 82 GLU82 -0.2778 1201 CB 19.8153 45.4745 1.0429 C.3 82 GLU82 -0.0193 1202 CG 20.3212 46.4754 -0.0183 C.3 82 GLU82 0.0356 1203 CD 20.2143 45.9004 -1.4357 C.2 82 GLU82 0.1760 1204 OE1 19.2222 46.1330 -2.1225 O.co2 82 GLU82 -0.6478 1205 OE2 21.1169 45.1890 -1.8673 O.co2 82 GLU82 -0.6478 1206 H 18.4830 43.8810 2.6750 H 82 GLU82 0.1312 1207 HA 17.8438 46.3473 1.1564 H 82 GLU82 0.0557 1208 HB1 20.2792 44.4967 0.9038 H 82 GLU82 0.0290 1209 HB2 20.1621 45.8265 2.0146 H 82 GLU82 0.0290 1210 HG1 21.3686 46.7149 0.1640 H 82 GLU82 0.0374 1211 HG2 19.7693 47.4137 0.0313 H 82 GLU82 0.0374 1212 N 16.5140 45.0690 -0.4460 N.am 83 GLY83 -0.2485 1213 CA 15.8450 44.6570 -1.6690 C.3 83 GLY83 0.0767 1214 C 15.0070 43.4280 -1.3980 C.2 83 GLY83 0.2182 1215 O 14.9720 42.9030 -0.2770 O.2 83 GLY83 -0.2779 1216 H 16.0650 45.7740 0.1390 H 83 GLY83 0.1309 1217 HA1 16.5929 44.4674 -2.4389 H 83 GLY83 0.0521 1218 HA2 15.2085 45.4865 -1.9758 H 83 GLY83 0.0521 1219 N 14.2810 42.9920 -2.4340 N.am 84 PRO84 -0.2318 1220 CA 13.3600 41.8690 -2.2700 C.3 84 PRO84 0.0907 1221 C 14.0590 40.5110 -2.1950 C.2 84 PRO84 0.2189 1222 O 15.0700 40.2800 -2.8250 O.2 84 PRO84 -0.2778 1223 CB 12.5083 41.9526 -3.5442 C.3 84 PRO84 -0.0276 1224 CG 13.4271 42.5969 -4.5813 C.3 84 PRO84 -0.0379 1225 CD 14.3069 43.5598 -3.7793 C.3 84 PRO84 0.0071 1226 HA 12.7621 42.0289 -1.3729 H 84 PRO84 0.0559 1227 HB1 11.6569 42.6098 -3.3695 H 84 PRO84 0.0285 1228 HB2 12.1074 40.9927 -3.8751 H 84 PRO84 0.0285 1229 HG1 12.8768 43.0923 -5.3814 H 84 PRO84 0.0278 1230 HG2 14.0495 41.8248 -5.0366 H 84 PRO84 0.0278 1231 HD1 15.3321 43.5974 -4.1496 H 84 PRO84 0.0431 1232 HD2 13.8740 44.5599 -3.7245 H 84 PRO84 0.0431 1233 N 13.4680 39.6140 -1.4210 N.am 85 TYR85 -0.2453 1234 CA 13.8760 38.2050 -1.3050 C.3 85 TYR85 0.0917 1235 C 12.6710 37.3600 -1.6900 C.2 85 TYR85 0.2190 1236 O 11.5670 37.5470 -1.1470 O.2 85 TYR85 -0.2778 1237 CB 14.3156 37.8688 0.1372 C.3 85 TYR85 -0.0036 1238 CG 15.6448 38.4495 0.5581 C.ar 85 TYR85 -0.0453 1239 CD1 15.8315 39.8252 0.6678 C.ar 85 TYR85 -0.0561 1240 CD2 16.6878 37.6051 0.9359 C.ar 85 TYR85 -0.0561 1241 CE1 17.0520 40.3479 1.0740 C.ar 85 TYR85 -0.0317 1242 CE2 17.8959 38.1252 1.3825 C.ar 85 TYR85 -0.0317 1243 CZ 18.0863 39.4977 1.4302 C.ar 85 TYR85 0.0726 1244 OH 19.2950 40.0188 1.8417 O.3 85 TYR85 -0.3598 1245 H 12.6710 39.9220 -0.8640 H 85 TYR85 0.1312 1246 HA 14.6854 38.0112 -2.0110 H 85 TYR85 0.0560 1247 HB1 14.3945 36.7878 0.2403 H 85 TYR85 0.0333 1248 HB2 13.5583 38.1931 0.8473 H 85 TYR85 0.0333 1249 HD1 15.0261 40.5068 0.4432 H 85 TYR85 0.0621 1250 HD2 16.5604 36.5328 0.9046 H 85 TYR85 0.0621 1251 HE1 17.1948 41.4173 1.1260 H 85 TYR85 0.0643 1252 HE2 18.6957 37.4625 1.6780 H 85 TYR85 0.0643 1253 HH 19.9600 39.3424 1.8058 H 85 TYR85 0.2173 1254 N 12.8700 36.4230 -2.6100 N.am 86 ARG86 -0.2456 1255 CA 11.7680 35.6070 -3.1650 C.3 86 ARG86 0.0879 1256 C 11.4780 34.4220 -2.2520 C.2 86 ARG86 0.2187 1257 O 12.4130 33.7360 -1.7920 O.2 86 ARG86 -0.2778 1258 CB 12.1935 34.9660 -4.4953 C.3 86 ARG86 -0.0258 1259 CG 12.5747 35.9490 -5.5949 C.3 86 ARG86 -0.0154 1260 CD 12.8542 35.1911 -6.8942 C.3 86 ARG86 0.1045 1261 NE 13.2790 36.1353 -7.9101 N.pl3 86 ARG86 -0.4450 1262 CZ 13.6943 35.8147 -9.1157 C.cat 86 ARG86 0.5062 1263 NH1 13.7461 34.5706 -9.5019 N.pl3 86 ARG86 -0.4573 1264 NH2 14.0495 36.7672 -9.9228 N.pl3 86 ARG86 -0.4573 1265 H 13.8190 36.2600 -2.9470 H 86 ARG86 0.1312 1266 HA 10.8791 36.2265 -3.2753 H 86 ARG86 0.0557 1267 HB1 11.3800 34.3386 -4.8665 H 86 ARG86 0.0286 1268 HB2 13.0420 34.2978 -4.3327 H 86 ARG86 0.0286 1269 HG1 13.4552 36.5221 -5.3021 H 86 ARG86 0.0299 1270 HG2 11.7715 36.6679 -5.7451 H 86 ARG86 0.0299 1271 HD1 11.9604 34.6775 -7.2532 H 86 ARG86 0.0711 1272 HD2 13.6450 34.4517 -6.7514 H 86 ARG86 0.0711 1273 HE 13.2650 37.1257 -7.7216 H 86 ARG86 0.3153 1274 HH11 14.0470 34.3432 -10.4222 H 86 ARG86 0.3114 1275 HH12 13.4612 33.8532 -8.8679 H 86 ARG86 0.3114 1276 HH21 14.4142 36.5999 -10.8286 H 86 ARG86 0.3114 1277 HH22 13.9257 37.7093 -9.5827 H 86 ARG86 0.3114 1278 N 10.2040 34.1260 -2.0780 N.am 87 LEU87 -0.2456 1279 CA 9.7800 32.9510 -1.2790 C.3 87 LEU87 0.0880 1280 C 10.0860 31.6630 -2.0330 C.2 87 LEU87 0.2187 1281 O 9.5970 31.4640 -3.1610 O.2 87 LEU87 -0.2778 1282 CB 8.2752 33.0535 -0.9697 C.3 87 LEU87 -0.0266 1283 CG 7.7197 31.9437 -0.0483 C.3 87 LEU87 -0.0449 1284 CD1 8.2971 32.0157 1.3730 C.3 87 LEU87 -0.0626 1285 CD2 6.1878 32.0054 0.0082 C.3 87 LEU87 -0.0626 1286 H 9.4930 34.7200 -2.5040 H 87 LEU87 0.1312 1287 HA 10.3590 32.9678 -0.3550 H 87 LEU87 0.0557 1288 HB1 7.7326 33.0341 -1.9155 H 87 LEU87 0.0287 1289 HB2 8.0650 34.0262 -0.5240 H 87 LEU87 0.0287 1290 HG 7.9861 30.9731 -0.4697 H 87 LEU87 0.0296 1291 HD11 7.9225 31.1979 1.9898 H 87 LEU87 0.0232 1292 HD12 8.0204 32.9496 1.8610 H 87 LEU87 0.0232 1293 HD13 9.3829 31.9475 1.3736 H 87 LEU87 0.0232 1294 HD21 5.7854 31.2120 0.6391 H 87 LEU87 0.0232 1295 HD22 5.7550 31.8859 -0.9845 H 87 LEU87 0.0232 1296 HD23 5.8445 32.9592 0.4105 H 87 LEU87 0.0232 1297 N 10.8590 30.7630 -1.4380 N.am 88 LYS88 -0.2457 1298 CA 11.0830 29.4290 -2.0220 C.3 88 LYS88 0.0878 1299 C 10.1290 28.4090 -1.4220 C.2 88 LYS88 0.2187 1300 O 9.6000 27.5660 -2.1550 O.2 88 LYS88 -0.2778 1301 CB 12.5461 28.9757 -2.0556 C.3 88 LYS88 -0.0289 1302 CG 12.6887 27.8083 -3.0523 C.3 88 LYS88 -0.0496 1303 CD 14.1075 27.5808 -3.5770 C.3 88 LYS88 -0.0278 1304 CE 14.1086 26.6453 -4.7954 C.3 88 LYS88 0.1103 1305 NZ 13.4757 27.2420 -5.9709 N.4 88 LYS88 -0.0749 1306 H 11.3090 31.0010 -0.5540 H 88 LYS88 0.1312 1307 HA 10.7767 29.5031 -3.0673 H 88 LYS88 0.0557 1308 HB1 12.9086 28.7046 -1.0633 H 88 LYS88 0.0285 1309 HB2 13.1546 29.8124 -2.3972 H 88 LYS88 0.0285 1310 HG1 12.0532 28.0111 -3.9156 H 88 LYS88 0.0266 1311 HG2 12.2994 26.8911 -2.6083 H 88 LYS88 0.0266 1312 HD1 14.7191 27.1572 -2.7808 H 88 LYS88 0.0282 1313 HD2 14.5607 28.5349 -3.8503 H 88 LYS88 0.0282 1314 HE1 13.5854 25.7163 -4.5618 H 88 LYS88 0.0559 1315 HE2 15.1329 26.3862 -5.0670 H 88 LYS88 0.0559 1316 HZ1 13.4191 26.6038 -6.7824 H 88 LYS88 0.2742 1317 HZ2 13.9504 28.1268 -6.2566 H 88 LYS88 0.2742 1318 HZ3 12.5160 27.6023 -5.7683 H 88 LYS88 0.2742 1319 N 9.9480 28.4400 -0.1100 N.am 89 GLN89 -0.2456 1320 CA 9.2210 27.3660 0.5750 C.3 89 GLN89 0.0882 1321 C 8.8240 27.8490 1.9480 C.2 89 GLN89 0.2187 1322 O 9.4580 28.7800 2.4820 O.2 89 GLN89 -0.2778 1323 CB 10.0115 26.0410 0.5811 C.3 89 GLN89 -0.0210 1324 CG 11.4396 26.1098 1.1570 C.3 89 GLN89 0.0225 1325 CD 11.5054 25.8711 2.6738 C.2 89 GLN89 0.1981 1326 OE1 10.5385 26.0132 3.4072 O.2 89 GLN89 -0.2798 1327 NE2 12.7198 25.4888 3.0965 N.am 89 GLN89 -0.2724 1328 H 10.3190 29.2210 0.4310 H 89 GLN89 0.1312 1329 HA 8.2969 27.2414 0.0136 H 89 GLN89 0.0557 1330 HB1 10.0928 25.7063 -0.4529 H 89 GLN89 0.0289 1331 HB2 9.4309 25.2628 1.0753 H 89 GLN89 0.0289 1332 HG1 11.9221 27.0589 0.9262 H 89 GLN89 0.0356 1333 HG2 12.0418 25.3328 0.6855 H 89 GLN89 0.0356 1334 HE21 12.8544 25.2953 4.0667 H 89 GLN89 0.1266 1335 HE22 13.4815 25.3860 2.4587 H 89 GLN89 0.1266 1336 N 7.8320 27.2040 2.5380 N.am 90 PHE90 -0.2453 1337 CA 7.6100 27.3330 3.9860 C.3 90 PHE90 0.0917 1338 C 7.4930 25.9620 4.5890 C.2 90 PHE90 0.2190 1339 O 7.1570 24.9580 3.9320 O.2 90 PHE90 -0.2778 1340 CB 6.4740 28.3089 4.3349 C.3 90 PHE90 -0.0036 1341 CG 5.0800 27.8353 4.0104 C.ar 90 PHE90 -0.0454 1342 CD1 4.4263 26.9284 4.8405 C.ar 90 PHE90 -0.0585 1343 CD2 4.3834 28.3823 2.9375 C.ar 90 PHE90 -0.0585 1344 CE1 3.1140 26.5561 4.5869 C.ar 90 PHE90 -0.0615 1345 CE2 3.0692 28.0101 2.6814 C.ar 90 PHE90 -0.0615 1346 CZ 2.4348 27.0920 3.5040 C.ar 90 PHE90 -0.0617 1347 H 7.2150 26.6110 1.9830 H 90 PHE90 0.1312 1348 HA 8.5362 27.7336 4.3955 H 90 PHE90 0.0560 1349 HB1 6.6615 29.2477 3.8173 H 90 PHE90 0.0333 1350 HB2 6.5149 28.5438 5.3971 H 90 PHE90 0.0333 1351 HD1 4.9319 26.5175 5.7019 H 90 PHE90 0.0620 1352 HD2 4.8634 29.1116 2.3011 H 90 PHE90 0.0620 1353 HE1 2.6178 25.8568 5.2402 H 90 PHE90 0.0618 1354 HE2 2.5385 28.4352 1.8432 H 90 PHE90 0.0618 1355 HZ 1.4155 26.7960 3.3064 H 90 PHE90 0.0618 1356 N 7.7700 25.9010 5.8880 N.am 91 HIS91 -0.2453 1357 CA 7.6840 24.6310 6.6410 C.3 91 HIS91 0.0932 1358 C 7.4560 24.9580 8.1000 C.2 91 HIS91 0.2191 1359 O 7.4290 26.1330 8.5040 O.2 91 HIS91 -0.2778 1360 CB 8.9860 23.8140 6.4130 C.3 91 HIS91 0.0151 1361 CG 10.1880 24.5190 6.9670 C.2 91 HIS91 0.0630 1362 ND1 10.9450 25.3760 6.2240 N.2 91 HIS91 -0.2388 1363 CD2 10.6960 24.5820 8.2130 C.2 91 HIS91 0.0507 1364 CE1 11.8780 25.9190 7.0290 C.2 91 HIS91 0.1163 1365 NE2 11.7510 25.4560 8.2680 N.2 91 HIS91 -0.2420 1366 H 8.0490 26.7510 6.3770 H 91 HIS91 0.1312 1367 HA 6.8160 24.0430 6.2620 H 91 HIS91 0.0561 1368 HB1 9.1240 23.5610 5.3360 H 91 HIS91 0.0349 1369 HB2 8.8780 22.8540 6.9690 H 91 HIS91 0.0349 1370 HD2 10.3140 24.0070 9.0740 H 91 HIS91 0.0848 1371 HE1 12.6410 26.6460 6.7050 H 91 HIS91 0.1047 1372 N 7.3510 23.9200 8.9210 N.am 92 PHE92 -0.2453 1373 CA 6.9960 24.0780 10.3460 C.3 92 PHE92 0.0917 1374 C 7.9290 23.2710 11.2400 C.2 92 PHE92 0.2190 1375 O 8.5440 22.2770 10.8480 O.2 92 PHE92 -0.2778 1376 CB 5.5551 23.5888 10.5887 C.3 92 PHE92 -0.0036 1377 CG 4.5130 24.3438 9.8080 C.ar 92 PHE92 -0.0454 1378 CD1 4.1291 23.9051 8.5439 C.ar 92 PHE92 -0.0585 1379 CD2 3.8605 25.4373 10.3704 C.ar 92 PHE92 -0.0585 1380 CE1 3.1041 24.5394 7.8565 C.ar 92 PHE92 -0.0615 1381 CE2 2.8285 26.0687 9.6869 C.ar 92 PHE92 -0.0615 1382 CZ 2.4489 25.6199 8.4295 C.ar 92 PHE92 -0.0617 1383 H 7.5210 22.9830 8.5560 H 92 PHE92 0.1312 1384 HA 7.0860 25.1287 10.6197 H 92 PHE92 0.0560 1385 HB1 5.3032 23.6606 11.6483 H 92 PHE92 0.0333 1386 HB2 5.4688 22.5353 10.3272 H 92 PHE92 0.0333 1387 HD1 4.6172 23.0514 8.0966 H 92 PHE92 0.0620 1388 HD2 4.1394 25.7883 11.3543 H 92 PHE92 0.0620 1389 HE1 2.8078 24.1789 6.8827 H 92 PHE92 0.0618 1390 HE2 2.3196 26.9105 10.1333 H 92 PHE92 0.0618 1391 HZ 1.6465 26.1104 7.8976 H 92 PHE92 0.0618 1392 N 7.9490 23.6770 12.5010 N.am 93 HIS93 -0.2453 1393 CA 8.5990 22.9140 13.6000 C.3 93 HIS93 0.0932 1394 C 7.5840 22.8100 14.7050 C.2 93 HIS93 0.2191 1395 O 6.8760 23.8100 14.9530 O.2 93 HIS93 -0.2778 1396 CB 9.8620 23.6550 14.0820 C.3 93 HIS93 0.0151 1397 CG 10.8690 23.9040 12.9970 C.2 93 HIS93 0.0630 1398 ND1 11.8600 23.0290 12.6620 N.2 93 HIS93 -0.2388 1399 CD2 11.0030 24.9430 12.1490 C.2 93 HIS93 0.0507 1400 CE1 12.5580 23.5190 11.6390 C.2 93 HIS93 0.1163 1401 NE2 12.0640 24.7230 11.3100 N.2 93 HIS93 -0.2420 1402 H 7.4940 24.5610 12.7300 H 93 HIS93 0.1312 1403 HA 8.8730 21.8940 13.2410 H 93 HIS93 0.0561 1404 HB1 10.3320 23.1150 14.9380 H 93 HIS93 0.0349 1405 HB2 9.5340 24.6510 14.4610 H 93 HIS93 0.0349 1406 HD2 10.3560 25.8360 12.1330 H 93 HIS93 0.0848 1407 HE1 13.4050 23.0170 11.1420 H 93 HIS93 0.1047 1408 N 7.4690 21.6760 15.3590 N.am 94 TRP94 -0.2453 1409 CA 6.4360 21.5230 16.3880 C.3 94 TRP94 0.0918 1410 C 6.8620 20.4740 17.4140 C.2 94 TRP94 0.2188 1411 O 7.8710 19.7610 17.2590 O.2 94 TRP94 -0.2778 1412 CB 5.0572 21.2396 15.7624 C.3 94 TRP94 -0.0021 1413 CG 5.0224 19.9013 15.0556 C.ar 94 TRP94 -0.0260 1414 CD1 4.6300 18.6849 15.6219 C.ar 94 TRP94 -0.0136 1415 CD2 5.3294 19.6299 13.6727 C.ar 94 TRP94 -0.0028 1416 NE1 4.6996 17.7128 14.6835 N.ar 94 TRP94 -0.2641 1417 CE2 5.1225 18.2455 13.4743 C.ar 94 TRP94 0.0269 1418 CE3 5.7322 20.4183 12.6278 C.ar 94 TRP94 -0.0528 1419 CZ2 5.3226 17.6937 12.2396 C.ar 94 TRP94 -0.0430 1420 CZ3 5.9375 19.8563 11.3677 C.ar 94 TRP94 -0.0611 1421 CH2 5.7322 18.4925 11.1724 C.ar 94 TRP94 -0.0602 1422 H 8.0990 20.9010 15.1500 H 94 TRP94 0.1312 1423 HA 6.3879 22.4690 16.9288 H 94 TRP94 0.0560 1424 HB1 4.8013 22.0257 15.0522 H 94 TRP94 0.0334 1425 HB2 4.2817 21.2560 16.5282 H 94 TRP94 0.0334 1426 HD1 4.3173 18.5426 16.6444 H 94 TRP94 0.0748 1427 HE1 4.4874 16.7641 14.8150 H 94 TRP94 0.1331 1428 HE3 5.8839 21.4763 12.7784 H 94 TRP94 0.0624 1429 HZ2 5.1528 16.6367 12.0943 H 94 TRP94 0.0633 1430 HZ3 6.2460 20.4725 10.5392 H 94 TRP94 0.0618 1431 HH2 5.8803 18.0548 10.1960 H 94 TRP94 0.0618 1432 N 6.0700 20.4080 18.4720 N.am 95 GLY95 -0.2485 1433 CA 6.3610 19.5530 19.6200 C.3 95 GLY95 0.0765 1434 C 5.5230 18.2890 19.7100 C.2 95 GLY95 0.2155 1435 O 4.4610 18.1660 19.0800 O.2 95 GLY95 -0.2781 1436 H 5.2230 20.9760 18.4860 H 95 GLY95 0.1309 1437 HA1 6.1528 20.1403 20.5080 H 95 GLY95 0.0521 1438 HA2 7.4211 19.2960 19.6258 H 95 GLY95 0.0521 1439 N 5.9480 17.3990 20.6050 N.am 96 LYS96 -0.2459 1440 CA 5.1950 16.1810 20.9730 C.3 96 LYS96 0.0878 1441 C 4.0320 16.6050 21.8660 C.2 96 LYS96 0.2187 1442 O 2.9360 15.9960 21.8180 O.2 96 LYS96 -0.2778 1443 CB 6.1519 15.1600 21.6057 C.3 96 LYS96 -0.0289 1444 CG 5.5574 13.7459 21.7100 C.3 96 LYS96 -0.0496 1445 CD 6.6398 12.6738 21.9311 C.3 96 LYS96 -0.0278 1446 CE 6.0992 11.2411 21.8017 C.3 96 LYS96 0.1103 1447 NZ 7.1482 10.2183 21.8818 N.4 96 LYS96 -0.0749 1448 H 6.8440 17.5670 21.0630 H 96 LYS96 0.1312 1449 HA 4.7679 15.7804 20.0531 H 96 LYS96 0.0557 1450 HB1 6.5002 15.5058 22.5798 H 96 LYS96 0.0285 1451 HB2 7.0364 15.1116 20.9698 H 96 LYS96 0.0285 1452 HG1 5.0165 13.5221 20.7897 H 96 LYS96 0.0266 1453 HG2 4.8160 13.7123 22.5095 H 96 LYS96 0.0266 1454 HD1 7.0990 12.8165 22.9103 H 96 LYS96 0.0282 1455 HD2 7.4353 12.8169 21.1982 H 96 LYS96 0.0282 1456 HE1 5.5884 11.1198 20.8434 H 96 LYS96 0.0559 1457 HE2 5.3636 11.0413 22.5842 H 96 LYS96 0.0559 1458 HZ1 6.7287 9.2697 21.7881 H 96 LYS96 0.2742 1459 HZ2 7.6404 10.2820 22.7968 H 96 LYS96 0.2742 1460 HZ3 7.8390 10.3589 21.1154 H 96 LYS96 0.2742 1461 N 4.2800 17.6040 22.6940 N.am 97 LYS97 -0.2457 1462 CA 3.2880 18.0790 23.6730 C.3 97 LYS97 0.0878 1463 C 3.1490 19.5680 23.4520 C.2 97 LYS97 0.2187 1464 O 3.9650 20.1570 22.7420 O.2 97 LYS97 -0.2778 1465 CB 3.8779 17.9592 25.0966 C.3 97 LYS97 -0.0289 1466 CG 4.0003 16.5372 25.6448 C.3 97 LYS97 -0.0496 1467 CD 4.7987 16.4894 26.9623 C.3 97 LYS97 -0.0278 1468 CE 4.2760 17.4235 28.0730 C.3 97 LYS97 0.1103 1469 NZ 4.8470 18.7701 28.0492 N.4 97 LYS97 -0.0749 1470 H 5.1900 18.0620 22.6540 H 97 LYS97 0.1312 1471 HA 2.3246 17.5793 23.5523 H 97 LYS97 0.0557 1472 HB1 3.2662 18.5282 25.8002 H 97 LYS97 0.0285 1473 HB2 4.8641 18.4288 25.1132 H 97 LYS97 0.0285 1474 HG1 4.4877 15.8967 24.9090 H 97 LYS97 0.0266 1475 HG2 3.0025 16.1239 25.7980 H 97 LYS97 0.0266 1476 HD1 5.8508 16.7029 26.7694 H 97 LYS97 0.0282 1477 HD2 4.7692 15.4628 27.3295 H 97 LYS97 0.0282 1478 HE1 4.5220 16.9989 29.0480 H 97 LYS97 0.0559 1479 HE2 3.1880 17.5112 28.0371 H 97 LYS97 0.0559 1480 HZ1 4.4794 19.3655 28.8238 H 97 LYS97 0.2742 1481 HZ2 4.5618 19.3208 27.2086 H 97 LYS97 0.2742 1482 HZ3 5.8806 18.7815 28.0934 H 97 LYS97 0.2742 1483 N 2.0990 20.1290 24.0170 N.am 98 HIS98 -0.2453 1484 CA 1.5280 21.4490 23.6430 C.3 98 HIS98 0.0932 1485 C 2.3950 22.6270 24.1270 C.2 98 HIS98 0.2191 1486 O 2.2230 23.7140 23.5440 O.2 98 HIS98 -0.2778 1487 CB 0.1102 21.5578 24.2365 C.3 98 HIS98 0.0146 1488 CG 0.1710 21.6321 25.7495 C.ar 98 HIS98 0.0551 1489 ND1 0.8029 20.7257 26.5295 N.ar 98 HIS98 -0.2469 1490 CD2 -0.2490 22.6957 26.5651 C.ar 98 HIS98 0.0047 1491 CE1 0.7928 21.2372 27.7723 C.ar 98 HIS98 0.0737 1492 NE2 0.1445 22.4143 27.8280 N.ar 98 HIS98 -0.2539 1493 H 1.6420 19.6160 24.7710 H 98 HIS98 0.1312 1494 HA 1.4806 21.4818 22.5541 H 98 HIS98 0.0561 1495 HB1 -0.4963 20.7003 23.9448 H 98 HIS98 0.0348 1496 HB2 -0.3950 22.4469 23.8568 H 98 HIS98 0.0348 1497 HD2 -0.7510 23.5922 26.2314 H 98 HIS98 0.0764 1498 HE1 1.2773 20.7734 28.6201 H 98 HIS98 0.0963 1499 HE2 0.0215 22.9761 28.6211 H 98 HIS98 0.1339 1500 N 3.3290 22.4340 25.0690 N.am 99 ASP99 -0.2451 1501 CA 4.1530 23.5020 25.7360 C.3 99 ASP99 0.0974 1502 C 5.5560 23.6560 25.0590 C.2 99 ASP99 0.2192 1503 O 6.4230 24.4750 25.5050 O.2 99 ASP99 -0.2778 1504 CB 4.3264 23.0942 27.2132 C.3 99 ASP99 0.0576 1505 CG 4.5535 21.5749 27.4360 C.2 99 ASP99 0.1780 1506 OD1 4.0688 21.0530 28.4328 O.co2 99 ASP99 -0.6478 1507 OD2 5.1970 20.8899 26.6343 O.co2 99 ASP99 -0.6478 1508 H 3.4970 21.4710 25.3610 H 99 ASP99 0.1312 1509 HA 3.6205 24.4501 25.6541 H 99 ASP99 0.0563 1510 HB1 3.4153 23.3597 27.7497 H 99 ASP99 0.0394 1511 HB2 5.1344 23.6431 27.6955 H 99 ASP99 0.0394 1512 N 5.8530 22.8960 24.0080 N.am 100 VAL100 -0.2449 1513 CA 7.1700 22.9680 23.3180 C.3 100 VAL100 0.1032 1514 C 6.8680 22.9050 21.8190 C.2 100 VAL100 0.3354 1515 O 5.8090 22.2830 21.3780 O.2 100 VAL100 -0.2638 1516 CB 8.0813 21.8066 23.7763 C.3 100 VAL100 -0.0222 1517 CG1 8.4798 21.9660 25.2500 C.3 100 VAL100 -0.0608 1518 CG2 7.4567 20.4197 23.5376 C.3 100 VAL100 -0.0608 1519 H 5.1530 22.2400 23.6620 H 100 VAL100 0.1312 1520 HA 7.6274 23.9347 23.5402 H 100 VAL100 0.0565 1521 HB 9.0066 21.8529 23.2011 H 100 VAL100 0.0315 1522 HG11 9.2040 21.2063 25.5450 H 100 VAL100 0.0233 1523 HG12 7.6186 21.8678 25.9118 H 100 VAL100 0.0233 1524 HG13 8.9302 22.9413 25.4364 H 100 VAL100 0.0233 1525 HG21 8.1319 19.6294 23.8670 H 100 VAL100 0.0233 1526 HG22 7.2471 20.2428 22.4842 H 100 VAL100 0.0233 1527 HG23 6.5230 20.3001 24.0897 H 100 VAL100 0.0233 1528 N 7.8780 23.2790 21.0440 N.4 101 GLY101 0.0012 1529 CA 7.7860 23.0070 19.6070 C.3 101 GLY101 0.1934 1530 C 8.4110 24.1040 18.8100 C.2 101 GLY101 0.2293 1531 O 8.9760 23.8200 17.7570 O.2 101 GLY101 -0.2776 1532 H1 7.9711 24.3101 21.1524 H 101 GLY101 0.2879 1533 H2 8.7594 22.8578 21.3999 H 101 GLY101 0.2879 1534 HA1 6.7458 22.9655 19.2846 H 101 GLY101 0.0663 1535 HA2 8.2541 22.0515 19.3750 H 101 GLY101 0.0663 1536 N 8.3020 25.3490 19.2440 N.am 102 SER102 -0.2434 1537 CA 8.9520 26.4590 18.5280 C.3 102 SER102 0.1109 1538 C 10.4630 26.3620 18.6690 C.2 102 SER102 0.2209 1539 O 10.9930 25.6830 19.5680 O.2 102 SER102 -0.2777 1540 CB 8.4879 27.7930 19.1227 C.3 102 SER102 0.0681 1541 OG 8.7993 27.8621 20.5101 O.3 102 SER102 -0.3930 1542 H 7.7600 25.5420 20.0860 H 102 SER102 0.1312 1543 HA 8.6801 26.3930 17.4726 H 102 SER102 0.0580 1544 HB1 7.4079 27.8642 19.0185 H 102 SER102 0.0577 1545 HB2 8.8945 28.6519 18.5674 H 102 SER102 0.0577 1546 HG 9.7350 28.0472 20.6067 H 102 SER102 0.2095 1547 N 11.1270 26.9910 17.7150 N.am 103 GLU103 -0.2456 1548 CA 12.5980 27.1130 17.7380 C.3 103 GLU103 0.0883 1549 C 12.9970 28.3530 18.5280 C.2 103 GLU103 0.2187 1550 O 13.6940 28.2700 19.5560 O.2 103 GLU103 -0.2778 1551 CB 13.0979 27.1647 16.2751 C.3 103 GLU103 -0.0193 1552 CG 12.7610 25.8789 15.4990 C.3 103 GLU103 0.0356 1553 CD 13.8368 25.4696 14.4783 C.2 103 GLU103 0.1760 1554 OE1 13.5910 25.5597 13.2854 O.co2 103 GLU103 -0.6478 1555 OE2 14.9173 25.0510 14.8703 O.co2 103 GLU103 -0.6478 1556 H 10.6080 27.4040 16.9400 H 103 GLU103 0.1312 1557 HA 13.0204 26.2401 18.2388 H 103 GLU103 0.0557 1558 HB1 14.1710 27.3252 16.2497 H 103 GLU103 0.0290 1559 HB2 12.6672 28.0200 15.7513 H 103 GLU103 0.0290 1560 HG1 11.7996 25.9836 14.9975 H 103 GLU103 0.0374 1561 HG2 12.6614 25.0439 16.1789 H 103 GLU103 0.0374 1562 N 12.5610 29.5100 18.0580 N.am 104 HIS104 -0.2453 1563 CA 12.7150 30.7350 18.8530 C.3 104 HIS104 0.0932 1564 C 11.8670 30.6300 20.1110 C.2 104 HIS104 0.2191 1565 O 10.8110 29.9730 20.1160 O.2 104 HIS104 -0.2778 1566 CB 12.2941 31.9323 17.9936 C.3 104 HIS104 0.0146 1567 CG 13.4638 32.3240 17.1325 C.ar 104 HIS104 0.0551 1568 ND1 13.7852 31.7380 15.9615 N.ar 104 HIS104 -0.2469 1569 CD2 14.4842 33.2198 17.4738 C.ar 104 HIS104 0.0047 1570 CE1 14.9489 32.2793 15.5854 C.ar 104 HIS104 0.0737 1571 NE2 15.4134 33.1481 16.4997 N.ar 104 HIS104 -0.2539 1572 H 12.1170 29.5510 17.1410 H 104 HIS104 0.1312 1573 HA 13.7609 30.8101 19.1521 H 104 HIS104 0.0561 1574 HB1 12.0272 32.7923 18.6073 H 104 HIS104 0.0348 1575 HB2 11.4402 31.6903 17.3602 H 104 HIS104 0.0348 1576 HD2 14.5329 33.8034 18.3801 H 104 HIS104 0.0764 1577 HE1 15.4676 32.0027 14.6792 H 104 HIS104 0.0963 1578 HE2 16.2619 33.6299 16.4640 H 104 HIS104 0.1339 1579 N 12.3230 31.2820 21.1580 N.am 105 THR105 -0.2434 1580 CA 11.5300 31.5050 22.3760 C.3 105 THR105 0.1135 1581 C 11.5260 32.9900 22.6220 C.2 105 THR105 0.2212 1582 O 12.4170 33.7260 22.1590 O.2 105 THR105 -0.2777 1583 CB 12.1125 30.7266 23.5712 C.3 105 THR105 0.0763 1584 OG1 13.4689 31.0938 23.7722 O.3 105 THR105 -0.3900 1585 CG2 12.0129 29.2115 23.3436 C.3 105 THR105 -0.0370 1586 H 13.2730 31.6510 21.1230 H 105 THR105 0.1313 1587 HA 10.4999 31.1996 22.1854 H 105 THR105 0.0583 1588 HB 11.5206 30.9898 24.4568 H 105 THR105 0.0611 1589 HG1 13.8070 30.7160 24.5795 H 105 THR105 0.2098 1590 HG21 12.3027 28.6507 24.2321 H 105 THR105 0.0255 1591 HG22 12.6547 28.8924 22.5214 H 105 THR105 0.0255 1592 HG23 10.9915 28.9264 23.0952 H 105 THR105 0.0255 1593 N 10.5450 33.4330 23.4330 N.am 106 VAL106 -0.2453 1594 CA 10.4530 34.8650 23.7950 C.3 106 VAL106 0.0901 1595 C 10.4120 34.9180 25.3150 C.2 106 VAL106 0.2189 1596 O 9.4640 34.3460 25.9050 O.2 106 VAL106 -0.2778 1597 CB 9.2137 35.5103 23.1423 C.3 106 VAL106 -0.0227 1598 CG1 9.0559 36.9812 23.5629 C.3 106 VAL106 -0.0608 1599 CG2 9.2727 35.4101 21.6088 C.3 106 VAL106 -0.0608 1600 H 9.8590 32.7740 23.8010 H 106 VAL106 0.1312 1601 HA 11.3525 35.3847 23.4625 H 106 VAL106 0.0560 1602 HB 8.3283 34.9674 23.4763 H 106 VAL106 0.0315 1603 HG11 8.1885 37.4366 23.0864 H 106 VAL106 0.0233 1604 HG12 9.9352 37.5662 23.2895 H 106 VAL106 0.0233 1605 HG13 8.9201 37.0787 24.6404 H 106 VAL106 0.0233 1606 HG21 8.3889 35.8569 21.1535 H 106 VAL106 0.0233 1607 HG22 9.3206 34.3757 21.2701 H 106 VAL106 0.0233 1608 HG23 10.1478 35.9281 21.2149 H 106 VAL106 0.0233 1609 N 11.4420 35.5000 25.9220 N.am 107 ASP107 -0.2451 1610 CA 11.5440 35.5750 27.4030 C.3 107 ASP107 0.0974 1611 C 11.3270 34.1850 27.9930 C.2 107 ASP107 0.2190 1612 O 10.6790 34.0340 29.0680 O.2 107 ASP107 -0.2778 1613 CB 10.6224 36.6784 27.9427 C.3 107 ASP107 0.0576 1614 CG 11.0583 38.0296 27.3439 C.2 107 ASP107 0.1780 1615 OD1 12.0250 38.6106 27.8316 O.co2 107 ASP107 -0.6478 1616 OD2 10.4358 38.4917 26.3918 O.co2 107 ASP107 -0.6478 1617 H 12.1850 35.9070 25.3540 H 107 ASP107 0.1312 1618 HA 12.5800 35.8484 27.6058 H 107 ASP107 0.0563 1619 HB1 10.6852 36.7480 29.0278 H 107 ASP107 0.0394 1620 HB2 9.5818 36.4880 27.6825 H 107 ASP107 0.0394 1621 N 11.9750 33.2110 27.3600 N.am 108 GLY108 -0.2485 1622 CA 12.0070 31.8160 27.8180 C.3 108 GLY108 0.0765 1623 C 10.7540 31.0500 27.4840 C.2 108 GLY108 0.2155 1624 O 10.6830 29.8510 27.7990 O.2 108 GLY108 -0.2781 1625 H 12.4800 33.4470 26.5060 H 108 GLY108 0.1309 1626 HA1 12.1599 31.8145 28.8978 H 108 GLY108 0.0521 1627 HA2 12.8518 31.3197 27.3519 H 108 GLY108 0.0521 1628 N 9.7750 31.6770 26.8400 N.am 109 LYS109 -0.2459 1629 CA 8.5070 30.9840 26.5430 C.3 109 LYS109 0.0878 1630 C 8.5900 30.3570 25.1580 C.2 109 LYS109 0.2187 1631 O 8.9550 31.0490 24.1940 O.2 109 LYS109 -0.2778 1632 CB 7.3517 32.0062 26.6025 C.3 109 LYS109 -0.0289 1633 CG 5.9360 31.3948 26.4954 C.3 109 LYS109 -0.0496 1634 CD 5.3168 31.4457 25.0847 C.3 109 LYS109 -0.0278 1635 CE 3.9289 30.7750 25.0293 C.3 109 LYS109 0.1103 1636 NZ 3.3935 30.6426 23.6776 N.4 109 LYS109 -0.0749 1637 H 9.9010 32.6460 26.5480 H 109 LYS109 0.1312 1638 HA 8.3480 30.2058 27.2921 H 109 LYS109 0.0557 1639 HB1 7.4842 32.7846 25.8497 H 109 LYS109 0.0285 1640 HB2 7.4276 32.5206 27.5615 H 109 LYS109 0.0285 1641 HG1 5.2740 31.9408 27.1688 H 109 LYS109 0.0266 1642 HG2 5.9499 30.3684 26.8642 H 109 LYS109 0.0266 1643 HD1 5.9888 30.9696 24.3728 H 109 LYS109 0.0282 1644 HD2 5.2331 32.4837 24.7602 H 109 LYS109 0.0282 1645 HE1 3.2053 31.3417 25.6181 H 109 LYS109 0.0559 1646 HE2 3.9724 29.7750 25.4627 H 109 LYS109 0.0559 1647 HZ1 2.4700 30.1473 23.6520 H 109 LYS109 0.2742 1648 HZ2 4.0374 30.1491 23.0355 H 109 LYS109 0.2742 1649 HZ3 3.1252 31.5637 23.2701 H 109 LYS109 0.2742 1650 N 8.1970 29.0870 25.0390 N.am 110 SER110 -0.2436 1651 CA 8.0220 28.3780 23.7640 C.3 110 SER110 0.1109 1652 C 6.5570 28.4080 23.3640 C.2 110 SER110 0.2209 1653 O 5.6620 28.5120 24.2020 O.2 110 SER110 -0.2777 1654 CB 8.4731 26.9209 23.9357 C.3 110 SER110 0.0681 1655 OG 9.8662 26.8749 24.2110 O.3 110 SER110 -0.3930 1656 H 8.0040 28.5700 25.8970 H 110 SER110 0.1312 1657 HA 8.6191 28.8818 23.0014 H 110 SER110 0.0580 1658 HB1 8.2762 26.3641 23.0152 H 110 SER110 0.0577 1659 HB2 7.8967 26.4604 24.7481 H 110 SER110 0.0577 1660 HG 10.1470 26.0132 24.5073 H 110 SER110 0.2095 1661 N 6.3350 28.2760 22.0740 N.am 111 PHE111 -0.2453 1662 CA 5.0110 28.0520 21.4700 C.3 111 PHE111 0.0920 1663 C 4.9350 26.6200 20.9930 C.2 111 PHE111 0.2217 1664 O 5.9670 25.9730 20.7750 O.2 111 PHE111 -0.2776 1665 CB 4.9247 29.0947 20.3186 C.3 111 PHE111 -0.0036 1666 CG 5.3058 30.4991 20.7582 C.ar 111 PHE111 -0.0454 1667 CD1 6.6385 30.8826 20.9280 C.ar 111 PHE111 -0.0585 1668 CD2 4.3250 31.4661 20.9461 C.ar 111 PHE111 -0.0585 1669 CE1 6.9667 32.1493 21.3917 C.ar 111 PHE111 -0.0615 1670 CE2 4.6452 32.7426 21.3890 C.ar 111 PHE111 -0.0615 1671 CZ 5.9680 33.0795 21.6346 C.ar 111 PHE111 -0.0617 1672 H 7.1380 28.3330 21.4470 H 111 PHE111 0.1312 1673 HA 4.2407 28.2363 22.2205 H 111 PHE111 0.0560 1674 HB1 3.9254 29.1229 19.8883 H 111 PHE111 0.0333 1675 HB2 5.5807 28.8175 19.4961 H 111 PHE111 0.0333 1676 HD1 7.4415 30.1937 20.7084 H 111 PHE111 0.0620 1677 HD2 3.3015 31.2335 20.7071 H 111 PHE111 0.0620 1678 HE1 8.0038 32.4176 21.5345 H 111 PHE111 0.0618 1679 HE2 3.8635 33.4765 21.5242 H 111 PHE111 0.0618 1680 HZ 6.2270 34.0742 21.9681 H 111 PHE111 0.0618 1681 N 3.7320 26.1050 20.7300 N.am 112 PRO112 -0.2316 1682 CA 3.6130 24.7300 20.2870 C.3 112 PRO112 0.0907 1683 C 4.1710 24.4870 18.8830 C.2 112 PRO112 0.2190 1684 O 4.4810 23.3440 18.5290 O.2 112 PRO112 -0.2778 1685 CB 2.0950 24.4729 20.3058 C.3 112 PRO112 -0.0276 1686 CG 1.4443 25.8530 20.2793 C.3 112 PRO112 -0.0379 1687 CD 2.4549 26.7662 20.9748 C.3 112 PRO112 0.0071 1688 HA 4.1205 24.0869 21.0052 H 112 PRO112 0.0559 1689 HB1 1.8196 23.9719 21.2305 H 112 PRO112 0.0285 1690 HB2 1.7392 23.8368 19.4936 H 112 PRO112 0.0285 1691 HG1 0.4653 25.8705 20.7596 H 112 PRO112 0.0278 1692 HG2 1.3048 26.1546 19.2427 H 112 PRO112 0.0278 1693 HD1 2.4613 27.7901 20.6259 H 112 PRO112 0.0431 1694 HD2 2.3004 26.7676 22.0551 H 112 PRO112 0.0431 1695 N 4.2510 25.5340 18.0530 N.am 113 SER113 -0.2436 1696 CA 4.8030 25.3790 16.6960 C.3 113 SER113 0.1109 1697 C 5.3510 26.7240 16.2300 C.2 113 SER113 0.2209 1698 O 5.0050 27.7760 16.7890 O.2 113 SER113 -0.2777 1699 CB 3.7456 24.7673 15.7553 C.3 113 SER113 0.0681 1700 OG 4.2428 24.5857 14.4343 O.3 113 SER113 -0.3930 1701 H 3.9260 26.4500 18.3630 H 113 SER113 0.1312 1702 HA 5.6582 24.7102 16.7789 H 113 SER113 0.0580 1703 HB1 2.8492 25.3879 15.7453 H 113 SER113 0.0577 1704 HB2 3.4443 23.7977 16.1625 H 113 SER113 0.0577 1705 HG 3.5637 24.2620 13.8457 H 113 SER113 0.2095 1706 N 6.1710 26.6650 15.1910 N.am 114 GLU114 -0.2456 1707 CA 6.7090 27.8480 14.5090 C.3 114 GLU114 0.0883 1708 C 6.7130 27.5590 13.0090 C.2 114 GLU114 0.2187 1709 O 7.1690 26.4770 12.5880 O.2 114 GLU114 -0.2778 1710 CB 8.0873 28.1823 15.0544 C.3 114 GLU114 -0.0193 1711 CG 8.5675 29.5647 14.5900 C.3 114 GLU114 0.0356 1712 CD 9.9054 29.9138 15.2340 C.2 114 GLU114 0.1760 1713 OE1 10.2191 29.3525 16.2802 O.co2 114 GLU114 -0.6478 1714 OE2 10.6165 30.7414 14.6779 O.co2 114 GLU114 -0.6478 1715 H 6.4440 25.7450 14.8460 H 114 GLU114 0.1312 1716 HA 6.0270 28.6776 14.7026 H 114 GLU114 0.0557 1717 HB1 8.8105 27.4104 14.7859 H 114 GLU114 0.0290 1718 HB2 8.0212 28.1807 16.1429 H 114 GLU114 0.0290 1719 HG1 7.8536 30.3398 14.8672 H 114 GLU114 0.0374 1720 HG2 8.6825 29.5973 13.5071 H 114 GLU114 0.0374 1721 N 6.2230 28.5220 12.2540 N.am 115 LEU115 -0.2456 1722 CA 6.2240 28.5310 10.7850 C.3 115 LEU115 0.0880 1723 C 7.4290 29.3290 10.3120 C.2 115 LEU115 0.2187 1724 O 7.6710 30.4320 10.8220 O.2 115 LEU115 -0.2778 1725 CB 4.9060 29.1952 10.3359 C.3 115 LEU115 -0.0266 1726 CG 4.8357 29.7243 8.8872 C.3 115 LEU115 -0.0449 1727 CD1 5.0005 28.6130 7.8459 C.3 115 LEU115 -0.0626 1728 CD2 3.5112 30.4640 8.6551 C.3 115 LEU115 -0.0626 1729 H 5.8100 29.3250 12.7280 H 115 LEU115 0.1312 1730 HA 6.2906 27.5047 10.4208 H 115 LEU115 0.0557 1731 HB1 4.7086 30.0279 11.0078 H 115 LEU115 0.0287 1732 HB2 4.0876 28.4978 10.5002 H 115 LEU115 0.0287 1733 HG 5.6329 30.4533 8.7351 H 115 LEU115 0.0296 1734 HD11 4.9041 29.0251 6.8424 H 115 LEU115 0.0232 1735 HD12 4.2359 27.8467 7.9585 H 115 LEU115 0.0232 1736 HD13 5.9731 28.1297 7.9123 H 115 LEU115 0.0232 1737 HD21 3.4552 30.8665 7.6430 H 115 LEU115 0.0232 1738 HD22 3.3947 31.2987 9.3468 H 115 LEU115 0.0232 1739 HD23 2.6631 29.7938 8.7957 H 115 LEU115 0.0232 1740 N 8.1420 28.8050 9.3180 N.am 116 HIS116 -0.2453 1741 CA 9.2810 29.4870 8.6840 C.3 116 HIS116 0.0932 1742 C 8.9750 29.6760 7.2070 C.2 116 HIS116 0.2190 1743 O 8.8000 28.6740 6.4730 O.2 116 HIS116 -0.2778 1744 CB 10.5360 28.6390 8.8350 C.3 116 HIS116 0.0146 1745 CG 11.0520 28.6640 10.2280 C.ar 116 HIS116 0.0551 1746 ND1 11.9600 27.7410 10.7130 N.ar 116 HIS116 -0.2469 1747 CD2 10.7750 29.5380 11.2360 C.ar 116 HIS116 0.0047 1748 CE1 12.2090 28.0580 11.9660 C.ar 116 HIS116 0.0737 1749 NE2 11.5020 29.1480 12.3250 N.ar 116 HIS116 -0.2539 1750 H 7.8850 27.8790 8.9770 H 116 HIS116 0.1312 1751 HA 9.4390 30.4810 9.1650 H 116 HIS116 0.0561 1752 HB1 11.3220 28.9430 8.1050 H 116 HIS116 0.0348 1753 HB2 10.2550 27.5850 8.6030 H 116 HIS116 0.0348 1754 HD2 10.0900 30.4010 11.1830 H 116 HIS116 0.0764 1755 HE1 12.8990 27.5090 12.6290 H 116 HIS116 0.0963 1756 HE2 11.5090 29.5980 13.2400 H 116 HIS116 0.1339 1757 N 8.9270 30.9280 6.7860 N.am 117 LEU117 -0.2456 1758 CA 8.7670 31.3330 5.3820 C.3 117 LEU117 0.0880 1759 C 10.1640 31.6710 4.8850 C.2 117 LEU117 0.2187 1760 O 10.7630 32.6640 5.3540 O.2 117 LEU117 -0.2778 1761 CB 7.8383 32.5542 5.3066 C.3 117 LEU117 -0.0266 1762 CG 6.3821 32.2684 5.7327 C.3 117 LEU117 -0.0449 1763 CD1 5.8282 33.4011 6.6097 C.3 117 LEU117 -0.0626 1764 CD2 5.4772 32.0488 4.5113 C.3 117 LEU117 -0.0626 1765 H 9.0070 31.6660 7.4850 H 117 LEU117 0.1312 1766 HA 8.3646 30.4975 4.8071 H 117 LEU117 0.0557 1767 HB1 7.8474 32.9729 4.2997 H 117 LEU117 0.0287 1768 HB2 8.2614 33.3233 5.9472 H 117 LEU117 0.0287 1769 HG 6.3566 31.3591 6.3354 H 117 LEU117 0.0296 1770 HD11 4.8081 33.1873 6.9308 H 117 LEU117 0.0232 1771 HD12 5.8203 34.3493 6.0715 H 117 LEU117 0.0232 1772 HD13 6.4342 33.5323 7.5073 H 117 LEU117 0.0232 1773 HD21 4.4713 31.7563 4.8142 H 117 LEU117 0.0232 1774 HD22 5.8682 31.2692 3.8603 H 117 LEU117 0.0232 1775 HD23 5.3951 32.9578 3.9147 H 117 LEU117 0.0232 1776 N 10.6910 30.8590 3.9730 N.am 118 VAL118 -0.2454 1777 CA 12.1150 30.8780 3.5960 C.3 118 VAL118 0.0901 1778 C 12.2780 31.5870 2.2670 C.2 118 VAL118 0.2189 1779 O 11.7300 31.1290 1.2580 O.2 118 VAL118 -0.2778 1780 CB 12.6305 29.4274 3.5234 C.3 118 VAL118 -0.0227 1781 CG1 14.1423 29.3749 3.2577 C.3 118 VAL118 -0.0608 1782 CG2 12.2929 28.6428 4.7995 C.3 118 VAL118 -0.0608 1783 H 10.0770 30.1880 3.5110 H 118 VAL118 0.1312 1784 HA 12.6630 31.4306 4.3618 H 118 VAL118 0.0560 1785 HB 12.1272 28.9230 2.6963 H 118 VAL118 0.0315 1786 HG11 14.4795 28.3445 3.1579 H 118 VAL118 0.0233 1787 HG12 14.7042 29.8345 4.0711 H 118 VAL118 0.0233 1788 HG13 14.4059 29.8953 2.3379 H 118 VAL118 0.0233 1789 HG21 12.7071 27.6388 4.7406 H 118 VAL118 0.0233 1790 HG22 11.2171 28.5331 4.9413 H 118 VAL118 0.0233 1791 HG23 12.7051 29.1265 5.6860 H 118 VAL118 0.0233 1792 N 13.0310 32.6850 2.2660 N.am 119 HIS119 -0.2453 1793 CA 13.2160 33.5580 1.0830 C.3 119 HIS119 0.0932 1794 C 14.6940 33.6700 0.7450 C.2 119 HIS119 0.2190 1795 O 15.5460 33.5500 1.6490 O.2 119 HIS119 -0.2778 1796 CB 12.6591 34.9701 1.3314 C.3 119 HIS119 0.0146 1797 CG 11.2494 34.9602 1.8708 C.ar 119 HIS119 0.0551 1798 ND1 10.9527 34.7888 3.1754 N.ar 119 HIS119 -0.2469 1799 CD2 10.0830 35.3784 1.2093 C.ar 119 HIS119 0.0047 1800 CE1 9.6423 35.0445 3.2959 C.ar 119 HIS119 0.0737 1801 NE2 9.0875 35.3951 2.1229 N.ar 119 HIS119 -0.2539 1802 H 13.5090 32.9400 3.1310 H 119 HIS119 0.1312 1803 HA 12.7019 33.0666 0.2672 H 119 HIS119 0.0561 1804 HB1 12.6526 35.5320 0.4000 H 119 HIS119 0.0348 1805 HB2 13.2833 35.5164 2.0385 H 119 HIS119 0.0348 1806 HD2 10.0105 35.6791 0.1745 H 119 HIS119 0.0764 1807 HE1 9.1086 34.9969 4.2339 H 119 HIS119 0.0963 1808 HE2 8.1524 35.6487 1.9787 H 119 HIS119 0.1339 1809 N 14.9970 33.9770 -0.5060 N.am 120 TRP120 -0.2453 1810 CA 16.3820 34.0750 -0.9350 C.3 120 TRP120 0.0918 1811 C 16.5870 35.2720 -1.8490 C.2 120 TRP120 0.2190 1812 O 15.6780 35.7500 -2.5320 O.2 120 TRP120 -0.2778 1813 CB 16.8718 32.7599 -1.5572 C.3 120 TRP120 -0.0021 1814 CG 16.2012 32.4635 -2.8827 C.ar 120 TRP120 -0.0260 1815 CD1 14.8683 32.0848 -3.0659 C.ar 120 TRP120 -0.0136 1816 CD2 16.8245 32.4090 -4.1826 C.ar 120 TRP120 -0.0028 1817 NE1 14.6628 31.8008 -4.3724 N.ar 120 TRP120 -0.2641 1818 CE2 15.8350 31.9726 -5.0929 C.ar 120 TRP120 0.0269 1819 CE3 18.0969 32.6553 -4.6236 C.ar 120 TRP120 -0.0528 1820 CZ2 16.1477 31.7868 -6.4120 C.ar 120 TRP120 -0.0430 1821 CZ3 18.4202 32.4662 -5.9667 C.ar 120 TRP120 -0.0611 1822 CH2 17.4458 32.0299 -6.8636 C.ar 120 TRP120 -0.0602 1823 H 14.2490 34.1470 -1.1780 H 120 TRP120 0.1312 1824 HA 16.9892 34.2779 -0.0525 H 120 TRP120 0.0560 1825 HB1 16.6695 31.9379 -0.8719 H 120 TRP120 0.0334 1826 HB2 17.9540 32.7876 -1.6906 H 120 TRP120 0.0334 1827 HD1 14.1286 31.9922 -2.2841 H 120 TRP120 0.0748 1828 HE1 13.8211 31.4757 -4.7621 H 120 TRP120 0.1331 1829 HE3 18.8551 32.9939 -3.9345 H 120 TRP120 0.0624 1830 HZ2 15.3831 31.4450 -7.0947 H 120 TRP120 0.0633 1831 HZ3 19.4273 32.6566 -6.3098 H 120 TRP120 0.0618 1832 HH2 17.7009 31.8843 -7.9035 H 120 TRP120 0.0618 1833 N 17.8400 35.7150 -1.8750 N.am 121 ASN121 -0.2452 1834 CA 18.2520 36.9210 -2.6210 C.3 121 ASN121 0.0957 1835 C 18.5750 36.5410 -4.0690 C.2 121 ASN121 0.2191 1836 O 19.7450 36.3610 -4.4090 O.2 121 ASN121 -0.2778 1837 CB 19.4607 37.5032 -1.8569 C.3 121 ASN121 0.0446 1838 CG 19.7238 38.9819 -2.1485 C.2 121 ASN121 0.2000 1839 OD1 18.9327 39.6684 -2.7788 O.2 121 ASN121 -0.2797 1840 ND2 20.8845 39.4293 -1.6422 N.am 121 ASN121 -0.2723 1841 H 18.5500 35.1980 -1.3560 H 121 ASN121 0.1312 1842 HA 17.4116 37.6197 -2.6047 H 121 ASN121 0.0562 1843 HB1 20.3674 36.9378 -2.0436 H 121 ASN121 0.0375 1844 HB2 19.2896 37.4242 -0.7863 H 121 ASN121 0.0375 1845 HD21 21.1587 40.3807 -1.7679 H 121 ASN121 0.1266 1846 HD22 21.5031 38.8414 -1.1173 H 121 ASN121 0.1266 1847 N 17.5470 36.4140 -4.8760 N.am 122 ALA122 -0.2459 1848 CA 17.6650 35.9630 -6.2740 C.3 122 ALA122 0.0850 1849 C 18.1750 37.0980 -7.1590 C.2 122 ALA122 0.2184 1850 O 18.5880 36.8380 -8.2800 O.2 122 ALA122 -0.2778 1851 CB 16.2857 35.5021 -6.7399 C.3 122 ALA122 -0.0411 1852 H 16.6190 36.6390 -4.5170 H 122 ALA122 0.1312 1853 HA 18.3908 35.1509 -6.3109 H 122 ALA122 0.0554 1854 HB1 16.3167 35.1070 -7.7554 H 122 ALA122 0.0249 1855 HB2 15.5804 36.3324 -6.7127 H 122 ALA122 0.0249 1856 HB3 15.8991 34.7224 -6.0855 H 122 ALA122 0.0249 1857 N 18.1410 38.3170 -6.6520 N.am 123 LYS123 -0.2457 1858 CA 18.6960 39.4590 -7.4030 C.3 123 LYS123 0.0878 1859 C 20.2150 39.3090 -7.4490 C.2 123 LYS123 0.2187 1860 O 20.8070 39.6740 -8.4500 O.2 123 LYS123 -0.2778 1861 CB 18.2636 40.7877 -6.7533 C.3 123 LYS123 -0.0289 1862 CG 19.1885 41.2142 -5.6080 C.3 123 LYS123 -0.0496 1863 CD 18.6767 42.3651 -4.7541 C.3 123 LYS123 -0.0278 1864 CE 19.7504 42.7270 -3.7285 C.3 123 LYS123 0.1103 1865 NZ 19.2908 43.6899 -2.7577 N.4 123 LYS123 -0.0749 1866 H 17.7270 38.4700 -5.7320 H 123 LYS123 0.1312 1867 HA 18.3016 39.3955 -8.4190 H 123 LYS123 0.0557 1868 HB1 17.2355 40.6984 -6.3994 H 123 LYS123 0.0285 1869 HB2 18.2568 41.5751 -7.5077 H 123 LYS123 0.0285 1870 HG1 20.1592 41.4979 -6.0175 H 123 LYS123 0.0266 1871 HG2 19.3673 40.3574 -4.9635 H 123 LYS123 0.0266 1872 HD1 17.7547 42.0669 -4.2518 H 123 LYS123 0.0282 1873 HD2 18.4400 43.2287 -5.3767 H 123 LYS123 0.0282 1874 HE1 20.6384 43.1384 -4.2119 H 123 LYS123 0.0559 1875 HE2 20.0669 41.8420 -3.1759 H 123 LYS123 0.0559 1876 HZ1 20.0108 43.8354 -2.0182 H 123 LYS123 0.2742 1877 HZ2 18.4135 43.3986 -2.2915 H 123 LYS123 0.2742 1878 HZ3 19.1953 44.6505 -3.1542 H 123 LYS123 0.2742 1879 N 20.8230 38.7590 -6.4090 N.am 124 LYS124 -0.2457 1880 CA 22.2920 38.7300 -6.2630 C.3 124 LYS124 0.0878 1881 C 22.8830 37.3460 -6.5530 C.2 124 LYS124 0.2187 1882 O 24.0160 37.2610 -7.0790 O.2 124 LYS124 -0.2778 1883 CB 22.6071 39.1643 -4.8271 C.3 124 LYS124 -0.0289 1884 CG 24.1063 39.3342 -4.5456 C.3 124 LYS124 -0.0496 1885 CD 24.3445 39.7320 -3.0888 C.3 124 LYS124 -0.0278 1886 CE 25.8260 39.7560 -2.6963 C.3 124 LYS124 0.1103 1887 NZ 25.9873 39.8138 -1.2480 N.4 124 LYS124 -0.0749 1888 H 20.2520 38.3370 -5.6770 H 124 LYS124 0.1312 1889 HA 22.7299 39.4365 -6.9701 H 124 LYS124 0.0557 1890 HB1 22.1812 38.4399 -4.1305 H 124 LYS124 0.0285 1891 HB2 22.0992 40.1078 -4.6238 H 124 LYS124 0.0285 1892 HG1 24.5336 40.0798 -5.2167 H 124 LYS124 0.0266 1893 HG2 24.6255 38.3962 -4.7470 H 124 LYS124 0.0266 1894 HD1 23.8158 39.0160 -2.4649 H 124 LYS124 0.0282 1895 HD2 23.8874 40.7002 -2.8816 H 124 LYS124 0.0282 1896 HE1 26.3243 40.6197 -3.1382 H 124 LYS124 0.0559 1897 HE2 26.3368 38.8591 -3.0520 H 124 LYS124 0.0559 1898 HZ1 26.9667 39.9343 -0.9419 H 124 LYS124 0.2742 1899 HZ2 25.6136 38.9458 -0.7992 H 124 LYS124 0.2742 1900 HZ3 25.3554 40.5208 -0.8178 H 124 LYS124 0.2742 1901 N 22.1650 36.2840 -6.2330 N.am 125 TYR125 -0.2453 1902 CA 22.6890 34.9070 -6.3640 C.3 125 TYR125 0.0917 1903 C 21.8990 34.1590 -7.4190 C.2 125 TYR125 0.2191 1904 O 20.7240 34.4070 -7.6190 O.2 125 TYR125 -0.2778 1905 CB 22.6313 34.1861 -5.0100 C.3 125 TYR125 -0.0036 1906 CG 23.4075 34.9382 -3.9594 C.ar 125 TYR125 -0.0453 1907 CD1 24.7939 35.0279 -4.0319 C.ar 125 TYR125 -0.0561 1908 CD2 22.7474 35.5959 -2.9295 C.ar 125 TYR125 -0.0561 1909 CE1 25.5082 35.7600 -3.0950 C.ar 125 TYR125 -0.0317 1910 CE2 23.4566 36.3483 -2.0022 C.ar 125 TYR125 -0.0317 1911 CZ 24.8371 36.4254 -2.0826 C.ar 125 TYR125 0.0726 1912 OH 25.5378 37.1927 -1.1759 O.3 125 TYR125 -0.3598 1913 H 21.2160 36.4180 -5.8830 H 125 TYR125 0.1312 1914 HA 23.7239 34.9475 -6.7091 H 125 TYR125 0.0560 1915 HB1 23.0441 33.1801 -5.0983 H 125 TYR125 0.0333 1916 HB2 21.5946 34.0719 -4.6928 H 125 TYR125 0.0333 1917 HD1 25.3255 34.5393 -4.8340 H 125 TYR125 0.0621 1918 HD2 21.6743 35.5234 -2.8697 H 125 TYR125 0.0621 1919 HE1 26.5833 35.8214 -3.1659 H 125 TYR125 0.0643 1920 HE2 22.9449 36.9059 -1.2328 H 125 TYR125 0.0643 1921 HH 24.9754 37.3949 -0.4299 H 125 TYR125 0.2173 1922 N 22.5050 33.1760 -8.0760 N.am 126 SER126 -0.2436 1923 CA 21.8450 32.4770 -9.2110 C.3 126 SER126 0.1109 1924 C 21.0620 31.2450 -8.7450 C.2 126 SER126 0.2210 1925 O 20.2830 30.6930 -9.5470 O.2 126 SER126 -0.2777 1926 CB 22.8803 32.0810 -10.2809 C.3 126 SER126 0.0681 1927 OG 23.5272 30.8414 -10.0500 O.3 126 SER126 -0.3930 1928 H 23.4440 32.8940 -7.7960 H 126 SER126 0.1312 1929 HA 21.1382 33.1755 -9.6598 H 126 SER126 0.0580 1930 HB1 23.6225 32.8757 -10.4151 H 126 SER126 0.0577 1931 HB2 22.3723 31.9832 -11.2405 H 126 SER126 0.0577 1932 HG 23.9936 30.8882 -9.2129 H 126 SER126 0.2095 1933 N 21.3120 30.7440 -7.5400 N.am 127 THR127 -0.2433 1934 CA 20.5510 29.5860 -7.0200 C.3 127 THR127 0.1135 1935 C 20.2840 29.8080 -5.5430 C.2 127 THR127 0.2212 1936 O 21.0590 30.4870 -4.8640 O.2 127 THR127 -0.2777 1937 CB 21.2672 28.2463 -7.2912 C.3 127 THR127 0.0763 1938 OG1 22.5460 28.2035 -6.7035 O.3 127 THR127 -0.3900 1939 CG2 21.3533 27.9008 -8.7878 C.3 127 THR127 -0.0370 1940 H 22.0410 31.1640 -6.9640 H 127 THR127 0.1313 1941 HA 19.5776 29.5834 -7.5128 H 127 THR127 0.0583 1942 HB 20.6923 27.4494 -6.8175 H 127 THR127 0.0611 1943 HG1 23.0860 28.8555 -7.1464 H 127 THR127 0.2098 1944 HG21 21.8227 26.9280 -8.9322 H 127 THR127 0.0255 1945 HG22 21.9355 28.6304 -9.3520 H 127 THR127 0.0255 1946 HG23 20.3605 27.8612 -9.2352 H 127 THR127 0.0255 1947 N 19.2750 29.1310 -5.0670 N.am 128 PHE128 -0.2453 1948 CA 18.9960 29.0670 -3.6280 C.3 128 PHE128 0.0917 1949 C 20.2290 28.5390 -2.8810 C.2 128 PHE128 0.2188 1950 O 20.5810 29.0770 -1.8290 O.2 128 PHE128 -0.2778 1951 CB 17.7686 28.1679 -3.4248 C.3 128 PHE128 -0.0036 1952 CG 17.3529 28.0709 -1.9824 C.ar 128 PHE128 -0.0454 1953 CD1 16.5221 29.0352 -1.4249 C.ar 128 PHE128 -0.0585 1954 CD2 17.7849 27.0131 -1.1904 C.ar 128 PHE128 -0.0585 1955 CE1 16.1416 28.9605 -0.0926 C.ar 128 PHE128 -0.0615 1956 CE2 17.3978 26.9286 0.1387 C.ar 128 PHE128 -0.0615 1957 CZ 16.5841 27.9063 0.6935 C.ar 128 PHE128 -0.0617 1958 H 18.6630 28.6320 -5.7130 H 128 PHE128 0.1312 1959 HA 18.7956 30.0856 -3.2914 H 128 PHE128 0.0560 1960 HB1 17.9611 27.1675 -3.8145 H 128 PHE128 0.0333 1961 HB2 16.9342 28.5658 -4.0032 H 128 PHE128 0.0333 1962 HD1 16.1643 29.8476 -2.0355 H 128 PHE128 0.0620 1963 HD2 18.4318 26.2528 -1.6041 H 128 PHE128 0.0620 1964 HE1 15.5038 29.7249 0.3265 H 128 PHE128 0.0618 1965 HE2 17.7342 26.0970 0.7354 H 128 PHE128 0.0618 1966 HZ 16.2967 27.8452 1.7324 H 128 PHE128 0.0618 1967 N 20.8680 27.4630 -3.3590 N.am 129 GLY129 -0.2485 1968 CA 22.0070 26.8670 -2.6360 C.3 129 GLY129 0.0765 1969 C 23.2020 27.8030 -2.5900 C.2 129 GLY129 0.2155 1970 O 23.8970 27.8730 -1.5770 O.2 129 GLY129 -0.2781 1971 H 20.5610 27.0480 -4.2390 H 129 GLY129 0.1309 1972 HA1 22.2819 25.9499 -3.1556 H 129 GLY129 0.0521 1973 HA2 21.6845 26.6222 -1.6232 H 129 GLY129 0.0521 1974 N 23.3960 28.6300 -3.6150 N.am 130 GLU130 -0.2459 1975 CA 24.4410 29.6690 -3.5700 C.3 130 GLU130 0.0883 1976 C 24.0790 30.7250 -2.5340 C.2 130 GLU130 0.2187 1977 O 24.9080 31.0730 -1.7050 O.2 130 GLU130 -0.2778 1978 CB 24.5122 30.2467 -4.9785 C.3 130 GLU130 -0.0193 1979 CG 25.4433 31.4452 -5.1987 C.3 130 GLU130 0.0356 1980 CD 25.2219 32.0024 -6.6142 C.2 130 GLU130 0.1760 1981 OE1 24.7424 31.2699 -7.4754 O.co2 130 GLU130 -0.6478 1982 OE2 25.5185 33.1670 -6.8468 O.co2 130 GLU130 -0.6478 1983 H 22.8110 28.5430 -4.4460 H 130 GLU130 0.1312 1984 HA 25.3851 29.1995 -3.2909 H 130 GLU130 0.0557 1985 HB1 23.5042 30.5294 -5.2839 H 130 GLU130 0.0290 1986 HB2 24.8433 29.4464 -5.6382 H 130 GLU130 0.0290 1987 HG1 26.4886 31.1609 -5.0925 H 130 GLU130 0.0374 1988 HG2 25.2384 32.2363 -4.4807 H 130 GLU130 0.0374 1989 N 22.8250 31.1960 -2.5460 N.am 131 ALA131 -0.2459 1990 CA 22.3970 32.1910 -1.5480 C.3 131 ALA131 0.0850 1991 C 22.5600 31.6130 -0.1310 C.2 131 ALA131 0.2184 1992 O 22.8980 32.3600 0.7880 O.2 131 ALA131 -0.2778 1993 CB 20.9414 32.5732 -1.8267 C.3 131 ALA131 -0.0411 1994 H 22.1640 30.8640 -3.2490 H 131 ALA131 0.1312 1995 HA 23.0562 33.0537 -1.6497 H 131 ALA131 0.0554 1996 HB1 20.5970 33.3414 -1.1382 H 131 ALA131 0.0249 1997 HB2 20.2762 31.7138 -1.7380 H 131 ALA131 0.0249 1998 HB3 20.8404 32.9663 -2.8367 H 131 ALA131 0.0249 1999 N 22.2840 30.3390 0.0540 N.am 132 ALA132 -0.2459 2000 CA 22.2750 29.7160 1.3870 C.3 132 ALA132 0.0850 2001 C 23.6800 29.6700 1.9930 C.2 132 ALA132 0.2185 2002 O 23.7630 29.3630 3.1820 O.2 132 ALA132 -0.2778 2003 CB 21.6780 28.3083 1.2732 C.3 132 ALA132 -0.0411 2004 H 22.0680 29.7610 -0.7590 H 132 ALA132 0.1312 2005 HA 21.6528 30.3439 2.0218 H 132 ALA132 0.0554 2006 HB1 21.6054 27.8260 2.2487 H 132 ALA132 0.0249 2007 HB2 22.2831 27.6731 0.6255 H 132 ALA132 0.0249 2008 HB3 20.6741 28.3489 0.8497 H 132 ALA132 0.0249 2009 N 24.7260 29.9490 1.1980 N.am 133 SER133 -0.2436 2010 CA 26.1630 30.0090 1.5920 C.3 133 SER133 0.1109 2011 C 26.5360 31.4140 2.1210 C.2 133 SER133 0.2209 2012 O 27.4300 31.5520 2.9730 O.2 133 SER133 -0.2777 2013 CB 27.0523 29.6219 0.3984 C.3 133 SER133 0.0681 2014 OG 27.2704 30.7308 -0.4657 O.3 133 SER133 -0.3930 2015 H 24.5140 30.1410 0.2190 H 133 SER133 0.1312 2016 HA 26.2942 29.2912 2.4020 H 133 SER133 0.0580 2017 HB1 26.5852 28.7824 -0.1316 H 133 SER133 0.0577 2018 HB2 28.0225 29.2813 0.7698 H 133 SER133 0.0577 2019 HG 27.5869 30.4615 -1.3246 H 133 SER133 0.2095 2020 N 25.8060 32.4420 1.7270 N.am 134 ALA134 -0.2458 2021 CA 26.2440 33.8550 1.8200 C.3 134 ALA134 0.0852 2022 C 25.5940 34.5500 3.0190 C.2 134 ALA134 0.2211 2023 O 24.4140 34.3400 3.2530 O.2 134 ALA134 -0.2776 2024 CB 25.8273 34.5675 0.5331 C.3 134 ALA134 -0.0411 2025 H 24.8840 32.2520 1.3350 H 134 ALA134 0.1312 2026 HA 27.3289 33.8472 1.8950 H 134 ALA134 0.0554 2027 HB1 26.1689 35.6017 0.5427 H 134 ALA134 0.0249 2028 HB2 24.7436 34.5667 0.4062 H 134 ALA134 0.0249 2029 HB3 26.2610 34.0792 -0.3401 H 134 ALA134 0.0249 2030 N 26.2890 35.4730 3.7340 N.am 135 PRO135 -0.2316 2031 CA 25.6710 36.1400 4.8890 C.3 135 PRO135 0.0907 2032 C 24.3710 36.8890 4.5800 C.2 135 PRO135 0.2189 2033 O 23.5020 36.9340 5.4420 O.2 135 PRO135 -0.2778 2034 CB 26.7624 37.1619 5.2734 C.3 135 PRO135 -0.0276 2035 CG 28.0704 36.5987 4.7304 C.3 135 PRO135 -0.0379 2036 CD 27.6714 35.8510 3.4638 C.3 135 PRO135 0.0071 2037 HA 25.5248 35.3844 5.6583 H 135 PRO135 0.0559 2038 HB1 26.8230 37.3610 6.3400 H 135 PRO135 0.0285 2039 HB2 26.5915 38.1219 4.7811 H 135 PRO135 0.0285 2040 HG1 28.4876 35.8931 5.4501 H 135 PRO135 0.0278 2041 HG2 28.8201 37.3682 4.5444 H 135 PRO135 0.0278 2042 HD1 27.6706 36.4848 2.5750 H 135 PRO135 0.0431 2043 HD2 28.2952 34.9690 3.3187 H 135 PRO135 0.0431 2044 N 24.2690 37.4480 3.3820 N.am 136 ASP136 -0.2451 2045 CA 23.0800 38.2210 2.9520 C.3 136 ASP136 0.0974 2046 C 22.1720 37.3690 2.0510 C.2 136 ASP136 0.2190 2047 O 21.3360 37.9300 1.3520 O.2 136 ASP136 -0.2778 2048 CB 23.5130 39.5346 2.2853 C.3 136 ASP136 0.0576 2049 CG 24.3438 39.3101 1.0155 C.2 136 ASP136 0.1780 2050 OD1 25.5179 38.9627 1.0945 O.co2 136 ASP136 -0.6478 2051 OD2 23.8278 39.4894 -0.0780 O.co2 136 ASP136 -0.6478 2052 H 25.0440 37.3410 2.7270 H 136 ASP136 0.1312 2053 HA 22.4949 38.4688 3.8383 H 136 ASP136 0.0563 2054 HB1 24.1121 40.1238 2.9779 H 136 ASP136 0.0394 2055 HB2 22.6423 40.1407 2.0325 H 136 ASP136 0.0394 2056 N 22.3250 36.0530 2.0390 N.am 137 GLY137 -0.2485 2057 CA 21.6460 35.2380 1.0240 C.3 137 GLY137 0.0765 2058 C 20.1910 34.9450 1.3230 C.2 137 GLY137 0.2155 2059 O 19.3940 34.8480 0.3620 O.2 137 GLY137 -0.2781 2060 H 22.9170 35.6040 2.7380 H 137 GLY137 0.1309 2061 HA1 22.2106 34.3372 0.9556 H 137 GLY137 0.0521 2062 HA2 21.7064 35.7424 0.0633 H 137 GLY137 0.0521 2063 N 19.8340 34.7240 2.5860 N.am 138 LEU138 -0.2459 2064 CA 18.4870 34.2590 2.9400 C.3 138 LEU138 0.0880 2065 C 17.8090 35.2080 3.9130 C.2 138 LEU138 0.2187 2066 O 18.4690 35.8670 4.7460 O.2 138 LEU138 -0.2778 2067 CB 18.5573 32.8551 3.5642 C.3 138 LEU138 -0.0266 2068 CG 19.1872 31.7736 2.6685 C.3 138 LEU138 -0.0449 2069 CD1 19.2194 30.4402 3.4236 C.3 138 LEU138 -0.0626 2070 CD2 18.4484 31.6069 1.3336 C.3 138 LEU138 -0.0626 2071 H 20.5150 34.8820 3.3290 H 138 LEU138 0.1312 2072 HA 17.8719 34.2335 2.0424 H 138 LEU138 0.0557 2073 HB1 17.5528 32.5332 3.8452 H 138 LEU138 0.0287 2074 HB2 19.1278 32.9102 4.4913 H 138 LEU138 0.0287 2075 HG 20.2168 32.0607 2.4513 H 138 LEU138 0.0296 2076 HD11 19.6620 29.6469 2.8226 H 138 LEU138 0.0232 2077 HD12 18.2134 30.1206 3.6971 H 138 LEU138 0.0232 2078 HD13 19.7998 30.5287 4.3416 H 138 LEU138 0.0232 2079 HD21 18.8793 30.7951 0.7463 H 138 LEU138 0.0232 2080 HD22 18.5145 32.5081 0.7278 H 138 LEU138 0.0232 2081 HD23 17.3927 31.3839 1.4912 H 138 LEU138 0.0232 2082 N 16.4940 35.2170 3.8740 N.am 139 ALA139 -0.2459 2083 CA 15.6510 35.8960 4.8520 C.3 139 ALA139 0.0850 2084 C 14.5520 34.9310 5.2510 C.2 139 ALA139 0.2184 2085 O 13.8120 34.4600 4.3690 O.2 139 ALA139 -0.2778 2086 CB 15.0788 37.1818 4.2411 C.3 139 ALA139 -0.0411 2087 H 16.0350 34.7180 3.1120 H 139 ALA139 0.1312 2088 HA 16.2552 36.1265 5.7283 H 139 ALA139 0.0554 2089 HB1 14.4342 37.7043 4.9488 H 139 ALA139 0.0249 2090 HB2 14.4950 36.9762 3.3438 H 139 ALA139 0.0249 2091 HB3 15.8817 37.8640 3.9616 H 139 ALA139 0.0249 2092 N 14.4700 34.6070 6.5350 N.am 140 VAL140 -0.2454 2093 CA 13.4260 33.7120 7.0320 C.3 140 VAL140 0.0901 2094 C 12.5040 34.5090 7.9310 C.2 140 VAL140 0.2189 2095 O 12.9840 35.1320 8.8850 O.2 140 VAL140 -0.2778 2096 CB 14.0391 32.4941 7.7595 C.3 140 VAL140 -0.0227 2097 CG1 12.9638 31.6059 8.4145 C.3 140 VAL140 -0.0608 2098 CG2 14.8793 31.6385 6.7972 C.3 140 VAL140 -0.0608 2099 H 15.1510 34.9910 7.1900 H 140 VAL140 0.1312 2100 HA 12.8426 33.3480 6.1882 H 140 VAL140 0.0560 2101 HB 14.6975 32.8613 8.5488 H 140 VAL140 0.0315 2102 HG11 13.4098 30.7178 8.8631 H 140 VAL140 0.0233 2103 HG12 12.2289 31.2732 7.6805 H 140 VAL140 0.0233 2104 HG13 12.4300 32.1324 9.2062 H 140 VAL140 0.0233 2105 HG21 15.3790 30.8293 7.3311 H 140 VAL140 0.0233 2106 HG22 15.6469 32.2216 6.2910 H 140 VAL140 0.0233 2107 HG23 14.2521 31.1881 6.0287 H 140 VAL140 0.0233 2108 N 11.2200 34.4730 7.6290 N.am 141 VAL141 -0.2454 2109 CA 10.1880 35.0840 8.4780 C.3 141 VAL141 0.0901 2110 C 9.6310 33.9710 9.3400 C.2 141 VAL141 0.2187 2111 O 9.1410 32.9460 8.8180 O.2 141 VAL141 -0.2778 2112 CB 9.1115 35.7979 7.6359 C.3 141 VAL141 -0.0227 2113 CG1 8.0708 36.4989 8.5264 C.3 141 VAL141 -0.0608 2114 CG2 9.7407 36.8060 6.6600 C.3 141 VAL141 -0.0608 2115 H 10.9320 34.0020 6.7710 H 141 VAL141 0.1312 2116 HA 10.6873 35.8264 9.0837 H 141 VAL141 0.0560 2117 HB 8.5862 35.0564 7.0406 H 141 VAL141 0.0315 2118 HG11 7.3189 37.0096 7.9244 H 141 VAL141 0.0233 2119 HG12 8.5429 37.2407 9.1719 H 141 VAL141 0.0233 2120 HG13 7.5481 35.7879 9.1674 H 141 VAL141 0.0233 2121 HG21 8.9782 37.2739 6.0398 H 141 VAL141 0.0233 2122 HG22 10.4508 36.3300 5.9832 H 141 VAL141 0.0233 2123 HG23 10.2691 37.5965 7.1935 H 141 VAL141 0.0233 2124 N 9.7340 34.1510 10.6580 N.am 142 GLY142 -0.2485 2125 CA 9.1840 33.2050 11.5910 C.3 142 GLY142 0.0765 2126 C 7.8730 33.6940 12.1640 C.2 142 GLY142 0.2155 2127 O 7.7650 34.8710 12.5360 O.2 142 GLY142 -0.2781 2128 H 10.2140 34.9790 11.0120 H 142 GLY142 0.1309 2129 HA1 9.9062 33.0935 12.4010 H 142 GLY142 0.0521 2130 HA2 9.0625 32.2413 11.1114 H 142 GLY142 0.0521 2131 N 6.9150 32.7940 12.2670 N.am 143 VAL143 -0.2456 2132 CA 5.5710 33.0760 12.8350 C.3 143 VAL143 0.0901 2133 C 5.2980 32.0170 13.8920 C.2 143 VAL143 0.2189 2134 O 5.3090 30.8270 13.5960 O.2 143 VAL143 -0.2778 2135 CB 4.4923 33.0857 11.7292 C.3 143 VAL143 -0.0227 2136 CG1 3.1520 33.6175 12.2617 C.3 143 VAL143 -0.0608 2137 CG2 4.9393 33.8795 10.4906 C.3 143 VAL143 -0.0608 2138 H 7.1080 31.8480 11.9370 H 143 VAL143 0.1312 2139 HA 5.6111 34.0508 13.3259 H 143 VAL143 0.0560 2140 HB 4.3238 32.0639 11.3980 H 143 VAL143 0.0315 2141 HG11 2.3832 33.5851 11.4891 H 143 VAL143 0.0233 2142 HG12 3.2447 34.6491 12.6029 H 143 VAL143 0.0233 2143 HG13 2.7927 33.0223 13.1016 H 143 VAL143 0.0233 2144 HG21 4.1259 33.9807 9.7716 H 143 VAL143 0.0233 2145 HG22 5.7621 33.3828 9.9751 H 143 VAL143 0.0233 2146 HG23 5.2789 34.8773 10.7633 H 143 VAL143 0.0233 2147 N 5.0290 32.4480 15.1190 N.am 144 PHE144 -0.2453 2148 CA 4.6320 31.5090 16.1630 C.3 144 PHE144 0.0917 2149 C 3.1940 31.0790 15.9610 C.2 144 PHE144 0.2190 2150 O 2.3580 31.8880 15.5570 O.2 144 PHE144 -0.2778 2151 CB 4.8001 32.1769 17.5273 C.3 144 PHE144 -0.0036 2152 CG 6.2292 32.5725 17.7879 C.ar 144 PHE144 -0.0454 2153 CD1 7.2443 31.6186 17.7608 C.ar 144 PHE144 -0.0585 2154 CD2 6.5555 33.8963 18.0690 C.ar 144 PHE144 -0.0585 2155 CE1 8.5582 31.9773 18.0226 C.ar 144 PHE144 -0.0615 2156 CE2 7.8701 34.2562 18.3322 C.ar 144 PHE144 -0.0615 2157 CZ 8.8715 33.2968 18.3131 C.ar 144 PHE144 -0.0617 2158 H 5.1000 33.4430 15.3330 H 144 PHE144 0.1312 2159 HA 5.2732 30.6286 16.0845 H 144 PHE144 0.0560 2160 HB1 4.4818 31.4854 18.3022 H 144 PHE144 0.0333 2161 HB2 4.1569 33.0548 17.6032 H 144 PHE144 0.0333 2162 HD1 7.0246 30.5845 17.5405 H 144 PHE144 0.0620 2163 HD2 5.7867 34.6553 18.0860 H 144 PHE144 0.0620 2164 HE1 9.3338 31.2251 17.9899 H 144 PHE144 0.0618 2165 HE2 8.1158 35.2837 18.5472 H 144 PHE144 0.0618 2166 HZ 9.8939 33.5788 18.5105 H 144 PHE144 0.0618 2167 N 2.9270 29.8300 16.3100 N.am 145 LEU145 -0.2456 2168 CA 1.5580 29.2860 16.3640 C.3 145 LEU145 0.0880 2169 C 1.2140 28.9630 17.8090 C.2 145 LEU145 0.2187 2170 O 1.9830 28.2960 18.5070 O.2 145 LEU145 -0.2778 2171 CB 1.4301 28.0210 15.5056 C.3 145 LEU145 -0.0266 2172 CG 1.6903 28.2297 13.9999 C.3 145 LEU145 -0.0449 2173 CD1 3.1745 28.0865 13.6359 C.3 145 LEU145 -0.0626 2174 CD2 0.8546 27.2531 13.1607 C.3 145 LEU145 -0.0626 2175 H 3.7040 29.2160 16.5530 H 145 LEU145 0.1312 2176 HA 0.8676 30.0439 15.9957 H 145 LEU145 0.0557 2177 HB1 0.4197 27.6290 15.6375 H 145 LEU145 0.0287 2178 HB2 2.0998 27.2635 15.8984 H 145 LEU145 0.0287 2179 HG 1.3753 29.2382 13.7335 H 145 LEU145 0.0296 2180 HD11 3.3230 28.2297 12.5676 H 145 LEU145 0.0232 2181 HD12 3.5527 27.0976 13.8907 H 145 LEU145 0.0232 2182 HD13 3.7937 28.8208 14.1449 H 145 LEU145 0.0232 2183 HD21 1.0060 27.4232 12.0948 H 145 LEU145 0.0232 2184 HD22 -0.2094 27.3743 13.3634 H 145 LEU145 0.0232 2185 HD23 1.1215 26.2181 13.3767 H 145 LEU145 0.0232 2186 N 0.0430 29.3900 18.2330 N.am 146 GLU146 -0.2456 2187 CA -0.5380 29.0150 19.5220 C.3 146 GLU146 0.0883 2188 C -1.7710 28.1810 19.2280 C.2 146 GLU146 0.2188 2189 O -2.2730 28.2070 18.0560 O.2 146 GLU146 -0.2778 2190 CB -0.8785 30.2716 20.3464 C.3 146 GLU146 -0.0193 2191 CG 0.3346 31.1669 20.6843 C.3 146 GLU146 0.0356 2192 CD 1.1458 30.7674 21.9437 C.2 146 GLU146 0.1760 2193 OE1 1.6965 29.6714 22.0288 O.co2 146 GLU146 -0.6478 2194 OE2 1.2668 31.5720 22.8634 O.co2 146 GLU146 -0.6478 2195 H -0.4890 30.0170 17.6290 H 146 GLU146 0.1312 2196 HA 0.1698 28.3979 20.0769 H 146 GLU146 0.0557 2197 HB1 -1.3951 29.9972 21.2675 H 146 GLU146 0.0290 2198 HB2 -1.5908 30.8673 19.7729 H 146 GLU146 0.0290 2199 HG1 -0.0235 32.1841 20.8443 H 146 GLU146 0.0374 2200 HG2 1.0227 31.2271 19.8430 H 146 GLU146 0.0374 2201 N -2.2440 27.4300 20.2150 N.am 147 THR147 -0.2434 2202 CA -3.5430 26.7560 20.0150 C.3 147 THR147 0.1135 2203 C -4.6750 27.5530 20.6480 C.2 147 THR147 0.2210 2204 O -4.5090 28.2060 21.6920 O.2 147 THR147 -0.2777 2205 CB -3.4935 25.3086 20.5471 C.3 147 THR147 0.0763 2206 OG1 -2.9866 25.3050 21.8728 O.3 147 THR147 -0.3900 2207 CG2 -2.6331 24.4116 19.6383 C.3 147 THR147 -0.0370 2208 H -1.7250 27.3210 21.0870 H 147 THR147 0.1313 2209 HA -3.7207 26.6921 18.9518 H 147 THR147 0.0583 2210 HB -4.5163 24.9116 20.5426 H 147 THR147 0.0611 2211 HG1 -2.9716 24.4192 22.2230 H 147 THR147 0.2098 2212 HG21 -2.6718 23.3655 19.9450 H 147 THR147 0.0255 2213 HG22 -1.5894 24.7262 19.6461 H 147 THR147 0.0255 2214 HG23 -2.9862 24.4536 18.6074 H 147 THR147 0.0255 2215 N -5.7610 27.5360 19.9060 N.am 148 GLY148 -0.2484 2216 CA -6.9770 28.2720 20.2480 C.3 148 GLY148 0.0765 2217 C -8.0650 27.9650 19.2590 C.2 148 GLY148 0.2155 2218 O -8.3420 26.7850 18.9980 O.2 148 GLY148 -0.2781 2219 H -5.7540 26.9820 19.0500 H 148 GLY148 0.1309 2220 HA1 -6.7414 29.3377 20.2447 H 148 GLY148 0.0521 2221 HA2 -7.2936 27.9722 21.2472 H 148 GLY148 0.0521 2222 N -8.6170 29.0140 18.6580 N.am 149 ASP149 -0.2454 2223 CA -9.6760 28.8190 17.6430 C.3 149 ASP149 0.0974 2224 C -9.1230 28.1970 16.3670 C.2 149 ASP149 0.2192 2225 O -7.9460 28.4430 15.9930 O.2 149 ASP149 -0.2778 2226 CB -10.2918 30.1852 17.3115 C.3 149 ASP149 0.0576 2227 CG -10.7534 30.8697 18.6003 C.2 149 ASP149 0.1780 2228 OD1 -11.8780 30.6193 19.0240 O.co2 149 ASP149 -0.6478 2229 OD2 -9.9780 31.6399 19.1650 O.co2 149 ASP149 -0.6478 2230 H -8.3100 29.9570 18.8970 H 149 ASP149 0.1312 2231 HA -10.4313 28.1638 18.0811 H 149 ASP149 0.0563 2232 HB1 -11.1466 30.0835 16.6434 H 149 ASP149 0.0394 2233 HB2 -9.5679 30.8343 16.8186 H 149 ASP149 0.0394 2234 N -9.9730 27.4350 15.6870 N.am 150 GLU150 -0.2456 2235 CA -9.6370 26.8880 14.3530 C.3 150 GLU150 0.0883 2236 C -9.2650 28.0100 13.3940 C.2 150 GLU150 0.2187 2237 O -9.9080 29.0520 13.3530 O.2 150 GLU150 -0.2778 2238 CB -10.6733 25.8774 13.8401 C.3 150 GLU150 -0.0193 2239 CG -10.0700 24.9940 12.7326 C.3 150 GLU150 0.0356 2240 CD -10.7143 23.6027 12.6350 C.2 150 GLU150 0.1760 2241 OE1 -10.2503 22.6617 13.2761 O.co2 150 GLU150 -0.6478 2242 OE2 -11.6773 23.4363 11.9019 O.co2 150 GLU150 -0.6478 2243 H -10.8830 27.2210 16.0960 H 150 GLU150 0.1312 2244 HA -8.7110 26.3408 14.5324 H 150 GLU150 0.0557 2245 HB1 -11.5798 26.3744 13.4936 H 150 GLU150 0.0290 2246 HB2 -10.9718 25.2472 14.6789 H 150 GLU150 0.0290 2247 HG1 -9.0127 24.8355 12.9260 H 150 GLU150 0.0374 2248 HG2 -10.1350 25.4912 11.7651 H 150 GLU150 0.0374 2249 N -8.2330 27.7680 12.6180 N.am 151 HIS151 -0.2453 2250 CA -7.7700 28.6800 11.5550 C.3 151 HIS151 0.0934 2251 C -8.3370 28.2050 10.2200 C.2 151 HIS151 0.2217 2252 O -8.0280 27.1060 9.7730 O.2 151 HIS151 -0.2776 2253 CB -6.2429 28.6100 11.6054 C.3 151 HIS151 0.0146 2254 CG -5.5856 29.6193 10.6972 C.ar 151 HIS151 0.0551 2255 ND1 -5.6914 29.6105 9.3525 N.ar 151 HIS151 -0.2469 2256 CD2 -4.6711 30.6201 11.0646 C.ar 151 HIS151 0.0047 2257 CE1 -4.8738 30.5804 8.9170 C.ar 151 HIS151 0.0737 2258 NE2 -4.2480 31.2118 9.9251 N.ar 151 HIS151 -0.2539 2259 H -7.7210 26.8970 12.7590 H 151 HIS151 0.1312 2260 HA -8.0835 29.6914 11.8067 H 151 HIS151 0.0561 2261 HB1 -5.8870 27.6119 11.3738 H 151 HIS151 0.0348 2262 HB2 -5.9183 28.8103 12.6213 H 151 HIS151 0.0348 2263 HD2 -4.3532 30.8505 12.0714 H 151 HIS151 0.0764 2264 HE1 -4.7206 30.8081 7.8746 H 151 HIS151 0.0963 2265 HE2 -3.6053 31.9476 9.8411 H 151 HIS151 0.1339 2266 N -9.2110 28.9730 9.5320 N.am 152 PRO152 -0.2316 2267 CA -9.8550 28.4380 8.3330 C.3 152 PRO152 0.0907 2268 C -8.8670 28.0080 7.2400 C.2 152 PRO152 0.2190 2269 O -9.0110 26.9700 6.6690 O.2 152 PRO152 -0.2778 2270 CB -10.7329 29.6088 7.8590 C.3 152 PRO152 -0.0276 2271 CG -10.9121 30.5052 9.0831 C.3 152 PRO152 -0.0379 2272 CD -9.6466 30.3095 9.9171 C.3 152 PRO152 0.0071 2273 HA -10.4598 27.5858 8.6478 H 152 PRO152 0.0559 2274 HB1 -11.6850 29.2703 7.4499 H 152 PRO152 0.0285 2275 HB2 -10.2361 30.1908 7.0810 H 152 PRO152 0.0285 2276 HG1 -11.7735 30.1596 9.6561 H 152 PRO152 0.0278 2277 HG2 -11.0862 31.5493 8.8226 H 152 PRO152 0.0278 2278 HD1 -8.8472 31.0049 9.6571 H 152 PRO152 0.0431 2279 HD2 -9.8719 30.3495 10.9836 H 152 PRO152 0.0431 2280 N -7.9060 28.8520 6.8850 N.am 153 SER153 -0.2436 2281 CA -6.9960 28.5330 5.7610 C.3 153 SER153 0.1109 2282 C -6.0910 27.3560 6.1160 C.2 153 SER153 0.2209 2283 O -5.7710 26.5370 5.2460 O.2 153 SER153 -0.2777 2284 CB -6.3142 29.7884 5.2316 C.3 153 SER153 0.0681 2285 OG -7.3430 30.5493 4.6058 O.3 153 SER153 -0.3930 2286 H -7.7930 29.7300 7.3920 H 153 SER153 0.1312 2287 HA -7.6356 28.1659 4.9561 H 153 SER153 0.0580 2288 HB1 -5.5443 29.5206 4.5023 H 153 SER153 0.0577 2289 HB2 -5.8560 30.3453 6.0519 H 153 SER153 0.0577 2290 HG -7.0266 31.3676 4.2390 H 153 SER153 0.2095 2291 N -5.7780 27.2160 7.4080 N.am 154 MET154 -0.2456 2292 CA -4.9660 26.0830 7.8530 C.3 154 MET154 0.0886 2293 C -5.6640 24.7790 7.5420 C.2 154 MET154 0.2187 2294 O -4.9130 23.8340 7.2640 O.2 154 MET154 -0.2778 2295 CB -4.6565 26.2537 9.3441 C.3 154 MET154 -0.0199 2296 CG -3.6374 25.2564 9.9044 C.3 154 MET154 -0.0047 2297 SD -2.0731 25.2889 9.0044 S.3 154 MET154 -0.1641 2298 CE -1.1849 26.4891 10.0137 C.3 154 MET154 -0.0181 2299 H -6.1070 27.9020 8.0870 H 154 MET154 0.1312 2300 HA -4.0411 26.1215 7.2751 H 154 MET154 0.0557 2301 HB1 -5.5854 26.1722 9.9013 H 154 MET154 0.0293 2302 HB2 -4.2784 27.2616 9.5140 H 154 MET154 0.0293 2303 HG1 -4.0399 24.2506 9.8671 H 154 MET154 0.0377 2304 HG2 -3.4566 25.4459 10.9613 H 154 MET154 0.0377 2305 HE1 -0.3369 26.8934 9.4611 H 154 MET154 0.0340 2306 HE2 -0.8337 26.0257 10.9357 H 154 MET154 0.0340 2307 HE3 -1.8399 27.3215 10.2732 H 154 MET154 0.0340 2308 N -6.9950 24.7360 7.4680 N.am 155 ASN155 -0.2452 2309 CA -7.6970 23.4650 7.1560 C.3 155 ASN155 0.0957 2310 C -7.2540 22.8860 5.8420 C.2 155 ASN155 0.2191 2311 O -7.1620 21.6720 5.7170 O.2 155 ASN155 -0.2778 2312 CB -9.2251 23.6483 7.1759 C.3 155 ASN155 0.0446 2313 CG -9.7287 23.4751 8.6056 C.2 155 ASN155 0.2000 2314 OD1 -9.3911 22.4980 9.2564 O.2 155 ASN155 -0.2797 2315 ND2 -10.5341 24.4449 9.0600 N.am 155 ASN155 -0.2723 2316 H -7.5370 25.5850 7.6270 H 155 ASN155 0.1312 2317 HA -7.3745 22.7532 7.9153 H 155 ASN155 0.0562 2318 HB1 -9.7256 22.8810 6.5838 H 155 ASN155 0.0375 2319 HB2 -9.5262 24.6132 6.7735 H 155 ASN155 0.0375 2320 HD21 -10.9089 24.3569 9.9870 H 155 ASN155 0.1266 2321 HD22 -10.7744 25.2443 8.5125 H 155 ASN155 0.1266 2322 N -7.0070 23.7350 4.8860 N.am 156 ARG156 -0.2456 2323 CA -6.5800 23.1620 3.6230 C.3 156 ARG156 0.0879 2324 C -5.2690 22.4200 3.8150 C.2 156 ARG156 0.2187 2325 O -5.0680 21.3160 3.3020 O.2 156 ARG156 -0.2778 2326 CB -6.4773 24.2644 2.5689 C.3 156 ARG156 -0.0258 2327 CG -6.3141 23.6668 1.1701 C.3 156 ARG156 -0.0154 2328 CD -6.3926 24.7170 0.0680 C.3 156 ARG156 0.1045 2329 NE -6.3104 24.0207 -1.2124 N.pl3 156 ARG156 -0.4450 2330 CZ -5.8510 24.5616 -2.3300 C.cat 156 ARG156 0.5062 2331 NH1 -5.4840 25.8123 -2.3766 N.pl3 156 ARG156 -0.4573 2332 NH2 -5.7613 23.8255 -3.4024 N.pl3 156 ARG156 -0.4573 2333 H -7.1070 24.7410 5.0170 H 156 ARG156 0.1312 2334 HA -7.3428 22.4387 3.3235 H 156 ARG156 0.0557 2335 HB1 -5.6575 24.9463 2.7997 H 156 ARG156 0.0286 2336 HB2 -7.3899 24.8612 2.5990 H 156 ARG156 0.0286 2337 HG1 -7.0934 22.9212 1.0060 H 156 ARG156 0.0299 2338 HG2 -5.3625 23.1371 1.1028 H 156 ARG156 0.0299 2339 HD1 -5.5685 25.4272 0.1693 H 156 ARG156 0.0711 2340 HD2 -7.3406 25.2603 0.0976 H 156 ARG156 0.0711 2341 HE -6.6082 23.0679 -1.2563 H 156 ARG156 0.3153 2342 HH11 -5.0747 26.1737 -3.2139 H 156 ARG156 0.3114 2343 HH12 -5.6011 26.4105 -1.5904 H 156 ARG156 0.3114 2344 HH21 -5.3610 24.2283 -4.2250 H 156 ARG156 0.3114 2345 HH22 -6.0762 22.8802 -3.4074 H 156 ARG156 0.3114 2346 N -4.3810 23.0230 4.5670 N.am 157 LEU157 -0.2456 2347 CA -3.0900 22.4110 4.7990 C.3 157 LEU157 0.0880 2348 C -3.2090 21.1520 5.6570 C.2 157 LEU157 0.2187 2349 O -2.6740 20.0850 5.3090 O.2 157 LEU157 -0.2778 2350 CB -2.1203 23.4533 5.3806 C.3 157 LEU157 -0.0266 2351 CG -0.6340 23.0477 5.2724 C.3 157 LEU157 -0.0449 2352 CD1 0.2629 24.2847 5.1366 C.3 157 LEU157 -0.0626 2353 CD2 -0.1708 22.1913 6.4600 C.3 157 LEU157 -0.0626 2354 H -4.6000 23.9250 4.9900 H 157 LEU157 0.1312 2355 HA -2.7157 22.0984 3.8226 H 157 LEU157 0.0557 2356 HB1 -2.3815 23.7050 6.4094 H 157 LEU157 0.0287 2357 HB2 -2.2653 24.3734 4.8132 H 157 LEU157 0.0287 2358 HG -0.4985 22.4632 4.3612 H 157 LEU157 0.0296 2359 HD11 1.3031 23.9901 4.9971 H 157 LEU157 0.0232 2360 HD12 0.2060 24.9171 6.0232 H 157 LEU157 0.0232 2361 HD13 -0.0226 24.8887 4.2747 H 157 LEU157 0.0232 2362 HD21 0.8899 21.9513 6.3793 H 157 LEU157 0.0232 2363 HD22 -0.7083 21.2473 6.5234 H 157 LEU157 0.0232 2364 HD23 -0.3193 22.7223 7.3991 H 157 LEU157 0.0232 2365 N -3.9450 21.2260 6.7630 N.am 158 THR158 -0.2434 2366 CA -4.0320 20.0440 7.6240 C.3 158 THR158 0.1135 2367 C -4.7850 18.9080 6.9430 C.2 158 THR158 0.2212 2368 O -4.4020 17.7540 7.1750 O.2 158 THR158 -0.2777 2369 CB -4.6138 20.3187 9.0275 C.3 158 THR158 0.0763 2370 OG1 -5.9928 20.0365 9.1627 O.3 158 THR158 -0.3900 2371 CG2 -4.3022 21.7059 9.5823 C.3 158 THR158 -0.0370 2372 H -4.4370 22.0860 7.0060 H 158 THR158 0.1313 2373 HA -3.0027 19.7218 7.7736 H 158 THR158 0.0583 2374 HB -4.1118 19.6153 9.6877 H 158 THR158 0.0611 2375 HG1 -6.4736 20.4821 8.4668 H 158 THR158 0.2098 2376 HG21 -4.4246 21.7182 10.6632 H 158 THR158 0.0255 2377 HG22 -4.9828 22.4474 9.1726 H 158 THR158 0.0255 2378 HG23 -3.2772 22.0080 9.3648 H 158 THR158 0.0255 2379 N -5.7600 19.1870 6.0860 N.am 159 ASP159 -0.2450 2380 CA -6.4310 18.1080 5.3210 C.3 159 ASP159 0.0974 2381 C -5.4910 17.4310 4.3360 C.2 159 ASP159 0.2192 2382 O -5.7260 16.2580 4.0410 O.2 159 ASP159 -0.2778 2383 CB -7.9637 18.2673 5.2638 C.3 159 ASP159 0.0576 2384 CG -8.4233 18.1266 6.7554 C.2 159 ASP159 0.1780 2385 OD1 -8.6768 17.0171 7.2165 O.co2 159 ASP159 -0.6478 2386 OD2 -8.4717 19.0964 7.5052 O.co2 159 ASP159 -0.6478 2387 H -6.0510 20.1550 5.9520 H 159 ASP159 0.1312 2388 HA -6.3665 17.2552 6.0017 H 159 ASP159 0.0563 2389 HB1 -8.4314 17.4841 4.6680 H 159 ASP159 0.0394 2390 HB2 -8.2591 19.2383 4.8684 H 159 ASP159 0.0394 2391 N -4.4500 18.1130 3.8910 N.am 160 ALA160 -0.2459 2392 CA -3.5170 17.5630 2.8930 C.3 160 ALA160 0.0850 2393 C -2.4750 16.6700 3.5680 C.2 160 ALA160 0.2184 2394 O -1.7390 15.9690 2.8530 O.2 160 ALA160 -0.2778 2395 CB -2.8300 18.7271 2.1690 C.3 160 ALA160 -0.0411 2396 H -4.2870 19.0530 4.2510 H 160 ALA160 0.1312 2397 HA -4.0886 16.9604 2.1848 H 160 ALA160 0.0554 2398 HB1 -2.1520 18.3693 1.3933 H 160 ALA160 0.0249 2399 HB2 -2.2523 19.3426 2.8595 H 160 ALA160 0.0249 2400 HB3 -3.5687 19.3713 1.6925 H 160 ALA160 0.0249 2401 N -2.3610 16.7080 4.8890 N.am 161 LEU161 -0.2457 2402 CA -1.2450 16.0090 5.5560 C.3 161 LEU161 0.0880 2403 C -1.3550 14.4960 5.4640 C.2 161 LEU161 0.2187 2404 O -0.3320 13.8640 5.4200 O.2 161 LEU161 -0.2778 2405 CB -1.1328 16.4578 7.0247 C.3 161 LEU161 -0.0266 2406 CG -0.7840 17.9476 7.1989 C.3 161 LEU161 -0.0449 2407 CD1 -0.7241 18.3247 8.6846 C.3 161 LEU161 -0.0626 2408 CD2 0.5242 18.3416 6.5001 C.3 161 LEU161 -0.0626 2409 H -3.0460 17.2210 5.4450 H 161 LEU161 0.1312 2410 HA -0.3357 16.2841 5.0236 H 161 LEU161 0.0557 2411 HB1 -0.3761 15.8631 7.5370 H 161 LEU161 0.0287 2412 HB2 -2.0736 16.2486 7.5354 H 161 LEU161 0.0287 2413 HG -1.5780 18.5276 6.7394 H 161 LEU161 0.0296 2414 HD11 -0.5139 19.3869 8.8133 H 161 LEU161 0.0232 2415 HD12 0.0571 17.7651 9.1992 H 161 LEU161 0.0232 2416 HD13 -1.6693 18.1163 9.1814 H 161 LEU161 0.0232 2417 HD21 0.7991 19.3708 6.7312 H 161 LEU161 0.0232 2418 HD22 0.4392 18.2734 5.4158 H 161 LEU161 0.0232 2419 HD23 1.3475 17.7030 6.8144 H 161 LEU161 0.0232 2420 N -2.5520 13.9330 5.3770 N.am 162 TYR162 -0.2453 2421 CA -2.7460 12.4770 5.2750 C.3 162 TYR162 0.0917 2422 C -1.9000 11.9560 4.1250 C.2 162 TYR162 0.2190 2423 O -1.2420 10.9170 4.2730 O.2 162 TYR162 -0.2778 2424 CB -4.2431 12.1874 5.0539 C.3 162 TYR162 -0.0036 2425 CG -4.6597 10.8954 5.7034 C.ar 162 TYR162 -0.0453 2426 CD1 -4.2178 9.6727 5.2054 C.ar 162 TYR162 -0.0561 2427 CD2 -5.4750 10.9124 6.8312 C.ar 162 TYR162 -0.0561 2428 CE1 -4.5472 8.4883 5.8519 C.ar 162 TYR162 -0.0317 2429 CE2 -5.8146 9.7298 7.4718 C.ar 162 TYR162 -0.0317 2430 CZ -5.3311 8.5210 6.9961 C.ar 162 TYR162 0.0726 2431 OH -5.5700 7.3676 7.7121 O.3 162 TYR162 -0.3598 2432 H -3.3750 14.5350 5.3810 H 162 TYR162 0.1312 2433 HA -2.3927 12.0521 6.2132 H 162 TYR162 0.0560 2434 HB1 -4.5061 12.1676 3.9945 H 162 TYR162 0.0333 2435 HB2 -4.8375 12.9955 5.4825 H 162 TYR162 0.0333 2436 HD1 -3.5970 9.6384 4.3207 H 162 TYR162 0.0621 2437 HD2 -5.8457 11.8506 7.2182 H 162 TYR162 0.0621 2438 HE1 -4.1740 7.5466 5.4761 H 162 TYR162 0.0643 2439 HE2 -6.4382 9.7470 8.3531 H 162 TYR162 0.0643 2440 HH -5.6021 6.6270 7.1163 H 162 TYR162 0.2173 2441 N -1.9810 12.6020 2.9650 N.am 163 MET163 -0.2456 2442 CA -1.3800 12.0840 1.7160 C.3 163 MET163 0.0885 2443 C 0.1490 12.2240 1.7900 C.2 163 MET163 0.2187 2444 O 0.8190 11.5690 1.0080 O.2 163 MET163 -0.2778 2445 CB -1.9331 12.8751 0.5213 C.3 163 MET163 -0.0199 2446 CG -3.4663 12.8452 0.4370 C.3 163 MET163 -0.0047 2447 SD -4.1249 11.1656 0.4840 S.3 163 MET163 -0.1641 2448 CE -3.4208 10.5375 -1.0516 C.3 163 MET163 -0.0181 2449 H -2.4780 13.4920 2.9350 H 163 MET163 0.1312 2450 HA -1.6282 11.0245 1.6372 H 163 MET163 0.0557 2451 HB1 -1.5105 12.4779 -0.4023 H 163 MET163 0.0293 2452 HB2 -1.6053 13.9143 0.5815 H 163 MET163 0.0293 2453 HG1 -3.7817 13.3194 -0.4927 H 163 MET163 0.0377 2454 HG2 -3.9157 13.4219 1.2461 H 163 MET163 0.0377 2455 HE1 -3.9821 9.6686 -1.3946 H 163 MET163 0.0340 2456 HE2 -2.3750 10.2640 -0.9096 H 163 MET163 0.0340 2457 HE3 -3.4773 11.2970 -1.8315 H 163 MET163 0.0340 2458 N 0.6890 12.9730 2.7450 N.am 164 VAL164 -0.2454 2459 CA 2.1570 13.0720 2.9050 C.3 164 VAL164 0.0901 2460 C 2.5790 12.5710 4.2870 C.2 164 VAL164 0.2189 2461 O 3.6090 12.9700 4.8230 O.2 164 VAL164 -0.2778 2462 CB 2.6515 14.5068 2.6174 C.3 164 VAL164 -0.0227 2463 CG1 2.4770 14.8669 1.1351 C.3 164 VAL164 -0.0608 2464 CG2 1.9807 15.5598 3.5130 C.3 164 VAL164 -0.0608 2465 H 0.0800 13.4900 3.3800 H 164 VAL164 0.1312 2466 HA 2.6053 12.4007 2.1869 H 164 VAL164 0.0560 2467 HB 3.7243 14.5357 2.8152 H 164 VAL164 0.0315 2468 HG11 2.9195 15.8382 0.9180 H 164 VAL164 0.0233 2469 HG12 1.4246 14.9096 0.8531 H 164 VAL164 0.0233 2470 HG13 2.9639 14.1317 0.4942 H 164 VAL164 0.0233 2471 HG21 2.4163 16.5456 3.3488 H 164 VAL164 0.0233 2472 HG22 2.0952 15.3216 4.5708 H 164 VAL164 0.0233 2473 HG23 0.9154 15.6320 3.2963 H 164 VAL164 0.0233 2474 N 1.8480 11.6160 4.8540 N.am 165 ARG165 -0.2456 2475 CA 2.2020 11.1230 6.1980 C.3 165 ARG165 0.0879 2476 C 3.5640 10.4500 6.2240 C.2 165 ARG165 0.2187 2477 O 4.2860 10.5670 7.2270 O.2 165 ARG165 -0.2778 2478 CB 1.1317 10.1520 6.7037 C.3 165 ARG165 -0.0258 2479 CG 0.0848 10.8734 7.5478 C.3 165 ARG165 -0.0154 2480 CD -0.9950 9.9094 8.0258 C.3 165 ARG165 0.1045 2481 NE -1.8213 10.5799 9.0240 N.pl3 165 ARG165 -0.4450 2482 CZ -2.8929 10.0236 9.5676 C.cat 165 ARG165 0.5062 2483 NH1 -3.2449 8.8011 9.2707 N.pl3 165 ARG165 -0.4573 2484 NH2 -3.6001 10.7197 10.4119 N.pl3 165 ARG165 -0.4573 2485 H 1.0450 11.2260 4.3610 H 165 ARG165 0.1312 2486 HA 2.2766 11.9916 6.8509 H 165 ARG165 0.0557 2487 HB1 1.5748 9.3698 7.3240 H 165 ARG165 0.0286 2488 HB2 0.6669 9.6391 5.8603 H 165 ARG165 0.0286 2489 HG1 -0.3557 11.6910 6.9785 H 165 ARG165 0.0299 2490 HG2 0.5754 11.3264 8.4110 H 165 ARG165 0.0299 2491 HD1 -0.5435 9.0302 8.4935 H 165 ARG165 0.0711 2492 HD2 -1.6210 9.5903 7.1874 H 165 ARG165 0.0711 2493 HE -1.5618 11.5026 9.3188 H 165 ARG165 0.3153 2494 HH11 -4.0674 8.3845 9.6529 H 165 ARG165 0.3114 2495 HH12 -2.6806 8.2754 8.6390 H 165 ARG165 0.3114 2496 HH21 -4.4148 10.3299 10.8335 H 165 ARG165 0.3114 2497 HH22 -3.3030 11.6494 10.6251 H 165 ARG165 0.3114 2498 N 3.9350 9.7450 5.1760 N.am 166 PHE166 -0.2453 2499 CA 5.2240 9.0190 5.1750 C.3 166 PHE166 0.0917 2500 C 6.3570 9.8840 4.6160 C.2 166 PHE166 0.2190 2501 O 6.1840 10.6760 3.6780 O.2 166 PHE166 -0.2778 2502 CB 5.0085 7.7188 4.3774 C.3 166 PHE166 -0.0036 2503 CG 3.6331 7.1729 4.6754 C.ar 166 PHE166 -0.0454 2504 CD1 3.3253 6.7262 5.9564 C.ar 166 PHE166 -0.0585 2505 CD2 2.6101 7.2782 3.7357 C.ar 166 PHE166 -0.0585 2506 CE1 2.0130 6.4335 6.3083 C.ar 166 PHE166 -0.0615 2507 CE2 1.3012 6.9644 4.0774 C.ar 166 PHE166 -0.0615 2508 CZ 0.9994 6.5513 5.3674 C.ar 166 PHE166 -0.0617 2509 H 3.3280 9.6990 4.3570 H 166 PHE166 0.1312 2510 HA 5.4656 8.7522 6.2066 H 166 PHE166 0.0560 2511 HB1 5.7643 6.9750 4.6327 H 166 PHE166 0.0333 2512 HB2 5.0929 7.9014 3.3059 H 166 PHE166 0.0333 2513 HD1 4.1149 6.6353 6.6869 H 166 PHE166 0.0620 2514 HD2 2.8251 7.6341 2.7393 H 166 PHE166 0.0620 2515 HE1 1.7872 6.0854 7.3037 H 166 PHE166 0.0618 2516 HE2 0.5207 7.0370 3.3349 H 166 PHE166 0.0618 2517 HZ -0.0143 6.2844 5.6231 H 166 PHE166 0.0618 2518 N 7.5310 9.6950 5.2020 N.am 167 LYS167 -0.2456 2519 CA 8.7560 10.3440 4.7160 C.3 167 LYS167 0.0878 2520 C 8.9010 10.0960 3.2120 C.2 167 LYS167 0.2185 2521 O 8.7640 8.9530 2.7460 O.2 167 LYS167 -0.2778 2522 CB 10.0197 9.8968 5.5157 C.3 167 LYS167 -0.0289 2523 CG 10.7284 8.6073 5.0250 C.3 167 LYS167 -0.0496 2524 CD 11.8461 8.0574 5.9546 C.3 167 LYS167 -0.0278 2525 CE 12.5526 6.7326 5.5239 C.3 167 LYS167 0.1103 2526 NZ 12.2509 5.4652 6.2282 N.4 167 LYS167 -0.0749 2527 H 7.5850 9.0810 6.0150 H 167 LYS167 0.1312 2528 HA 8.5928 11.4108 4.8782 H 167 LYS167 0.0557 2529 HB1 9.7355 9.7813 6.5614 H 167 LYS167 0.0285 2530 HB2 10.7485 10.7076 5.4984 H 167 LYS167 0.0285 2531 HG1 11.1474 8.7740 4.0323 H 167 LYS167 0.0266 2532 HG2 9.9480 7.8779 4.8974 H 167 LYS167 0.0266 2533 HD1 11.4779 7.9625 6.9659 H 167 LYS167 0.0282 2534 HD2 12.6064 8.8366 6.0194 H 167 LYS167 0.0282 2535 HE1 13.6251 6.8828 5.6559 H 167 LYS167 0.0559 2536 HE2 12.4211 6.5622 4.4548 H 167 LYS167 0.0559 2537 HZ1 12.8820 4.6907 5.9509 H 167 LYS167 0.2742 2538 HZ2 11.3086 5.0756 5.9958 H 167 LYS167 0.2742 2539 HZ3 12.2622 5.5391 7.2681 H 167 LYS167 0.2742 2540 N 9.2650 11.1380 2.4740 N.am 168 GLY168 -0.2485 2541 CA 9.6130 11.0170 1.0510 C.3 168 GLY168 0.0765 2542 C 8.4080 11.1240 0.1400 C.2 168 GLY168 0.2156 2543 O 8.5440 10.7450 -1.0270 O.2 168 GLY168 -0.2781 2544 H 9.3050 12.0580 2.9120 H 168 GLY168 0.1309 2545 HA1 10.1207 10.0656 0.8848 H 168 GLY168 0.0521 2546 HA2 10.3053 11.8264 0.8234 H 168 GLY168 0.0521 2547 N 7.2400 11.4910 0.6450 N.am 169 THR169 -0.2436 2548 CA 6.0200 11.5870 -0.1800 C.3 169 THR169 0.1135 2549 C 5.7000 13.0490 -0.4430 C.2 169 THR169 0.2212 2550 O 6.1120 13.9530 0.3340 O.2 169 THR169 -0.2777 2551 CB 4.8524 10.8728 0.5165 C.3 169 THR169 0.0763 2552 OG1 4.5435 11.5214 1.7234 O.3 169 THR169 -0.3900 2553 CG2 5.1198 9.3788 0.7596 C.3 169 THR169 -0.0370 2554 H 7.1820 11.7150 1.6380 H 169 THR169 0.1312 2555 HA 6.2035 11.1026 -1.1404 H 169 THR169 0.0583 2556 HB 3.9616 10.9514 -0.1107 H 169 THR169 0.0611 2557 HG1 5.2963 11.4797 2.2965 H 169 THR169 0.2098 2558 HG21 4.2672 8.9132 1.2536 H 169 THR169 0.0255 2559 HG22 5.9971 9.2079 1.3847 H 169 THR169 0.0255 2560 HG23 5.2824 8.8552 -0.1822 H 169 THR169 0.0255 2561 N 4.9640 13.2580 -1.5120 N.am 170 LYS170 -0.2456 2562 CA 4.6520 14.6070 -2.0170 C.3 170 LYS170 0.0878 2563 C 3.2730 14.6090 -2.6510 C.2 170 LYS170 0.2187 2564 O 2.8500 13.5680 -3.1830 O.2 170 LYS170 -0.2778 2565 CB 5.8135 15.0489 -2.9455 C.3 170 LYS170 -0.0289 2566 CG 5.9346 16.5696 -3.1522 C.3 170 LYS170 -0.0496 2567 CD 7.3419 17.0588 -3.5746 C.3 170 LYS170 -0.0278 2568 CE 7.3900 18.5930 -3.7300 C.3 170 LYS170 0.1103 2569 NZ 8.5163 19.3330 -3.1575 N.4 170 LYS170 -0.0749 2570 H 4.5920 12.4510 -2.0140 H 170 LYS170 0.1312 2571 HA 4.6026 15.2508 -1.1408 H 170 LYS170 0.0557 2572 HB1 5.7542 14.5363 -3.9062 H 170 LYS170 0.0285 2573 HB2 6.7449 14.7090 -2.4918 H 170 LYS170 0.0285 2574 HG1 5.6993 17.0613 -2.2130 H 170 LYS170 0.0266 2575 HG2 5.1808 16.8999 -3.8673 H 170 LYS170 0.0266 2576 HD1 7.6422 16.5806 -4.5073 H 170 LYS170 0.0282 2577 HD2 8.0704 16.7457 -2.8292 H 170 LYS170 0.0282 2578 HE1 6.5250 18.9921 -3.2129 H 170 LYS170 0.0559 2579 HE2 7.3004 18.8671 -4.7818 H 170 LYS170 0.0559 2580 HZ1 8.3613 20.3604 -3.2741 H 170 LYS170 0.2742 2581 HZ2 9.4229 19.0843 -3.5855 H 170 LYS170 0.2742 2582 HZ3 8.5379 19.2208 -2.1254 H 170 LYS170 0.2742 2583 N 2.6260 15.7580 -2.6540 N.am 171 ALA171 -0.2459 2584 CA 1.3350 15.9470 -3.3370 C.3 171 ALA171 0.0850 2585 C 1.3060 17.3240 -3.9810 C.2 171 ALA171 0.2184 2586 O 1.8820 18.2740 -3.4710 O.2 171 ALA171 -0.2778 2587 CB 0.2042 15.7984 -2.3113 C.3 171 ALA171 -0.0411 2588 H 3.0380 16.5510 -2.1620 H 171 ALA171 0.1312 2589 HA 1.2441 15.1958 -4.1240 H 171 ALA171 0.0554 2590 HB1 -0.7744 15.9296 -2.7742 H 171 ALA171 0.0249 2591 HB2 0.2968 16.5297 -1.5083 H 171 ALA171 0.0249 2592 HB3 0.2250 14.8081 -1.8555 H 171 ALA171 0.0249 2593 N 0.5660 17.4490 -5.0530 N.am 172 GLN172 -0.2456 2594 CA 0.3170 18.7740 -5.6310 C.3 172 GLN172 0.0882 2595 C -0.4460 19.6380 -4.6260 C.2 172 GLN172 0.2187 2596 O -1.2990 19.1330 -3.8830 O.2 172 GLN172 -0.2778 2597 CB -0.4816 18.6508 -6.9409 C.3 172 GLN172 -0.0210 2598 CG -0.6171 19.9931 -7.6913 C.3 172 GLN172 0.0225 2599 CD -1.5496 19.8808 -8.9014 C.2 172 GLN172 0.1981 2600 OE1 -2.6645 20.3844 -8.8963 O.2 172 GLN172 -0.2798 2601 NE2 -1.0305 19.1978 -9.9320 N.am 172 GLN172 -0.2724 2602 H 0.1600 16.6210 -5.4890 H 172 GLN172 0.1312 2603 HA 1.2920 19.2265 -5.8266 H 172 GLN172 0.0557 2604 HB1 -1.4695 18.2396 -6.7250 H 172 GLN172 0.0289 2605 HB2 0.0122 17.9259 -7.5891 H 172 GLN172 0.0289 2606 HG1 0.3565 20.3545 -8.0230 H 172 GLN172 0.0356 2607 HG2 -1.0390 20.7643 -7.0496 H 172 GLN172 0.0356 2608 HE21 -1.5789 19.0796 -10.7593 H 172 GLN172 0.1266 2609 HE22 -0.1120 18.8073 -9.8937 H 172 GLN172 0.1266 2610 N -0.1540 20.9290 -4.6310 N.am 173 PHE173 -0.2453 2611 CA -0.7240 21.8630 -3.6400 C.3 173 PHE173 0.0917 2612 C -0.7980 23.2330 -4.2710 C.2 173 PHE173 0.2191 2613 O 0.0720 24.0690 -4.0460 O.2 173 PHE173 -0.2778 2614 CB 0.2030 21.8142 -2.4082 C.3 173 PHE173 -0.0036 2615 CG -0.3969 22.3886 -1.1528 C.ar 173 PHE173 -0.0454 2616 CD1 -1.2907 21.6389 -0.3924 C.ar 173 PHE173 -0.0585 2617 CD2 0.0292 23.6211 -0.6707 C.ar 173 PHE173 -0.0585 2618 CE1 -1.7487 22.1128 0.8311 C.ar 173 PHE173 -0.0615 2619 CE2 -0.4020 24.0820 0.5656 C.ar 173 PHE173 -0.0615 2620 CZ -1.2962 23.3319 1.3157 C.ar 173 PHE173 -0.0617 2621 H 0.4840 21.2890 -5.3410 H 173 PHE173 0.1312 2622 HA -1.7325 21.5283 -3.3921 H 173 PHE173 0.0560 2623 HB1 1.1553 22.3023 -2.6196 H 173 PHE173 0.0333 2624 HB2 0.4569 20.7758 -2.1920 H 173 PHE173 0.0333 2625 HD1 -1.6021 20.6629 -0.7367 H 173 PHE173 0.0620 2626 HD2 0.7358 24.2064 -1.2411 H 173 PHE173 0.0620 2627 HE1 -2.4274 21.5170 1.4236 H 173 PHE173 0.0618 2628 HE2 -0.0232 25.0174 0.9507 H 173 PHE173 0.0618 2629 HZ -1.6222 23.6891 2.2818 H 173 PHE173 0.0618 2630 N -1.8200 23.4490 -5.0790 N.am 174 SER174 -0.2436 2631 CA -1.9760 24.6830 -5.8750 C.3 174 SER174 0.1109 2632 C -2.8490 25.7180 -5.1660 C.2 174 SER174 0.2209 2633 O -3.7930 25.3670 -4.4500 O.2 174 SER174 -0.2777 2634 CB -2.6198 24.2867 -7.2139 C.3 174 SER174 0.0681 2635 OG -1.8634 23.2297 -7.7899 O.3 174 SER174 -0.3930 2636 H -2.5370 22.7280 -5.1570 H 174 SER174 0.1312 2637 HA -0.9875 25.0849 -6.0970 H 174 SER174 0.0580 2638 HB1 -2.6371 25.1477 -7.8915 H 174 SER174 0.0577 2639 HB2 -3.6523 23.9580 -7.0517 H 174 SER174 0.0577 2640 HG -2.2418 22.9275 -8.6146 H 174 SER174 0.2095 2641 N -2.5770 26.9820 -5.4430 N.am 175 CYS175 -0.2448 2642 CA -3.3920 28.1370 -5.0070 C.3 175 CYS175 0.0975 2643 C -3.5360 28.1720 -3.4970 C.2 175 CYS175 0.2195 2644 O -4.5850 28.5150 -2.9930 O.2 175 CYS175 -0.2778 2645 CB -4.7261 28.2275 -5.7588 C.3 175 CYS175 0.0279 2646 SG -4.5467 28.7071 -7.4979 S.3 175 CYS175 -0.0910 2647 H -1.7430 27.1750 -5.9980 H 175 CYS175 0.1312 2648 HA -2.8184 29.0149 -5.2486 H 175 CYS175 0.0566 2649 HB1 -5.3764 28.9689 -5.2925 H 175 CYS175 0.0405 2650 HB2 -5.2556 27.2766 -5.7072 H 175 CYS175 0.0405 2651 N -2.4350 27.9180 -2.8070 N.am 176 PHE176 -0.2453 2652 CA -2.3410 28.2340 -1.3730 C.3 176 PHE176 0.0917 2653 C -1.6160 29.5620 -1.2330 C.2 176 PHE176 0.2190 2654 O -0.4450 29.6780 -1.6230 O.2 176 PHE176 -0.2778 2655 CB -1.5988 27.1214 -0.6172 C.3 176 PHE176 -0.0036 2656 CG -1.7433 27.2909 0.8761 C.ar 176 PHE176 -0.0454 2657 CD1 -2.7464 26.6180 1.5700 C.ar 176 PHE176 -0.0585 2658 CD2 -0.8954 28.1429 1.5795 C.ar 176 PHE176 -0.0585 2659 CE1 -2.9047 26.7977 2.9386 C.ar 176 PHE176 -0.0615 2660 CE2 -1.0633 28.3385 2.9439 C.ar 176 PHE176 -0.0615 2661 CZ -2.0667 27.6645 3.6249 C.ar 176 PHE176 -0.0617 2662 H -1.6360 27.4950 -3.2790 H 176 PHE176 0.1312 2663 HA -3.3485 28.3329 -0.9653 H 176 PHE176 0.0560 2664 HB1 -0.5417 27.0966 -0.8887 H 176 PHE176 0.0333 2665 HB2 -2.0055 26.1513 -0.9041 H 176 PHE176 0.0333 2666 HD1 -3.4033 25.9404 1.0468 H 176 PHE176 0.0620 2667 HD2 -0.1092 28.6758 1.0635 H 176 PHE176 0.0620 2668 HE1 -3.6789 26.2670 3.4739 H 176 PHE176 0.0618 2669 HE2 -0.4095 29.0131 3.4776 H 176 PHE176 0.0618 2670 HZ -2.1913 27.8138 4.6875 H 176 PHE176 0.0618 2671 N -2.3020 30.5480 -0.6430 N.am 177 ASN177 -0.2452 2672 CA -1.7230 31.8920 -0.4440 C.3 177 ASN177 0.0959 2673 C -1.0870 31.9060 0.9440 C.2 177 ASN177 0.2218 2674 O -1.7960 31.8900 1.9530 O.2 177 ASN177 -0.2776 2675 CB -2.8740 32.9072 -0.5288 C.3 177 ASN177 0.0446 2676 CG -2.3568 34.3406 -0.6925 C.2 177 ASN177 0.2000 2677 OD1 -1.2383 34.6737 -0.3286 O.2 177 ASN177 -0.2797 2678 ND2 -3.2416 35.1592 -1.2818 N.am 177 ASN177 -0.2723 2679 H -3.2530 30.3660 -0.3210 H 177 ASN177 0.1312 2680 HA -1.0135 32.0655 -1.2525 H 177 ASN177 0.0562 2681 HB1 -3.5244 32.8600 0.3450 H 177 ASN177 0.0375 2682 HB2 -3.4955 32.6749 -1.3940 H 177 ASN177 0.0375 2683 HD21 -2.9761 36.0918 -1.5201 H 177 ASN177 0.1266 2684 HD22 -4.1653 34.8539 -1.5113 H 177 ASN177 0.1266 2685 N 0.2530 32.0140 1.0310 N.am 178 PRO178 -0.2316 2686 CA 0.9190 32.0450 2.3380 C.3 178 PRO178 0.0907 2687 C 0.5510 33.2760 3.1800 C.2 178 PRO178 0.2189 2688 O 0.7590 33.2520 4.3760 O.2 178 PRO178 -0.2778 2689 CB 2.4106 31.9832 1.9846 C.3 178 PRO178 -0.0276 2690 CG 2.5072 32.4797 0.5443 C.3 178 PRO178 -0.0379 2691 CD 1.1653 32.1365 -0.1029 C.3 178 PRO178 0.0071 2692 HA 0.6160 31.1542 2.8907 H 178 PRO178 0.0559 2693 HB1 2.7412 30.9450 2.0202 H 178 PRO178 0.0285 2694 HB2 3.0497 32.5455 2.6670 H 178 PRO178 0.0285 2695 HG1 3.3549 32.0557 0.0077 H 178 PRO178 0.0278 2696 HG2 2.6344 33.5590 0.5453 H 178 PRO178 0.0278 2697 HD1 0.8342 32.9318 -0.7729 H 178 PRO178 0.0431 2698 HD2 1.1837 31.1766 -0.6151 H 178 PRO178 0.0431 2699 N -0.0190 34.3160 2.5640 N.am 179 LYS179 -0.2456 2700 CA -0.4790 35.4720 3.3440 C.3 179 LYS179 0.0878 2701 C -1.5460 35.0280 4.3470 C.2 179 LYS179 0.2187 2702 O -1.7160 35.6960 5.3860 O.2 179 LYS179 -0.2778 2703 CB -1.0139 36.3485 2.1555 C.3 179 LYS179 -0.0289 2704 CG -1.2353 37.8692 2.2778 C.3 179 LYS179 -0.0496 2705 CD -1.0874 38.6456 0.9205 C.3 179 LYS179 -0.0278 2706 CE -1.9185 38.1376 -0.2938 C.3 179 LYS179 0.1103 2707 NZ -1.8472 38.9226 -1.5493 N.4 179 LYS179 -0.0749 2708 H -0.1350 34.3070 1.5510 H 179 LYS179 0.1312 2709 HA 0.3833 35.9070 3.8442 H 179 LYS179 0.0557 2710 HB1 -1.9253 35.8982 1.7605 H 179 LYS179 0.0285 2711 HB2 -0.2855 36.2521 1.3514 H 179 LYS179 0.0285 2712 HG1 -0.5098 38.2746 2.9837 H 179 LYS179 0.0266 2713 HG2 -2.2172 38.0549 2.7141 H 179 LYS179 0.0266 2714 HD1 -0.0350 38.6395 0.6322 H 179 LYS179 0.0282 2715 HD2 -1.3326 39.6931 1.0978 H 179 LYS179 0.0282 2716 HE1 -2.9708 38.0608 -0.0174 H 179 LYS179 0.0559 2717 HE2 -1.5848 37.1311 -0.5401 H 179 LYS179 0.0559 2718 HZ1 -2.3382 38.4626 -2.3504 H 179 LYS179 0.2742 2719 HZ2 -0.8779 38.9936 -1.9342 H 179 LYS179 0.2742 2720 HZ3 -2.2099 39.8879 -1.4630 H 179 LYS179 0.2742 2721 N -2.2550 33.9540 4.0560 N.am 180 SER180 -0.2436 2722 CA -3.3110 33.4590 4.9620 C.3 180 SER180 0.1109 2723 C -2.7590 32.9600 6.3050 C.2 180 SER180 0.2209 2724 O -3.5610 32.7690 7.2140 O.2 180 SER180 -0.2777 2725 CB -4.0106 32.2829 4.2820 C.3 180 SER180 0.0681 2726 OG -3.1280 31.1708 4.1631 O.3 180 SER180 -0.3930 2727 H -2.0700 33.4540 3.1860 H 180 SER180 0.1312 2728 HA -4.0066 34.2789 5.1442 H 180 SER180 0.0580 2729 HB1 -4.4040 32.6073 3.3110 H 180 SER180 0.0577 2730 HB2 -4.8444 31.9926 4.9152 H 180 SER180 0.0577 2731 HG -3.3855 30.5750 3.4655 H 180 SER180 0.2095 2732 N -1.4630 32.7220 6.3890 N.am 181 LEU181 -0.2456 2733 CA -0.8280 32.2290 7.6390 C.3 181 LEU181 0.0880 2734 C -0.1320 33.3510 8.3970 C.2 181 LEU181 0.2187 2735 O 0.6410 33.0830 9.3180 O.2 181 LEU181 -0.2778 2736 CB 0.1798 31.1153 7.2975 C.3 181 LEU181 -0.0266 2737 CG -0.4278 29.8885 6.5903 C.3 181 LEU181 -0.0449 2738 CD1 0.6736 28.8725 6.2540 C.3 181 LEU181 -0.0626 2739 CD2 -1.5276 29.2271 7.4343 C.3 181 LEU181 -0.0626 2740 H -0.8780 32.8820 5.5690 H 181 LEU181 0.1312 2741 HA -1.6022 31.8362 8.2993 H 181 LEU181 0.0557 2742 HB1 0.6624 30.7759 8.2146 H 181 LEU181 0.0287 2743 HB2 0.9722 31.5292 6.6715 H 181 LEU181 0.0287 2744 HG -0.8743 30.2120 5.6488 H 181 LEU181 0.0296 2745 HD11 0.2661 28.0015 5.7403 H 181 LEU181 0.0232 2746 HD12 1.1746 28.5200 7.1561 H 181 LEU181 0.0232 2747 HD13 1.4307 29.3143 5.6054 H 181 LEU181 0.0232 2748 HD21 -1.8795 28.3035 6.9748 H 181 LEU181 0.0232 2749 HD22 -2.3913 29.8820 7.5413 H 181 LEU181 0.0232 2750 HD23 -1.1647 28.9841 8.4329 H 181 LEU181 0.0232 2751 N -0.4240 34.5950 8.0460 N.am 182 LEU182 -0.2456 2752 CA 0.2080 35.7320 8.7190 C.3 182 LEU182 0.0883 2753 C -0.7410 36.3380 9.7340 C.2 182 LEU182 0.2214 2754 O -1.9570 36.3770 9.5190 O.2 182 LEU182 -0.2776 2755 CB 0.5814 36.7993 7.6766 C.3 182 LEU182 -0.0266 2756 CG 1.5511 36.3230 6.5803 C.3 182 LEU182 -0.0449 2757 CD1 1.7748 37.4463 5.5584 C.3 182 LEU182 -0.0626 2758 CD2 2.8900 35.8418 7.1596 C.3 182 LEU182 -0.0626 2759 H -1.0970 34.7630 7.2980 H 182 LEU182 0.1312 2760 HA 1.1083 35.3726 9.2150 H 182 LEU182 0.0557 2761 HB1 1.0277 37.6537 8.1855 H 182 LEU182 0.0287 2762 HB2 -0.3309 37.1648 7.2022 H 182 LEU182 0.0287 2763 HG 1.0974 35.4828 6.0525 H 182 LEU182 0.0296 2764 HD11 2.4458 37.1283 4.7604 H 182 LEU182 0.0232 2765 HD12 2.2087 38.3258 6.0303 H 182 LEU182 0.0232 2766 HD13 0.8346 37.7525 5.0998 H 182 LEU182 0.0232 2767 HD21 3.5877 35.5788 6.3640 H 182 LEU182 0.0232 2768 HD22 2.7618 34.9523 7.7768 H 182 LEU182 0.0232 2769 HD23 3.3580 36.6112 7.7742 H 182 LEU182 0.0232 2770 N -0.2020 36.9020 10.8320 N.am 183 PRO183 -0.2316 2771 CA -1.0080 37.6800 11.7680 C.3 183 PRO183 0.0907 2772 C -1.2950 39.0580 11.1760 C.2 183 PRO183 0.2189 2773 O -0.7420 39.4660 10.1750 O.2 183 PRO183 -0.2778 2774 CB -0.0756 37.7893 12.9845 C.3 183 PRO183 -0.0276 2775 CG 1.3307 37.7619 12.3875 C.3 183 PRO183 -0.0379 2776 CD 1.2131 36.8190 11.1925 C.3 183 PRO183 0.0071 2777 HA -1.9350 37.1485 11.9910 H 183 PRO183 0.0559 2778 HB1 -0.2073 36.9129 13.6216 H 183 PRO183 0.0285 2779 HB2 -0.2536 38.6692 13.6042 H 183 PRO183 0.0285 2780 HG1 2.0976 37.4464 13.0924 H 183 PRO183 0.0278 2781 HG2 1.5968 38.7607 12.0421 H 183 PRO183 0.0278 2782 HD1 1.8391 37.1303 10.3559 H 183 PRO183 0.0431 2783 HD2 1.4199 35.7840 11.4675 H 183 PRO183 0.0431 2784 N -2.1770 39.8060 11.8450 N.am 184 ALA184 -0.2459 2785 CA -2.5670 41.1580 11.3920 C.3 184 ALA184 0.0850 2786 C -1.5000 42.2030 11.7080 C.2 184 ALA184 0.2185 2787 O -1.4630 43.2590 11.1070 O.2 184 ALA184 -0.2778 2788 CB -3.8878 41.5363 12.0716 C.3 184 ALA184 -0.0411 2789 H -2.5950 39.4320 12.6970 H 184 ALA184 0.1312 2790 HA -2.7064 41.1211 10.3106 H 184 ALA184 0.0554 2791 HB1 -4.2408 42.5135 11.7396 H 184 ALA184 0.0249 2792 HB2 -3.7818 41.5691 13.1568 H 184 ALA184 0.0249 2793 HB3 -4.6654 40.8089 11.8380 H 184 ALA184 0.0249 2794 N -0.5750 41.9460 12.5940 N.am 185 SER185 -0.2436 2795 CA 0.5450 42.8720 12.8440 C.3 185 SER185 0.1109 2796 C 1.7870 42.4880 12.0250 C.2 185 SER185 0.2209 2797 O 2.0780 41.3060 11.8570 O.2 185 SER185 -0.2777 2798 CB 0.8646 42.7139 14.3326 C.3 185 SER185 0.0681 2799 OG 2.0627 43.3731 14.7210 O.3 185 SER185 -0.3930 2800 H -0.6290 41.0790 13.1290 H 185 SER185 0.1312 2801 HA 0.2499 43.9005 12.6297 H 185 SER185 0.0580 2802 HB1 0.9406 41.6413 14.5482 H 185 SER185 0.0577 2803 HB2 0.0202 43.0994 14.9157 H 185 SER185 0.0577 2804 HG 2.2365 43.1613 15.6443 H 185 SER185 0.2095 2805 N 2.5400 43.4810 11.5720 N.am 186 ARG186 -0.2456 2806 CA 3.8570 43.3080 10.9080 C.3 186 ARG186 0.0879 2807 C 4.9860 43.7850 11.8150 C.2 186 ARG186 0.2187 2808 O 6.0870 43.9910 11.2930 O.2 186 ARG186 -0.2778 2809 CB 3.8693 44.0764 9.5701 C.3 186 ARG186 -0.0258 2810 CG 2.8632 43.5286 8.5475 C.3 186 ARG186 -0.0154 2811 CD 3.3244 42.2196 7.8833 C.3 186 ARG186 0.1045 2812 NE 2.1679 41.5095 7.3270 N.pl3 186 ARG186 -0.4450 2813 CZ 1.3475 40.7700 8.0744 C.cat 186 ARG186 0.5062 2814 NH1 1.5649 40.5900 9.3439 N.pl3 186 ARG186 -0.4573 2815 NH2 0.2946 40.2091 7.5483 N.pl3 186 ARG186 -0.4573 2816 H 2.1900 44.4320 11.6880 H 186 ARG186 0.1312 2817 HA 4.0269 42.2444 10.7415 H 186 ARG186 0.0557 2818 HB1 4.8641 44.0651 9.1209 H 186 ARG186 0.0286 2819 HB2 3.6414 45.1253 9.7664 H 186 ARG186 0.0286 2820 HG1 2.7032 44.2728 7.7661 H 186 ARG186 0.0299 2821 HG2 1.8928 43.3979 9.0267 H 186 ARG186 0.0299 2822 HD1 3.8533 41.5567 8.5723 H 186 ARG186 0.0711 2823 HD2 4.0151 42.4294 7.0616 H 186 ARG186 0.0711 2824 HE 1.9762 41.5952 6.3505 H 186 ARG186 0.3153 2825 HH11 0.9332 40.0339 9.8842 H 186 ARG186 0.3114 2826 HH12 2.3435 41.0039 9.8090 H 186 ARG186 0.3114 2827 HH21 -0.3113 39.6856 8.1506 H 186 ARG186 0.3114 2828 HH22 0.0894 40.2997 6.5786 H 186 ARG186 0.3114 2829 N 4.7600 43.8950 13.1170 N.am 187 HIS187 -0.2453 2830 CA 5.8720 44.1220 14.0520 C.3 187 HIS187 0.0932 2831 C 6.7460 42.8800 14.1900 C.2 187 HIS187 0.2190 2832 O 6.2530 41.7570 14.1060 O.2 187 HIS187 -0.2778 2833 CB 5.3250 44.4977 15.4370 C.3 187 HIS187 0.0146 2834 CG 4.6296 45.8385 15.3836 C.ar 187 HIS187 0.0551 2835 ND1 5.1887 46.9498 14.8571 N.ar 187 HIS187 -0.2469 2836 CD2 3.3709 46.1840 15.9036 C.ar 187 HIS187 0.0047 2837 CE1 4.2800 47.9273 15.0042 C.ar 187 HIS187 0.0737 2838 NE2 3.1771 47.4978 15.6436 N.ar 187 HIS187 -0.2539 2839 H 3.8070 43.8220 13.4730 H 187 HIS187 0.1312 2840 HA 6.4568 44.9480 13.6530 H 187 HIS187 0.0561 2841 HB1 6.1312 44.5718 16.1644 H 187 HIS187 0.0348 2842 HB2 4.6414 43.7337 15.8012 H 187 HIS187 0.0348 2843 HD2 2.6800 45.5261 16.4100 H 187 HIS187 0.0764 2844 HE1 4.4236 48.9375 14.6476 H 187 HIS187 0.0963 2845 HE2 2.3801 48.0250 15.8608 H 187 HIS187 0.1339 2846 N 8.0310 43.1030 14.4060 N.am 188 TYR188 -0.2453 2847 CA 8.9950 41.9830 14.3620 C.3 188 TYR188 0.0917 2848 C 10.2310 42.3100 15.1840 C.2 188 TYR188 0.2190 2849 O 10.5440 43.4760 15.4780 O.2 188 TYR188 -0.2778 2850 CB 9.3614 41.6095 12.9064 C.3 188 TYR188 -0.0036 2851 CG 10.0728 42.7233 12.1795 C.ar 188 TYR188 -0.0453 2852 CD1 11.4497 42.8791 12.2918 C.ar 188 TYR188 -0.0561 2853 CD2 9.3605 43.6308 11.4064 C.ar 188 TYR188 -0.0561 2854 CE1 12.0864 43.9692 11.7208 C.ar 188 TYR188 -0.0317 2855 CE2 9.9899 44.7300 10.8401 C.ar 188 TYR188 -0.0317 2856 CZ 11.3517 44.9075 11.0179 C.ar 188 TYR188 0.0726 2857 OH 11.9756 46.0339 10.5351 O.3 188 TYR188 -0.3598 2858 H 8.3580 44.0490 14.6030 H 188 TYR188 0.1312 2859 HA 8.5146 41.1328 14.8501 H 188 TYR188 0.0560 2860 HB1 8.4564 41.3473 12.3585 H 188 TYR188 0.0333 2861 HB2 9.9888 40.7167 12.8899 H 188 TYR188 0.0333 2862 HD1 12.0267 42.1691 12.8585 H 188 TYR188 0.0621 2863 HD2 8.3042 43.4878 11.2673 H 188 TYR188 0.0621 2864 HE1 13.1478 44.1092 11.8451 H 188 TYR188 0.0643 2865 HE2 9.4196 45.4588 10.2835 H 188 TYR188 0.0643 2866 HH 11.3397 46.6085 10.1254 H 188 TYR188 0.2173 2867 N 10.9690 41.2480 15.4520 N.am 189 TRP189 -0.2453 2868 CA 12.3800 41.2740 15.8920 C.3 189 TRP189 0.0918 2869 C 13.2440 40.8120 14.7340 C.2 189 TRP189 0.2191 2870 O 12.8180 39.9420 13.9450 O.2 189 TRP189 -0.2778 2871 CB 12.6120 40.2868 17.0442 C.3 189 TRP189 -0.0021 2872 CG 11.7948 40.6398 18.2645 C.ar 189 TRP189 -0.0260 2873 CD1 12.1049 41.6263 19.2040 C.ar 189 TRP189 -0.0136 2874 CD2 10.6442 39.9339 18.7701 C.ar 189 TRP189 -0.0028 2875 NE1 11.2321 41.5443 20.2385 N.ar 189 TRP189 -0.2641 2876 CE2 10.3374 40.5009 20.0287 C.ar 189 TRP189 0.0269 2877 CE3 9.9222 38.8693 18.3016 C.ar 189 TRP189 -0.0528 2878 CZ2 9.3235 39.9769 20.7851 C.ar 189 TRP189 -0.0430 2879 CZ3 8.8857 38.3387 19.0668 C.ar 189 TRP189 -0.0611 2880 CH2 8.5843 38.8929 20.3104 C.ar 189 TRP189 -0.0602 2881 H 10.5290 40.3340 15.3470 H 189 TRP189 0.1312 2882 HA 12.6245 42.2929 16.1755 H 189 TRP189 0.0560 2883 HB1 13.6630 40.2840 17.3362 H 189 TRP189 0.0334 2884 HB2 12.3739 39.2683 16.7328 H 189 TRP189 0.0334 2885 HD1 12.9410 42.3074 19.1369 H 189 TRP189 0.0748 2886 HE1 11.2565 42.1055 21.0421 H 189 TRP189 0.1331 2887 HE3 10.1641 38.4271 17.3465 H 189 TRP189 0.0624 2888 HZ2 9.1065 40.3961 21.7566 H 189 TRP189 0.0633 2889 HZ3 8.3132 37.5035 18.6917 H 189 TRP189 0.0618 2890 HH2 7.7864 38.4754 20.9071 H 189 TRP189 0.0618 2891 N 14.4660 41.2990 14.6420 N.am 190 THR190 -0.2434 2892 CA 15.3760 40.8400 13.5740 C.3 190 THR190 0.1135 2893 C 16.7890 40.7360 14.1200 C.2 190 THR190 0.2212 2894 O 17.2240 41.5430 14.9750 O.2 190 THR190 -0.2777 2895 CB 15.3167 41.7635 12.3393 C.3 190 THR190 0.0763 2896 OG1 16.1710 41.3147 11.3067 O.3 190 THR190 -0.3900 2897 CG2 15.6320 43.2348 12.6471 C.3 190 THR190 -0.0370 2898 H 14.7850 41.9980 15.3130 H 190 THR190 0.1313 2899 HA 15.0719 39.8301 13.3211 H 190 THR190 0.0583 2900 HB 14.3024 41.7103 11.9397 H 190 THR190 0.0611 2901 HG1 17.0480 41.1897 11.6486 H 190 THR190 0.2098 2902 HG21 15.5008 43.8491 11.7567 H 190 THR190 0.0255 2903 HG22 16.6612 43.3596 12.9803 H 190 THR190 0.0255 2904 HG23 14.9751 43.6330 13.4207 H 190 THR190 0.0255 2905 N 17.5020 39.7210 13.6700 N.am 191 TYR191 -0.2453 2906 CA 18.9130 39.5330 14.0440 C.3 191 TYR191 0.0920 2907 C 19.5780 38.6890 12.9550 C.2 191 TYR191 0.2217 2908 O 18.9070 37.9510 12.2230 O.2 191 TYR191 -0.2776 2909 CB 18.9969 38.9285 15.4641 C.3 191 TYR191 -0.0036 2910 CG 18.7141 37.4529 15.4871 C.ar 191 TYR191 -0.0453 2911 CD1 17.4056 36.9867 15.4339 C.ar 191 TYR191 -0.0561 2912 CD2 19.7625 36.5386 15.5174 C.ar 191 TYR191 -0.0561 2913 CE1 17.1503 35.6251 15.3925 C.ar 191 TYR191 -0.0317 2914 CE2 19.5062 35.1762 15.4760 C.ar 191 TYR191 -0.0317 2915 CZ 18.2019 34.7209 15.4159 C.ar 191 TYR191 0.0726 2916 OH 17.9563 33.3665 15.4142 O.3 191 TYR191 -0.3598 2917 H 17.0620 39.0460 13.0440 H 191 TYR191 0.1312 2918 HA 19.3578 40.5287 14.0359 H 191 TYR191 0.0560 2919 HB1 18.2891 39.4294 16.1249 H 191 TYR191 0.0333 2920 HB2 19.9719 39.1087 15.9122 H 191 TYR191 0.0333 2921 HD1 16.5786 37.6818 15.4016 H 191 TYR191 0.0621 2922 HD2 20.7815 36.8927 15.5561 H 191 TYR191 0.0621 2923 HE1 16.1312 35.2741 15.3289 H 191 TYR191 0.0643 2924 HE2 20.3073 34.4568 15.4906 H 191 TYR191 0.0643 2925 HH 18.7605 32.8879 15.2706 H 191 TYR191 0.2173 2926 N 20.9260 38.7530 12.8670 N.am 192 PRO192 -0.2316 2927 CA 21.6660 37.9250 11.9250 C.3 192 PRO192 0.0907 2928 C 21.8790 36.5350 12.5140 C.2 192 PRO192 0.2187 2929 O 22.3920 36.3990 13.6440 O.2 192 PRO192 -0.2778 2930 CB 22.9958 38.6760 11.8014 C.3 192 PRO192 -0.0276 2931 CG 23.1874 39.3553 13.1578 C.3 192 PRO192 -0.0379 2932 CD 21.7697 39.6582 13.6500 C.3 192 PRO192 0.0071 2933 HA 21.1275 37.8712 10.9760 H 192 PRO192 0.0559 2934 HB1 22.8989 39.4422 11.0312 H 192 PRO192 0.0285 2935 HB2 23.8375 38.0408 11.5234 H 192 PRO192 0.0285 2936 HG1 23.8079 40.2496 13.0952 H 192 PRO192 0.0278 2937 HG2 23.6745 38.6656 13.8478 H 192 PRO192 0.0278 2938 HD1 21.6565 39.4576 14.7135 H 192 PRO192 0.0431 2939 HD2 21.4740 40.6820 13.4154 H 192 PRO192 0.0431 2940 N 21.5200 35.5150 11.7490 N.am 193 GLY193 -0.2485 2941 CA 21.6340 34.1490 12.2540 C.3 193 GLY193 0.0765 2942 C 21.9000 33.1410 11.1550 C.2 193 GLY193 0.2156 2943 O 22.6060 33.3970 10.1680 O.2 193 GLY193 -0.2781 2944 H 21.1640 35.6830 10.8080 H 193 GLY193 0.1309 2945 HA1 20.6955 33.9353 12.7549 H 193 GLY193 0.0521 2946 HA2 22.4294 34.0850 12.9936 H 193 GLY193 0.0521 2947 N 21.3620 31.9610 11.3770 N.am 194 SER194 -0.2439 2948 CA 21.7170 30.7470 10.6010 C.3 194 SER194 0.1109 2949 C 20.4870 29.9500 10.2140 C.2 194 SER194 0.2209 2950 O 19.4020 30.1010 10.7750 O.2 194 SER194 -0.2777 2951 CB 22.6979 29.8451 11.3789 C.3 194 SER194 0.0681 2952 OG 22.0819 29.1388 12.4462 O.3 194 SER194 -0.3930 2953 H 20.6670 31.8760 12.1190 H 194 SER194 0.1312 2954 HA 22.1738 31.0776 9.6693 H 194 SER194 0.0580 2955 HB1 23.5068 30.4454 11.7934 H 194 SER194 0.0577 2956 HB2 23.1921 29.1348 10.7072 H 194 SER194 0.0577 2957 HG 21.3864 28.5899 12.0896 H 194 SER194 0.2095 2958 N 20.7020 29.0010 9.2970 N.am 195 LEU195 -0.2456 2959 CA 19.7800 27.8680 9.1430 C.3 195 LEU195 0.0880 2960 C 19.7090 27.1300 10.4740 C.2 195 LEU195 0.2187 2961 O 20.7350 26.9760 11.1610 O.2 195 LEU195 -0.2778 2962 CB 20.3321 26.9172 8.0631 C.3 195 LEU195 -0.0266 2963 CG 20.5338 27.5628 6.6794 C.3 195 LEU195 -0.0449 2964 CD1 21.2940 26.6087 5.7492 C.3 195 LEU195 -0.0626 2965 CD2 19.1966 27.9664 6.0495 C.3 195 LEU195 -0.0626 2966 H 21.5220 29.0650 8.6930 H 195 LEU195 0.1312 2967 HA 18.7979 28.2657 8.8830 H 195 LEU195 0.0557 2968 HB1 19.6758 26.0508 7.9632 H 195 LEU195 0.0287 2969 HB2 21.2931 26.5257 8.3976 H 195 LEU195 0.0287 2970 HG 21.1460 28.4596 6.7845 H 195 LEU195 0.0296 2971 HD11 21.4687 27.0627 4.7733 H 195 LEU195 0.0232 2972 HD12 20.7348 25.6868 5.5964 H 195 LEU195 0.0232 2973 HD13 22.2636 26.3397 6.1663 H 195 LEU195 0.0232 2974 HD21 19.3431 28.3491 5.0416 H 195 LEU195 0.0232 2975 HD22 18.6930 28.7387 6.6303 H 195 LEU195 0.0232 2976 HD23 18.5284 27.1106 5.9774 H 195 LEU195 0.0232 2977 N 18.5440 26.6080 10.8270 N.am 196 THR196 -0.2434 2978 CA 18.3870 25.8570 12.0810 C.3 196 THR196 0.1135 2979 C 18.4600 24.3460 11.8770 C.2 196 THR196 0.2213 2980 O 18.2810 23.6040 12.8540 O.2 196 THR196 -0.2777 2981 CB 17.0477 26.1565 12.7624 C.3 196 THR196 0.0763 2982 OG1 16.0382 25.5535 11.9756 O.3 196 THR196 -0.3900 2983 CG2 16.7598 27.6514 12.9217 C.3 196 THR196 -0.0370 2984 H 17.7370 26.7300 10.2150 H 196 THR196 0.1313 2985 HA 19.1857 26.1450 12.7635 H 196 THR196 0.0583 2986 HB 17.0895 25.7066 13.7655 H 196 THR196 0.0611 2987 HG1 15.2563 25.4310 12.5097 H 196 THR196 0.2098 2988 HG21 15.8534 27.8152 13.5062 H 196 THR196 0.0255 2989 HG22 16.6155 28.1150 11.9486 H 196 THR196 0.0255 2990 HG23 17.5790 28.1608 13.4268 H 196 THR196 0.0255 2991 N 18.8020 23.8980 10.6720 N.am 197 THR197 -0.2433 2992 CA 19.1370 22.5000 10.4070 C.3 197 THR197 0.1137 2993 C 20.4650 22.4850 9.6880 C.2 197 THR197 0.2239 2994 O 20.8470 23.4720 9.0540 O.2 197 THR197 -0.2775 2995 CB 17.9943 21.7695 9.6763 C.3 197 THR197 0.0763 2996 OG1 17.7526 22.3504 8.4081 O.3 197 THR197 -0.3900 2997 CG2 16.7035 21.7833 10.5128 C.3 197 THR197 -0.0370 2998 H 18.8320 24.5610 9.8970 H 197 THR197 0.1313 2999 HA 19.2855 22.0215 11.3731 H 197 THR197 0.0583 3000 HB 18.3051 20.7293 9.5436 H 197 THR197 0.0611 3001 HG1 17.1015 21.8434 7.9326 H 197 THR197 0.2098 3002 HG21 15.9245 21.1704 10.0606 H 197 THR197 0.0255 3003 HG22 16.3078 22.7940 10.6201 H 197 THR197 0.0255 3004 HG23 16.8833 21.3911 11.5143 H 197 THR197 0.0255 3005 N 21.1680 21.3310 9.7220 N.am 198 PRO198 -0.2315 3006 CA 22.3130 21.1520 8.8360 C.3 198 PRO198 0.0909 3007 C 21.9900 21.6300 7.4270 C.2 198 PRO198 0.2216 3008 O 20.8920 21.3570 6.9300 O.2 198 PRO198 -0.2776 3009 CB 22.5886 19.6562 8.9595 C.3 198 PRO198 -0.0275 3010 CG 22.1761 19.3543 10.3981 C.3 198 PRO198 -0.0379 3011 CD 20.9110 20.1869 10.5873 C.3 198 PRO198 0.0071 3012 HA 23.1382 21.7135 9.2421 H 198 PRO198 0.0560 3013 HB1 23.6234 19.4051 8.7528 H 198 PRO198 0.0285 3014 HB2 21.9595 19.0932 8.2699 H 198 PRO198 0.0285 3015 HG1 22.9493 19.7115 11.0799 H 198 PRO198 0.0278 3016 HG2 22.0282 18.2994 10.6050 H 198 PRO198 0.0278 3017 HD1 20.0259 19.6728 10.2202 H 198 PRO198 0.0431 3018 HD2 20.7777 20.5129 11.6136 H 198 PRO198 0.0431 3019 N 22.9030 22.3510 6.7490 N.am 199 PRO199 -0.2316 3020 CA 24.2960 22.5820 7.1370 C.3 199 PRO199 0.0907 3021 C 24.5370 23.7550 8.1020 C.2 199 PRO199 0.2189 3022 O 25.7100 24.0640 8.3500 O.2 199 PRO199 -0.2778 3023 CB 24.9225 22.9091 5.7739 C.3 199 PRO199 -0.0276 3024 CG 23.8097 23.6180 5.0011 C.3 199 PRO199 -0.0379 3025 CD 22.5295 22.9206 5.4600 C.3 199 PRO199 0.0071 3026 HA 24.7053 21.6666 7.5611 H 199 PRO199 0.0559 3027 HB1 25.1679 21.9777 5.2626 H 199 PRO199 0.0285 3028 HB2 25.8397 23.4975 5.8298 H 199 PRO199 0.0285 3029 HG1 23.9493 23.5757 3.9209 H 199 PRO199 0.0278 3030 HG2 23.7752 24.6674 5.2942 H 199 PRO199 0.0278 3031 HD1 21.6837 23.5975 5.5887 H 199 PRO199 0.0431 3032 HD2 22.2559 22.0924 4.8038 H 199 PRO199 0.0431 3033 N 23.4990 24.3810 8.6510 N.am 200 LEU200 -0.2456 3034 CA 23.6740 25.3560 9.7590 C.3 200 LEU200 0.0880 3035 C 24.4050 26.6170 9.2910 C.2 200 LEU200 0.2187 3036 O 24.9310 27.3730 10.1120 O.2 200 LEU200 -0.2778 3037 CB 24.3336 24.7489 11.0227 C.3 200 LEU200 -0.0266 3038 CG 23.6370 23.5027 11.5986 C.3 200 LEU200 -0.0449 3039 CD1 24.4542 22.8725 12.7283 C.3 200 LEU200 -0.0626 3040 CD2 22.2027 23.7633 12.0682 C.3 200 LEU200 -0.0626 3041 H 22.5600 24.1870 8.3030 H 200 LEU200 0.1312 3042 HA 22.6642 25.6769 10.0058 H 200 LEU200 0.0557 3043 HB1 24.3986 25.5076 11.8034 H 200 LEU200 0.0287 3044 HB2 25.3589 24.4754 10.7841 H 200 LEU200 0.0287 3045 HG 23.6050 22.7653 10.8137 H 200 LEU200 0.0296 3046 HD11 24.0365 21.9097 13.0232 H 200 LEU200 0.0232 3047 HD12 24.4569 23.5143 13.6073 H 200 LEU200 0.0232 3048 HD13 25.4868 22.7065 12.4190 H 200 LEU200 0.0232 3049 HD21 21.6829 22.8277 12.2718 H 200 LEU200 0.0232 3050 HD22 21.6169 24.3170 11.3377 H 200 LEU200 0.0232 3051 HD23 22.2048 24.3346 12.9867 H 200 LEU200 0.0232 3052 N 24.3560 26.9000 7.9800 N.am 201 SER201 -0.2436 3053 CA 25.0890 28.0470 7.4180 C.3 201 SER201 0.1109 3054 C 24.5790 29.3530 8.0100 C.2 201 SER201 0.2209 3055 O 23.3720 29.5410 8.1930 O.2 201 SER201 -0.2777 3056 CB 24.8672 28.0786 5.8967 C.3 201 SER201 0.0681 3057 OG 25.3217 26.8673 5.3041 O.3 201 SER201 -0.3930 3058 H 23.8000 26.3090 7.3610 H 201 SER201 0.1312 3059 HA 26.1444 27.9078 7.6584 H 201 SER201 0.0580 3060 HB1 25.3991 28.9333 5.4621 H 201 SER201 0.0577 3061 HB2 23.7987 28.2116 5.6926 H 201 SER201 0.0577 3062 HG 25.1946 26.8794 4.3578 H 201 SER201 0.2095 3063 N 25.5080 30.2670 8.2090 N.am 202 GLU202 -0.2456 3064 CA 25.2260 31.5800 8.8190 C.3 202 GLU202 0.0883 3065 C 24.8800 32.5970 7.7280 C.2 202 GLU202 0.2187 3066 O 25.5800 33.5790 7.4860 O.2 202 GLU202 -0.2778 3067 CB 26.3867 31.9356 9.7488 C.3 202 GLU202 -0.0193 3068 CG 26.7089 30.7597 10.6973 C.3 202 GLU202 0.0356 3069 CD 27.4958 31.2101 11.9273 C.2 202 GLU202 0.1760 3070 OE1 28.4461 31.9677 11.7724 O.co2 202 GLU202 -0.6478 3071 OE2 27.1430 30.8131 13.0331 O.co2 202 GLU202 -0.6478 3072 H 26.4660 30.0560 7.9280 H 202 GLU202 0.1312 3073 HA 24.3412 31.4628 9.4444 H 202 GLU202 0.0557 3074 HB1 26.0952 32.8036 10.3331 H 202 GLU202 0.0290 3075 HB2 27.2791 32.2108 9.1855 H 202 GLU202 0.0290 3076 HG1 27.2883 29.9887 10.1916 H 202 GLU202 0.0374 3077 HG2 25.7872 30.2929 11.0429 H 202 GLU202 0.0374 3078 N 23.7300 32.3660 7.0910 N.am 203 SER203 -0.2436 3079 CA 23.3110 33.0340 5.8530 C.3 203 SER203 0.1109 3080 C 21.9390 33.6950 6.0120 C.2 203 SER203 0.2209 3081 O 21.4030 34.1740 5.0150 O.2 203 SER203 -0.2777 3082 CB 23.2544 31.9698 4.7463 C.3 203 SER203 0.0681 3083 OG 22.4021 30.9043 5.1557 O.3 203 SER203 -0.3930 3084 H 23.0970 31.6750 7.4930 H 203 SER203 0.1312 3085 HA 24.0314 33.8073 5.6018 H 203 SER203 0.0580 3086 HB1 24.2715 31.6020 4.5665 H 203 SER203 0.0577 3087 HB2 22.8914 32.4018 3.8069 H 203 SER203 0.0577 3088 HG 22.4375 30.1804 4.5340 H 203 SER203 0.2095 3089 N 21.3690 33.7030 7.2170 N.am 204 VAL204 -0.2453 3090 CA 19.9540 34.0860 7.3880 C.3 204 VAL204 0.0901 3091 C 19.8210 35.4090 8.1190 C.2 204 VAL204 0.2190 3092 O 20.3360 35.5670 9.2310 O.2 204 VAL204 -0.2778 3093 CB 19.1795 32.9544 8.0924 C.3 204 VAL204 -0.0227 3094 CG1 17.6725 33.2606 8.1199 C.3 204 VAL204 -0.0608 3095 CG2 19.4121 31.5909 7.4195 C.3 204 VAL204 -0.0608 3096 H 21.9200 33.4400 8.0340 H 204 VAL204 0.1312 3097 HA 19.5109 34.2138 6.3984 H 204 VAL204 0.0560 3098 HB 19.5410 32.8706 9.1171 H 204 VAL204 0.0315 3099 HG11 17.1076 32.4251 8.5328 H 204 VAL204 0.0233 3100 HG12 17.2976 33.4531 7.1150 H 204 VAL204 0.0233 3101 HG13 17.4444 34.1376 8.7234 H 204 VAL204 0.0233 3102 HG21 18.8358 30.8115 7.9190 H 204 VAL204 0.0233 3103 HG22 20.4586 31.2865 7.4525 H 204 VAL204 0.0233 3104 HG23 19.1017 31.6065 6.3755 H 204 VAL204 0.0233 3105 N 19.0610 36.3220 7.5290 N.am 205 THR205 -0.2434 3106 CA 18.4830 37.4610 8.2520 C.3 205 THR205 0.1135 3107 C 17.1460 36.9890 8.8020 C.2 205 THR205 0.2212 3108 O 16.2160 36.7070 8.0250 O.2 205 THR205 -0.2777 3109 CB 18.3186 38.6600 7.3024 C.3 205 THR205 0.0763 3110 OG1 19.6255 39.0283 6.8859 O.3 205 THR205 -0.3900 3111 CG2 17.6237 39.8567 7.9828 C.3 205 THR205 -0.0370 3112 H 18.8700 36.2280 6.5310 H 205 THR205 0.1313 3113 HA 19.1446 37.7313 9.0764 H 205 THR205 0.0583 3114 HB 17.7287 38.3326 6.4359 H 205 THR205 0.0611 3115 HG1 19.5835 39.7193 6.2296 H 205 THR205 0.2098 3116 HG21 17.5452 40.7155 7.3172 H 205 THR205 0.0255 3117 HG22 18.1729 40.1757 8.8687 H 205 THR205 0.0255 3118 HG23 16.6094 39.6063 8.2953 H 205 THR205 0.0255 3119 N 17.0750 36.8460 10.1290 N.am 206 TRP206 -0.2453 3120 CA 15.8470 36.3790 10.7770 C.3 206 TRP206 0.0918 3121 C 14.9130 37.5560 10.9880 C.2 206 TRP206 0.2190 3122 O 15.3430 38.5920 11.5140 O.2 206 TRP206 -0.2778 3123 CB 16.1956 35.7328 12.1216 C.3 206 TRP206 -0.0021 3124 CG 16.7059 34.3389 11.8539 C.ar 206 TRP206 -0.0260 3125 CD1 18.0068 33.9883 11.4885 C.ar 206 TRP206 -0.0136 3126 CD2 15.9187 33.1346 11.8031 C.ar 206 TRP206 -0.0028 3127 NE1 18.0460 32.6598 11.2210 N.ar 206 TRP206 -0.2641 3128 CE2 16.7853 32.0994 11.3881 C.ar 206 TRP206 0.0269 3129 CE3 14.5950 32.8739 12.0385 C.ar 206 TRP206 -0.0528 3130 CZ2 16.2962 30.8351 11.2069 C.ar 206 TRP206 -0.0430 3131 CZ3 14.1022 31.5786 11.8884 C.ar 206 TRP206 -0.0611 3132 CH2 14.9541 30.5586 11.4653 C.ar 206 TRP206 -0.0602 3133 H 17.8900 37.0660 10.7010 H 206 TRP206 0.1312 3134 HA 15.3556 35.6567 10.1192 H 206 TRP206 0.0560 3135 HB1 15.3230 35.6687 12.7746 H 206 TRP206 0.0334 3136 HB2 16.9511 36.3160 12.6458 H 206 TRP206 0.0334 3137 HD1 18.8260 34.6834 11.3824 H 206 TRP206 0.0748 3138 HE1 18.8277 32.1551 10.9110 H 206 TRP206 0.1331 3139 HE3 13.9320 33.6646 12.3582 H 206 TRP206 0.0624 3140 HZ2 16.9469 30.0482 10.8568 H 206 TRP206 0.0633 3141 HZ3 13.0643 31.3695 12.1058 H 206 TRP206 0.0618 3142 HH2 14.5799 29.5543 11.3400 H 206 TRP206 0.0618 3143 N 13.6430 37.3410 10.7050 N.am 207 ILE207 -0.2454 3144 CA 12.5620 38.3050 10.9690 C.3 207 ILE207 0.0903 3145 C 11.4830 37.5290 11.6950 C.2 207 ILE207 0.2189 3146 O 10.7600 36.7200 11.0660 O.2 207 ILE207 -0.2778 3147 CB 12.0668 38.8930 9.6244 C.3 207 ILE207 -0.0201 3148 CG1 13.1962 39.6666 8.9071 C.3 207 ILE207 -0.0514 3149 CG2 10.8248 39.7846 9.8091 C.3 207 ILE207 -0.0605 3150 CD1 12.8225 40.1619 7.5037 C.3 207 ILE207 -0.0650 3151 H 13.3940 36.4500 10.2760 H 207 ILE207 0.1312 3152 HA 12.9368 39.0955 11.6203 H 207 ILE207 0.0560 3153 HB 11.7830 38.0569 8.9830 H 207 ILE207 0.0318 3154 HG11 14.0743 39.0299 8.7999 H 207 ILE207 0.0266 3155 HG12 13.5102 40.5110 9.5216 H 207 ILE207 0.0266 3156 HG21 10.4363 40.1254 8.8503 H 207 ILE207 0.0233 3157 HG22 11.0630 40.6639 10.4055 H 207 ILE207 0.0233 3158 HG23 10.0105 39.2554 10.3040 H 207 ILE207 0.0233 3159 HD11 13.6857 40.6107 7.0127 H 207 ILE207 0.0230 3160 HD12 12.0422 40.9203 7.5374 H 207 ILE207 0.0230 3161 HD13 12.4733 39.3420 6.8752 H 207 ILE207 0.0230 3162 N 11.4000 37.6900 13.0010 N.am 208 VAL208 -0.2454 3163 CA 10.4860 36.9010 13.8340 C.3 208 VAL208 0.0901 3164 C 9.2990 37.7960 14.1760 C.2 208 VAL208 0.2189 3165 O 9.4970 38.8330 14.8480 O.2 208 VAL208 -0.2778 3166 CB 11.2313 36.4176 15.0975 C.3 208 VAL208 -0.0227 3167 CG1 10.3128 35.6207 16.0389 C.3 208 VAL208 -0.0608 3168 CG2 12.4627 35.5708 14.7321 C.3 208 VAL208 -0.0608 3169 H 11.9930 38.3890 13.4480 H 208 VAL208 0.1312 3170 HA 10.1291 36.0361 13.2698 H 208 VAL208 0.0560 3171 HB 11.5873 37.2925 15.6427 H 208 VAL208 0.0315 3172 HG11 10.8555 35.2880 16.9240 H 208 VAL208 0.0233 3173 HG12 9.9161 34.7334 15.5433 H 208 VAL208 0.0233 3174 HG13 9.4662 36.2158 16.3816 H 208 VAL208 0.0233 3175 HG21 12.9788 35.2236 15.6275 H 208 VAL208 0.0233 3176 HG22 13.1845 36.1337 14.1403 H 208 VAL208 0.0233 3177 HG23 12.1756 34.6885 14.1584 H 208 VAL208 0.0233 3178 N 8.1130 37.4550 13.7090 N.am 209 LEU209 -0.2456 3179 CA 6.9400 38.3220 13.9760 C.3 209 LEU209 0.0880 3180 C 6.5660 38.2640 15.4560 C.2 209 LEU209 0.2187 3181 O 6.5520 37.2150 16.1000 O.2 209 LEU209 -0.2778 3182 CB 5.7394 37.9125 13.1037 C.3 209 LEU209 -0.0266 3183 CG 6.0136 37.8919 11.5860 C.3 209 LEU209 -0.0449 3184 CD1 4.7072 37.6476 10.8167 C.3 209 LEU209 -0.0626 3185 CD2 6.6946 39.1751 11.0843 C.3 209 LEU209 -0.0626 3186 H 8.0030 36.5980 13.1660 H 209 LEU209 0.1312 3187 HA 7.2369 39.3442 13.7363 H 209 LEU209 0.0557 3188 HB1 4.9138 38.5973 13.3047 H 209 LEU209 0.0287 3189 HB2 5.3905 36.9238 13.4084 H 209 LEU209 0.0287 3190 HG 6.6840 37.0569 11.3755 H 209 LEU209 0.0296 3191 HD11 4.8977 37.5014 9.7531 H 209 LEU209 0.0232 3192 HD12 4.0253 38.4916 10.9247 H 209 LEU209 0.0232 3193 HD13 4.1909 36.7628 11.1890 H 209 LEU209 0.0232 3194 HD21 6.8027 39.1605 9.9996 H 209 LEU209 0.0232 3195 HD22 7.6960 39.2812 11.5015 H 209 LEU209 0.0232 3196 HD23 6.1205 40.0622 11.3542 H 209 LEU209 0.0232 3197 N 6.1850 39.4180 15.9690 N.am 210 ARG210 -0.2457 3198 CA 5.7730 39.5740 17.3590 C.3 210 ARG210 0.0879 3199 C 4.4730 38.8170 17.6540 C.2 210 ARG210 0.2187 3200 O 4.3230 38.2660 18.7430 O.2 210 ARG210 -0.2778 3201 CB 5.6147 41.0905 17.5342 C.3 210 ARG210 -0.0258 3202 CG 5.0944 41.5563 18.8972 C.3 210 ARG210 -0.0154 3203 CD 4.8195 43.0625 18.8654 C.3 210 ARG210 0.1045 3204 NE 4.3090 43.5235 20.1568 N.pl3 210 ARG210 -0.4450 3205 CZ 3.0083 43.6176 20.4195 C.cat 210 ARG210 0.5062 3206 NH1 2.1092 43.2716 19.5538 N.pl3 210 ARG210 -0.4573 3207 NH2 2.6119 44.0702 21.5759 N.pl3 210 ARG210 -0.4573 3208 H 6.1780 40.2400 15.3650 H 210 ARG210 0.1312 3209 HA 6.5629 39.1805 17.9946 H 210 ARG210 0.0557 3210 HB1 4.9477 41.4593 16.7536 H 210 ARG210 0.0286 3211 HB2 6.5754 41.5692 17.3396 H 210 ARG210 0.0286 3212 HG1 5.8198 41.3165 19.6748 H 210 ARG210 0.0299 3213 HG2 4.1746 41.0308 19.1539 H 210 ARG210 0.0299 3214 HD1 4.1291 43.3369 18.0640 H 210 ARG210 0.0711 3215 HD2 5.7364 43.6129 18.6666 H 210 ARG210 0.0711 3216 HE 4.9654 43.7731 20.8615 H 210 ARG210 0.3153 3217 HH11 1.1280 43.3773 19.6766 H 210 ARG210 0.3114 3218 HH12 2.3620 42.8552 18.6672 H 210 ARG210 0.3114 3219 HH21 1.6319 44.1331 21.7438 H 210 ARG210 0.3114 3220 HH22 3.2734 44.3414 22.2660 H 210 ARG210 0.3114 3221 N 3.5130 38.8530 16.7460 N.am 211 GLU211 -0.2456 3222 CA 2.1650 38.3440 17.0410 C.3 211 GLU211 0.0885 3223 C 2.0120 36.9220 16.5250 C.2 211 GLU211 0.2214 3224 O 2.2630 36.6540 15.3480 O.2 211 GLU211 -0.2776 3225 CB 1.1295 39.2290 16.3040 C.3 211 GLU211 -0.0192 3226 CG 0.4860 40.3351 17.1633 C.3 211 GLU211 0.0356 3227 CD 1.2812 41.6454 17.2881 C.2 211 GLU211 0.1760 3228 OE1 2.5044 41.6480 17.2815 O.co2 211 GLU211 -0.6478 3229 OE2 0.6665 42.6982 17.4052 O.co2 211 GLU211 -0.6478 3230 H 3.7110 39.2410 15.8240 H 211 GLU211 0.1312 3231 HA 1.9813 38.4236 18.1093 H 211 GLU211 0.0557 3232 HB1 0.2943 38.6115 15.9675 H 211 GLU211 0.0290 3233 HB2 1.5599 39.6405 15.3906 H 211 GLU211 0.0290 3234 HG1 0.2717 39.9692 18.1663 H 211 GLU211 0.0374 3235 HG2 -0.4776 40.5963 16.7254 H 211 GLU211 0.0374 3236 N 1.6510 35.9470 17.3970 N.am 212 PRO212 -0.2316 3237 CA 1.3520 34.5860 16.9420 C.3 212 PRO212 0.0907 3238 C 0.0330 34.4760 16.1700 C.2 212 PRO212 0.2189 3239 O -0.8660 35.2660 16.4130 O.2 212 PRO212 -0.2778 3240 CB 1.2580 33.7643 18.2415 C.3 212 PRO212 -0.0276 3241 CG 1.8170 34.6638 19.3391 C.3 212 PRO212 -0.0379 3242 CD 1.5847 36.0930 18.8480 C.3 212 PRO212 0.0071 3243 HA 2.1881 34.2596 16.3219 H 212 PRO212 0.0559 3244 HB1 1.7979 32.8198 18.1686 H 212 PRO212 0.0285 3245 HB2 0.2240 33.5180 18.4921 H 212 PRO212 0.0285 3246 HG1 2.8897 34.4876 19.4289 H 212 PRO212 0.0278 3247 HG2 1.3673 34.4708 20.3135 H 212 PRO212 0.0278 3248 HD1 0.5939 36.4761 19.0961 H 212 PRO212 0.0431 3249 HD2 2.3698 36.7512 19.2182 H 212 PRO212 0.0431 3250 N -0.0890 33.4450 15.3400 N.am 213 ILE213 -0.2454 3251 CA -1.4000 33.0080 14.8060 C.3 213 ILE213 0.0903 3252 C -1.8990 31.8720 15.6800 C.2 213 ILE213 0.2190 3253 O -1.1340 31.2550 16.4130 O.2 213 ILE213 -0.2778 3254 CB -1.2603 32.5767 13.3272 C.3 213 ILE213 -0.0201 3255 CG1 -0.2978 31.3831 13.1334 C.3 213 ILE213 -0.0514 3256 CG2 -0.8464 33.7747 12.4552 C.3 213 ILE213 -0.0605 3257 CD1 -0.4117 30.7284 11.7507 C.3 213 ILE213 -0.0650 3258 H 0.7500 32.9370 15.0610 H 213 ILE213 0.1312 3259 HA -2.1050 33.8373 14.8882 H 213 ILE213 0.0560 3260 HB -2.2491 32.2602 12.9908 H 213 ILE213 0.0318 3261 HG11 -0.5037 30.6111 13.8742 H 213 ILE213 0.0266 3262 HG12 0.7315 31.6985 13.3083 H 213 ILE213 0.0266 3263 HG21 -0.8831 33.5290 11.3947 H 213 ILE213 0.0233 3264 HG22 0.1674 34.1030 12.6851 H 213 ILE213 0.0233 3265 HG23 -1.5118 34.6239 12.6121 H 213 ILE213 0.0233 3266 HD11 0.2552 29.8699 11.6714 H 213 ILE213 0.0230 3267 HD12 -0.1453 31.4213 10.9556 H 213 ILE213 0.0230 3268 HD13 -1.4271 30.3779 11.5640 H 213 ILE213 0.0230 3269 N -3.1880 31.6070 15.6480 N.am 214 SER214 -0.2436 3270 CA -3.7360 30.4750 16.4030 C.3 214 SER214 0.1109 3271 C -4.3510 29.4810 15.4550 C.2 214 SER214 0.2209 3272 O -5.0370 29.8910 14.4910 O.2 214 SER214 -0.2777 3273 CB -4.7990 30.9646 17.3984 C.3 214 SER214 0.0681 3274 OG -4.1977 31.8624 18.3237 O.3 214 SER214 -0.3930 3275 H -3.8110 32.1940 15.0930 H 214 SER214 0.1312 3276 HA -2.9406 29.9987 16.9596 H 214 SER214 0.0580 3277 HB1 -5.2265 30.1062 17.9319 H 214 SER214 0.0577 3278 HB2 -5.6132 31.4645 16.8612 H 214 SER214 0.0577 3279 HG -4.8322 32.1625 18.9720 H 214 SER214 0.2095 3280 N -4.1550 28.2250 15.8050 N.am 215 ILE215 -0.2453 3281 CA -4.8260 27.0980 15.1160 C.3 215 ILE215 0.0903 3282 C -5.4990 26.2470 16.1830 C.2 215 ILE215 0.2190 3283 O -5.1900 26.3840 17.3760 O.2 215 ILE215 -0.2778 3284 CB -3.7733 26.2867 14.3209 C.3 215 ILE215 -0.0201 3285 CG1 -2.6865 25.6505 15.2180 C.3 215 ILE215 -0.0514 3286 CG2 -3.1359 27.1577 13.2253 C.3 215 ILE215 -0.0605 3287 CD1 -1.8273 24.6140 14.4814 C.3 215 ILE215 -0.0650 3288 H -3.5190 28.0220 16.5770 H 215 ILE215 0.1312 3289 HA -5.6070 27.4874 14.4607 H 215 ILE215 0.0560 3290 HB -4.2969 25.4695 13.8261 H 215 ILE215 0.0318 3291 HG11 -3.1462 25.1437 16.0666 H 215 ILE215 0.0266 3292 HG12 -2.0477 26.4263 15.6424 H 215 ILE215 0.0266 3293 HG21 -2.4510 26.5823 12.6069 H 215 ILE215 0.0233 3294 HG22 -2.5696 27.9876 13.6488 H 215 ILE215 0.0233 3295 HG23 -3.8925 27.5762 12.5648 H 215 ILE215 0.0233 3296 HD11 -1.1272 24.1392 15.1677 H 215 ILE215 0.0230 3297 HD12 -1.2428 25.0655 13.6808 H 215 ILE215 0.0230 3298 HD13 -2.4467 23.8289 14.0468 H 215 ILE215 0.0230 3299 N -6.3910 25.3650 15.8010 N.am 216 SER216 -0.2436 3300 CA -7.0640 24.5280 16.8060 C.3 216 SER216 0.1109 3301 C -6.1620 23.3900 17.2580 C.2 216 SER216 0.2209 3302 O -5.2000 23.0060 16.5550 O.2 216 SER216 -0.2777 3303 CB -8.3970 23.9843 16.2860 C.3 216 SER216 0.0681 3304 OG -8.1887 23.1238 15.1758 O.3 216 SER216 -0.3930 3305 H -6.6170 25.2600 14.8120 H 216 SER216 0.1312 3306 HA -7.2666 25.1552 17.6729 H 216 SER216 0.0580 3307 HB1 -9.0432 24.8276 16.0284 H 216 SER216 0.0577 3308 HB2 -8.9083 23.4332 17.0814 H 216 SER216 0.0577 3309 HG -9.0237 22.9307 14.7450 H 216 SER216 0.2095 3310 N -6.5070 22.7960 18.3850 N.am 217 GLU217 -0.2456 3311 CA -5.8170 21.5730 18.8180 C.3 217 GLU217 0.0883 3312 C -5.9710 20.4610 17.7730 C.2 217 GLU217 0.2187 3313 O -5.0130 19.7130 17.5690 O.2 217 GLU217 -0.2778 3314 CB -6.2452 21.1674 20.2357 C.3 217 GLU217 -0.0193 3315 CG -5.6614 19.8290 20.7353 C.3 217 GLU217 0.0356 3316 CD -4.1343 19.6670 20.5847 C.2 217 GLU217 0.1760 3317 OE1 -3.3972 20.6440 20.4885 O.co2 217 GLU217 -0.6478 3318 OE2 -3.6700 18.5345 20.5596 O.co2 217 GLU217 -0.6478 3319 H -7.2550 23.1870 18.9570 H 217 GLU217 0.1312 3320 HA -4.7571 21.8316 18.8377 H 217 GLU217 0.0557 3321 HB1 -7.3327 21.1158 20.2857 H 217 GLU217 0.0290 3322 HB2 -5.9488 21.9601 20.9235 H 217 GLU217 0.0290 3323 HG1 -6.1321 19.0050 20.1995 H 217 GLU217 0.0374 3324 HG2 -5.9035 19.6892 21.7878 H 217 GLU217 0.0374 3325 N -7.1440 20.3050 17.1640 N.am 218 ARG218 -0.2457 3326 CA -7.3150 19.2850 16.1090 C.3 218 ARG218 0.0879 3327 C -6.3000 19.5420 14.9860 C.2 218 ARG218 0.2187 3328 O -5.7030 18.5810 14.4730 O.2 218 ARG218 -0.2778 3329 CB -8.7447 19.4045 15.5275 C.3 218 ARG218 -0.0258 3330 CG -9.0485 18.4499 14.3509 C.3 218 ARG218 -0.0154 3331 CD -10.4571 18.6250 13.7503 C.3 218 ARG218 0.1045 3332 NE -10.5476 19.8214 12.9114 N.pl3 218 ARG218 -0.4450 3333 CZ -10.5151 19.8934 11.5821 C.cat 218 ARG218 0.5062 3334 NH1 -10.3262 18.8578 10.8071 N.pl3 218 ARG218 -0.4573 3335 NH2 -10.6795 21.0459 11.0297 N.pl3 218 ARG218 -0.4573 3336 H -7.9330 20.8950 17.4280 H 218 ARG218 0.1312 3337 HA -7.1321 18.3062 16.5544 H 218 ARG218 0.0557 3338 HB1 -8.9148 20.4296 15.2003 H 218 ARG218 0.0286 3339 HB2 -9.4645 19.2288 16.3273 H 218 ARG218 0.0286 3340 HG1 -8.9400 17.4253 14.7069 H 218 ARG218 0.0299 3341 HG2 -8.3152 18.5736 13.5539 H 218 ARG218 0.0299 3342 HD1 -11.2044 18.7368 14.5391 H 218 ARG218 0.0711 3343 HD2 -10.7492 17.7556 13.1590 H 218 ARG218 0.0711 3344 HE -10.6511 20.7553 13.2831 H 218 ARG218 0.3153 3345 HH11 -10.2688 19.0061 9.8172 H 218 ARG218 0.3114 3346 HH12 -10.2498 17.9504 11.1974 H 218 ARG218 0.3114 3347 HH21 -10.6170 21.2047 10.0491 H 218 ARG218 0.3114 3348 HH22 -10.8765 21.8439 11.6198 H 218 ARG218 0.3114 3349 N -6.1810 20.7880 14.5640 N.am 219 GLN219 -0.2456 3350 CA -5.2500 21.1530 13.4850 C.3 219 GLN219 0.0882 3351 C -3.8090 20.8560 13.9090 C.2 219 GLN219 0.2187 3352 O -3.0660 20.2250 13.1240 O.2 219 GLN219 -0.2778 3353 CB -5.4185 22.6312 13.1144 C.3 219 GLN219 -0.0210 3354 CG -6.6568 22.8447 12.2373 C.3 219 GLN219 0.0225 3355 CD -6.7308 24.2836 11.7304 C.2 219 GLN219 0.1981 3356 OE1 -6.1629 25.2131 12.2881 O.2 219 GLN219 -0.2798 3357 NE2 -7.4692 24.3921 10.6253 N.am 219 GLN219 -0.2724 3358 H -6.7490 21.5160 14.9970 H 219 GLN219 0.1312 3359 HA -5.4782 20.5160 12.6292 H 219 GLN219 0.0557 3360 HB1 -4.5383 22.9802 12.5707 H 219 GLN219 0.0289 3361 HB2 -5.4794 23.2414 14.0166 H 219 GLN219 0.0289 3362 HG1 -7.5732 22.6127 12.7721 H 219 GLN219 0.0356 3363 HG2 -6.6269 22.1814 11.3727 H 219 GLN219 0.0356 3364 HE21 -7.5667 25.2716 10.1659 H 219 GLN219 0.1266 3365 HE22 -7.9433 23.5973 10.2492 H 219 GLN219 0.1266 3366 N -3.4350 21.2360 15.1270 N.am 220 MET220 -0.2456 3367 CA -2.0780 20.9730 15.6240 C.3 220 MET220 0.0885 3368 C -1.8570 19.4560 15.6360 C.2 220 MET220 0.2185 3369 O -0.7500 18.9980 15.2960 O.2 220 MET220 -0.2778 3370 CB -1.9476 21.5878 17.0279 C.3 220 MET220 -0.0199 3371 CG -0.5268 21.5334 17.6099 C.3 220 MET220 -0.0047 3372 SD 0.6287 22.6469 16.7800 S.3 220 MET220 -0.1641 3373 CE 1.4823 21.4639 15.7233 C.3 220 MET220 -0.0181 3374 H -4.1030 21.7190 15.7280 H 220 MET220 0.1312 3375 HA -1.3888 21.4520 14.9317 H 220 MET220 0.0557 3376 HB1 -2.6356 21.0848 17.7103 H 220 MET220 0.0293 3377 HB2 -2.2761 22.6275 16.9975 H 220 MET220 0.0293 3378 HG1 -0.1322 20.5181 17.6033 H 220 MET220 0.0377 3379 HG2 -0.5692 21.8340 18.6573 H 220 MET220 0.0377 3380 HE1 2.2844 21.9500 15.1689 H 220 MET220 0.0340 3381 HE2 0.7826 21.0287 15.0158 H 220 MET220 0.0340 3382 HE3 1.9001 20.6515 16.3176 H 220 MET220 0.0340 3383 N -2.8620 18.6800 16.0470 N.am 221 GLY221 -0.2485 3384 CA -2.8290 17.2110 16.0310 C.3 221 GLY221 0.0765 3385 C -2.5010 16.5930 14.6870 C.2 221 GLY221 0.2155 3386 O -1.8690 15.5300 14.6520 O.2 221 GLY221 -0.2781 3387 H -3.7060 19.1350 16.3940 H 221 GLY221 0.1309 3388 HA1 -3.8113 16.8719 16.3588 H 221 GLY221 0.0521 3389 HA2 -2.0878 16.8940 16.7626 H 221 GLY221 0.0521 3390 N -2.9590 17.1880 13.5990 N.am 222 LYS222 -0.2459 3391 CA -2.7280 16.6230 12.2510 C.3 222 LYS222 0.0878 3392 C -1.2130 16.6800 11.9690 C.2 222 LYS222 0.2187 3393 O -0.7120 15.7900 11.2740 O.2 222 LYS222 -0.2778 3394 CB -3.5391 17.4168 11.2048 C.3 222 LYS222 -0.0289 3395 CG -5.0649 17.4766 11.4621 C.3 222 LYS222 -0.0496 3396 CD -5.9084 16.3366 10.8613 C.3 222 LYS222 -0.0278 3397 CE -6.1020 16.4306 9.3404 C.3 222 LYS222 0.1103 3398 NZ -6.8455 17.6044 8.8826 N.4 222 LYS222 -0.0749 3399 H -3.4840 18.0570 13.6910 H 222 LYS222 0.1312 3400 HA -3.0420 15.5789 12.2734 H 222 LYS222 0.0557 3401 HB1 -3.3456 17.0335 10.2032 H 222 LYS222 0.0285 3402 HB2 -3.1538 18.4367 11.2172 H 222 LYS222 0.0285 3403 HG1 -5.4577 18.4300 11.1104 H 222 LYS222 0.0266 3404 HG2 -5.2418 17.4811 12.5311 H 222 LYS222 0.0266 3405 HD1 -6.8908 16.3355 11.3354 H 222 LYS222 0.0282 3406 HD2 -5.4505 15.3805 11.1164 H 222 LYS222 0.0282 3407 HE1 -6.6254 15.5525 8.9579 H 222 LYS222 0.0559 3408 HE2 -5.1237 16.4299 8.8679 H 222 LYS222 0.0559 3409 HZ1 -7.8767 17.4367 8.8361 H 222 LYS222 0.2742 3410 HZ2 -6.6467 17.8135 7.8830 H 222 LYS222 0.2742 3411 HZ3 -6.6452 18.4593 9.4326 H 222 LYS222 0.2742 3412 N -0.5030 17.7160 12.4130 N.am 223 PHE223 -0.2453 3413 CA 0.9750 17.7530 12.2750 C.3 223 PHE223 0.0917 3414 C 1.6230 16.5690 12.9940 C.2 223 PHE223 0.2190 3415 O 2.5540 15.9490 12.4720 O.2 223 PHE223 -0.2778 3416 CB 1.5426 19.0906 12.7569 C.3 223 PHE223 -0.0036 3417 CG 1.1061 20.2301 11.8747 C.ar 223 PHE223 -0.0454 3418 CD1 1.8417 20.5663 10.7418 C.ar 223 PHE223 -0.0585 3419 CD2 -0.0385 20.9597 12.1747 C.ar 223 PHE223 -0.0585 3420 CE1 1.4455 21.6241 9.9333 C.ar 223 PHE223 -0.0615 3421 CE2 -0.4361 22.0211 11.3732 C.ar 223 PHE223 -0.0615 3422 CZ 0.3118 22.3587 10.2544 C.ar 223 PHE223 -0.0617 3423 H -0.9840 18.4990 12.8560 H 223 PHE223 0.1312 3424 HA 1.1939 17.6326 11.2131 H 223 PHE223 0.0560 3425 HB1 2.6300 19.0599 12.7466 H 223 PHE223 0.0333 3426 HB2 1.2513 19.2761 13.7886 H 223 PHE223 0.0333 3427 HD1 2.7304 20.0056 10.4878 H 223 PHE223 0.0620 3428 HD2 -0.6224 20.6957 13.0409 H 223 PHE223 0.0620 3429 HE1 2.0235 21.8786 9.0571 H 223 PHE223 0.0618 3430 HE2 -1.3231 22.5851 11.6236 H 223 PHE223 0.0618 3431 HZ 0.0126 23.1922 9.6360 H 223 PHE223 0.0618 3432 N 1.1370 16.2440 14.1810 N.am 224 ARG224 -0.2456 3433 CA 1.7200 15.1480 14.9850 C.3 224 ARG224 0.0879 3434 C 1.3980 13.7680 14.3740 C.2 224 ARG224 0.2187 3435 O 2.0620 12.7810 14.7900 O.2 224 ARG224 -0.2778 3436 CB 1.2167 15.2247 16.4384 C.3 224 ARG224 -0.0258 3437 CG 1.2189 16.6433 17.0369 C.3 224 ARG224 -0.0154 3438 CD 1.0410 16.6335 18.5629 C.3 224 ARG224 0.1045 3439 NE 0.5285 17.9225 19.0403 N.pl3 224 ARG224 -0.4450 3440 CZ -0.7254 18.1402 19.4457 C.cat 224 ARG224 0.5062 3441 NH1 -1.6318 17.2093 19.4208 N.pl3 224 ARG224 -0.4573 3442 NH2 -1.0779 19.3103 19.8866 N.pl3 224 ARG224 -0.4573 3443 H 0.3400 16.7620 14.5510 H 224 ARG224 0.1312 3444 HA 2.8039 15.2832 14.9631 H 224 ARG224 0.0557 3445 HB1 1.8350 14.5675 17.0514 H 224 ARG224 0.0286 3446 HB2 0.2003 14.8322 16.5001 H 224 ARG224 0.0286 3447 HG1 0.4097 17.2155 16.5845 H 224 ARG224 0.0299 3448 HG2 2.1433 17.1639 16.7840 H 224 ARG224 0.0299 3449 HD1 1.9994 16.4657 19.0594 H 224 ARG224 0.0711 3450 HD2 0.3798 15.8260 18.8828 H 224 ARG224 0.0711 3451 HE 1.1204 18.7226 19.0846 H 224 ARG224 0.3153 3452 HH11 -2.5412 17.4791 19.7619 H 224 ARG224 0.3114 3453 HH12 -1.4555 16.2917 19.0955 H 224 ARG224 0.3114 3454 HH21 -2.0465 19.4345 20.1723 H 224 ARG224 0.3114 3455 HH22 -0.4690 20.0867 19.9606 H 224 ARG224 0.3114 3456 N 0.4540 13.7110 13.4280 N.am 225 SER225 -0.2436 3457 CA 0.1020 12.4910 12.6620 C.3 225 SER225 0.1109 3458 C 1.1940 12.1440 11.6540 C.2 225 SER225 0.2209 3459 O 1.3400 10.9580 11.3620 O.2 225 SER225 -0.2777 3460 CB -1.3175 12.5719 12.0753 C.3 225 SER225 0.0681 3461 OG -1.4276 13.0018 10.7271 O.3 225 SER225 -0.3930 3462 H -0.0600 14.5670 13.2190 H 225 SER225 0.1312 3463 HA 0.1131 11.6908 13.4046 H 225 SER225 0.0580 3464 HB1 -1.9549 13.1916 12.7148 H 225 SER225 0.0577 3465 HB2 -1.7426 11.5697 12.1204 H 225 SER225 0.0577 3466 HG -0.9125 13.8037 10.6251 H 225 SER225 0.2095 3467 N 1.9720 13.1300 11.1990 N.am 226 LEU226 -0.2456 3468 CA 3.0460 12.8990 10.2220 C.3 226 LEU226 0.0880 3469 C 4.0950 11.9660 10.8170 C.2 226 LEU226 0.2187 3470 O 4.2350 11.8790 12.0590 O.2 226 LEU226 -0.2778 3471 CB 3.6775 14.2533 9.8550 C.3 226 LEU226 -0.0266 3472 CG 2.7116 15.2320 9.1574 C.3 226 LEU226 -0.0449 3473 CD1 3.3231 16.6369 9.1101 C.3 226 LEU226 -0.0626 3474 CD2 2.3416 14.7472 7.7479 C.3 226 LEU226 -0.0626 3475 H 1.8150 14.0780 11.5420 H 226 LEU226 0.1312 3476 HA 2.6041 12.4176 9.3495 H 226 LEU226 0.0557 3477 HB1 4.5494 14.1008 9.2162 H 226 LEU226 0.0287 3478 HB2 4.0558 14.7180 10.7665 H 226 LEU226 0.0287 3479 HG 1.7937 15.3121 9.7413 H 226 LEU226 0.0296 3480 HD11 2.6708 17.3413 8.5961 H 226 LEU226 0.0232 3481 HD12 4.2868 16.6292 8.6013 H 226 LEU226 0.0232 3482 HD13 3.4800 17.0204 10.1172 H 226 LEU226 0.0232 3483 HD21 1.8027 15.5113 7.1907 H 226 LEU226 0.0232 3484 HD22 1.6975 13.8707 7.7939 H 226 LEU226 0.0232 3485 HD23 3.2293 14.4888 7.1690 H 226 LEU226 0.0232 3486 N 4.8480 11.3130 9.9480 N.am 227 LEU227 -0.2456 3487 CA 5.8860 10.3600 10.3790 C.3 227 LEU227 0.0880 3488 C 7.2640 10.7980 9.9110 C.2 227 LEU227 0.2187 3489 O 7.4270 11.3150 8.8080 O.2 227 LEU227 -0.2778 3490 CB 5.5225 8.9945 9.7703 C.3 227 LEU227 -0.0266 3491 CG 4.2487 8.3724 10.3734 C.3 227 LEU227 -0.0449 3492 CD1 3.6625 7.3174 9.4342 C.3 227 LEU227 -0.0626 3493 CD2 4.5275 7.7645 11.7503 C.3 227 LEU227 -0.0626 3494 H 4.7060 11.4740 8.9510 H 227 LEU227 0.1312 3495 HA 5.9037 10.2975 11.4667 H 227 LEU227 0.0557 3496 HB1 6.3402 8.2900 9.8751 H 227 LEU227 0.0287 3497 HB2 5.4037 9.1076 8.6946 H 227 LEU227 0.0287 3498 HG 3.4888 9.1452 10.4929 H 227 LEU227 0.0296 3499 HD11 2.7833 6.8419 9.8686 H 227 LEU227 0.0232 3500 HD12 4.3919 6.5393 9.2050 H 227 LEU227 0.0232 3501 HD13 3.3570 7.7886 8.5018 H 227 LEU227 0.0232 3502 HD21 3.6354 7.2946 12.1635 H 227 LEU227 0.0232 3503 HD22 4.8427 8.5228 12.4566 H 227 LEU227 0.0232 3504 HD23 5.3209 7.0192 11.6961 H 227 LEU227 0.0232 3505 N 8.2560 10.5300 10.7470 N.am 228 PHE228 -0.2453 3506 CA 9.6780 10.6280 10.3570 C.3 228 PHE228 0.0917 3507 C 10.0740 9.5020 9.3920 C.2 228 PHE228 0.2191 3508 O 11.1360 9.5800 8.7740 O.2 228 PHE228 -0.2778 3509 CB 10.5792 10.4927 11.6072 C.3 228 PHE228 -0.0036 3510 CG 10.6450 11.7015 12.5106 C.ar 228 PHE228 -0.0454 3511 CD1 10.9413 12.9622 12.0022 C.ar 228 PHE228 -0.0585 3512 CD2 10.5825 11.5451 13.8924 C.ar 228 PHE228 -0.0585 3513 CE1 11.1680 14.0401 12.8490 C.ar 228 PHE228 -0.0615 3514 CE2 10.7934 12.6226 14.7453 C.ar 228 PHE228 -0.0615 3515 CZ 11.0868 13.8742 14.2235 C.ar 228 PHE228 -0.0617 3516 H 8.0290 10.2440 11.6990 H 228 PHE228 0.1312 3517 HA 9.8247 11.5792 9.8443 H 228 PHE228 0.0560 3518 HB1 11.6099 10.2934 11.3082 H 228 PHE228 0.0333 3519 HB2 10.2642 9.6227 12.1859 H 228 PHE228 0.0333 3520 HD1 11.0318 13.1045 10.9392 H 228 PHE228 0.0620 3521 HD2 10.3947 10.5702 14.3108 H 228 PHE228 0.0620 3522 HE1 11.4119 15.0076 12.4342 H 228 PHE228 0.0618 3523 HE2 10.7412 12.4852 15.8149 H 228 PHE228 0.0618 3524 HZ 11.2624 14.7120 14.8832 H 228 PHE228 0.0618 3525 N 9.2640 8.4460 9.3360 N.am 229 THR229 -0.2434 3526 CA 9.6060 7.1300 8.7560 C.3 229 THR229 0.1135 3527 C 8.8820 6.9160 7.4280 C.2 229 THR229 0.2213 3528 O 7.8080 7.5020 7.1950 O.2 229 THR229 -0.2777 3529 CB 9.2109 6.0750 9.8188 C.3 229 THR229 0.0763 3530 OG1 7.9722 6.3996 10.4287 O.3 229 THR229 -0.3900 3531 CG2 10.2947 5.9394 10.9087 C.3 229 THR229 -0.0370 3532 H 8.3280 8.5550 9.7270 H 229 THR229 0.1313 3533 HA 10.6809 7.0736 8.6059 H 229 THR229 0.0583 3534 HB 9.0841 5.0949 9.3502 H 229 THR229 0.0611 3535 HG1 8.1027 7.1388 11.0113 H 229 THR229 0.2098 3536 HG21 9.9756 5.2550 11.6908 H 229 THR229 0.0255 3537 HG22 10.5334 6.8946 11.3765 H 229 THR229 0.0255 3538 HG23 11.2270 5.5510 10.5049 H 229 THR229 0.0255 3539 N 9.4690 6.0620 6.5970 N.am 230 SER230 -0.2435 3540 CA 8.9210 5.6520 5.2830 C.3 230 SER230 0.1109 3541 C 7.8660 4.5620 5.4990 C.2 230 SER230 0.2209 3542 O 7.7640 4.0190 6.6370 O.2 230 SER230 -0.2777 3543 CB 9.8732 5.3272 4.0977 C.3 230 SER230 0.0681 3544 OG 10.9545 4.4593 4.3479 O.3 230 SER230 -0.3930 3545 H 10.3610 5.6600 6.8840 H 230 SER230 0.1312 3546 HA 8.3223 6.5004 4.9470 H 230 SER230 0.0580 3547 HB1 10.3047 6.2419 3.7000 H 230 SER230 0.0577 3548 HB2 9.3065 4.9395 3.2428 H 230 SER230 0.0577 3549 HG 10.6183 3.6324 4.7079 H 230 SER230 0.2095 3550 N 7.0890 4.2740 4.4550 N.am 231 GLU231 -0.2456 3551 CA 5.8930 3.3880 4.5080 C.3 231 GLU231 0.0883 3552 C 6.1940 2.0360 5.1780 C.2 231 GLU231 0.2187 3553 O 5.2960 1.5170 5.8930 O.2 231 GLU231 -0.2778 3554 CB 5.1586 3.2275 3.1672 C.3 231 GLU231 -0.0193 3555 CG 3.8735 2.3589 3.2526 C.3 231 GLU231 0.0356 3556 CD 2.8765 2.7846 4.3607 C.2 231 GLU231 0.1760 3557 OE1 2.7848 3.9598 4.6829 O.co2 231 GLU231 -0.6478 3558 OE2 2.1842 1.9442 4.9294 O.co2 231 GLU231 -0.6478 3559 H 7.3310 4.6900 3.5560 H 231 GLU231 0.1312 3560 HA 5.2255 3.9055 5.1962 H 231 GLU231 0.0557 3561 HB1 5.8369 2.7923 2.4321 H 231 GLU231 0.0290 3562 HB2 4.8941 4.2170 2.7941 H 231 GLU231 0.0290 3563 HG1 4.1446 1.3171 3.4245 H 231 GLU231 0.0374 3564 HG2 3.3439 2.3853 2.3019 H 231 GLU231 0.0374 3565 N 7.3820 1.4720 4.9680 N.am 232 ASP232 -0.2451 3566 CA 7.6840 0.0690 5.3540 C.3 232 ASP232 0.0974 3567 C 8.2630 -0.0250 6.7680 C.2 232 ASP232 0.2192 3568 O 8.3010 -1.1570 7.3160 O.2 232 ASP232 -0.2778 3569 CB 8.7570 -0.4723 4.3894 C.3 232 ASP232 0.0576 3570 CG 8.4118 -0.2221 2.9146 C.2 232 ASP232 0.1780 3571 OD1 7.7950 -1.0893 2.3005 O.co2 232 ASP232 -0.6478 3572 OD2 8.7715 0.8364 2.3961 O.co2 232 ASP232 -0.6478 3573 H 8.1150 2.0260 4.5240 H 232 ASP232 0.1312 3574 HA 6.7667 -0.5167 5.2819 H 232 ASP232 0.0563 3575 HB1 8.9007 -1.5425 4.5344 H 232 ASP232 0.0394 3576 HB2 9.7193 0.0051 4.5768 H 232 ASP232 0.0394 3577 N 8.7380 1.0870 7.3230 N.am 233 ASP233 -0.2451 3578 CA 9.4790 1.1130 8.6100 C.3 233 ASP233 0.0974 3579 C 8.4820 1.1970 9.7700 C.2 233 ASP233 0.2192 3580 O 7.3250 1.6730 9.5680 O.2 233 ASP233 -0.2778 3581 CB 10.6801 2.1226 8.7874 C.3 233 ASP233 0.0576 3582 CG 10.9919 3.3417 7.8561 C.2 233 ASP233 0.1780 3583 OD1 10.9621 3.2440 6.6420 O.co2 233 ASP233 -0.6478 3584 OD2 11.3177 4.4299 8.3381 O.co2 233 ASP233 -0.6478 3585 H 8.5850 1.9710 6.8380 H 233 ASP233 0.1312 3586 HA 9.9178 0.1178 8.6978 H 233 ASP233 0.0563 3587 HB1 11.5904 1.5273 8.7391 H 233 ASP233 0.0394 3588 HB2 10.6794 2.5130 9.8060 H 233 ASP233 0.0394 3589 N 8.9090 0.7310 10.9430 N.am 234 GLU234 -0.2456 3590 CA 8.1370 0.8860 12.1970 C.3 234 GLU234 0.0883 3591 C 7.8620 2.3870 12.3480 C.2 234 GLU234 0.2187 3592 O 8.7850 3.1910 12.1180 O.2 234 GLU234 -0.2778 3593 CB 8.7387 0.2156 13.4419 C.3 234 GLU234 -0.0193 3594 CG 8.0219 -1.1069 13.7909 C.3 234 GLU234 0.0356 3595 CD 6.4884 -0.9641 13.9411 C.2 234 GLU234 0.1760 3596 OE1 6.0001 0.1413 14.1789 O.co2 234 GLU234 -0.6478 3597 OE2 5.7946 -1.9681 13.8068 O.co2 234 GLU234 -0.6478 3598 H 9.8060 0.2470 10.9780 H 234 GLU234 0.1312 3599 HA 7.1732 0.4355 11.9571 H 234 GLU234 0.0557 3600 HB1 8.6502 0.8789 14.3039 H 234 GLU234 0.0290 3601 HB2 9.8055 0.0466 13.3006 H 234 GLU234 0.0290 3602 HG1 8.4103 -1.5154 14.7223 H 234 GLU234 0.0374 3603 HG2 8.2125 -1.8452 13.0127 H 234 GLU234 0.0374 3604 N 6.6180 2.7480 12.6460 N.am 235 ARG235 -0.2457 3605 CA 6.1670 4.1530 12.6500 C.3 235 ARG235 0.0879 3606 C 6.8630 4.8910 13.7820 C.2 235 ARG235 0.2187 3607 O 6.8250 4.4330 14.9240 O.2 235 ARG235 -0.2778 3608 CB 4.6480 4.1355 12.4047 C.3 235 ARG235 -0.0258 3609 CG 4.3917 3.1407 11.2350 C.3 235 ARG235 -0.0154 3610 CD 3.1795 3.3458 10.3297 C.3 235 ARG235 0.1045 3611 NE 3.1865 2.2234 9.3846 N.pl3 235 ARG235 -0.4450 3612 CZ 3.0654 2.2590 8.0560 C.cat 235 ARG235 0.5062 3613 NH1 2.9464 3.3642 7.3835 N.pl3 235 ARG235 -0.4573 3614 NH2 3.0658 1.1474 7.3865 N.pl3 235 ARG235 -0.4573 3615 H 5.9440 2.0200 12.8830 H 235 ARG235 0.1312 3616 HA 6.5994 4.5686 11.7363 H 235 ARG235 0.0557 3617 HB1 4.2923 5.1284 12.1465 H 235 ARG235 0.0286 3618 HB2 4.1119 3.8182 13.2995 H 235 ARG235 0.0286 3619 HG1 4.3514 2.1272 11.6393 H 235 ARG235 0.0299 3620 HG2 5.2471 3.1505 10.5553 H 235 ARG235 0.0299 3621 HD1 3.2424 4.2947 9.7945 H 235 ARG235 0.0711 3622 HD2 2.2450 3.3050 10.8912 H 235 ARG235 0.0711 3623 HE 3.3256 1.2983 9.7354 H 235 ARG235 0.3153 3624 HH11 2.8033 3.2846 6.3813 H 235 ARG235 0.3114 3625 HH12 3.0026 4.2581 7.7967 H 235 ARG235 0.3114 3626 HH21 2.9459 1.2363 6.3875 H 235 ARG235 0.3114 3627 HH22 3.1935 0.2558 7.7997 H 235 ARG235 0.3114 3628 N 7.4640 6.0210 13.4460 N.am 236 ILE236 -0.2454 3629 CA 7.9350 7.0160 14.4440 C.3 236 ILE236 0.0903 3630 C 7.2960 8.3360 14.0490 C.2 236 ILE236 0.2189 3631 O 7.5800 8.8290 12.9510 O.2 236 ILE236 -0.2778 3632 CB 9.4765 7.1033 14.4563 C.3 236 ILE236 -0.0201 3633 CG1 10.1301 5.7173 14.6377 C.3 236 ILE236 -0.0514 3634 CG2 9.9540 8.0688 15.5558 C.3 236 ILE236 -0.0605 3635 CD1 11.6521 5.7365 14.4556 C.3 236 ILE236 -0.0650 3636 H 7.6110 6.2180 12.4560 H 236 ILE236 0.1312 3637 HA 7.5649 6.7193 15.4270 H 236 ILE236 0.0560 3638 HB 9.7992 7.4962 13.4913 H 236 ILE236 0.0318 3639 HG11 9.7272 5.0062 13.9177 H 236 ILE236 0.0266 3640 HG12 9.8800 5.3142 15.6195 H 236 ILE236 0.0266 3641 HG21 11.0195 8.2790 15.4651 H 236 ILE236 0.0233 3642 HG22 9.7780 7.6486 16.5460 H 236 ILE236 0.0233 3643 HG23 9.4324 9.0237 15.5120 H 236 ILE236 0.0233 3644 HD11 12.0586 4.7269 14.5174 H 236 ILE236 0.0230 3645 HD12 12.1436 6.3351 15.2217 H 236 ILE236 0.0230 3646 HD13 11.9246 6.1429 13.4812 H 236 ILE236 0.0230 3647 N 6.4770 8.9000 14.9230 N.am 237 HIS237 -0.2453 3648 CA 5.8050 10.1920 14.6460 C.3 237 HIS237 0.0932 3649 C 6.7920 11.3550 14.5930 C.2 237 HIS237 0.2190 3650 O 7.7010 11.4540 15.4190 O.2 237 HIS237 -0.2778 3651 CB 4.6926 10.4372 15.6718 C.3 237 HIS237 0.0146 3652 CG 3.6381 9.3607 15.5237 C.ar 237 HIS237 0.0551 3653 ND1 2.5405 9.4883 14.7483 N.ar 237 HIS237 -0.2469 3654 CD2 3.6401 8.0637 16.0663 C.ar 237 HIS237 0.0047 3655 CE1 1.8984 8.3108 14.8139 C.ar 237 HIS237 0.0737 3656 NE2 2.5365 7.4318 15.6068 N.ar 237 HIS237 -0.2539 3657 H 6.3030 8.4320 15.8130 H 237 HIS237 0.1312 3658 HA 5.3500 10.1155 13.6609 H 237 HIS237 0.0561 3659 HB1 4.2246 11.4092 15.5077 H 237 HIS237 0.0348 3660 HB2 5.0876 10.4300 16.6870 H 237 HIS237 0.0348 3661 HD2 4.3987 7.6353 16.7039 H 237 HIS237 0.0764 3662 HE1 0.9831 8.0966 14.2816 H 237 HIS237 0.0963 3663 HE2 2.2685 6.5073 15.7949 H 237 HIS237 0.1339 3664 N 6.5650 12.2370 13.6290 N.am 238 MET238 -0.2456 3665 CA 7.3130 13.4960 13.4860 C.3 238 MET238 0.0885 3666 C 6.8300 14.4890 14.5330 C.2 238 MET238 0.2187 3667 O 5.7790 15.1010 14.3640 O.2 238 MET238 -0.2778 3668 CB 7.0922 14.0281 12.0582 C.3 238 MET238 -0.0199 3669 CG 7.8740 15.3111 11.7406 C.3 238 MET238 -0.0047 3670 SD 7.6159 15.8439 10.0363 S.3 238 MET238 -0.1641 3671 CE 8.8367 14.8012 9.2184 C.3 238 MET238 -0.0181 3672 H 5.8320 12.0320 12.9500 H 238 MET238 0.1312 3673 HA 8.3651 13.2759 13.6425 H 238 MET238 0.0557 3674 HB1 6.0289 14.1997 11.8888 H 238 MET238 0.0293 3675 HB2 7.3855 13.2562 11.3476 H 238 MET238 0.0293 3676 HG1 8.9378 15.1602 11.9004 H 238 MET238 0.0377 3677 HG2 7.5964 16.1241 12.4103 H 238 MET238 0.0377 3678 HE1 9.0438 15.1797 8.2178 H 238 MET238 0.0340 3679 HE2 8.4844 13.7714 9.1574 H 238 MET238 0.0340 3680 HE3 9.7724 14.8106 9.7760 H 238 MET238 0.0340 3681 N 7.6050 14.5940 15.6030 N.am 239 VAL239 -0.2454 3682 CA 7.3630 15.5420 16.7230 C.3 239 VAL239 0.0901 3683 C 8.7140 15.9780 17.2870 C.2 239 VAL239 0.2189 3684 O 9.7230 15.2580 17.1150 O.2 239 VAL239 -0.2778 3685 CB 6.4741 14.8927 17.8032 C.3 239 VAL239 -0.0227 3686 CG1 5.0180 14.7373 17.3357 C.3 239 VAL239 -0.0608 3687 CG2 7.0335 13.5489 18.2964 C.3 239 VAL239 -0.0608 3688 H 8.4210 13.9850 15.6620 H 239 VAL239 0.1312 3689 HA 6.8820 16.4279 16.3013 H 239 VAL239 0.0560 3690 HB 6.4595 15.5752 18.6493 H 239 VAL239 0.0315 3691 HG11 4.3762 14.4040 18.1509 H 239 VAL239 0.0233 3692 HG12 4.9286 14.0036 16.5342 H 239 VAL239 0.0233 3693 HG13 4.6184 15.6832 16.9678 H 239 VAL239 0.0233 3694 HG21 6.3958 13.1210 19.0663 H 239 VAL239 0.0233 3695 HG22 8.0336 13.6626 18.7149 H 239 VAL239 0.0233 3696 HG23 7.0895 12.8205 17.4879 H 239 VAL239 0.0233 3697 N 8.7380 17.1310 17.9410 N.am 240 ASN240 -0.2452 3698 CA 9.9670 17.6970 18.5430 C.3 240 ASN240 0.0957 3699 C 11.0380 17.8860 17.4640 C.2 240 ASN240 0.2191 3700 O 12.2230 17.6610 17.7090 O.2 240 ASN240 -0.2778 3701 CB 10.5142 16.8542 19.7083 C.3 240 ASN240 0.0446 3702 CG 9.5569 16.8578 20.9050 C.2 240 ASN240 0.2000 3703 OD1 8.7974 17.7914 21.1295 O.2 240 ASN240 -0.2797 3704 ND2 9.6454 15.7564 21.6646 N.am 240 ASN240 -0.2723 3705 H 7.8670 17.6540 18.0340 H 240 ASN240 0.1312 3706 HA 9.6831 18.6886 18.8794 H 240 ASN240 0.0562 3707 HB1 11.4628 17.2597 20.0619 H 240 ASN240 0.0375 3708 HB2 10.7053 15.8282 19.3933 H 240 ASN240 0.0375 3709 HD21 9.0757 15.6691 22.4801 H 240 ASN240 0.1266 3710 HD22 10.2891 15.0290 21.4268 H 240 ASN240 0.1266 3711 N 10.6240 18.3290 16.2920 N.am 241 ASN241 -0.2452 3712 CA 11.5440 18.5880 15.1630 C.3 241 ASN241 0.0957 3713 C 12.0420 20.0360 15.2110 C.2 241 ASN241 0.2191 3714 O 11.9050 20.7730 14.2390 O.2 241 ASN241 -0.2778 3715 CB 10.8701 18.2170 13.8254 C.3 241 ASN241 0.0446 3716 CG 9.5476 18.9639 13.5553 C.2 241 ASN241 0.2000 3717 OD1 8.6800 19.0864 14.4091 O.2 241 ASN241 -0.2797 3718 ND2 9.4459 19.4528 12.3108 N.am 241 ASN241 -0.2723 3719 H 9.6270 18.5000 16.1590 H 241 ASN241 0.1312 3720 HA 12.4064 17.9413 15.2964 H 241 ASN241 0.0562 3721 HB1 10.6462 17.1508 13.8177 H 241 ASN241 0.0375 3722 HB2 11.5585 18.3931 12.9981 H 241 ASN241 0.0375 3723 HD21 8.6190 19.9449 12.0425 H 241 ASN241 0.1266 3724 HD22 10.1872 19.3287 11.6521 H 241 ASN241 0.1266 3725 N 12.6030 20.4390 16.3440 N.am 242 PHE242 -0.2453 3726 CA 13.1120 21.8010 16.5840 C.3 242 PHE242 0.0917 3727 C 14.5190 21.7250 17.1520 C.2 242 PHE242 0.2190 3728 O 14.8650 20.7820 17.8750 O.2 242 PHE242 -0.2778 3729 CB 12.1614 22.6089 17.4935 C.3 242 PHE242 -0.0036 3730 CG 11.9497 22.0525 18.8788 C.ar 242 PHE242 -0.0454 3731 CD1 10.8845 21.2008 19.1488 C.ar 242 PHE242 -0.0585 3732 CD2 12.7641 22.4655 19.9294 C.ar 242 PHE242 -0.0585 3733 CE1 10.6392 20.7651 20.4466 C.ar 242 PHE242 -0.0615 3734 CE2 12.5297 22.0225 21.2243 C.ar 242 PHE242 -0.0615 3735 CZ 11.4652 21.1712 21.4847 C.ar 242 PHE242 -0.0617 3736 H 12.6880 19.7600 17.1000 H 242 PHE242 0.1312 3737 HA 13.1869 22.3058 15.6168 H 242 PHE242 0.0560 3738 HB1 11.1952 22.7141 17.0025 H 242 PHE242 0.0333 3739 HB2 12.5469 23.6180 17.6205 H 242 PHE242 0.0333 3740 HD1 10.2433 20.8859 18.3374 H 242 PHE242 0.0620 3741 HD2 13.5863 23.1414 19.7359 H 242 PHE242 0.0620 3742 HE1 9.8175 20.0953 20.6484 H 242 PHE242 0.0618 3743 HE2 13.1825 22.3415 22.0240 H 242 PHE242 0.0618 3744 HZ 11.2945 20.8144 22.4901 H 242 PHE242 0.0618 3745 N 15.2720 22.7630 16.8550 N.am 243 ARG243 -0.2456 3746 CA 16.5770 23.0350 17.4650 C.3 243 ARG243 0.0881 3747 C 16.3470 24.0280 18.5940 C.2 243 ARG243 0.2213 3748 O 15.6400 25.0270 18.4090 O.2 243 ARG243 -0.2776 3749 CB 17.4750 23.6598 16.3868 C.3 243 ARG243 -0.0258 3750 CG 18.9224 23.8816 16.8402 C.3 243 ARG243 -0.0154 3751 CD 19.7200 24.6716 15.8044 C.3 243 ARG243 0.1045 3752 NE 21.0960 24.8449 16.2730 N.pl3 243 ARG243 -0.4450 3753 CZ 22.0357 25.5027 15.6029 C.cat 243 ARG243 0.5062 3754 NH1 21.7663 26.1741 14.5187 N.pl3 243 ARG243 -0.4573 3755 NH2 23.2620 25.4803 16.0416 N.pl3 243 ARG243 -0.4573 3756 H 14.9250 23.4200 16.1560 H 243 ARG243 0.1312 3757 HA 16.9873 22.0882 17.8128 H 243 ARG243 0.0557 3758 HB1 17.0504 24.6135 16.0717 H 243 ARG243 0.0286 3759 HB2 17.4676 23.0257 15.4992 H 243 ARG243 0.0286 3760 HG1 19.3997 22.9205 17.0254 H 243 ARG243 0.0299 3761 HG2 18.9384 24.4304 17.7824 H 243 ARG243 0.0299 3762 HD1 19.2520 25.6395 15.6543 H 243 ARG243 0.0711 3763 HD2 19.7437 24.1655 14.8401 H 243 ARG243 0.0711 3764 HE 21.3709 24.4456 17.1458 H 243 ARG243 0.3153 3765 HH11 22.5054 26.5952 13.9911 H 243 ARG243 0.3114 3766 HH12 20.8187 26.2741 14.2241 H 243 ARG243 0.3114 3767 HH21 23.9838 25.9125 15.5023 H 243 ARG243 0.3114 3768 HH22 23.4852 25.0479 16.9135 H 243 ARG243 0.3114 3769 N 16.9370 23.8170 19.7730 N.am 244 PRO244 -0.2316 3770 CA 16.7470 24.7750 20.8710 C.3 244 PRO244 0.0909 3771 C 17.5830 26.0480 20.7270 C.2 244 PRO244 0.2216 3772 O 18.4650 26.1420 19.8530 O.2 244 PRO244 -0.2776 3773 CB 17.2205 23.9425 22.0729 C.3 244 PRO244 -0.0275 3774 CG 18.2676 22.9850 21.5041 C.3 244 PRO244 -0.0379 3775 CD 17.7756 22.6676 20.0938 C.3 244 PRO244 0.0071 3776 HA 15.6851 25.0168 20.9250 H 244 PRO244 0.0560 3777 HB1 16.3795 23.3631 22.4549 H 244 PRO244 0.0285 3778 HB2 17.6128 24.5288 22.9035 H 244 PRO244 0.0285 3779 HG1 18.4007 22.0916 22.1144 H 244 PRO244 0.0278 3780 HG2 19.2289 23.4972 21.4462 H 244 PRO244 0.0278 3781 HD1 18.5872 22.5846 19.3704 H 244 PRO244 0.0431 3782 HD2 17.1405 21.7800 20.0691 H 244 PRO244 0.0431 3783 N 17.3540 27.0550 21.5950 N.am 245 PRO245 -0.2316 3784 CA 18.0660 28.3190 21.4860 C.3 245 PRO245 0.0907 3785 C 19.5790 28.1410 21.6100 C.2 245 PRO245 0.2189 3786 O 20.0660 27.3570 22.4330 O.2 245 PRO245 -0.2778 3787 CB 17.5081 29.1395 22.6578 C.3 245 PRO245 -0.0276 3788 CG 16.1507 28.5163 22.9630 C.3 245 PRO245 -0.0379 3789 CD 16.3467 27.0328 22.6551 C.3 245 PRO245 0.0071 3790 HA 17.7982 28.7607 20.5260 H 245 PRO245 0.0559 3791 HB1 17.4396 30.1983 22.4248 H 245 PRO245 0.0285 3792 HB2 18.1383 29.0397 23.5434 H 245 PRO245 0.0285 3793 HG1 15.3996 28.9335 22.2895 H 245 PRO245 0.0278 3794 HG2 15.8189 28.6975 23.9853 H 245 PRO245 0.0278 3795 HD1 16.7662 26.4911 23.5029 H 245 PRO245 0.0431 3796 HD2 15.4206 26.5712 22.3138 H 245 PRO245 0.0431 3797 N 20.2810 28.9710 20.8620 N.am 246 GLN246 -0.2456 3798 CA 21.7450 28.9780 20.7610 C.3 246 GLN246 0.0885 3799 C 22.2860 30.2590 21.3840 C.2 246 GLN246 0.2214 3800 O 21.5750 31.2720 21.4960 O.2 246 GLN246 -0.2776 3801 CB 22.0918 28.8629 19.2630 C.3 246 GLN246 -0.0210 3802 CG 21.4605 27.6343 18.5760 C.3 246 GLN246 0.0225 3803 CD 22.0252 26.3139 19.1292 C.2 246 GLN246 0.1981 3804 OE1 23.0551 25.8257 18.6879 O.2 246 GLN246 -0.2798 3805 NE2 21.3033 25.7579 20.1089 N.am 246 GLN246 -0.2724 3806 H 19.7670 29.6600 20.3130 H 246 GLN246 0.1312 3807 HA 22.1047 28.1153 21.3187 H 246 GLN246 0.0557 3808 HB1 23.1719 28.8407 19.1199 H 246 GLN246 0.0289 3809 HB2 21.7411 29.7579 18.7465 H 246 GLN246 0.0289 3810 HG1 21.6739 27.6670 17.5086 H 246 GLN246 0.0356 3811 HG2 20.3732 27.6305 18.6638 H 246 GLN246 0.0356 3812 HE21 21.6050 24.9084 20.5398 H 246 GLN246 0.1266 3813 HE22 20.4555 26.1779 20.4356 H 246 GLN246 0.1266 3814 N 23.5930 30.2810 21.7200 N.am 247 PRO247 -0.2316 3815 CA 24.1810 31.4640 22.3470 C.3 247 PRO247 0.0907 3816 C 24.1370 32.7200 21.4640 C.2 247 PRO247 0.2189 3817 O 24.4640 32.6530 20.2960 O.2 247 PRO247 -0.2778 3818 CB 25.6400 31.0435 22.5970 C.3 247 PRO247 -0.0276 3819 CG 25.6382 29.5197 22.5488 C.3 247 PRO247 -0.0379 3820 CD 24.5312 29.1692 21.5590 C.3 247 PRO247 0.0071 3821 HA 23.6455 31.6272 23.2841 H 247 PRO247 0.0559 3822 HB1 26.0320 31.4320 23.5371 H 247 PRO247 0.0285 3823 HB2 26.2934 31.3972 21.7984 H 247 PRO247 0.0285 3824 HG1 25.3817 29.1261 23.5332 H 247 PRO247 0.0278 3825 HG2 26.6044 29.1018 22.2646 H 247 PRO247 0.0278 3826 HD1 24.8858 29.1807 20.5278 H 247 PRO247 0.0431 3827 HD2 24.0789 28.2095 21.8037 H 247 PRO247 0.0431 3828 N 23.7700 33.8410 22.0690 N.am 248 LEU248 -0.2456 3829 CA 23.6510 35.1010 21.3200 C.3 248 LEU248 0.0880 3830 C 25.0180 35.5990 20.8490 C.2 248 LEU248 0.2187 3831 O 25.1110 36.2570 19.7920 O.2 248 LEU248 -0.2778 3832 CB 22.9100 36.1442 22.1723 C.3 248 LEU248 -0.0266 3833 CG 22.4988 37.4222 21.4119 C.3 248 LEU248 -0.0449 3834 CD1 21.5402 37.1280 20.2464 C.3 248 LEU248 -0.0626 3835 CD2 21.8572 38.4274 22.3771 C.3 248 LEU248 -0.0626 3836 H 23.5670 33.8300 23.0690 H 248 LEU248 0.1312 3837 HA 23.0569 34.8655 20.4371 H 248 LEU248 0.0557 3838 HB1 23.5268 36.4131 23.0312 H 248 LEU248 0.0287 3839 HB2 22.0113 35.6845 22.5860 H 248 LEU248 0.0287 3840 HG 23.3941 37.8930 21.0039 H 248 LEU248 0.0296 3841 HD11 21.2226 38.0531 19.7639 H 248 LEU248 0.0232 3842 HD12 20.6450 36.6118 20.5942 H 248 LEU248 0.0232 3843 HD13 22.0072 36.5120 19.4791 H 248 LEU248 0.0232 3844 HD21 21.5598 39.3399 21.8603 H 248 LEU248 0.0232 3845 HD22 22.5505 38.7099 23.1697 H 248 LEU248 0.0232 3846 HD23 20.9653 38.0108 22.8462 H 248 LEU248 0.0232 3847 N 26.0680 35.4240 21.6650 N.am 249 LYS249 -0.2457 3848 CA 27.4600 35.8000 21.2830 C.3 249 LYS249 0.0878 3849 C 27.5410 37.2640 20.8780 C.2 249 LYS249 0.2185 3850 O 28.2540 37.6070 19.9230 O.2 249 LYS249 -0.2778 3851 CB 28.0540 34.7969 20.2859 C.3 249 LYS249 -0.0289 3852 CG 28.5893 33.5181 20.9702 C.3 249 LYS249 -0.0496 3853 CD 29.1799 32.5742 19.9186 C.3 249 LYS249 -0.0278 3854 CE 30.3498 31.6662 20.3307 C.3 249 LYS249 0.1103 3855 NZ 31.2266 31.3540 19.1954 N.4 249 LYS249 -0.0749 3856 H 25.9080 35.0160 22.5860 H 249 LYS249 0.1312 3857 HA 28.0296 35.7384 22.2104 H 249 LYS249 0.0557 3858 HB1 28.8900 35.2596 19.7577 H 249 LYS249 0.0285 3859 HB2 27.3214 34.5460 19.5179 H 249 LYS249 0.0285 3860 HG1 27.8070 33.0194 21.5402 H 249 LYS249 0.0266 3861 HG2 29.3648 33.8039 21.6817 H 249 LYS249 0.0266 3862 HD1 29.5666 33.2467 19.1720 H 249 LYS249 0.0282 3863 HD2 28.3907 31.9937 19.4400 H 249 LYS249 0.0282 3864 HE1 29.9784 30.7314 20.7525 H 249 LYS249 0.0559 3865 HE2 30.9677 32.1546 21.0858 H 249 LYS249 0.0559 3866 HZ1 31.9258 30.6235 19.4097 H 249 LYS249 0.2742 3867 HZ2 31.7376 32.2149 18.8803 H 249 LYS249 0.2742 3868 HZ3 30.6900 31.0941 18.3414 H 249 LYS249 0.2742 3869 N 26.8730 38.1290 21.6430 N.am 250 GLY250 -0.2485 3870 CA 27.0160 39.5870 21.4740 C.3 250 GLY250 0.0765 3871 C 26.2370 40.1540 20.2990 C.2 250 GLY250 0.2155 3872 O 26.3480 41.3600 20.0400 O.2 250 GLY250 -0.2781 3873 H 26.2460 37.7720 22.3640 H 250 GLY250 0.1309 3874 HA1 28.0751 39.8228 21.3586 H 250 GLY250 0.0521 3875 HA2 26.6595 40.0523 22.3924 H 250 GLY250 0.0521 3876 N 25.4400 39.3660 19.5830 N.am 251 ARG251 -0.2459 3877 CA 24.5850 39.9250 18.5180 C.3 251 ARG251 0.0879 3878 C 23.5280 40.8480 19.1210 C.2 251 ARG251 0.2187 3879 O 23.0680 40.5900 20.2440 O.2 251 ARG251 -0.2778 3880 CB 23.9442 38.7566 17.7503 C.3 251 ARG251 -0.0258 3881 CG 24.9657 37.9906 16.8926 C.3 251 ARG251 -0.0154 3882 CD 24.3668 36.7616 16.1965 C.3 251 ARG251 0.1045 3883 NE 24.3444 35.6249 17.1156 N.pl3 251 ARG251 -0.4450 3884 CZ 23.6457 34.5111 16.9296 C.cat 251 ARG251 0.5062 3885 NH1 22.8733 34.3582 15.8891 N.pl3 251 ARG251 -0.4573 3886 NH2 23.7266 33.5361 17.7887 N.pl3 251 ARG251 -0.4573 3887 H 25.4200 38.3640 19.7720 H 251 ARG251 0.1312 3888 HA 25.2294 40.5116 17.8600 H 251 ARG251 0.0557 3889 HB1 23.1502 39.1274 17.1000 H 251 ARG251 0.0286 3890 HB2 23.4698 38.0778 18.4587 H 251 ARG251 0.0286 3891 HG1 25.8254 37.6865 17.4922 H 251 ARG251 0.0299 3892 HG2 25.3558 38.6707 16.1346 H 251 ARG251 0.0299 3893 HD1 24.9850 36.4695 15.3440 H 251 ARG251 0.0711 3894 HD2 23.3554 36.9741 15.8449 H 251 ARG251 0.0711 3895 HE 24.9171 35.6732 17.9362 H 251 ARG251 0.3153 3896 HH11 22.3927 33.4890 15.7699 H 251 ARG251 0.3114 3897 HH12 22.7751 35.0965 15.2251 H 251 ARG251 0.3114 3898 HH21 23.1899 32.7062 17.6424 H 251 ARG251 0.3114 3899 HH22 24.3221 33.6018 18.5893 H 251 ARG251 0.3114 3900 N 23.1290 41.8170 18.3100 N.am 252 VAL252 -0.2454 3901 CA 22.0820 42.8380 18.5770 C.3 252 VAL252 0.0901 3902 C 20.7510 42.3170 18.0260 C.2 252 VAL252 0.2189 3903 O 20.7130 41.9310 16.8030 O.2 252 VAL252 -0.2778 3904 CB 22.4644 44.1912 17.9438 C.3 252 VAL252 -0.0227 3905 CG1 21.3869 45.2623 18.1931 C.3 252 VAL252 -0.0608 3906 CG2 23.8242 44.6821 18.4640 C.3 252 VAL252 -0.0608 3907 H 23.5910 41.8680 17.4020 H 252 VAL252 0.1312 3908 HA 22.0006 42.9395 19.6615 H 252 VAL252 0.0560 3909 HB 22.5570 44.0512 16.8657 H 252 VAL252 0.0315 3910 HG11 21.6778 46.2196 17.7613 H 252 VAL252 0.0233 3911 HG12 21.2301 45.4127 19.2617 H 252 VAL252 0.0233 3912 HG13 20.4281 44.9836 17.7556 H 252 VAL252 0.0233 3913 HG21 24.0905 45.6426 18.0228 H 252 VAL252 0.0233 3914 HG22 24.6261 43.9833 18.2243 H 252 VAL252 0.0233 3915 HG23 23.8081 44.8075 19.5472 H 252 VAL252 0.0233 3916 N 19.7500 42.1070 18.8940 N.am 253 VAL253 -0.2454 3917 CA 18.3560 41.8770 18.4190 C.3 253 VAL253 0.0901 3918 C 17.6800 43.2360 18.3150 C.2 253 VAL253 0.2189 3919 O 17.6130 43.9670 19.2990 O.2 253 VAL253 -0.2778 3920 CB 17.5991 40.9287 19.3704 C.3 253 VAL253 -0.0227 3921 CG1 16.1635 40.6713 18.8795 C.3 253 VAL253 -0.0608 3922 CG2 18.3432 39.5939 19.5386 C.3 253 VAL253 -0.0608 3923 H 19.9460 42.1050 19.8950 H 253 VAL253 0.1312 3924 HA 18.4037 41.4251 17.4265 H 253 VAL253 0.0560 3925 HB 17.5387 41.3968 20.3549 H 253 VAL253 0.0315 3926 HG11 15.6483 39.9674 19.5317 H 253 VAL253 0.0233 3927 HG12 16.1605 40.2523 17.8725 H 253 VAL253 0.0233 3928 HG13 15.5719 41.5873 18.8616 H 253 VAL253 0.0233 3929 HG21 17.7923 38.9225 20.1980 H 253 VAL253 0.0233 3930 HG22 19.3317 39.7341 19.9767 H 253 VAL253 0.0233 3931 HG23 18.4703 39.0885 18.5810 H 253 VAL253 0.0233 3932 N 17.2280 43.5660 17.1170 N.am 254 LYS254 -0.2456 3933 CA 16.4880 44.8070 16.8570 C.3 254 LYS254 0.0878 3934 C 14.9980 44.5250 16.8840 C.2 254 LYS254 0.2187 3935 O 14.5630 43.4440 16.4870 O.2 254 LYS254 -0.2778 3936 CB 16.9229 45.3990 15.5141 C.3 254 LYS254 -0.0289 3937 CG 18.3481 45.9587 15.5817 C.3 254 LYS254 -0.0496 3938 CD 18.7250 46.7534 14.3232 C.3 254 LYS254 -0.0278 3939 CE 19.8765 47.7339 14.5750 C.3 254 LYS254 0.1103 3940 NZ 19.5194 48.7438 15.5752 N.4 254 LYS254 -0.0749 3941 H 17.4010 42.9300 16.3390 H 254 LYS254 0.1312 3942 HA 16.7090 45.5093 17.6614 H 254 LYS254 0.0557 3943 HB1 16.2371 46.1996 15.2340 H 254 LYS254 0.0285 3944 HB2 16.8519 44.6451 14.7328 H 254 LYS254 0.0285 3945 HG1 19.0642 45.1507 15.7396 H 254 LYS254 0.0266 3946 HG2 18.4191 46.5958 16.4629 H 254 LYS254 0.0266 3947 HD1 17.8608 47.3095 13.9573 H 254 LYS254 0.0282 3948 HD2 18.9882 46.0599 13.5232 H 254 LYS254 0.0282 3949 HE1 20.1359 48.2498 13.6479 H 254 LYS254 0.0559 3950 HE2 20.7691 47.2054 14.9170 H 254 LYS254 0.0559 3951 HZ1 20.2727 49.4549 15.6647 H 254 LYS254 0.2742 3952 HZ2 19.3565 48.2856 16.4949 H 254 LYS254 0.2742 3953 HZ3 18.6243 49.2049 15.3027 H 254 LYS254 0.2742 3954 N 14.2210 45.4970 17.3110 N.am 255 ALA255 -0.2459 3955 CA 12.7460 45.4250 17.3350 C.3 255 ALA255 0.0850 3956 C 12.1880 46.5950 16.5360 C.2 255 ALA255 0.2185 3957 O 12.7470 47.7010 16.5970 O.2 255 ALA255 -0.2778 3958 CB 12.2638 45.5052 18.7884 C.3 255 ALA255 -0.0411 3959 H 14.6640 46.3520 17.6460 H 255 ALA255 0.1312 3960 HA 12.4197 44.4916 16.8748 H 255 ALA255 0.0554 3961 HB1 11.1757 45.4631 18.8496 H 255 ALA255 0.0249 3962 HB2 12.5911 46.4292 19.2671 H 255 ALA255 0.0249 3963 HB3 12.6570 44.6754 19.3742 H 255 ALA255 0.0249 3964 N 11.1110 46.3370 15.7910 N.am 256 SER256 -0.2436 3965 CA 10.3820 47.3660 15.0310 C.3 256 SER256 0.1109 3966 C 9.4450 48.1530 15.9480 C.2 256 SER256 0.2209 3967 O 8.7910 49.0440 15.4510 O.2 256 SER256 -0.2777 3968 CB 9.7674 46.8350 13.7414 C.3 256 SER256 0.0681 3969 OG 8.9278 45.7308 14.0091 O.3 256 SER256 -0.3930 3970 H 10.7750 45.3750 15.7460 H 256 SER256 0.1312 3971 HA 11.1342 48.0933 14.7204 H 256 SER256 0.0580 3972 HB1 10.6000 46.5635 13.0813 H 256 SER256 0.0577 3973 HB2 9.1916 47.6173 13.2378 H 256 SER256 0.0577 3974 HG 8.8106 45.1995 13.2252 H 256 SER256 0.2095 3975 N 9.3470 47.8010 17.2240 N.am 257 PHE257 -0.2453 3976 CA 8.3180 48.3300 18.1460 C.3 257 PHE257 0.0917 3977 C 8.9570 48.4760 19.5190 C.2 257 PHE257 0.2190 3978 O 9.9740 47.8380 19.7900 O.2 257 PHE257 -0.2778 3979 CB 7.1377 47.3372 18.1750 C.3 257 PHE257 -0.0036 3980 CG 7.5179 46.0015 18.7693 C.ar 257 PHE257 -0.0454 3981 CD1 8.1646 45.0341 18.0018 C.ar 257 PHE257 -0.0585 3982 CD2 7.2758 45.7419 20.1160 C.ar 257 PHE257 -0.0585 3983 CE1 8.5747 43.8371 18.5737 C.ar 257 PHE257 -0.0615 3984 CE2 7.6915 44.5502 20.6926 C.ar 257 PHE257 -0.0615 3985 CZ 8.3398 43.5988 19.9204 C.ar 257 PHE257 -0.0617 3986 H 10.0200 47.1270 17.5900 H 257 PHE257 0.1312 3987 HA 8.0035 49.3113 17.7888 H 257 PHE257 0.0560 3988 HB1 6.7672 47.1797 17.1614 H 257 PHE257 0.0333 3989 HB2 6.3049 47.7575 18.7398 H 257 PHE257 0.0333 3990 HD1 8.3700 45.2157 16.9557 H 257 PHE257 0.0620 3991 HD2 6.7904 46.4863 20.7292 H 257 PHE257 0.0620 3992 HE1 9.0872 43.0973 17.9746 H 257 PHE257 0.0618 3993 HE2 7.5285 44.3664 21.7443 H 257 PHE257 0.0618 3994 HZ 8.6657 42.6767 20.3733 H 257 PHE257 0.0618 3995 N 8.3090 49.2660 20.3680 N.am 258 ARG258 -0.2456 3996 CA 8.6680 49.3880 21.8020 C.3 258 ARG258 0.0879 3997 C 7.7860 48.4580 22.6250 C.2 258 ARG258 0.2186 3998 O 6.5500 48.4840 22.4520 O.2 258 ARG258 -0.2778 3999 CB 8.3939 50.8326 22.2657 C.3 258 ARG258 -0.0258 4000 CG 9.0825 51.9315 21.4386 C.3 258 ARG258 -0.0154 4001 CD 8.6236 53.3271 21.9000 C.3 258 ARG258 0.1045 4002 NE 9.1547 54.3992 21.0528 N.pl3 258 ARG258 -0.4450 4003 CZ 8.7042 54.6885 19.8325 C.cat 258 ARG258 0.5062 4004 NH1 7.7547 53.9903 19.2706 N.pl3 258 ARG258 -0.4573 4005 NH2 9.2204 55.6910 19.1747 N.pl3 258 ARG258 -0.4573 4006 H 7.5260 49.8160 20.0160 H 258 ARG258 0.1312 4007 HA 9.7205 49.1241 21.9284 H 258 ARG258 0.0557 4008 HB1 8.6872 50.9374 23.3119 H 258 ARG258 0.0286 4009 HB2 7.3179 51.0151 22.2374 H 258 ARG258 0.0286 4010 HG1 8.8516 51.8012 20.3822 H 258 ARG258 0.0299 4011 HG2 10.1660 51.8430 21.5275 H 258 ARG258 0.0299 4012 HD1 8.9724 53.5219 22.9173 H 258 ARG258 0.0711 4013 HD2 7.5337 53.4117 21.9223 H 258 ARG258 0.0711 4014 HE 9.9030 54.9593 21.4057 H 258 ARG258 0.3153 4015 HH11 7.4667 54.1997 18.3383 H 258 ARG258 0.3114 4016 HH12 7.3256 53.2475 19.7752 H 258 ARG258 0.3114 4017 HH21 8.9243 55.8679 18.2376 H 258 ARG258 0.3114 4018 HH22 9.9082 56.2759 19.5966 H 258 ARG258 0.3114 4019 N 8.4120 47.6060 23.4380 N.am 259 ALA259 -0.2476 4020 CA 7.7400 46.5260 24.1950 C.3 259 ALA259 0.0671 4021 C 6.8690 47.1310 25.2980 C.2 259 ALA259 0.1372 4022 O 7.2900 48.1090 25.9180 O.2 259 ALA259 -0.2994 4023 CB 8.7552 45.5191 24.7479 C.3 259 ALA259 -0.0427 4024 H 9.4210 47.7050 23.5450 H 259 ALA259 0.1311 4025 HA 7.0812 46.0247 23.4852 H 259 ALA259 0.0537 4026 H 5.8820 46.6990 25.5340 H 259 ALA259 0.1043 4027 HB1 8.2624 44.6979 25.2696 H 259 ALA259 0.0249 4028 HB2 9.4434 45.9946 25.4479 H 259 ALA259 0.0249 4029 HB3 9.3514 45.0871 23.9436 H 259 ALA259 0.0249 4030 ZN 12.7240 26.0400 9.9110 Zn 260 ZN260 2.0000 @BOND 1 1 2 1 2 1 5 1 3 1 6 1 4 1 7 1 5 2 3 1 6 2 8 1 7 2 9 1 8 3 4 2 9 3 10 am 10 10 11 1 11 10 24 1 12 11 14 1 13 11 12 1 14 11 25 1 15 12 13 2 16 12 34 am 17 14 15 1 18 14 26 1 19 14 27 1 20 15 16 ar 21 15 17 ar 22 16 18 ar 23 16 28 1 24 17 19 ar 25 17 20 ar 26 18 19 ar 27 18 29 1 28 19 21 ar 29 20 22 ar 30 20 30 1 31 21 23 ar 32 21 31 1 33 22 23 ar 34 22 32 1 35 23 33 1 36 34 35 1 37 34 38 1 38 35 36 1 39 35 39 1 40 35 40 1 41 36 37 2 42 36 41 am 43 41 42 1 44 41 53 1 45 42 45 1 46 42 43 1 47 42 54 1 48 43 44 2 49 43 62 am 50 45 46 1 51 45 55 1 52 45 56 1 53 46 47 ar 54 46 48 ar 55 47 49 ar 56 47 57 1 57 48 50 ar 58 48 58 1 59 49 51 ar 60 49 59 1 61 50 51 ar 62 50 60 1 63 51 52 1 64 52 61 1 65 62 63 1 66 62 66 1 67 63 64 1 68 63 67 1 69 63 68 1 70 64 65 2 71 64 69 am 72 69 70 1 73 69 78 1 74 70 73 1 75 70 71 1 76 70 79 1 77 71 72 2 78 71 86 am 79 73 74 1 80 73 80 1 81 73 81 1 82 74 75 1 83 74 82 1 84 74 83 1 85 75 76 2 86 75 77 am 87 77 84 1 88 77 85 1 89 86 87 1 90 86 94 1 91 87 90 1 92 87 88 1 93 87 95 1 94 88 89 2 95 88 98 am 96 90 91 1 97 90 96 1 98 90 97 1 99 91 92 ar 100 91 93 ar 101 98 99 1 102 98 106 1 103 99 102 1 104 99 100 1 105 99 107 1 106 100 101 2 107 100 110 am 108 102 103 1 109 102 108 1 110 102 109 1 111 103 104 ar 112 103 105 ar 113 110 111 1 114 110 114 1 115 111 112 1 116 111 115 1 117 111 116 1 118 112 113 2 119 112 117 am 120 117 123 1 121 117 118 1 122 118 121 1 123 118 119 1 124 118 124 1 125 119 120 2 126 119 131 am 127 121 122 1 128 121 125 1 129 121 126 1 130 122 123 1 131 122 127 1 132 122 128 1 133 123 129 1 134 123 130 1 135 131 132 1 136 131 137 1 137 132 135 1 138 132 133 1 139 132 138 1 140 133 134 2 141 133 142 am 142 135 136 1 143 135 139 1 144 135 140 1 145 136 141 1 146 142 143 1 147 142 152 1 148 143 146 1 149 143 144 1 150 143 153 1 151 144 145 2 152 144 159 am 153 146 147 1 154 146 154 1 155 146 155 1 156 147 148 ar 157 147 149 ar 158 148 150 ar 159 149 151 ar 160 149 156 1 161 150 151 ar 162 150 157 1 163 151 158 1 164 159 160 1 165 159 173 1 166 160 163 1 167 160 161 1 168 160 174 1 169 161 162 2 170 161 183 am 171 163 164 1 172 163 175 1 173 163 176 1 174 164 165 ar 175 164 166 ar 176 165 167 ar 177 165 177 1 178 166 168 ar 179 166 169 ar 180 167 168 ar 181 167 178 1 182 168 170 ar 183 169 171 ar 184 169 179 1 185 170 172 ar 186 170 180 1 187 171 172 ar 188 171 181 1 189 172 182 1 190 183 184 1 191 183 193 1 192 184 187 1 193 184 185 1 194 184 194 1 195 185 186 2 196 185 200 am 197 187 188 1 198 187 195 1 199 187 196 1 200 188 189 ar 201 188 190 ar 202 189 191 ar 203 190 192 ar 204 190 197 1 205 191 192 ar 206 191 198 1 207 192 199 1 208 200 201 1 209 200 209 1 210 201 204 1 211 201 202 1 212 201 210 1 213 202 203 2 214 202 222 am 215 204 205 1 216 204 211 1 217 204 212 1 218 205 206 1 219 205 213 1 220 205 214 1 221 206 207 1 222 206 215 1 223 206 216 1 224 207 208 1 225 207 217 1 226 207 218 1 227 208 219 1 228 208 220 1 229 208 221 1 230 222 223 1 231 222 230 1 232 223 226 1 233 223 224 1 234 223 231 1 235 224 225 2 236 224 241 am 237 226 227 1 238 226 232 1 239 226 233 1 240 227 228 1 241 227 229 1 242 227 234 1 243 228 235 1 244 228 236 1 245 228 237 1 246 229 238 1 247 229 239 1 248 229 240 1 249 241 242 1 250 241 253 1 251 242 245 1 252 242 243 1 253 242 254 1 254 243 244 2 255 243 262 am 256 245 246 1 257 245 255 1 258 245 256 1 259 246 247 ar 260 246 248 ar 261 247 249 ar 262 247 257 1 263 248 250 ar 264 248 258 1 265 249 251 ar 266 249 259 1 267 250 251 ar 268 250 260 1 269 251 252 1 270 252 261 1 271 262 268 1 272 262 263 1 273 263 266 1 274 263 264 1 275 263 269 1 276 264 265 2 277 264 276 am 278 266 267 1 279 266 270 1 280 266 271 1 281 267 268 1 282 267 272 1 283 267 273 1 284 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3436 3445 1 3500 3436 3446 1 3501 3437 3438 1 3502 3437 3447 1 3503 3437 3448 1 3504 3438 3439 1 3505 3438 3449 1 3506 3438 3450 1 3507 3439 3440 ar 3508 3439 3451 1 3509 3440 3441 ar 3510 3440 3442 ar 3511 3441 3452 1 3512 3441 3453 1 3513 3442 3454 1 3514 3442 3455 1 3515 3456 3457 1 3516 3456 3462 1 3517 3457 3460 1 3518 3457 3458 1 3519 3457 3463 1 3520 3458 3459 2 3521 3458 3467 am 3522 3460 3461 1 3523 3460 3464 1 3524 3460 3465 1 3525 3461 3466 1 3526 3467 3468 1 3527 3467 3475 1 3528 3468 3471 1 3529 3468 3469 1 3530 3468 3476 1 3531 3469 3470 2 3532 3469 3486 am 3533 3471 3472 1 3534 3471 3477 1 3535 3471 3478 1 3536 3472 3473 1 3537 3472 3474 1 3538 3472 3479 1 3539 3473 3480 1 3540 3473 3481 1 3541 3473 3482 1 3542 3474 3483 1 3543 3474 3484 1 3544 3474 3485 1 3545 3486 3487 1 3546 3486 3494 1 3547 3487 3490 1 3548 3487 3488 1 3549 3487 3495 1 3550 3488 3489 2 3551 3488 3505 am 3552 3490 3491 1 3553 3490 3496 1 3554 3490 3497 1 3555 3491 3492 1 3556 3491 3493 1 3557 3491 3498 1 3558 3492 3499 1 3559 3492 3500 1 3560 3492 3501 1 3561 3493 3502 1 3562 3493 3503 1 3563 3493 3504 1 3564 3505 3506 1 3565 3505 3516 1 3566 3506 3509 1 3567 3506 3507 1 3568 3506 3517 1 3569 3507 3508 2 3570 3507 3525 am 3571 3509 3510 1 3572 3509 3518 1 3573 3509 3519 1 3574 3510 3511 ar 3575 3510 3512 ar 3576 3511 3513 ar 3577 3511 3520 1 3578 3512 3514 ar 3579 3512 3521 1 3580 3513 3515 ar 3581 3513 3522 1 3582 3514 3515 ar 3583 3514 3523 1 3584 3515 3524 1 3585 3525 3526 1 3586 3525 3532 1 3587 3526 3529 1 3588 3526 3527 1 3589 3526 3533 1 3590 3527 3528 2 3591 3527 3539 am 3592 3529 3531 1 3593 3529 3530 1 3594 3529 3534 1 3595 3530 3535 1 3596 3531 3536 1 3597 3531 3537 1 3598 3531 3538 1 3599 3539 3540 1 3600 3539 3545 1 3601 3540 3543 1 3602 3540 3541 1 3603 3540 3546 1 3604 3541 3542 2 3605 3541 3550 am 3606 3543 3544 1 3607 3543 3547 1 3608 3543 3548 1 3609 3544 3549 1 3610 3550 3551 1 3611 3550 3559 1 3612 3551 3554 1 3613 3551 3552 1 3614 3551 3560 1 3615 3552 3553 2 3616 3552 3565 am 3617 3554 3555 1 3618 3554 3561 1 3619 3554 3562 1 3620 3555 3556 1 3621 3555 3563 1 3622 3555 3564 1 3623 3556 3557 ar 3624 3556 3558 ar 3625 3565 3566 1 3626 3565 3573 1 3627 3566 3569 1 3628 3566 3567 1 3629 3566 3574 1 3630 3567 3568 2 3631 3567 3577 am 3632 3569 3570 1 3633 3569 3575 1 3634 3569 3576 1 3635 3570 3571 ar 3636 3570 3572 ar 3637 3577 3578 1 3638 3577 3585 1 3639 3578 3581 1 3640 3578 3579 1 3641 3578 3586 1 3642 3579 3580 2 3643 3579 3589 am 3644 3581 3582 1 3645 3581 3587 1 3646 3581 3588 1 3647 3582 3583 ar 3648 3582 3584 ar 3649 3589 3590 1 3650 3589 3598 1 3651 3590 3593 1 3652 3590 3591 1 3653 3590 3599 1 3654 3591 3592 2 3655 3591 3604 am 3656 3593 3594 1 3657 3593 3600 1 3658 3593 3601 1 3659 3594 3595 1 3660 3594 3602 1 3661 3594 3603 1 3662 3595 3596 ar 3663 3595 3597 ar 3664 3604 3605 1 3665 3604 3615 1 3666 3605 3608 1 3667 3605 3606 1 3668 3605 3616 1 3669 3606 3607 2 3670 3606 3628 am 3671 3608 3609 1 3672 3608 3617 1 3673 3608 3618 1 3674 3609 3610 1 3675 3609 3619 1 3676 3609 3620 1 3677 3610 3611 1 3678 3610 3621 1 3679 3610 3622 1 3680 3611 3612 ar 3681 3611 3623 1 3682 3612 3613 ar 3683 3612 3614 ar 3684 3613 3624 1 3685 3613 3625 1 3686 3614 3626 1 3687 3614 3627 1 3688 3628 3629 1 3689 3628 3636 1 3690 3629 3632 1 3691 3629 3630 1 3692 3629 3637 1 3693 3630 3631 2 3694 3630 3647 am 3695 3632 3634 1 3696 3632 3633 1 3697 3632 3638 1 3698 3633 3635 1 3699 3633 3639 1 3700 3633 3640 1 3701 3634 3641 1 3702 3634 3642 1 3703 3634 3643 1 3704 3635 3644 1 3705 3635 3645 1 3706 3635 3646 1 3707 3647 3648 1 3708 3647 3657 1 3709 3648 3651 1 3710 3648 3649 1 3711 3648 3658 1 3712 3649 3650 2 3713 3649 3664 am 3714 3651 3652 1 3715 3651 3659 1 3716 3651 3660 1 3717 3652 3653 ar 3718 3652 3654 ar 3719 3653 3655 ar 3720 3654 3656 ar 3721 3654 3661 1 3722 3655 3656 ar 3723 3655 3662 1 3724 3656 3663 1 3725 3664 3665 1 3726 3664 3672 1 3727 3665 3668 1 3728 3665 3666 1 3729 3665 3673 1 3730 3666 3667 2 3731 3666 3681 am 3732 3668 3669 1 3733 3668 3674 1 3734 3668 3675 1 3735 3669 3670 1 3736 3669 3676 1 3737 3669 3677 1 3738 3670 3671 1 3739 3671 3678 1 3740 3671 3679 1 3741 3671 3680 1 3742 3681 3682 1 3743 3681 3688 1 3744 3682 3685 1 3745 3682 3683 1 3746 3682 3689 1 3747 3683 3684 2 3748 3683 3697 am 3749 3685 3686 1 3750 3685 3687 1 3751 3685 3690 1 3752 3686 3691 1 3753 3686 3692 1 3754 3686 3693 1 3755 3687 3694 1 3756 3687 3695 1 3757 3687 3696 1 3758 3697 3698 1 3759 3697 3705 1 3760 3698 3701 1 3761 3698 3699 1 3762 3698 3706 1 3763 3699 3700 2 3764 3699 3711 am 3765 3701 3702 1 3766 3701 3707 1 3767 3701 3708 1 3768 3702 3703 2 3769 3702 3704 am 3770 3704 3709 1 3771 3704 3710 1 3772 3711 3712 1 3773 3711 3719 1 3774 3712 3715 1 3775 3712 3713 1 3776 3712 3720 1 3777 3713 3714 2 3778 3713 3725 am 3779 3715 3716 1 3780 3715 3721 1 3781 3715 3722 1 3782 3716 3717 2 3783 3716 3718 am 3784 3718 3723 1 3785 3718 3724 1 3786 3725 3726 1 3787 3725 3736 1 3788 3726 3729 1 3789 3726 3727 1 3790 3726 3737 1 3791 3727 3728 2 3792 3727 3745 am 3793 3729 3730 1 3794 3729 3738 1 3795 3729 3739 1 3796 3730 3731 ar 3797 3730 3732 ar 3798 3731 3733 ar 3799 3731 3740 1 3800 3732 3734 ar 3801 3732 3741 1 3802 3733 3735 ar 3803 3733 3742 1 3804 3734 3735 ar 3805 3734 3743 1 3806 3735 3744 1 3807 3745 3746 1 3808 3745 3756 1 3809 3746 3749 1 3810 3746 3747 1 3811 3746 3757 1 3812 3747 3748 2 3813 3747 3769 am 3814 3749 3750 1 3815 3749 3758 1 3816 3749 3759 1 3817 3750 3751 1 3818 3750 3760 1 3819 3750 3761 1 3820 3751 3752 1 3821 3751 3762 1 3822 3751 3763 1 3823 3752 3753 ar 3824 3752 3764 1 3825 3753 3754 ar 3826 3753 3755 ar 3827 3754 3765 1 3828 3754 3766 1 3829 3755 3767 1 3830 3755 3768 1 3831 3769 3775 1 3832 3769 3770 1 3833 3770 3773 1 3834 3770 3771 1 3835 3770 3776 1 3836 3771 3772 2 3837 3771 3783 am 3838 3773 3774 1 3839 3773 3777 1 3840 3773 3778 1 3841 3774 3775 1 3842 3774 3779 1 3843 3774 3780 1 3844 3775 3781 1 3845 3775 3782 1 3846 3783 3789 1 3847 3783 3784 1 3848 3784 3787 1 3849 3784 3785 1 3850 3784 3790 1 3851 3785 3786 2 3852 3785 3797 am 3853 3787 3788 1 3854 3787 3791 1 3855 3787 3792 1 3856 3788 3789 1 3857 3788 3793 1 3858 3788 3794 1 3859 3789 3795 1 3860 3789 3796 1 3861 3797 3798 1 3862 3797 3806 1 3863 3798 3801 1 3864 3798 3799 1 3865 3798 3807 1 3866 3799 3800 2 3867 3799 3814 am 3868 3801 3802 1 3869 3801 3808 1 3870 3801 3809 1 3871 3802 3803 1 3872 3802 3810 1 3873 3802 3811 1 3874 3803 3804 2 3875 3803 3805 am 3876 3805 3812 1 3877 3805 3813 1 3878 3814 3820 1 3879 3814 3815 1 3880 3815 3818 1 3881 3815 3816 1 3882 3815 3821 1 3883 3816 3817 2 3884 3816 3828 am 3885 3818 3819 1 3886 3818 3822 1 3887 3818 3823 1 3888 3819 3820 1 3889 3819 3824 1 3890 3819 3825 1 3891 3820 3826 1 3892 3820 3827 1 3893 3828 3829 1 3894 3828 3836 1 3895 3829 3832 1 3896 3829 3830 1 3897 3829 3837 1 3898 3830 3831 2 3899 3830 3847 am 3900 3832 3833 1 3901 3832 3838 1 3902 3832 3839 1 3903 3833 3834 1 3904 3833 3835 1 3905 3833 3840 1 3906 3834 3841 1 3907 3834 3842 1 3908 3834 3843 1 3909 3835 3844 1 3910 3835 3845 1 3911 3835 3846 1 3912 3847 3848 1 3913 3847 3856 1 3914 3848 3851 1 3915 3848 3849 1 3916 3848 3857 1 3917 3849 3850 2 3918 3849 3869 am 3919 3851 3852 1 3920 3851 3858 1 3921 3851 3859 1 3922 3852 3853 1 3923 3852 3860 1 3924 3852 3861 1 3925 3853 3854 1 3926 3853 3862 1 3927 3853 3863 1 3928 3854 3855 1 3929 3854 3864 1 3930 3854 3865 1 3931 3855 3866 1 3932 3855 3867 1 3933 3855 3868 1 3934 3869 3870 1 3935 3869 3873 1 3936 3870 3871 1 3937 3870 3874 1 3938 3870 3875 1 3939 3871 3872 2 3940 3871 3876 am 3941 3876 3877 1 3942 3876 3887 1 3943 3877 3880 1 3944 3877 3878 1 3945 3877 3888 1 3946 3878 3879 2 3947 3878 3900 am 3948 3880 3881 1 3949 3880 3889 1 3950 3880 3890 1 3951 3881 3882 1 3952 3881 3891 1 3953 3881 3892 1 3954 3882 3883 1 3955 3882 3893 1 3956 3882 3894 1 3957 3883 3884 ar 3958 3883 3895 1 3959 3884 3885 ar 3960 3884 3886 ar 3961 3885 3896 1 3962 3885 3897 1 3963 3886 3898 1 3964 3886 3899 1 3965 3900 3901 1 3966 3900 3907 1 3967 3901 3904 1 3968 3901 3902 1 3969 3901 3908 1 3970 3902 3903 2 3971 3902 3916 am 3972 3904 3905 1 3973 3904 3906 1 3974 3904 3909 1 3975 3905 3910 1 3976 3905 3911 1 3977 3905 3912 1 3978 3906 3913 1 3979 3906 3914 1 3980 3906 3915 1 3981 3916 3917 1 3982 3916 3923 1 3983 3917 3920 1 3984 3917 3918 1 3985 3917 3924 1 3986 3918 3919 2 3987 3918 3932 am 3988 3920 3921 1 3989 3920 3922 1 3990 3920 3925 1 3991 3921 3926 1 3992 3921 3927 1 3993 3921 3928 1 3994 3922 3929 1 3995 3922 3930 1 3996 3922 3931 1 3997 3932 3933 1 3998 3932 3941 1 3999 3933 3936 1 4000 3933 3934 1 4001 3933 3942 1 4002 3934 3935 2 4003 3934 3954 am 4004 3936 3937 1 4005 3936 3943 1 4006 3936 3944 1 4007 3937 3938 1 4008 3937 3945 1 4009 3937 3946 1 4010 3938 3939 1 4011 3938 3947 1 4012 3938 3948 1 4013 3939 3940 1 4014 3939 3949 1 4015 3939 3950 1 4016 3940 3951 1 4017 3940 3952 1 4018 3940 3953 1 4019 3954 3955 1 4020 3954 3959 1 4021 3955 3958 1 4022 3955 3956 1 4023 3955 3960 1 4024 3956 3957 2 4025 3956 3964 am 4026 3958 3961 1 4027 3958 3962 1 4028 3958 3963 1 4029 3964 3965 1 4030 3964 3970 1 4031 3965 3968 1 4032 3965 3966 1 4033 3965 3971 1 4034 3966 3967 2 4035 3966 3975 am 4036 3968 3969 1 4037 3968 3972 1 4038 3968 3973 1 4039 3969 3974 1 4040 3975 3976 1 4041 3975 3986 1 4042 3976 3979 1 4043 3976 3977 1 4044 3976 3987 1 4045 3977 3978 2 4046 3977 3995 am 4047 3979 3980 1 4048 3979 3988 1 4049 3979 3989 1 4050 3980 3981 ar 4051 3980 3982 ar 4052 3981 3983 ar 4053 3981 3990 1 4054 3982 3984 ar 4055 3982 3991 1 4056 3983 3985 ar 4057 3983 3992 1 4058 3984 3985 ar 4059 3984 3993 1 4060 3985 3994 1 4061 3995 3996 1 4062 3995 4006 1 4063 3996 3999 1 4064 3996 3997 1 4065 3996 4007 1 4066 3997 3998 2 4067 3997 4019 am 4068 3999 4000 1 4069 3999 4008 1 4070 3999 4009 1 4071 4000 4001 1 4072 4000 4010 1 4073 4000 4011 1 4074 4001 4002 1 4075 4001 4012 1 4076 4001 4013 1 4077 4002 4003 ar 4078 4002 4014 1 4079 4003 4004 ar 4080 4003 4005 ar 4081 4004 4015 1 4082 4004 4016 1 4083 4005 4017 1 4084 4005 4018 1 4085 4019 4020 1 4086 4019 4024 1 4087 4020 4023 1 4088 4020 4021 1 4089 4020 4025 1 4090 4021 4022 2 4091 4021 4026 1 4092 4023 4027 1 4093 4023 4028 1 4094 4023 4029 1 @SUBSTRUCTURE 1 GLY1 2 RESIDUE 1 A GLY 1 ROOT 2 TRP2 11 RESIDUE 1 A TRP 2 3 GLY3 35 RESIDUE 1 A GLY 2 4 TYR4 42 RESIDUE 1 A TYR 2 5 GLY5 63 RESIDUE 1 A GLY 2 6 GLN6 70 RESIDUE 1 A GLN 2 7 ASP7 87 RESIDUE 1 A ASP 2 8 ASP8 99 RESIDUE 1 A ASP 2 9 GLY9 111 RESIDUE 1 A GLY 2 10 PRO10 118 RESIDUE 1 A PRO 2 11 SER11 132 RESIDUE 1 A SER 2 12 HIS12 143 RESIDUE 1 A HIS 2 13 TRP13 160 RESIDUE 1 A TRP 2 14 HIS14 184 RESIDUE 1 A HIS 2 15 LYS15 201 RESIDUE 1 A LYS 2 16 LEU16 223 RESIDUE 1 A LEU 2 17 TYR17 242 RESIDUE 1 A TYR 2 18 PRO18 263 RESIDUE 1 A PRO 2 19 ILE19 277 RESIDUE 1 A ILE 2 20 ALA20 296 RESIDUE 1 A ALA 2 21 GLN21 306 RESIDUE 1 A GLN 2 22 GLY22 323 RESIDUE 1 A GLY 2 23 ASP23 330 RESIDUE 1 A ASP 2 24 ARG24 342 RESIDUE 1 A ARG 2 25 GLN25 366 RESIDUE 1 A GLN 2 26 SER26 383 RESIDUE 1 A SER 2 27 PRO27 394 RESIDUE 1 A PRO 2 28 ILE28 408 RESIDUE 1 A ILE 2 29 ASN29 427 RESIDUE 1 A ASN 2 30 ILE30 441 RESIDUE 1 A ILE 2 31 ILE31 460 RESIDUE 1 A ILE 2 32 SER32 479 RESIDUE 1 A SER 2 33 SER33 490 RESIDUE 1 A SER 2 34 GLN34 501 RESIDUE 1 A GLN 2 35 ALA35 518 RESIDUE 1 A ALA 2 36 VAL36 528 RESIDUE 1 A VAL 2 37 TYR37 544 RESIDUE 1 A TYR 2 38 SER38 565 RESIDUE 1 A SER 2 39 PRO39 576 RESIDUE 1 A PRO 2 40 SER40 590 RESIDUE 1 A SER 2 41 LEU41 601 RESIDUE 1 A LEU 2 42 GLN42 620 RESIDUE 1 A GLN 2 43 PRO43 637 RESIDUE 1 A PRO 2 44 LEU44 651 RESIDUE 1 A LEU 2 45 GLU45 670 RESIDUE 1 A GLU 2 46 LEU46 685 RESIDUE 1 A LEU 2 47 SER47 704 RESIDUE 1 A SER 2 48 TYR48 715 RESIDUE 1 A TYR 2 49 GLU49 736 RESIDUE 1 A GLU 2 50 ALA50 751 RESIDUE 1 A ALA 2 51 CYS51 761 RESIDUE 1 A CYS 3 52 MET52 771 RESIDUE 1 A MET 2 53 SER53 788 RESIDUE 1 A SER 2 54 LEU54 799 RESIDUE 1 A LEU 2 55 SER55 818 RESIDUE 1 A SER 2 56 ILE56 829 RESIDUE 1 A ILE 2 57 THR57 848 RESIDUE 1 A THR 2 58 ASN58 862 RESIDUE 1 A ASN 2 59 ASN59 876 RESIDUE 1 A ASN 2 60 GLY60 890 RESIDUE 1 A GLY 2 61 HIS61 897 RESIDUE 1 A HIS 2 62 SER62 914 RESIDUE 1 A SER 2 63 VAL63 925 RESIDUE 1 A VAL 2 64 GLN64 941 RESIDUE 1 A GLN 2 65 VAL65 958 RESIDUE 1 A VAL 2 66 ASP66 974 RESIDUE 1 A ASP 2 67 PHE67 986 RESIDUE 1 A PHE 2 68 ASN68 1006 RESIDUE 1 A ASN 2 69 ASP69 1020 RESIDUE 1 A ASP 2 70 SER70 1032 RESIDUE 1 A SER 2 71 ASP71 1043 RESIDUE 1 A ASP 2 72 ASP72 1055 RESIDUE 1 A ASP 2 73 ARG73 1067 RESIDUE 1 A ARG 2 74 THR74 1091 RESIDUE 1 A THR 2 75 VAL75 1105 RESIDUE 1 A VAL 2 76 VAL76 1121 RESIDUE 1 A VAL 2 77 THR77 1137 RESIDUE 1 A THR 2 78 GLY78 1151 RESIDUE 1 A GLY 2 79 GLY79 1158 RESIDUE 1 A GLY 2 80 PRO80 1165 RESIDUE 1 A PRO 2 81 LEU81 1179 RESIDUE 1 A LEU 2 82 GLU82 1198 RESIDUE 1 A GLU 2 83 GLY83 1213 RESIDUE 1 A GLY 2 84 PRO84 1220 RESIDUE 1 A PRO 2 85 TYR85 1234 RESIDUE 1 A TYR 2 86 ARG86 1255 RESIDUE 1 A ARG 2 87 LEU87 1279 RESIDUE 1 A LEU 2 88 LYS88 1298 RESIDUE 1 A LYS 2 89 GLN89 1320 RESIDUE 1 A GLN 2 90 PHE90 1337 RESIDUE 1 A PHE 2 91 HIS91 1357 RESIDUE 1 A HIS 2 92 PHE92 1373 RESIDUE 1 A PHE 2 93 HIS93 1393 RESIDUE 1 A HIS 2 94 TRP94 1409 RESIDUE 1 A TRP 2 95 GLY95 1433 RESIDUE 1 A GLY 2 96 LYS96 1440 RESIDUE 1 A LYS 2 97 LYS97 1462 RESIDUE 1 A LYS 2 98 HIS98 1484 RESIDUE 1 A HIS 2 99 ASP99 1501 RESIDUE 1 A ASP 2 100 VAL100 1513 RESIDUE 1 A VAL 2 101 GLY101 1529 RESIDUE 1 A GLY 2 102 SER102 1537 RESIDUE 1 A SER 2 103 GLU103 1548 RESIDUE 1 A GLU 2 104 HIS104 1563 RESIDUE 1 A HIS 2 105 THR105 1580 RESIDUE 1 A THR 2 106 VAL106 1594 RESIDUE 1 A VAL 2 107 ASP107 1610 RESIDUE 1 A ASP 2 108 GLY108 1622 RESIDUE 1 A GLY 2 109 LYS109 1629 RESIDUE 1 A LYS 2 110 SER110 1651 RESIDUE 1 A SER 2 111 PHE111 1662 RESIDUE 1 A PHE 2 112 PRO112 1682 RESIDUE 1 A PRO 2 113 SER113 1696 RESIDUE 1 A SER 2 114 GLU114 1707 RESIDUE 1 A GLU 2 115 LEU115 1722 RESIDUE 1 A LEU 2 116 HIS116 1741 RESIDUE 1 A HIS 2 117 LEU117 1758 RESIDUE 1 A LEU 2 118 VAL118 1777 RESIDUE 1 A VAL 2 119 HIS119 1793 RESIDUE 1 A HIS 2 120 TRP120 1810 RESIDUE 1 A TRP 2 121 ASN121 1834 RESIDUE 1 A ASN 2 122 ALA122 1848 RESIDUE 1 A ALA 2 123 LYS123 1858 RESIDUE 1 A LYS 2 124 LYS124 1880 RESIDUE 1 A LYS 2 125 TYR125 1902 RESIDUE 1 A TYR 2 126 SER126 1923 RESIDUE 1 A SER 2 127 THR127 1934 RESIDUE 1 A THR 2 128 PHE128 1948 RESIDUE 1 A PHE 2 129 GLY129 1968 RESIDUE 1 A GLY 2 130 GLU130 1975 RESIDUE 1 A GLU 2 131 ALA131 1990 RESIDUE 1 A ALA 2 132 ALA132 2000 RESIDUE 1 A ALA 2 133 SER133 2010 RESIDUE 1 A SER 2 134 ALA134 2021 RESIDUE 1 A ALA 2 135 PRO135 2031 RESIDUE 1 A PRO 2 136 ASP136 2045 RESIDUE 1 A ASP 2 137 GLY137 2057 RESIDUE 1 A GLY 2 138 LEU138 2064 RESIDUE 1 A LEU 2 139 ALA139 2083 RESIDUE 1 A ALA 2 140 VAL140 2093 RESIDUE 1 A VAL 2 141 VAL141 2109 RESIDUE 1 A VAL 2 142 GLY142 2125 RESIDUE 1 A GLY 2 143 VAL143 2132 RESIDUE 1 A VAL 2 144 PHE144 2148 RESIDUE 1 A PHE 2 145 LEU145 2168 RESIDUE 1 A LEU 2 146 GLU146 2187 RESIDUE 1 A GLU 2 147 THR147 2202 RESIDUE 1 A THR 2 148 GLY148 2216 RESIDUE 1 A GLY 2 149 ASP149 2223 RESIDUE 1 A ASP 2 150 GLU150 2235 RESIDUE 1 A GLU 2 151 HIS151 2250 RESIDUE 1 A HIS 2 152 PRO152 2267 RESIDUE 1 A PRO 2 153 SER153 2281 RESIDUE 1 A SER 2 154 MET154 2292 RESIDUE 1 A MET 2 155 ASN155 2309 RESIDUE 1 A ASN 2 156 ARG156 2323 RESIDUE 1 A ARG 2 157 LEU157 2347 RESIDUE 1 A LEU 2 158 THR158 2366 RESIDUE 1 A THR 2 159 ASP159 2380 RESIDUE 1 A ASP 2 160 ALA160 2392 RESIDUE 1 A ALA 2 161 LEU161 2402 RESIDUE 1 A LEU 2 162 TYR162 2421 RESIDUE 1 A TYR 2 163 MET163 2442 RESIDUE 1 A MET 2 164 VAL164 2459 RESIDUE 1 A VAL 2 165 ARG165 2475 RESIDUE 1 A ARG 2 166 PHE166 2499 RESIDUE 1 A PHE 2 167 LYS167 2519 RESIDUE 1 A LYS 2 168 GLY168 2541 RESIDUE 1 A GLY 2 169 THR169 2548 RESIDUE 1 A THR 2 170 LYS170 2562 RESIDUE 1 A LYS 2 171 ALA171 2584 RESIDUE 1 A ALA 2 172 GLN172 2594 RESIDUE 1 A GLN 2 173 PHE173 2611 RESIDUE 1 A PHE 2 174 SER174 2631 RESIDUE 1 A SER 2 175 CYS175 2642 RESIDUE 1 A CYS 3 176 PHE176 2652 RESIDUE 1 A PHE 2 177 ASN177 2672 RESIDUE 1 A ASN 2 178 PRO178 2686 RESIDUE 1 A PRO 2 179 LYS179 2700 RESIDUE 1 A LYS 2 180 SER180 2722 RESIDUE 1 A SER 2 181 LEU181 2733 RESIDUE 1 A LEU 2 182 LEU182 2752 RESIDUE 1 A LEU 2 183 PRO183 2771 RESIDUE 1 A PRO 2 184 ALA184 2785 RESIDUE 1 A ALA 2 185 SER185 2795 RESIDUE 1 A SER 2 186 ARG186 2806 RESIDUE 1 A ARG 2 187 HIS187 2830 RESIDUE 1 A HIS 2 188 TYR188 2847 RESIDUE 1 A TYR 2 189 TRP189 2868 RESIDUE 1 A TRP 2 190 THR190 2892 RESIDUE 1 A THR 2 191 TYR191 2906 RESIDUE 1 A TYR 2 192 PRO192 2927 RESIDUE 1 A PRO 2 193 GLY193 2941 RESIDUE 1 A GLY 2 194 SER194 2948 RESIDUE 1 A SER 2 195 LEU195 2959 RESIDUE 1 A LEU 2 196 THR196 2978 RESIDUE 1 A THR 2 197 THR197 2992 RESIDUE 1 A THR 2 198 PRO198 3006 RESIDUE 1 A PRO 2 199 PRO199 3020 RESIDUE 1 A PRO 2 200 LEU200 3034 RESIDUE 1 A LEU 2 201 SER201 3053 RESIDUE 1 A SER 2 202 GLU202 3064 RESIDUE 1 A GLU 2 203 SER203 3079 RESIDUE 1 A SER 2 204 VAL204 3090 RESIDUE 1 A VAL 2 205 THR205 3106 RESIDUE 1 A THR 2 206 TRP206 3120 RESIDUE 1 A TRP 2 207 ILE207 3144 RESIDUE 1 A ILE 2 208 VAL208 3163 RESIDUE 1 A VAL 2 209 LEU209 3179 RESIDUE 1 A LEU 2 210 ARG210 3198 RESIDUE 1 A ARG 2 211 GLU211 3222 RESIDUE 1 A GLU 2 212 PRO212 3237 RESIDUE 1 A PRO 2 213 ILE213 3251 RESIDUE 1 A ILE 2 214 SER214 3270 RESIDUE 1 A SER 2 215 ILE215 3281 RESIDUE 1 A ILE 2 216 SER216 3300 RESIDUE 1 A SER 2 217 GLU217 3311 RESIDUE 1 A GLU 2 218 ARG218 3326 RESIDUE 1 A ARG 2 219 GLN219 3350 RESIDUE 1 A GLN 2 220 MET220 3367 RESIDUE 1 A MET 2 221 GLY221 3384 RESIDUE 1 A GLY 2 222 LYS222 3391 RESIDUE 1 A LYS 2 223 PHE223 3413 RESIDUE 1 A PHE 2 224 ARG224 3433 RESIDUE 1 A ARG 2 225 SER225 3457 RESIDUE 1 A SER 2 226 LEU226 3468 RESIDUE 1 A LEU 2 227 LEU227 3487 RESIDUE 1 A LEU 2 228 PHE228 3506 RESIDUE 1 A PHE 2 229 THR229 3526 RESIDUE 1 A THR 2 230 SER230 3540 RESIDUE 1 A SER 2 231 GLU231 3551 RESIDUE 1 A GLU 2 232 ASP232 3566 RESIDUE 1 A ASP 2 233 ASP233 3578 RESIDUE 1 A ASP 2 234 GLU234 3590 RESIDUE 1 A GLU 2 235 ARG235 3605 RESIDUE 1 A ARG 2 236 ILE236 3629 RESIDUE 1 A ILE 2 237 HIS237 3648 RESIDUE 1 A HIS 2 238 MET238 3665 RESIDUE 1 A MET 2 239 VAL239 3682 RESIDUE 1 A VAL 2 240 ASN240 3698 RESIDUE 1 A ASN 2 241 ASN241 3712 RESIDUE 1 A ASN 2 242 PHE242 3726 RESIDUE 1 A PHE 2 243 ARG243 3746 RESIDUE 1 A ARG 2 244 PRO244 3770 RESIDUE 1 A PRO 2 245 PRO245 3784 RESIDUE 1 A PRO 2 246 GLN246 3798 RESIDUE 1 A GLN 2 247 PRO247 3815 RESIDUE 1 A PRO 2 248 LEU248 3829 RESIDUE 1 A LEU 2 249 LYS249 3848 RESIDUE 1 A LYS 2 250 GLY250 3870 RESIDUE 1 A GLY 2 251 ARG251 3877 RESIDUE 1 A ARG 2 252 VAL252 3901 RESIDUE 1 A VAL 2 253 VAL253 3917 RESIDUE 1 A VAL 2 254 LYS254 3933 RESIDUE 1 A LYS 2 255 ALA255 3955 RESIDUE 1 A ALA 2 256 SER256 3965 RESIDUE 1 A SER 2 257 PHE257 3976 RESIDUE 1 A PHE 2 258 ARG258 3996 RESIDUE 1 A ARG 2 259 ALA259 4020 RESIDUE 1 A ALA 1 260 ZN260 4030 RESIDUE 1 A ZN 0 ROOT