USER MOD reduce.3.24.130724 H: found=0, std=0, add=1200, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1200 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 121 CYS SG : rot 155:sc= -0.524 USER MOD Set 2.1: A 114 LYS NZ :NH3+ -160:sc= 1.23 (180deg=0) USER MOD Set 2.2: A 115 TYR OH : rot 0:sc= 1.06 USER MOD Set 3.1: A 46 MET CE :methyl 175:sc= -5.93! (180deg=-6.09!) USER MOD Set 3.2: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 22 GLN :FLIP amide:sc= 1.05 F(o=-0.52,f=2.3) USER MOD Set 4.2: A 27 TYR OH : rot 18:sc= 1.24 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS :FLIP no HD1:sc= -0.0909 F(o=-1,f=-0.091) USER MOD Single : A 5 HIS : +bothHN:sc= 0.534 K(o=0.53,f=-4.6!) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl 176:sc= -0.49 (180deg=-0.573) USER MOD Single : A 14 HIS : no HE2:sc= 0.972 K(o=0.97,f=-2.8!) USER MOD Single : A 18 THR OG1 : rot -88:sc= 1.66 USER MOD Single : A 19 TYR OH : rot 180:sc= -1.38! USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0.529 K(o=0.53,f=-0.033) USER MOD Single : A 34 LYS NZ :NH3+ -167:sc= 1.18 (180deg=0.633) USER MOD Single : A 36 LYS NZ :NH3+ -159:sc= -0.109 (180deg=-0.465) USER MOD Single : A 44 SER OG : rot 84:sc= 0.681 USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 48 LYS NZ :NH3+ -162:sc= -0.0601 (180deg=-0.359) USER MOD Single : A 54 ASN : amide:sc= -0.449 K(o=-0.45,f=-3.9!) USER MOD Single : A 59 MET CE :methyl 164:sc= -0.0934 (180deg=-0.507) USER MOD Single : A 61 LYS NZ :NH3+ -172:sc= -0.012 (180deg=-0.112) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 MET CE :methyl -162:sc= -0.131 (180deg=-0.588) USER MOD Single : A 70 TYR OH : rot 90:sc= 0.707 USER MOD Single : A 74 THR OG1 : rot -77:sc= 0.791 USER MOD Single : A 76 LYS NZ :NH3+ -162:sc= -0.163 (180deg=-0.441) USER MOD Single : A 84 ASN : amide:sc= -0.372 K(o=-0.37,f=-0.91) USER MOD Single : A 85 LYS NZ :NH3+ 166:sc= -0.0054 (180deg=-0.2) USER MOD Single : A 86 LYS NZ :NH3+ -178:sc= 0.726 (180deg=0.713) USER MOD Single : A 92 THR OG1 : rot 180:sc=-0.00794 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.306 X(o=-0.31,f=-0.72) USER MOD Single : A 99 THR OG1 : rot -24:sc= 0.536 USER MOD Single : A 100 SER OG : rot -39:sc= 0.568 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.0212 USER MOD Single : A 103 SER OG : rot 108:sc= 1.11 USER MOD Single : A 107 THR OG1 : rot 82:sc= 0.117 USER MOD Single : A 110 THR OG1 : rot 81:sc= 0.738 USER MOD Single : A 111 GLN : amide:sc= -0.741 K(o=-0.74,f=-4!) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -172:sc= -0.746 (180deg=-0.9) USER MOD Single : A 119 TYR OH : rot 134:sc= 0.00499 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 100:sc= 0.188 USER MOD Single : A 128 ASN : amide:sc= -0.134 X(o=-0.13,f=-0.00093) USER MOD Single : A 130 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 133 GLN :FLIP amide:sc= -0.237 F(o=-1.3!,f=-0.24) USER MOD Single : A 138 SER OG : rot 83:sc= 1.28 USER MOD Single : A 139 ASN : amide:sc= -2.47! C(o=-2.5!,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 24.071 1.195 2.940 1.00 55.45 N ATOM 2 CA MET A 1 24.663 0.844 1.619 1.00 11.22 C ATOM 3 C MET A 1 24.027 -0.432 1.045 1.00 32.12 C ATOM 4 O MET A 1 24.240 -1.527 1.563 1.00 51.23 O ATOM 5 CB MET A 1 26.183 0.659 1.745 1.00 65.22 C ATOM 6 CG MET A 1 26.869 0.312 0.428 1.00 21.55 C ATOM 7 SD MET A 1 28.642 0.035 0.619 1.00 23.23 S ATOM 8 CE MET A 1 29.115 -0.316 -1.074 1.00 75.14 C ATOM 0 H1 MET A 1 24.520 2.060 3.303 1.00 55.45 H new ATOM 0 H2 MET A 1 23.049 1.355 2.831 1.00 55.45 H new ATOM 0 H3 MET A 1 24.230 0.416 3.610 1.00 55.45 H new ATOM 0 HA MET A 1 24.458 1.667 0.934 1.00 11.22 H new ATOM 0 HB2 MET A 1 26.620 1.575 2.142 1.00 65.22 H new ATOM 0 HB3 MET A 1 26.385 -0.130 2.469 1.00 65.22 H new ATOM 0 HG2 MET A 1 26.409 -0.582 0.008 1.00 21.55 H new ATOM 0 HG3 MET A 1 26.706 1.120 -0.286 1.00 21.55 H new ATOM 0 HE1 MET A 1 30.187 -0.509 -1.120 1.00 75.14 H new ATOM 0 HE2 MET A 1 28.573 -1.192 -1.429 1.00 75.14 H new ATOM 0 HE3 MET A 1 28.873 0.540 -1.704 1.00 75.14 H new ATOM 20 N GLY A 2 23.251 -0.281 -0.025 1.00 74.52 N ATOM 21 CA GLY A 2 22.624 -1.431 -0.676 1.00 23.21 C ATOM 22 C GLY A 2 22.548 -1.283 -2.192 1.00 21.50 C ATOM 23 O GLY A 2 23.123 -0.354 -2.760 1.00 42.20 O ATOM 0 H GLY A 2 23.041 0.618 -0.458 1.00 74.52 H new ATOM 0 HA2 GLY A 2 23.186 -2.332 -0.431 1.00 23.21 H new ATOM 0 HA3 GLY A 2 21.618 -1.564 -0.278 1.00 23.21 H new ATOM 27 N HIS A 3 21.842 -2.201 -2.851 1.00 34.42 N ATOM 28 CA HIS A 3 21.675 -2.140 -4.309 1.00 30.42 C ATOM 29 C HIS A 3 20.597 -1.109 -4.687 1.00 63.41 C ATOM 30 O HIS A 3 19.588 -0.978 -3.995 1.00 11.54 O ATOM 31 CB HIS A 3 21.321 -3.524 -4.858 1.00 3.21 C ATOM 32 CG HIS A 3 22.340 -4.569 -4.526 1.00 24.14 C ATOM 33 ND1 HIS A 3 23.602 -4.595 -5.082 1.00 23.54 N ATOM 34 CD2 HIS A 3 22.286 -5.628 -3.681 1.00 12.42 C ATOM 35 CE1 HIS A 3 24.273 -5.619 -4.600 1.00 20.50 C ATOM 36 NE2 HIS A 3 23.500 -6.258 -3.751 1.00 64.51 N ATOM 0 H HIS A 3 21.378 -2.992 -2.405 1.00 34.42 H new ATOM 0 HA HIS A 3 22.617 -1.822 -4.756 1.00 30.42 H new ATOM 0 HB2 HIS A 3 20.354 -3.829 -4.459 1.00 3.21 H new ATOM 0 HB3 HIS A 3 21.214 -3.462 -5.941 1.00 3.21 H new ATOM 0 HD2 HIS A 3 21.445 -5.919 -3.069 1.00 12.42 H new ATOM 0 HE1 HIS A 3 25.286 -5.888 -4.858 1.00 20.50 H new ATOM 0 HE2 HIS A 3 23.763 -7.092 -3.226 1.00 64.51 H new ATOM 45 N HIS A 4 20.799 -0.387 -5.793 1.00 10.43 N ATOM 46 CA HIS A 4 19.971 0.792 -6.079 1.00 25.31 C ATOM 47 C HIS A 4 19.521 0.886 -7.557 1.00 34.44 C ATOM 48 O HIS A 4 20.335 1.119 -8.455 1.00 10.24 O ATOM 49 CB HIS A 4 20.760 2.054 -5.687 1.00 33.22 C ATOM 50 CG HIS A 4 19.929 3.296 -5.563 1.00 52.11 C ATOM 51 ND1 HIS A 4 19.318 4.060 -6.502 1.00 40.20 N flip ATOM 52 CD2 HIS A 4 19.662 3.903 -4.355 1.00 24.44 C flip ATOM 53 CE1 HIS A 4 18.702 5.096 -5.846 1.00 64.10 C flip ATOM 54 NE2 HIS A 4 18.927 4.977 -4.553 1.00 35.53 N flip ATOM 0 H HIS A 4 21.513 -0.590 -6.493 1.00 10.43 H new ATOM 0 HA HIS A 4 19.058 0.701 -5.491 1.00 25.31 H new ATOM 0 HB2 HIS A 4 21.262 1.872 -4.737 1.00 33.22 H new ATOM 0 HB3 HIS A 4 21.538 2.226 -6.431 1.00 33.22 H new ATOM 0 HD2 HIS A 4 20.004 3.551 -3.393 1.00 24.44 H new ATOM 0 HE1 HIS A 4 18.126 5.881 -6.313 1.00 64.10 H new ATOM 0 HE2 HIS A 4 18.589 5.610 -3.828 1.00 35.53 H new ATOM 63 N HIS A 5 18.216 0.696 -7.790 1.00 33.41 N ATOM 64 CA HIS A 5 17.562 1.052 -9.070 1.00 44.40 C ATOM 65 C HIS A 5 17.962 0.120 -10.237 1.00 45.01 C ATOM 66 O HIS A 5 18.205 0.578 -11.355 1.00 11.41 O ATOM 67 CB HIS A 5 17.884 2.521 -9.420 1.00 14.42 C ATOM 68 CG HIS A 5 16.920 3.177 -10.374 1.00 2.42 C ATOM 69 ND1 HIS A 5 16.763 2.789 -11.687 1.00 23.04 N ATOM 70 CD2 HIS A 5 16.072 4.221 -10.193 1.00 62.44 C ATOM 71 CE1 HIS A 5 15.868 3.562 -12.271 1.00 5.22 C ATOM 72 NE2 HIS A 5 15.432 4.441 -11.388 1.00 23.32 N ATOM 0 H HIS A 5 17.579 0.293 -7.103 1.00 33.41 H new ATOM 0 HA HIS A 5 16.488 0.924 -8.932 1.00 44.40 H new ATOM 0 HB2 HIS A 5 17.909 3.101 -8.497 1.00 14.42 H new ATOM 0 HB3 HIS A 5 18.884 2.565 -9.851 1.00 14.42 H new ATOM 0 HD1 HIS A 5 17.262 2.022 -12.138 1.00 23.04 H new ATOM 0 HD2 HIS A 5 15.927 4.776 -9.278 1.00 62.44 H new ATOM 0 HE1 HIS A 5 15.546 3.488 -13.299 1.00 5.22 H new ATOM 0 HE2 HIS A 5 14.735 5.164 -11.564 1.00 23.32 H new ATOM 81 N HIS A 6 18.004 -1.188 -9.986 1.00 52.43 N ATOM 82 CA HIS A 6 18.266 -2.173 -11.052 1.00 43.35 C ATOM 83 C HIS A 6 17.299 -3.366 -10.963 1.00 23.33 C ATOM 84 O HIS A 6 16.690 -3.610 -9.922 1.00 73.33 O ATOM 85 CB HIS A 6 19.719 -2.663 -11.001 1.00 12.34 C ATOM 86 CG HIS A 6 20.725 -1.580 -11.250 1.00 35.45 C ATOM 87 ND1 HIS A 6 20.766 -0.846 -12.414 1.00 45.32 N ATOM 88 CD2 HIS A 6 21.735 -1.107 -10.482 1.00 22.51 C ATOM 89 CE1 HIS A 6 21.748 0.026 -12.353 1.00 63.13 C ATOM 90 NE2 HIS A 6 22.355 -0.109 -11.192 1.00 75.40 N ATOM 0 H HIS A 6 17.862 -1.595 -9.062 1.00 52.43 H new ATOM 0 HA HIS A 6 18.101 -1.672 -12.006 1.00 43.35 H new ATOM 0 HB2 HIS A 6 19.910 -3.108 -10.024 1.00 12.34 H new ATOM 0 HB3 HIS A 6 19.854 -3.451 -11.742 1.00 12.34 H new ATOM 0 HD2 HIS A 6 22.003 -1.451 -9.494 1.00 22.51 H new ATOM 0 HE1 HIS A 6 22.012 0.734 -13.125 1.00 63.13 H new ATOM 0 HE2 HIS A 6 23.154 0.438 -10.873 1.00 75.40 H new ATOM 99 N HIS A 7 17.174 -4.121 -12.054 1.00 14.04 N ATOM 100 CA HIS A 7 16.186 -5.210 -12.131 1.00 51.40 C ATOM 101 C HIS A 7 16.806 -6.528 -12.635 1.00 51.00 C ATOM 102 O HIS A 7 17.585 -6.542 -13.587 1.00 14.34 O ATOM 103 CB HIS A 7 15.019 -4.791 -13.040 1.00 13.24 C ATOM 104 CG HIS A 7 15.446 -4.364 -14.413 1.00 14.04 C ATOM 105 ND1 HIS A 7 15.448 -5.213 -15.497 1.00 65.33 N ATOM 106 CD2 HIS A 7 15.897 -3.172 -14.874 1.00 11.14 C ATOM 107 CE1 HIS A 7 15.883 -4.568 -16.559 1.00 14.41 C ATOM 108 NE2 HIS A 7 16.161 -3.329 -16.211 1.00 41.54 N ATOM 0 H HIS A 7 17.739 -4.004 -12.895 1.00 14.04 H new ATOM 0 HA HIS A 7 15.819 -5.393 -11.121 1.00 51.40 H new ATOM 0 HB2 HIS A 7 14.322 -5.624 -13.129 1.00 13.24 H new ATOM 0 HB3 HIS A 7 14.478 -3.972 -12.567 1.00 13.24 H new ATOM 0 HD2 HIS A 7 16.025 -2.268 -14.297 1.00 11.14 H new ATOM 0 HE1 HIS A 7 15.993 -4.985 -17.549 1.00 14.41 H new ATOM 0 HE2 HIS A 7 16.515 -2.604 -16.834 1.00 41.54 H new ATOM 117 N HIS A 8 16.447 -7.634 -11.984 1.00 52.51 N ATOM 118 CA HIS A 8 16.898 -8.973 -12.394 1.00 75.12 C ATOM 119 C HIS A 8 15.706 -9.932 -12.546 1.00 43.11 C ATOM 120 O HIS A 8 14.553 -9.541 -12.343 1.00 14.15 O ATOM 121 CB HIS A 8 17.902 -9.539 -11.376 1.00 13.14 C ATOM 122 CG HIS A 8 19.190 -8.772 -11.301 1.00 64.44 C ATOM 123 ND1 HIS A 8 19.749 -8.351 -10.112 1.00 24.43 N ATOM 124 CD2 HIS A 8 20.044 -8.362 -12.273 1.00 24.12 C ATOM 125 CE1 HIS A 8 20.880 -7.719 -10.354 1.00 51.54 C ATOM 126 NE2 HIS A 8 21.083 -7.710 -11.654 1.00 42.13 N ATOM 0 H HIS A 8 15.841 -7.633 -11.164 1.00 52.51 H new ATOM 0 HA HIS A 8 17.391 -8.879 -13.362 1.00 75.12 H new ATOM 0 HB2 HIS A 8 17.438 -9.548 -10.390 1.00 13.14 H new ATOM 0 HB3 HIS A 8 18.122 -10.575 -11.635 1.00 13.14 H new ATOM 0 HD2 HIS A 8 19.928 -8.519 -13.335 1.00 24.12 H new ATOM 0 HE1 HIS A 8 21.530 -7.282 -9.611 1.00 51.54 H new ATOM 0 HE2 HIS A 8 21.882 -7.287 -12.126 1.00 42.13 H new ATOM 135 N SER A 9 15.989 -11.182 -12.908 1.00 64.14 N ATOM 136 CA SER A 9 14.942 -12.204 -13.059 1.00 21.41 C ATOM 137 C SER A 9 14.359 -12.623 -11.700 1.00 71.41 C ATOM 138 O SER A 9 14.890 -12.275 -10.644 1.00 21.50 O ATOM 139 CB SER A 9 15.493 -13.437 -13.792 1.00 21.20 C ATOM 140 OG SER A 9 16.585 -14.019 -13.094 1.00 73.04 O ATOM 0 H SER A 9 16.933 -11.516 -13.103 1.00 64.14 H new ATOM 0 HA SER A 9 14.140 -11.763 -13.651 1.00 21.41 H new ATOM 0 HB2 SER A 9 14.700 -14.176 -13.908 1.00 21.20 H new ATOM 0 HB3 SER A 9 15.812 -13.152 -14.794 1.00 21.20 H new ATOM 0 HG SER A 9 16.909 -14.801 -13.587 1.00 73.04 H new ATOM 146 N HIS A 10 13.260 -13.372 -11.733 1.00 51.12 N ATOM 147 CA HIS A 10 12.577 -13.797 -10.507 1.00 52.10 C ATOM 148 C HIS A 10 13.251 -15.010 -9.849 1.00 11.23 C ATOM 149 O HIS A 10 13.805 -15.882 -10.521 1.00 31.11 O ATOM 150 CB HIS A 10 11.105 -14.104 -10.799 1.00 43.42 C ATOM 151 CG HIS A 10 10.277 -12.872 -11.020 1.00 75.43 C ATOM 152 ND1 HIS A 10 9.555 -12.266 -10.013 1.00 63.45 N ATOM 153 CD2 HIS A 10 10.067 -12.125 -12.130 1.00 1.04 C ATOM 154 CE1 HIS A 10 8.941 -11.202 -10.491 1.00 44.40 C ATOM 155 NE2 HIS A 10 9.235 -11.094 -11.770 1.00 45.42 N ATOM 0 H HIS A 10 12.821 -13.699 -12.594 1.00 51.12 H new ATOM 0 HA HIS A 10 12.644 -12.970 -9.800 1.00 52.10 H new ATOM 0 HB2 HIS A 10 11.041 -14.740 -11.682 1.00 43.42 H new ATOM 0 HB3 HIS A 10 10.687 -14.671 -9.967 1.00 43.42 H new ATOM 0 HD2 HIS A 10 10.477 -12.306 -13.113 1.00 1.04 H new ATOM 0 HE1 HIS A 10 8.305 -10.533 -9.930 1.00 44.40 H new ATOM 0 HE2 HIS A 10 8.898 -10.361 -12.394 1.00 45.42 H new ATOM 164 N MET A 11 13.188 -15.045 -8.523 1.00 51.53 N ATOM 165 CA MET A 11 13.760 -16.132 -7.722 1.00 64.43 C ATOM 166 C MET A 11 12.650 -17.066 -7.193 1.00 13.54 C ATOM 167 O MET A 11 11.487 -16.667 -7.114 1.00 43.21 O ATOM 168 CB MET A 11 14.553 -15.528 -6.554 1.00 12.14 C ATOM 169 CG MET A 11 15.622 -14.534 -6.994 1.00 24.00 C ATOM 170 SD MET A 11 16.447 -13.733 -5.602 1.00 14.23 S ATOM 171 CE MET A 11 17.186 -15.148 -4.787 1.00 62.34 C ATOM 0 H MET A 11 12.737 -14.319 -7.966 1.00 51.53 H new ATOM 0 HA MET A 11 14.425 -16.727 -8.348 1.00 64.43 H new ATOM 0 HB2 MET A 11 13.861 -15.029 -5.875 1.00 12.14 H new ATOM 0 HB3 MET A 11 15.026 -16.333 -5.992 1.00 12.14 H new ATOM 0 HG2 MET A 11 16.364 -15.051 -7.602 1.00 24.00 H new ATOM 0 HG3 MET A 11 15.166 -13.773 -7.627 1.00 24.00 H new ATOM 0 HE1 MET A 11 17.791 -14.809 -3.946 1.00 62.34 H new ATOM 0 HE2 MET A 11 16.400 -15.811 -4.425 1.00 62.34 H new ATOM 0 HE3 MET A 11 17.817 -15.686 -5.494 1.00 62.34 H new ATOM 181 N PRO A 12 12.983 -18.327 -6.838 1.00 63.53 N ATOM 182 CA PRO A 12 11.994 -19.277 -6.292 1.00 13.12 C ATOM 183 C PRO A 12 11.494 -18.881 -4.888 1.00 75.23 C ATOM 184 O PRO A 12 12.091 -19.251 -3.873 1.00 11.41 O ATOM 185 CB PRO A 12 12.764 -20.608 -6.249 1.00 74.03 C ATOM 186 CG PRO A 12 14.201 -20.213 -6.168 1.00 70.12 C ATOM 187 CD PRO A 12 14.325 -18.932 -6.953 1.00 45.32 C ATOM 0 HA PRO A 12 11.090 -19.315 -6.899 1.00 13.12 H new ATOM 0 HB2 PRO A 12 12.469 -21.208 -5.388 1.00 74.03 H new ATOM 0 HB3 PRO A 12 12.568 -21.208 -7.138 1.00 74.03 H new ATOM 0 HG2 PRO A 12 14.508 -20.067 -5.132 1.00 70.12 H new ATOM 0 HG3 PRO A 12 14.843 -20.989 -6.584 1.00 70.12 H new ATOM 0 HD2 PRO A 12 15.096 -18.281 -6.540 1.00 45.32 H new ATOM 0 HD3 PRO A 12 14.592 -19.122 -7.993 1.00 45.32 H new ATOM 195 N ASP A 13 10.403 -18.116 -4.840 1.00 15.41 N ATOM 196 CA ASP A 13 9.843 -17.636 -3.569 1.00 41.20 C ATOM 197 C ASP A 13 8.894 -18.663 -2.931 1.00 10.15 C ATOM 198 O ASP A 13 8.725 -19.776 -3.432 1.00 50.04 O ATOM 199 CB ASP A 13 9.087 -16.322 -3.790 1.00 74.33 C ATOM 200 CG ASP A 13 9.946 -15.248 -4.432 1.00 32.34 C ATOM 201 OD1 ASP A 13 11.057 -14.992 -3.933 1.00 74.04 O ATOM 202 OD2 ASP A 13 9.504 -14.653 -5.440 1.00 33.20 O ATOM 0 H ASP A 13 9.886 -17.813 -5.666 1.00 15.41 H new ATOM 0 HA ASP A 13 10.680 -17.479 -2.888 1.00 41.20 H new ATOM 0 HB2 ASP A 13 8.218 -16.510 -4.420 1.00 74.33 H new ATOM 0 HB3 ASP A 13 8.714 -15.958 -2.833 1.00 74.33 H new ATOM 207 N HIS A 14 8.276 -18.278 -1.812 1.00 51.30 N ATOM 208 CA HIS A 14 7.282 -19.122 -1.139 1.00 71.14 C ATOM 209 C HIS A 14 5.847 -18.712 -1.514 1.00 51.11 C ATOM 210 O HIS A 14 4.883 -19.364 -1.113 1.00 54.31 O ATOM 211 CB HIS A 14 7.467 -19.046 0.380 1.00 50.25 C ATOM 212 CG HIS A 14 8.803 -19.533 0.848 1.00 42.13 C ATOM 213 ND1 HIS A 14 9.845 -18.690 1.173 1.00 33.55 N ATOM 214 CD2 HIS A 14 9.267 -20.789 1.048 1.00 24.54 C ATOM 215 CE1 HIS A 14 10.886 -19.404 1.549 1.00 4.04 C ATOM 216 NE2 HIS A 14 10.560 -20.676 1.482 1.00 34.31 N ATOM 0 H HIS A 14 8.446 -17.384 -1.350 1.00 51.30 H new ATOM 0 HA HIS A 14 7.437 -20.148 -1.472 1.00 71.14 H new ATOM 0 HB2 HIS A 14 7.333 -18.013 0.702 1.00 50.25 H new ATOM 0 HB3 HIS A 14 6.686 -19.634 0.862 1.00 50.25 H new ATOM 0 HD1 HIS A 14 9.814 -17.671 1.129 1.00 33.55 H new ATOM 0 HD2 HIS A 14 8.720 -21.707 0.894 1.00 24.54 H new ATOM 0 HE1 HIS A 14 11.843 -19.012 1.859 1.00 4.04 H new ATOM 225 N GLY A 15 5.713 -17.620 -2.272 1.00 4.43 N ATOM 226 CA GLY A 15 4.401 -17.180 -2.739 1.00 31.52 C ATOM 227 C GLY A 15 3.787 -18.138 -3.748 1.00 51.35 C ATOM 228 O GLY A 15 2.583 -18.407 -3.717 1.00 73.54 O ATOM 0 H GLY A 15 6.490 -17.031 -2.572 1.00 4.43 H new ATOM 0 HA2 GLY A 15 3.731 -17.079 -1.885 1.00 31.52 H new ATOM 0 HA3 GLY A 15 4.493 -16.192 -3.191 1.00 31.52 H new ATOM 232 N ASP A 16 4.619 -18.642 -4.654 1.00 72.04 N ATOM 233 CA ASP A 16 4.217 -19.702 -5.576 1.00 64.44 C ATOM 234 C ASP A 16 3.944 -21.007 -4.803 1.00 0.04 C ATOM 235 O ASP A 16 3.921 -21.008 -3.570 1.00 5.42 O ATOM 236 CB ASP A 16 5.323 -19.918 -6.614 1.00 73.12 C ATOM 237 CG ASP A 16 5.704 -18.630 -7.329 1.00 12.53 C ATOM 238 OD1 ASP A 16 6.453 -17.818 -6.743 1.00 15.24 O ATOM 239 OD2 ASP A 16 5.268 -18.427 -8.483 1.00 61.34 O ATOM 0 H ASP A 16 5.583 -18.331 -4.771 1.00 72.04 H new ATOM 0 HA ASP A 16 3.299 -19.408 -6.085 1.00 64.44 H new ATOM 0 HB2 ASP A 16 6.203 -20.332 -6.123 1.00 73.12 H new ATOM 0 HB3 ASP A 16 4.992 -20.653 -7.347 1.00 73.12 H new ATOM 244 N TRP A 17 3.741 -22.113 -5.528 1.00 10.01 N ATOM 245 CA TRP A 17 3.492 -23.444 -4.921 1.00 72.24 C ATOM 246 C TRP A 17 2.075 -23.534 -4.302 1.00 10.33 C ATOM 247 O TRP A 17 1.384 -24.547 -4.434 1.00 33.23 O ATOM 248 CB TRP A 17 4.542 -23.795 -3.835 1.00 55.53 C ATOM 249 CG TRP A 17 5.966 -23.431 -4.178 1.00 51.21 C ATOM 250 CD1 TRP A 17 6.658 -22.343 -3.721 1.00 44.53 C ATOM 251 CD2 TRP A 17 6.871 -24.148 -5.027 1.00 53.14 C ATOM 252 NE1 TRP A 17 7.926 -22.335 -4.238 1.00 73.11 N ATOM 253 CE2 TRP A 17 8.085 -23.431 -5.041 1.00 73.14 C ATOM 254 CE3 TRP A 17 6.778 -25.325 -5.777 1.00 15.12 C ATOM 255 CZ2 TRP A 17 9.190 -23.848 -5.774 1.00 22.23 C ATOM 256 CZ3 TRP A 17 7.880 -25.739 -6.503 1.00 3.15 C ATOM 257 CH2 TRP A 17 9.071 -25.002 -6.498 1.00 54.15 C ATOM 0 H TRP A 17 3.743 -22.121 -6.548 1.00 10.01 H new ATOM 0 HA TRP A 17 3.574 -24.165 -5.734 1.00 72.24 H new ATOM 0 HB2 TRP A 17 4.267 -23.289 -2.909 1.00 55.53 H new ATOM 0 HB3 TRP A 17 4.495 -24.866 -3.639 1.00 55.53 H new ATOM 0 HD1 TRP A 17 6.261 -21.597 -3.049 1.00 44.53 H new ATOM 0 HE1 TRP A 17 8.637 -21.627 -4.054 1.00 73.11 H new ATOM 0 HE3 TRP A 17 5.863 -25.899 -5.789 1.00 15.12 H new ATOM 0 HZ2 TRP A 17 10.109 -23.281 -5.772 1.00 22.23 H new ATOM 0 HZ3 TRP A 17 7.821 -26.647 -7.084 1.00 3.15 H new ATOM 0 HH2 TRP A 17 9.912 -25.352 -7.078 1.00 54.15 H new ATOM 268 N THR A 18 1.664 -22.467 -3.612 1.00 14.34 N ATOM 269 CA THR A 18 0.362 -22.399 -2.938 1.00 51.34 C ATOM 270 C THR A 18 -0.809 -22.397 -3.926 1.00 22.02 C ATOM 271 O THR A 18 -0.665 -22.010 -5.088 1.00 52.13 O ATOM 272 CB THR A 18 0.255 -21.127 -2.058 1.00 54.23 C ATOM 273 OG1 THR A 18 0.378 -19.943 -2.870 1.00 51.44 O ATOM 274 CG2 THR A 18 1.334 -21.115 -0.979 1.00 4.33 C ATOM 0 H THR A 18 2.226 -21.622 -3.504 1.00 14.34 H new ATOM 0 HA THR A 18 0.300 -23.294 -2.319 1.00 51.34 H new ATOM 0 HB THR A 18 -0.723 -21.137 -1.577 1.00 54.23 H new ATOM 0 HG1 THR A 18 1.324 -19.704 -2.959 1.00 51.44 H new ATOM 0 HG21 THR A 18 1.236 -20.212 -0.376 1.00 4.33 H new ATOM 0 HG22 THR A 18 1.220 -21.991 -0.341 1.00 4.33 H new ATOM 0 HG23 THR A 18 2.318 -21.133 -1.448 1.00 4.33 H new ATOM 282 N TYR A 19 -1.969 -22.839 -3.445 1.00 4.41 N ATOM 283 CA TYR A 19 -3.207 -22.825 -4.231 1.00 12.31 C ATOM 284 C TYR A 19 -3.557 -21.409 -4.728 1.00 13.44 C ATOM 285 O TYR A 19 -3.126 -20.417 -4.146 1.00 13.32 O ATOM 286 CB TYR A 19 -4.361 -23.400 -3.393 1.00 15.42 C ATOM 287 CG TYR A 19 -4.540 -22.728 -2.037 1.00 3.11 C ATOM 288 CD1 TYR A 19 -5.313 -21.582 -1.902 1.00 52.02 C ATOM 289 CD2 TYR A 19 -3.939 -23.248 -0.891 1.00 5.30 C ATOM 290 CE1 TYR A 19 -5.483 -20.974 -0.672 1.00 43.23 C ATOM 291 CE2 TYR A 19 -4.106 -22.642 0.341 1.00 55.21 C ATOM 292 CZ TYR A 19 -4.878 -21.505 0.444 1.00 3.31 C ATOM 293 OH TYR A 19 -5.059 -20.902 1.669 1.00 0.44 O ATOM 0 H TYR A 19 -2.080 -23.216 -2.504 1.00 4.41 H new ATOM 0 HA TYR A 19 -3.052 -23.447 -5.112 1.00 12.31 H new ATOM 0 HB2 TYR A 19 -5.288 -23.306 -3.958 1.00 15.42 H new ATOM 0 HB3 TYR A 19 -4.188 -24.465 -3.239 1.00 15.42 H new ATOM 0 HD1 TYR A 19 -5.790 -21.158 -2.773 1.00 52.02 H new ATOM 0 HD2 TYR A 19 -3.333 -24.139 -0.967 1.00 5.30 H new ATOM 0 HE1 TYR A 19 -6.089 -20.084 -0.587 1.00 43.23 H new ATOM 0 HE2 TYR A 19 -3.633 -23.058 1.219 1.00 55.21 H new ATOM 0 HH TYR A 19 -4.566 -21.400 2.355 1.00 0.44 H new ATOM 303 N GLU A 20 -4.351 -21.342 -5.801 1.00 75.52 N ATOM 304 CA GLU A 20 -4.720 -20.071 -6.456 1.00 52.03 C ATOM 305 C GLU A 20 -5.297 -19.033 -5.475 1.00 32.32 C ATOM 306 O GLU A 20 -4.943 -17.851 -5.521 1.00 41.13 O ATOM 307 CB GLU A 20 -5.752 -20.351 -7.561 1.00 74.23 C ATOM 308 CG GLU A 20 -6.228 -19.109 -8.315 1.00 3.34 C ATOM 309 CD GLU A 20 -5.154 -18.502 -9.203 1.00 14.14 C ATOM 310 OE1 GLU A 20 -4.879 -19.076 -10.274 1.00 71.00 O ATOM 311 OE2 GLU A 20 -4.593 -17.442 -8.846 1.00 62.42 O ATOM 0 H GLU A 20 -4.759 -22.165 -6.245 1.00 75.52 H new ATOM 0 HA GLU A 20 -3.806 -19.647 -6.872 1.00 52.03 H new ATOM 0 HB2 GLU A 20 -5.319 -21.051 -8.276 1.00 74.23 H new ATOM 0 HB3 GLU A 20 -6.617 -20.844 -7.116 1.00 74.23 H new ATOM 0 HG2 GLU A 20 -7.091 -19.371 -8.927 1.00 3.34 H new ATOM 0 HG3 GLU A 20 -6.562 -18.361 -7.596 1.00 3.34 H new ATOM 318 N GLU A 21 -6.189 -19.483 -4.598 1.00 61.52 N ATOM 319 CA GLU A 21 -6.886 -18.593 -3.661 1.00 22.23 C ATOM 320 C GLU A 21 -5.910 -17.897 -2.692 1.00 73.52 C ATOM 321 O GLU A 21 -4.791 -18.364 -2.466 1.00 13.14 O ATOM 322 CB GLU A 21 -7.938 -19.396 -2.871 1.00 60.13 C ATOM 323 CG GLU A 21 -8.824 -18.554 -1.954 1.00 24.35 C ATOM 324 CD GLU A 21 -9.734 -17.601 -2.717 1.00 30.00 C ATOM 325 OE1 GLU A 21 -9.238 -16.574 -3.224 1.00 34.31 O ATOM 326 OE2 GLU A 21 -10.950 -17.878 -2.813 1.00 14.34 O ATOM 0 H GLU A 21 -6.451 -20.465 -4.513 1.00 61.52 H new ATOM 0 HA GLU A 21 -7.377 -17.813 -4.242 1.00 22.23 H new ATOM 0 HB2 GLU A 21 -8.573 -19.931 -3.577 1.00 60.13 H new ATOM 0 HB3 GLU A 21 -7.426 -20.148 -2.270 1.00 60.13 H new ATOM 0 HG2 GLU A 21 -9.434 -19.216 -1.339 1.00 24.35 H new ATOM 0 HG3 GLU A 21 -8.193 -17.980 -1.275 1.00 24.35 H new ATOM 333 N GLN A 22 -6.343 -16.768 -2.136 1.00 32.41 N ATOM 334 CA GLN A 22 -5.567 -16.042 -1.121 1.00 41.21 C ATOM 335 C GLN A 22 -5.191 -16.955 0.068 1.00 1.12 C ATOM 336 O GLN A 22 -6.056 -17.391 0.833 1.00 21.32 O ATOM 337 CB GLN A 22 -6.374 -14.828 -0.629 1.00 44.02 C ATOM 338 CG GLN A 22 -7.823 -15.159 -0.282 1.00 14.21 C ATOM 339 CD GLN A 22 -8.594 -13.968 0.263 1.00 22.33 C ATOM 340 OE1 GLN A 22 -8.603 -13.814 1.571 1.00 54.13 O flip ATOM 341 NE2 GLN A 22 -9.195 -13.203 -0.484 1.00 74.24 N flip ATOM 0 H GLN A 22 -7.234 -16.330 -2.370 1.00 32.41 H new ATOM 0 HA GLN A 22 -4.638 -15.702 -1.578 1.00 41.21 H new ATOM 0 HB2 GLN A 22 -5.885 -14.409 0.250 1.00 44.02 H new ATOM 0 HB3 GLN A 22 -6.360 -14.057 -1.399 1.00 44.02 H new ATOM 0 HG2 GLN A 22 -8.327 -15.533 -1.173 1.00 14.21 H new ATOM 0 HG3 GLN A 22 -7.839 -15.962 0.455 1.00 14.21 H new ATOM 0 HE21 GLN A 22 -9.168 -13.350 -1.493 1.00 74.24 H new ATOM 0 HE22 GLN A 22 -9.721 -12.420 -0.096 1.00 74.24 H new ATOM 350 N PHE A 23 -3.896 -17.244 0.219 1.00 40.35 N ATOM 351 CA PHE A 23 -3.431 -18.150 1.277 1.00 22.42 C ATOM 352 C PHE A 23 -3.542 -17.525 2.681 1.00 63.13 C ATOM 353 O PHE A 23 -3.408 -16.312 2.863 1.00 54.12 O ATOM 354 CB PHE A 23 -2.002 -18.659 0.995 1.00 25.30 C ATOM 355 CG PHE A 23 -0.999 -17.597 0.598 1.00 52.41 C ATOM 356 CD1 PHE A 23 -0.363 -16.825 1.557 1.00 74.53 C ATOM 357 CD2 PHE A 23 -0.676 -17.394 -0.739 1.00 1.33 C ATOM 358 CE1 PHE A 23 0.572 -15.873 1.194 1.00 4.34 C ATOM 359 CE2 PHE A 23 0.255 -16.440 -1.105 1.00 14.50 C ATOM 360 CZ PHE A 23 0.880 -15.680 -0.137 1.00 51.35 C ATOM 0 H PHE A 23 -3.154 -16.868 -0.372 1.00 40.35 H new ATOM 0 HA PHE A 23 -4.099 -19.011 1.267 1.00 22.42 H new ATOM 0 HB2 PHE A 23 -1.634 -19.167 1.886 1.00 25.30 H new ATOM 0 HB3 PHE A 23 -2.050 -19.404 0.200 1.00 25.30 H new ATOM 0 HD1 PHE A 23 -0.600 -16.969 2.601 1.00 74.53 H new ATOM 0 HD2 PHE A 23 -1.158 -17.989 -1.501 1.00 1.33 H new ATOM 0 HE1 PHE A 23 1.061 -15.280 1.953 1.00 4.34 H new ATOM 0 HE2 PHE A 23 0.493 -16.289 -2.148 1.00 14.50 H new ATOM 0 HZ PHE A 23 1.609 -14.935 -0.421 1.00 51.35 H new ATOM 370 N LYS A 24 -3.764 -18.390 3.671 1.00 21.50 N ATOM 371 CA LYS A 24 -4.115 -17.985 5.044 1.00 74.51 C ATOM 372 C LYS A 24 -3.045 -17.107 5.730 1.00 23.23 C ATOM 373 O LYS A 24 -3.329 -16.457 6.740 1.00 40.50 O ATOM 374 CB LYS A 24 -4.354 -19.245 5.890 1.00 42.14 C ATOM 375 CG LYS A 24 -5.078 -18.995 7.214 1.00 72.22 C ATOM 376 CD LYS A 24 -6.541 -18.609 6.998 1.00 4.24 C ATOM 377 CE LYS A 24 -7.306 -19.702 6.256 1.00 63.54 C ATOM 378 NZ LYS A 24 -8.740 -19.359 6.079 1.00 50.02 N ATOM 0 H LYS A 24 -3.706 -19.401 3.548 1.00 21.50 H new ATOM 0 HA LYS A 24 -5.015 -17.374 4.971 1.00 74.51 H new ATOM 0 HB2 LYS A 24 -4.934 -19.957 5.302 1.00 42.14 H new ATOM 0 HB3 LYS A 24 -3.393 -19.714 6.100 1.00 42.14 H new ATOM 0 HG2 LYS A 24 -5.026 -19.892 7.831 1.00 72.22 H new ATOM 0 HG3 LYS A 24 -4.570 -18.201 7.762 1.00 72.22 H new ATOM 0 HD2 LYS A 24 -7.015 -18.422 7.962 1.00 4.24 H new ATOM 0 HD3 LYS A 24 -6.593 -17.679 6.432 1.00 4.24 H new ATOM 0 HE2 LYS A 24 -6.849 -19.864 5.280 1.00 63.54 H new ATOM 0 HE3 LYS A 24 -7.223 -20.639 6.806 1.00 63.54 H new ATOM 0 HZ1 LYS A 24 -9.221 -20.128 5.571 1.00 50.02 H new ATOM 0 HZ2 LYS A 24 -9.183 -19.229 7.011 1.00 50.02 H new ATOM 0 HZ3 LYS A 24 -8.821 -18.479 5.531 1.00 50.02 H new ATOM 392 N GLN A 25 -1.831 -17.073 5.178 1.00 24.13 N ATOM 393 CA GLN A 25 -0.702 -16.381 5.820 1.00 13.51 C ATOM 394 C GLN A 25 -1.046 -14.938 6.243 1.00 41.12 C ATOM 395 O GLN A 25 -0.720 -14.524 7.356 1.00 54.14 O ATOM 396 CB GLN A 25 0.520 -16.380 4.893 1.00 45.45 C ATOM 397 CG GLN A 25 1.754 -15.703 5.488 1.00 1.33 C ATOM 398 CD GLN A 25 2.246 -16.367 6.767 1.00 72.53 C ATOM 399 OE1 GLN A 25 3.058 -17.286 6.735 1.00 42.51 O ATOM 400 NE2 GLN A 25 1.764 -15.907 7.906 1.00 71.04 N ATOM 0 H GLN A 25 -1.600 -17.515 4.288 1.00 24.13 H new ATOM 0 HA GLN A 25 -0.472 -16.934 6.730 1.00 13.51 H new ATOM 0 HB2 GLN A 25 0.771 -17.410 4.639 1.00 45.45 H new ATOM 0 HB3 GLN A 25 0.256 -15.877 3.962 1.00 45.45 H new ATOM 0 HG2 GLN A 25 2.556 -15.712 4.750 1.00 1.33 H new ATOM 0 HG3 GLN A 25 1.523 -14.658 5.695 1.00 1.33 H new ATOM 0 HE21 GLN A 25 1.090 -15.142 7.902 1.00 71.04 H new ATOM 0 HE22 GLN A 25 2.066 -16.317 8.790 1.00 71.04 H new ATOM 409 N LEU A 26 -1.712 -14.182 5.366 1.00 24.33 N ATOM 410 CA LEU A 26 -2.090 -12.793 5.681 1.00 72.55 C ATOM 411 C LEU A 26 -2.991 -12.713 6.923 1.00 64.11 C ATOM 412 O LEU A 26 -2.936 -11.752 7.687 1.00 1.04 O ATOM 413 CB LEU A 26 -2.799 -12.134 4.490 1.00 65.13 C ATOM 414 CG LEU A 26 -1.930 -11.895 3.244 1.00 50.22 C ATOM 415 CD1 LEU A 26 -2.739 -11.188 2.162 1.00 32.21 C ATOM 416 CD2 LEU A 26 -0.677 -11.091 3.595 1.00 41.40 C ATOM 0 H LEU A 26 -2.000 -14.500 4.441 1.00 24.33 H new ATOM 0 HA LEU A 26 -1.166 -12.255 5.893 1.00 72.55 H new ATOM 0 HB2 LEU A 26 -3.646 -12.758 4.205 1.00 65.13 H new ATOM 0 HB3 LEU A 26 -3.204 -11.176 4.817 1.00 65.13 H new ATOM 0 HG LEU A 26 -1.609 -12.863 2.861 1.00 50.22 H new ATOM 0 HD11 LEU A 26 -2.111 -11.025 1.286 1.00 32.21 H new ATOM 0 HD12 LEU A 26 -3.594 -11.805 1.886 1.00 32.21 H new ATOM 0 HD13 LEU A 26 -3.091 -10.228 2.540 1.00 32.21 H new ATOM 0 HD21 LEU A 26 -0.080 -10.936 2.696 1.00 41.40 H new ATOM 0 HD22 LEU A 26 -0.968 -10.125 4.008 1.00 41.40 H new ATOM 0 HD23 LEU A 26 -0.088 -11.638 4.332 1.00 41.40 H new ATOM 428 N TYR A 27 -3.813 -13.735 7.122 1.00 64.12 N ATOM 429 CA TYR A 27 -4.716 -13.782 8.272 1.00 61.52 C ATOM 430 C TYR A 27 -3.977 -14.197 9.552 1.00 42.30 C ATOM 431 O TYR A 27 -4.334 -13.778 10.646 1.00 23.35 O ATOM 432 CB TYR A 27 -5.878 -14.740 7.990 1.00 12.34 C ATOM 433 CG TYR A 27 -6.818 -14.247 6.905 1.00 12.32 C ATOM 434 CD1 TYR A 27 -6.537 -14.459 5.559 1.00 13.44 C ATOM 435 CD2 TYR A 27 -7.985 -13.563 7.230 1.00 24.10 C ATOM 436 CE1 TYR A 27 -7.390 -14.006 4.571 1.00 13.53 C ATOM 437 CE2 TYR A 27 -8.843 -13.107 6.247 1.00 73.51 C ATOM 438 CZ TYR A 27 -8.542 -13.331 4.920 1.00 43.50 C ATOM 439 OH TYR A 27 -9.394 -12.879 3.938 1.00 55.10 O ATOM 0 H TYR A 27 -3.876 -14.544 6.504 1.00 64.12 H new ATOM 0 HA TYR A 27 -5.111 -12.779 8.430 1.00 61.52 H new ATOM 0 HB2 TYR A 27 -5.476 -15.710 7.698 1.00 12.34 H new ATOM 0 HB3 TYR A 27 -6.444 -14.892 8.909 1.00 12.34 H new ATOM 0 HD1 TYR A 27 -5.637 -14.987 5.282 1.00 13.44 H new ATOM 0 HD2 TYR A 27 -8.225 -13.385 8.268 1.00 24.10 H new ATOM 0 HE1 TYR A 27 -7.156 -14.179 3.531 1.00 13.53 H new ATOM 0 HE2 TYR A 27 -9.745 -12.578 6.517 1.00 73.51 H new ATOM 0 HH TYR A 27 -9.202 -13.345 3.098 1.00 55.10 H new ATOM 449 N GLU A 28 -2.930 -14.997 9.416 1.00 13.34 N ATOM 450 CA GLU A 28 -2.184 -15.497 10.580 1.00 11.25 C ATOM 451 C GLU A 28 -1.188 -14.457 11.137 1.00 12.55 C ATOM 452 O GLU A 28 -0.500 -14.721 12.123 1.00 41.13 O ATOM 453 CB GLU A 28 -1.442 -16.788 10.202 1.00 2.35 C ATOM 454 CG GLU A 28 -2.368 -17.915 9.753 1.00 43.50 C ATOM 455 CD GLU A 28 -1.612 -19.178 9.375 1.00 31.04 C ATOM 456 OE1 GLU A 28 -1.284 -19.975 10.281 1.00 70.10 O ATOM 457 OE2 GLU A 28 -1.331 -19.377 8.173 1.00 44.53 O ATOM 0 H GLU A 28 -2.572 -15.318 8.517 1.00 13.34 H new ATOM 0 HA GLU A 28 -2.908 -15.699 11.370 1.00 11.25 H new ATOM 0 HB2 GLU A 28 -0.734 -16.570 9.402 1.00 2.35 H new ATOM 0 HB3 GLU A 28 -0.860 -17.127 11.059 1.00 2.35 H new ATOM 0 HG2 GLU A 28 -3.071 -18.143 10.554 1.00 43.50 H new ATOM 0 HG3 GLU A 28 -2.956 -17.579 8.899 1.00 43.50 H new ATOM 464 N LEU A 29 -1.136 -13.271 10.525 1.00 54.34 N ATOM 465 CA LEU A 29 -0.144 -12.244 10.894 1.00 21.51 C ATOM 466 C LEU A 29 -0.394 -11.619 12.284 1.00 72.44 C ATOM 467 O LEU A 29 0.505 -11.592 13.126 1.00 51.42 O ATOM 468 CB LEU A 29 -0.123 -11.125 9.839 1.00 20.44 C ATOM 469 CG LEU A 29 0.205 -11.568 8.404 1.00 64.03 C ATOM 470 CD1 LEU A 29 0.211 -10.367 7.457 1.00 23.41 C ATOM 471 CD2 LEU A 29 1.538 -12.314 8.350 1.00 72.44 C ATOM 0 H LEU A 29 -1.766 -12.993 9.772 1.00 54.34 H new ATOM 0 HA LEU A 29 0.818 -12.755 10.936 1.00 21.51 H new ATOM 0 HB2 LEU A 29 -1.097 -10.636 9.835 1.00 20.44 H new ATOM 0 HB3 LEU A 29 0.608 -10.376 10.145 1.00 20.44 H new ATOM 0 HG LEU A 29 -0.574 -12.256 8.076 1.00 64.03 H new ATOM 0 HD11 LEU A 29 0.445 -10.702 6.446 1.00 23.41 H new ATOM 0 HD12 LEU A 29 -0.771 -9.893 7.464 1.00 23.41 H new ATOM 0 HD13 LEU A 29 0.963 -9.649 7.785 1.00 23.41 H new ATOM 0 HD21 LEU A 29 1.745 -12.616 7.323 1.00 72.44 H new ATOM 0 HD22 LEU A 29 2.335 -11.660 8.704 1.00 72.44 H new ATOM 0 HD23 LEU A 29 1.486 -13.199 8.984 1.00 72.44 H new ATOM 483 N ASP A 30 -1.608 -11.113 12.522 1.00 75.11 N ATOM 484 CA ASP A 30 -1.896 -10.345 13.749 1.00 25.43 C ATOM 485 C ASP A 30 -2.546 -11.181 14.866 1.00 72.22 C ATOM 486 O ASP A 30 -2.216 -11.012 16.040 1.00 52.15 O ATOM 487 CB ASP A 30 -2.819 -9.170 13.412 1.00 75.20 C ATOM 488 CG ASP A 30 -2.210 -8.232 12.388 1.00 72.20 C ATOM 489 OD1 ASP A 30 -2.363 -8.492 11.183 1.00 25.02 O ATOM 490 OD2 ASP A 30 -1.569 -7.238 12.797 1.00 22.10 O ATOM 0 H ASP A 30 -2.403 -11.217 11.892 1.00 75.11 H new ATOM 0 HA ASP A 30 -0.933 -10.001 14.127 1.00 25.43 H new ATOM 0 HB2 ASP A 30 -3.766 -9.553 13.032 1.00 75.20 H new ATOM 0 HB3 ASP A 30 -3.042 -8.614 14.323 1.00 75.20 H new ATOM 495 N GLY A 31 -3.466 -12.076 14.506 1.00 10.44 N ATOM 496 CA GLY A 31 -4.263 -12.782 15.518 1.00 13.14 C ATOM 497 C GLY A 31 -5.296 -11.877 16.206 1.00 34.31 C ATOM 498 O GLY A 31 -5.932 -12.272 17.183 1.00 25.50 O ATOM 0 H GLY A 31 -3.678 -12.329 13.541 1.00 10.44 H new ATOM 0 HA2 GLY A 31 -4.778 -13.620 15.048 1.00 13.14 H new ATOM 0 HA3 GLY A 31 -3.596 -13.200 16.271 1.00 13.14 H new ATOM 502 N ASP A 32 -5.463 -10.665 15.677 1.00 43.11 N ATOM 503 CA ASP A 32 -6.367 -9.655 16.248 1.00 72.11 C ATOM 504 C ASP A 32 -7.812 -9.822 15.712 1.00 4.55 C ATOM 505 O ASP A 32 -8.008 -10.287 14.587 1.00 15.30 O ATOM 506 CB ASP A 32 -5.814 -8.262 15.896 1.00 73.03 C ATOM 507 CG ASP A 32 -6.571 -7.122 16.557 1.00 24.44 C ATOM 508 OD1 ASP A 32 -7.558 -6.639 15.972 1.00 42.22 O ATOM 509 OD2 ASP A 32 -6.180 -6.700 17.664 1.00 62.20 O ATOM 0 H ASP A 32 -4.976 -10.351 14.838 1.00 43.11 H new ATOM 0 HA ASP A 32 -6.414 -9.779 17.330 1.00 72.11 H new ATOM 0 HB2 ASP A 32 -4.766 -8.211 16.192 1.00 73.03 H new ATOM 0 HB3 ASP A 32 -5.847 -8.130 14.815 1.00 73.03 H new ATOM 514 N PRO A 33 -8.846 -9.480 16.512 1.00 3.53 N ATOM 515 CA PRO A 33 -10.252 -9.490 16.047 1.00 43.02 C ATOM 516 C PRO A 33 -10.498 -8.572 14.829 1.00 41.20 C ATOM 517 O PRO A 33 -11.110 -8.981 13.848 1.00 14.33 O ATOM 518 CB PRO A 33 -11.047 -8.997 17.273 1.00 15.13 C ATOM 519 CG PRO A 33 -10.032 -8.353 18.163 1.00 4.13 C ATOM 520 CD PRO A 33 -8.754 -9.108 17.938 1.00 52.52 C ATOM 0 HA PRO A 33 -10.548 -10.481 15.702 1.00 43.02 H new ATOM 0 HB2 PRO A 33 -11.822 -8.288 16.981 1.00 15.13 H new ATOM 0 HB3 PRO A 33 -11.546 -9.824 17.778 1.00 15.13 H new ATOM 0 HG2 PRO A 33 -9.911 -7.298 17.919 1.00 4.13 H new ATOM 0 HG3 PRO A 33 -10.338 -8.405 19.208 1.00 4.13 H new ATOM 0 HD2 PRO A 33 -7.878 -8.492 18.140 1.00 52.52 H new ATOM 0 HD3 PRO A 33 -8.682 -9.985 18.582 1.00 52.52 H new ATOM 528 N LYS A 34 -10.000 -7.339 14.889 1.00 74.02 N ATOM 529 CA LYS A 34 -10.179 -6.371 13.793 1.00 11.23 C ATOM 530 C LYS A 34 -9.437 -6.814 12.522 1.00 34.14 C ATOM 531 O LYS A 34 -9.793 -6.429 11.409 1.00 43.10 O ATOM 532 CB LYS A 34 -9.679 -5.000 14.228 1.00 42.43 C ATOM 533 CG LYS A 34 -10.395 -4.488 15.464 1.00 3.55 C ATOM 534 CD LYS A 34 -9.899 -3.118 15.884 1.00 50.43 C ATOM 535 CE LYS A 34 -8.410 -3.125 16.223 1.00 60.33 C ATOM 536 NZ LYS A 34 -8.057 -4.187 17.207 1.00 11.54 N ATOM 0 H LYS A 34 -9.468 -6.980 15.682 1.00 74.02 H new ATOM 0 HA LYS A 34 -11.243 -6.320 13.562 1.00 11.23 H new ATOM 0 HB2 LYS A 34 -8.609 -5.053 14.427 1.00 42.43 H new ATOM 0 HB3 LYS A 34 -9.816 -4.291 13.412 1.00 42.43 H new ATOM 0 HG2 LYS A 34 -11.466 -4.441 15.268 1.00 3.55 H new ATOM 0 HG3 LYS A 34 -10.251 -5.192 16.284 1.00 3.55 H new ATOM 0 HD2 LYS A 34 -10.084 -2.404 15.081 1.00 50.43 H new ATOM 0 HD3 LYS A 34 -10.466 -2.778 16.750 1.00 50.43 H new ATOM 0 HE2 LYS A 34 -7.833 -3.273 15.310 1.00 60.33 H new ATOM 0 HE3 LYS A 34 -8.127 -2.152 16.625 1.00 60.33 H new ATOM 0 HZ1 LYS A 34 -7.098 -4.018 17.571 1.00 11.54 H new ATOM 0 HZ2 LYS A 34 -8.735 -4.169 17.995 1.00 11.54 H new ATOM 0 HZ3 LYS A 34 -8.092 -5.117 16.742 1.00 11.54 H new ATOM 550 N ARG A 35 -8.400 -7.624 12.716 1.00 74.11 N ATOM 551 CA ARG A 35 -7.561 -8.145 11.624 1.00 75.55 C ATOM 552 C ARG A 35 -8.377 -8.733 10.455 1.00 23.54 C ATOM 553 O ARG A 35 -8.315 -8.221 9.334 1.00 62.35 O ATOM 554 CB ARG A 35 -6.618 -9.208 12.198 1.00 40.33 C ATOM 555 CG ARG A 35 -6.092 -10.225 11.190 1.00 33.11 C ATOM 556 CD ARG A 35 -5.589 -11.478 11.896 1.00 60.40 C ATOM 557 NE ARG A 35 -6.559 -11.984 12.881 1.00 35.52 N ATOM 558 CZ ARG A 35 -6.793 -13.251 13.122 1.00 0.10 C ATOM 559 NH1 ARG A 35 -6.188 -14.177 12.456 1.00 13.10 N ATOM 560 NH2 ARG A 35 -7.639 -13.587 14.041 1.00 71.55 N ATOM 0 H ARG A 35 -8.110 -7.944 13.640 1.00 74.11 H new ATOM 0 HA ARG A 35 -7.000 -7.308 11.208 1.00 75.55 H new ATOM 0 HB2 ARG A 35 -5.768 -8.705 12.659 1.00 40.33 H new ATOM 0 HB3 ARG A 35 -7.140 -9.743 12.991 1.00 40.33 H new ATOM 0 HG2 ARG A 35 -6.883 -10.490 10.488 1.00 33.11 H new ATOM 0 HG3 ARG A 35 -5.284 -9.782 10.607 1.00 33.11 H new ATOM 0 HD2 ARG A 35 -5.385 -12.253 11.157 1.00 60.40 H new ATOM 0 HD3 ARG A 35 -4.646 -11.258 12.396 1.00 60.40 H new ATOM 0 HE ARG A 35 -7.089 -11.297 13.417 1.00 35.52 H new ATOM 0 HH11 ARG A 35 -5.517 -13.927 11.730 1.00 13.10 H new ATOM 0 HH12 ARG A 35 -6.381 -15.158 12.656 1.00 13.10 H new ATOM 0 HH21 ARG A 35 -8.123 -12.866 14.577 1.00 71.55 H new ATOM 0 HH22 ARG A 35 -7.822 -14.572 14.230 1.00 71.55 H new ATOM 574 N LYS A 36 -9.138 -9.811 10.704 1.00 3.31 N ATOM 575 CA LYS A 36 -9.846 -10.496 9.609 1.00 23.54 C ATOM 576 C LYS A 36 -10.873 -9.562 8.955 1.00 40.44 C ATOM 577 O LYS A 36 -11.156 -9.678 7.768 1.00 24.52 O ATOM 578 CB LYS A 36 -10.523 -11.809 10.069 1.00 44.24 C ATOM 579 CG LYS A 36 -11.886 -11.641 10.750 1.00 63.20 C ATOM 580 CD LYS A 36 -11.771 -11.252 12.219 1.00 72.35 C ATOM 581 CE LYS A 36 -11.304 -12.417 13.087 1.00 51.24 C ATOM 582 NZ LYS A 36 -12.242 -13.573 13.019 1.00 4.42 N ATOM 0 H LYS A 36 -9.278 -10.219 11.628 1.00 3.31 H new ATOM 0 HA LYS A 36 -9.092 -10.767 8.869 1.00 23.54 H new ATOM 0 HB2 LYS A 36 -10.646 -12.458 9.202 1.00 44.24 H new ATOM 0 HB3 LYS A 36 -9.852 -12.322 10.758 1.00 44.24 H new ATOM 0 HG2 LYS A 36 -12.459 -10.879 10.221 1.00 63.20 H new ATOM 0 HG3 LYS A 36 -12.444 -12.574 10.669 1.00 63.20 H new ATOM 0 HD2 LYS A 36 -11.071 -10.422 12.320 1.00 72.35 H new ATOM 0 HD3 LYS A 36 -12.738 -10.899 12.577 1.00 72.35 H new ATOM 0 HE2 LYS A 36 -10.312 -12.735 12.765 1.00 51.24 H new ATOM 0 HE3 LYS A 36 -11.212 -12.085 14.121 1.00 51.24 H new ATOM 0 HZ1 LYS A 36 -12.107 -14.179 13.853 1.00 4.42 H new ATOM 0 HZ2 LYS A 36 -13.222 -13.224 12.999 1.00 4.42 H new ATOM 0 HZ3 LYS A 36 -12.053 -14.123 12.157 1.00 4.42 H new ATOM 596 N GLU A 37 -11.412 -8.630 9.741 1.00 35.13 N ATOM 597 CA GLU A 37 -12.337 -7.615 9.227 1.00 14.13 C ATOM 598 C GLU A 37 -11.629 -6.676 8.241 1.00 4.42 C ATOM 599 O GLU A 37 -12.109 -6.446 7.135 1.00 13.30 O ATOM 600 CB GLU A 37 -12.926 -6.802 10.386 1.00 43.54 C ATOM 601 CG GLU A 37 -13.780 -7.626 11.345 1.00 62.51 C ATOM 602 CD GLU A 37 -14.306 -6.811 12.515 1.00 1.13 C ATOM 603 OE1 GLU A 37 -14.990 -5.794 12.275 1.00 41.45 O ATOM 604 OE2 GLU A 37 -14.051 -7.190 13.680 1.00 42.20 O ATOM 0 H GLU A 37 -11.224 -8.555 10.741 1.00 35.13 H new ATOM 0 HA GLU A 37 -13.142 -8.127 8.699 1.00 14.13 H new ATOM 0 HB2 GLU A 37 -12.112 -6.341 10.945 1.00 43.54 H new ATOM 0 HB3 GLU A 37 -13.532 -5.993 9.979 1.00 43.54 H new ATOM 0 HG2 GLU A 37 -14.621 -8.054 10.799 1.00 62.51 H new ATOM 0 HG3 GLU A 37 -13.190 -8.460 11.725 1.00 62.51 H new ATOM 611 N PHE A 38 -10.478 -6.140 8.656 1.00 13.45 N ATOM 612 CA PHE A 38 -9.662 -5.274 7.795 1.00 0.44 C ATOM 613 C PHE A 38 -9.374 -5.952 6.446 1.00 22.31 C ATOM 614 O PHE A 38 -9.589 -5.368 5.382 1.00 2.54 O ATOM 615 CB PHE A 38 -8.340 -4.927 8.503 1.00 65.41 C ATOM 616 CG PHE A 38 -7.414 -4.046 7.692 1.00 3.34 C ATOM 617 CD1 PHE A 38 -6.497 -4.601 6.805 1.00 44.32 C ATOM 618 CD2 PHE A 38 -7.454 -2.666 7.826 1.00 3.33 C ATOM 619 CE1 PHE A 38 -5.649 -3.797 6.068 1.00 64.42 C ATOM 620 CE2 PHE A 38 -6.607 -1.859 7.089 1.00 73.34 C ATOM 621 CZ PHE A 38 -5.704 -2.425 6.211 1.00 50.31 C ATOM 0 H PHE A 38 -10.088 -6.290 9.586 1.00 13.45 H new ATOM 0 HA PHE A 38 -10.220 -4.358 7.603 1.00 0.44 H new ATOM 0 HB2 PHE A 38 -8.566 -4.427 9.445 1.00 65.41 H new ATOM 0 HB3 PHE A 38 -7.819 -5.852 8.750 1.00 65.41 H new ATOM 0 HD1 PHE A 38 -6.447 -5.674 6.691 1.00 44.32 H new ATOM 0 HD2 PHE A 38 -8.155 -2.217 8.514 1.00 3.33 H new ATOM 0 HE1 PHE A 38 -4.944 -4.241 5.381 1.00 64.42 H new ATOM 0 HE2 PHE A 38 -6.652 -0.786 7.200 1.00 73.34 H new ATOM 0 HZ PHE A 38 -5.041 -1.795 5.637 1.00 50.31 H new ATOM 631 N LEU A 39 -8.894 -7.191 6.511 1.00 2.24 N ATOM 632 CA LEU A 39 -8.569 -7.963 5.309 1.00 61.15 C ATOM 633 C LEU A 39 -9.826 -8.290 4.485 1.00 73.21 C ATOM 634 O LEU A 39 -9.824 -8.158 3.263 1.00 62.11 O ATOM 635 CB LEU A 39 -7.844 -9.259 5.697 1.00 61.20 C ATOM 636 CG LEU A 39 -6.509 -9.069 6.440 1.00 40.31 C ATOM 637 CD1 LEU A 39 -5.913 -10.420 6.826 1.00 32.53 C ATOM 638 CD2 LEU A 39 -5.524 -8.260 5.592 1.00 74.43 C ATOM 0 H LEU A 39 -8.720 -7.686 7.386 1.00 2.24 H new ATOM 0 HA LEU A 39 -7.915 -7.351 4.688 1.00 61.15 H new ATOM 0 HB2 LEU A 39 -8.508 -9.854 6.324 1.00 61.20 H new ATOM 0 HB3 LEU A 39 -7.658 -9.837 4.792 1.00 61.20 H new ATOM 0 HG LEU A 39 -6.704 -8.509 7.354 1.00 40.31 H new ATOM 0 HD11 LEU A 39 -4.970 -10.265 7.350 1.00 32.53 H new ATOM 0 HD12 LEU A 39 -6.607 -10.951 7.477 1.00 32.53 H new ATOM 0 HD13 LEU A 39 -5.736 -11.010 5.927 1.00 32.53 H new ATOM 0 HD21 LEU A 39 -4.588 -8.139 6.138 1.00 74.43 H new ATOM 0 HD22 LEU A 39 -5.333 -8.785 4.656 1.00 74.43 H new ATOM 0 HD23 LEU A 39 -5.949 -7.279 5.378 1.00 74.43 H new ATOM 650 N ASP A 40 -10.896 -8.708 5.161 1.00 61.14 N ATOM 651 CA ASP A 40 -12.150 -9.068 4.486 1.00 32.20 C ATOM 652 C ASP A 40 -12.737 -7.868 3.721 1.00 34.35 C ATOM 653 O ASP A 40 -13.059 -7.972 2.533 1.00 70.41 O ATOM 654 CB ASP A 40 -13.164 -9.589 5.513 1.00 11.50 C ATOM 655 CG ASP A 40 -14.414 -10.149 4.861 1.00 34.04 C ATOM 656 OD1 ASP A 40 -14.421 -11.351 4.519 1.00 33.53 O ATOM 657 OD2 ASP A 40 -15.392 -9.393 4.686 1.00 30.33 O ATOM 0 H ASP A 40 -10.923 -8.807 6.176 1.00 61.14 H new ATOM 0 HA ASP A 40 -11.934 -9.853 3.762 1.00 32.20 H new ATOM 0 HB2 ASP A 40 -12.696 -10.364 6.120 1.00 11.50 H new ATOM 0 HB3 ASP A 40 -13.441 -8.779 6.188 1.00 11.50 H new ATOM 662 N ASP A 41 -12.869 -6.732 4.410 1.00 54.04 N ATOM 663 CA ASP A 41 -13.315 -5.486 3.778 1.00 50.43 C ATOM 664 C ASP A 41 -12.373 -5.071 2.635 1.00 75.44 C ATOM 665 O ASP A 41 -12.825 -4.625 1.584 1.00 11.44 O ATOM 666 CB ASP A 41 -13.410 -4.360 4.818 1.00 5.51 C ATOM 667 CG ASP A 41 -14.677 -4.441 5.657 1.00 62.40 C ATOM 668 OD1 ASP A 41 -14.702 -5.192 6.655 1.00 74.20 O ATOM 669 OD2 ASP A 41 -15.661 -3.749 5.316 1.00 23.22 O ATOM 0 H ASP A 41 -12.673 -6.648 5.408 1.00 54.04 H new ATOM 0 HA ASP A 41 -14.304 -5.664 3.356 1.00 50.43 H new ATOM 0 HB2 ASP A 41 -12.541 -4.403 5.475 1.00 5.51 H new ATOM 0 HB3 ASP A 41 -13.377 -3.397 4.309 1.00 5.51 H new ATOM 674 N LEU A 42 -11.066 -5.227 2.850 1.00 11.04 N ATOM 675 CA LEU A 42 -10.060 -4.913 1.823 1.00 32.51 C ATOM 676 C LEU A 42 -10.287 -5.727 0.538 1.00 50.45 C ATOM 677 O LEU A 42 -10.512 -5.163 -0.536 1.00 34.04 O ATOM 678 CB LEU A 42 -8.650 -5.194 2.371 1.00 43.54 C ATOM 679 CG LEU A 42 -7.498 -5.083 1.353 1.00 23.34 C ATOM 680 CD1 LEU A 42 -7.366 -3.656 0.827 1.00 43.30 C ATOM 681 CD2 LEU A 42 -6.186 -5.561 1.976 1.00 22.15 C ATOM 0 H LEU A 42 -10.674 -5.570 3.727 1.00 11.04 H new ATOM 0 HA LEU A 42 -10.157 -3.856 1.573 1.00 32.51 H new ATOM 0 HB2 LEU A 42 -8.454 -4.501 3.189 1.00 43.54 H new ATOM 0 HB3 LEU A 42 -8.639 -6.198 2.795 1.00 43.54 H new ATOM 0 HG LEU A 42 -7.729 -5.728 0.505 1.00 23.34 H new ATOM 0 HD11 LEU A 42 -6.546 -3.607 0.111 1.00 43.30 H new ATOM 0 HD12 LEU A 42 -8.294 -3.362 0.337 1.00 43.30 H new ATOM 0 HD13 LEU A 42 -7.164 -2.979 1.657 1.00 43.30 H new ATOM 0 HD21 LEU A 42 -5.383 -5.476 1.244 1.00 22.15 H new ATOM 0 HD22 LEU A 42 -5.951 -4.947 2.845 1.00 22.15 H new ATOM 0 HD23 LEU A 42 -6.287 -6.602 2.284 1.00 22.15 H new ATOM 693 N PHE A 43 -10.254 -7.051 0.664 1.00 1.35 N ATOM 694 CA PHE A 43 -10.388 -7.943 -0.490 1.00 30.24 C ATOM 695 C PHE A 43 -11.759 -7.792 -1.165 1.00 71.30 C ATOM 696 O PHE A 43 -11.848 -7.691 -2.384 1.00 74.22 O ATOM 697 CB PHE A 43 -10.159 -9.404 -0.070 1.00 62.11 C ATOM 698 CG PHE A 43 -8.803 -9.658 0.546 1.00 3.24 C ATOM 699 CD1 PHE A 43 -7.659 -9.104 -0.012 1.00 34.14 C ATOM 700 CD2 PHE A 43 -8.673 -10.457 1.673 1.00 51.24 C ATOM 701 CE1 PHE A 43 -6.415 -9.341 0.543 1.00 33.11 C ATOM 702 CE2 PHE A 43 -7.431 -10.695 2.232 1.00 14.51 C ATOM 703 CZ PHE A 43 -6.301 -10.137 1.665 1.00 40.21 C ATOM 0 H PHE A 43 -10.135 -7.533 1.555 1.00 1.35 H new ATOM 0 HA PHE A 43 -9.626 -7.659 -1.216 1.00 30.24 H new ATOM 0 HB2 PHE A 43 -10.931 -9.692 0.643 1.00 62.11 H new ATOM 0 HB3 PHE A 43 -10.277 -10.046 -0.943 1.00 62.11 H new ATOM 0 HD1 PHE A 43 -7.742 -8.481 -0.890 1.00 34.14 H new ATOM 0 HD2 PHE A 43 -9.552 -10.898 2.119 1.00 51.24 H new ATOM 0 HE1 PHE A 43 -5.533 -8.904 0.099 1.00 33.11 H new ATOM 0 HE2 PHE A 43 -7.344 -11.316 3.111 1.00 14.51 H new ATOM 0 HZ PHE A 43 -5.330 -10.323 2.099 1.00 40.21 H new ATOM 713 N SER A 44 -12.824 -7.755 -0.362 1.00 3.21 N ATOM 714 CA SER A 44 -14.194 -7.640 -0.894 1.00 32.24 C ATOM 715 C SER A 44 -14.415 -6.300 -1.611 1.00 13.23 C ATOM 716 O SER A 44 -15.007 -6.255 -2.691 1.00 64.04 O ATOM 717 CB SER A 44 -15.226 -7.809 0.234 1.00 11.24 C ATOM 718 OG SER A 44 -15.082 -9.071 0.874 1.00 4.53 O ATOM 0 H SER A 44 -12.771 -7.802 0.656 1.00 3.21 H new ATOM 0 HA SER A 44 -14.327 -8.438 -1.625 1.00 32.24 H new ATOM 0 HB2 SER A 44 -15.104 -7.010 0.966 1.00 11.24 H new ATOM 0 HB3 SER A 44 -16.233 -7.717 -0.173 1.00 11.24 H new ATOM 0 HG SER A 44 -14.377 -9.015 1.553 1.00 4.53 H new ATOM 724 N PHE A 45 -13.925 -5.212 -1.014 1.00 4.30 N ATOM 725 CA PHE A 45 -14.044 -3.874 -1.610 1.00 24.22 C ATOM 726 C PHE A 45 -13.412 -3.821 -3.012 1.00 24.54 C ATOM 727 O PHE A 45 -14.076 -3.476 -3.995 1.00 21.20 O ATOM 728 CB PHE A 45 -13.389 -2.826 -0.693 1.00 44.31 C ATOM 729 CG PHE A 45 -13.292 -1.445 -1.300 1.00 43.23 C ATOM 730 CD1 PHE A 45 -14.417 -0.638 -1.424 1.00 33.44 C ATOM 731 CD2 PHE A 45 -12.070 -0.953 -1.743 1.00 51.21 C ATOM 732 CE1 PHE A 45 -14.324 0.626 -1.980 1.00 31.45 C ATOM 733 CE2 PHE A 45 -11.976 0.308 -2.299 1.00 24.15 C ATOM 734 CZ PHE A 45 -13.100 1.098 -2.418 1.00 55.02 C ATOM 0 H PHE A 45 -13.441 -5.228 -0.117 1.00 4.30 H new ATOM 0 HA PHE A 45 -15.105 -3.648 -1.715 1.00 24.22 H new ATOM 0 HB2 PHE A 45 -13.959 -2.764 0.234 1.00 44.31 H new ATOM 0 HB3 PHE A 45 -12.387 -3.166 -0.429 1.00 44.31 H new ATOM 0 HD1 PHE A 45 -15.375 -1.002 -1.082 1.00 33.44 H new ATOM 0 HD2 PHE A 45 -11.184 -1.564 -1.651 1.00 51.21 H new ATOM 0 HE1 PHE A 45 -15.206 1.243 -2.072 1.00 31.45 H new ATOM 0 HE2 PHE A 45 -11.020 0.676 -2.641 1.00 24.15 H new ATOM 0 HZ PHE A 45 -13.025 2.084 -2.853 1.00 55.02 H new ATOM 744 N MET A 46 -12.131 -4.168 -3.105 1.00 31.14 N ATOM 745 CA MET A 46 -11.426 -4.134 -4.387 1.00 72.32 C ATOM 746 C MET A 46 -11.959 -5.207 -5.356 1.00 14.04 C ATOM 747 O MET A 46 -12.036 -4.982 -6.565 1.00 55.44 O ATOM 748 CB MET A 46 -9.913 -4.283 -4.175 1.00 11.20 C ATOM 749 CG MET A 46 -9.491 -5.605 -3.548 1.00 53.25 C ATOM 750 SD MET A 46 -7.704 -5.727 -3.358 1.00 33.11 S ATOM 751 CE MET A 46 -7.174 -5.474 -5.051 1.00 63.23 C ATOM 0 H MET A 46 -11.562 -4.474 -2.316 1.00 31.14 H new ATOM 0 HA MET A 46 -11.614 -3.163 -4.845 1.00 72.32 H new ATOM 0 HB2 MET A 46 -9.412 -4.175 -5.137 1.00 11.20 H new ATOM 0 HB3 MET A 46 -9.566 -3.467 -3.541 1.00 11.20 H new ATOM 0 HG2 MET A 46 -9.967 -5.711 -2.573 1.00 53.25 H new ATOM 0 HG3 MET A 46 -9.846 -6.429 -4.167 1.00 53.25 H new ATOM 0 HE1 MET A 46 -6.085 -5.432 -5.089 1.00 63.23 H new ATOM 0 HE2 MET A 46 -7.527 -6.299 -5.670 1.00 63.23 H new ATOM 0 HE3 MET A 46 -7.587 -4.537 -5.425 1.00 63.23 H new ATOM 761 N GLN A 47 -12.355 -6.359 -4.818 1.00 44.35 N ATOM 762 CA GLN A 47 -12.930 -7.434 -5.634 1.00 33.24 C ATOM 763 C GLN A 47 -14.190 -6.955 -6.365 1.00 71.30 C ATOM 764 O GLN A 47 -14.334 -7.139 -7.575 1.00 5.02 O ATOM 765 CB GLN A 47 -13.269 -8.644 -4.754 1.00 34.01 C ATOM 766 CG GLN A 47 -13.837 -9.832 -5.519 1.00 74.40 C ATOM 767 CD GLN A 47 -14.143 -11.014 -4.618 1.00 45.04 C ATOM 768 OE1 GLN A 47 -14.493 -10.852 -3.454 1.00 22.13 O ATOM 769 NE2 GLN A 47 -14.012 -12.212 -5.148 1.00 12.11 N ATOM 0 H GLN A 47 -12.290 -6.575 -3.823 1.00 44.35 H new ATOM 0 HA GLN A 47 -12.189 -7.726 -6.378 1.00 33.24 H new ATOM 0 HB2 GLN A 47 -12.368 -8.961 -4.229 1.00 34.01 H new ATOM 0 HB3 GLN A 47 -13.989 -8.337 -3.995 1.00 34.01 H new ATOM 0 HG2 GLN A 47 -14.748 -9.526 -6.033 1.00 74.40 H new ATOM 0 HG3 GLN A 47 -13.126 -10.139 -6.286 1.00 74.40 H new ATOM 0 HE21 GLN A 47 -13.719 -12.310 -6.120 1.00 12.11 H new ATOM 0 HE22 GLN A 47 -14.204 -13.042 -4.587 1.00 12.11 H new ATOM 778 N LYS A 48 -15.087 -6.315 -5.622 1.00 30.33 N ATOM 779 CA LYS A 48 -16.359 -5.839 -6.172 1.00 4.31 C ATOM 780 C LYS A 48 -16.175 -4.680 -7.167 1.00 52.32 C ATOM 781 O LYS A 48 -17.056 -4.423 -7.989 1.00 13.31 O ATOM 782 CB LYS A 48 -17.299 -5.424 -5.034 1.00 14.32 C ATOM 783 CG LYS A 48 -17.761 -6.598 -4.174 1.00 34.24 C ATOM 784 CD LYS A 48 -18.681 -6.150 -3.046 1.00 25.12 C ATOM 785 CE LYS A 48 -19.293 -7.339 -2.315 1.00 20.32 C ATOM 786 NZ LYS A 48 -20.165 -8.153 -3.206 1.00 60.13 N ATOM 0 H LYS A 48 -14.959 -6.111 -4.631 1.00 30.33 H new ATOM 0 HA LYS A 48 -16.802 -6.665 -6.728 1.00 4.31 H new ATOM 0 HB2 LYS A 48 -16.792 -4.696 -4.401 1.00 14.32 H new ATOM 0 HB3 LYS A 48 -18.172 -4.926 -5.456 1.00 14.32 H new ATOM 0 HG2 LYS A 48 -18.281 -7.324 -4.800 1.00 34.24 H new ATOM 0 HG3 LYS A 48 -16.892 -7.104 -3.754 1.00 34.24 H new ATOM 0 HD2 LYS A 48 -18.120 -5.538 -2.340 1.00 25.12 H new ATOM 0 HD3 LYS A 48 -19.475 -5.523 -3.451 1.00 25.12 H new ATOM 0 HE2 LYS A 48 -18.497 -7.967 -1.914 1.00 20.32 H new ATOM 0 HE3 LYS A 48 -19.875 -6.982 -1.466 1.00 20.32 H new ATOM 0 HZ1 LYS A 48 -20.790 -8.751 -2.628 1.00 60.13 H new ATOM 0 HZ2 LYS A 48 -20.741 -7.522 -3.799 1.00 60.13 H new ATOM 0 HZ3 LYS A 48 -19.574 -8.755 -3.814 1.00 60.13 H new ATOM 800 N ARG A 49 -15.041 -3.978 -7.098 1.00 41.54 N ATOM 801 CA ARG A 49 -14.759 -2.899 -8.059 1.00 63.31 C ATOM 802 C ARG A 49 -14.014 -3.433 -9.299 1.00 53.13 C ATOM 803 O ARG A 49 -13.616 -2.661 -10.175 1.00 11.32 O ATOM 804 CB ARG A 49 -13.958 -1.760 -7.402 1.00 32.11 C ATOM 805 CG ARG A 49 -12.477 -2.064 -7.205 1.00 44.03 C ATOM 806 CD ARG A 49 -11.722 -0.880 -6.607 1.00 5.23 C ATOM 807 NE ARG A 49 -11.883 0.336 -7.404 1.00 35.21 N ATOM 808 CZ ARG A 49 -10.914 1.161 -7.706 1.00 45.01 C ATOM 809 NH1 ARG A 49 -9.691 0.899 -7.372 1.00 41.52 N ATOM 810 NH2 ARG A 49 -11.177 2.238 -8.369 1.00 53.21 N ATOM 0 H ARG A 49 -14.312 -4.130 -6.401 1.00 41.54 H new ATOM 0 HA ARG A 49 -15.719 -2.498 -8.385 1.00 63.31 H new ATOM 0 HB2 ARG A 49 -14.054 -0.864 -8.015 1.00 32.11 H new ATOM 0 HB3 ARG A 49 -14.402 -1.532 -6.433 1.00 32.11 H new ATOM 0 HG2 ARG A 49 -12.369 -2.930 -6.551 1.00 44.03 H new ATOM 0 HG3 ARG A 49 -12.032 -2.331 -8.163 1.00 44.03 H new ATOM 0 HD2 ARG A 49 -12.079 -0.698 -5.593 1.00 5.23 H new ATOM 0 HD3 ARG A 49 -10.663 -1.126 -6.533 1.00 5.23 H new ATOM 0 HE ARG A 49 -12.817 0.556 -7.749 1.00 35.21 H new ATOM 0 HH11 ARG A 49 -9.473 0.040 -6.867 1.00 41.52 H new ATOM 0 HH12 ARG A 49 -8.945 1.551 -7.614 1.00 41.52 H new ATOM 0 HH21 ARG A 49 -12.135 2.441 -8.654 1.00 53.21 H new ATOM 0 HH22 ARG A 49 -10.426 2.886 -8.608 1.00 53.21 H new ATOM 824 N GLY A 50 -13.814 -4.751 -9.366 1.00 33.42 N ATOM 825 CA GLY A 50 -13.244 -5.365 -10.566 1.00 51.12 C ATOM 826 C GLY A 50 -11.799 -5.847 -10.419 1.00 11.41 C ATOM 827 O GLY A 50 -11.178 -6.237 -11.406 1.00 43.21 O ATOM 0 H GLY A 50 -14.035 -5.405 -8.615 1.00 33.42 H new ATOM 0 HA2 GLY A 50 -13.867 -6.212 -10.854 1.00 51.12 H new ATOM 0 HA3 GLY A 50 -13.290 -4.644 -11.382 1.00 51.12 H new ATOM 831 N THR A 51 -11.254 -5.832 -9.204 1.00 35.35 N ATOM 832 CA THR A 51 -9.889 -6.341 -8.973 1.00 34.31 C ATOM 833 C THR A 51 -9.807 -7.236 -7.721 1.00 13.10 C ATOM 834 O THR A 51 -9.605 -6.760 -6.605 1.00 45.15 O ATOM 835 CB THR A 51 -8.841 -5.195 -8.885 1.00 43.34 C ATOM 836 OG1 THR A 51 -7.550 -5.720 -8.543 1.00 62.33 O ATOM 837 CG2 THR A 51 -9.249 -4.125 -7.876 1.00 40.44 C ATOM 0 H THR A 51 -11.723 -5.479 -8.370 1.00 35.35 H new ATOM 0 HA THR A 51 -9.647 -6.953 -9.842 1.00 34.31 H new ATOM 0 HB THR A 51 -8.793 -4.727 -9.868 1.00 43.34 H new ATOM 0 HG1 THR A 51 -6.902 -4.987 -8.493 1.00 62.33 H new ATOM 0 HG21 THR A 51 -8.489 -3.344 -7.847 1.00 40.44 H new ATOM 0 HG22 THR A 51 -10.204 -3.691 -8.172 1.00 40.44 H new ATOM 0 HG23 THR A 51 -9.346 -4.575 -6.888 1.00 40.44 H new ATOM 845 N PRO A 52 -10.005 -8.559 -7.893 1.00 1.21 N ATOM 846 CA PRO A 52 -9.905 -9.527 -6.790 1.00 32.14 C ATOM 847 C PRO A 52 -8.455 -9.953 -6.490 1.00 1.54 C ATOM 848 O PRO A 52 -7.588 -9.915 -7.366 1.00 54.22 O ATOM 849 CB PRO A 52 -10.718 -10.710 -7.320 1.00 31.35 C ATOM 850 CG PRO A 52 -10.508 -10.674 -8.799 1.00 43.24 C ATOM 851 CD PRO A 52 -10.360 -9.216 -9.171 1.00 72.35 C ATOM 0 HA PRO A 52 -10.263 -9.117 -5.846 1.00 32.14 H new ATOM 0 HB2 PRO A 52 -10.374 -11.652 -6.893 1.00 31.35 H new ATOM 0 HB3 PRO A 52 -11.774 -10.612 -7.066 1.00 31.35 H new ATOM 0 HG2 PRO A 52 -9.619 -11.239 -9.079 1.00 43.24 H new ATOM 0 HG3 PRO A 52 -11.351 -11.125 -9.323 1.00 43.24 H new ATOM 0 HD2 PRO A 52 -9.585 -9.072 -9.924 1.00 72.35 H new ATOM 0 HD3 PRO A 52 -11.284 -8.813 -9.585 1.00 72.35 H new ATOM 859 N VAL A 53 -8.199 -10.377 -5.254 1.00 24.30 N ATOM 860 CA VAL A 53 -6.856 -10.807 -4.845 1.00 72.23 C ATOM 861 C VAL A 53 -6.736 -12.337 -4.817 1.00 54.10 C ATOM 862 O VAL A 53 -7.196 -12.992 -3.879 1.00 34.11 O ATOM 863 CB VAL A 53 -6.477 -10.247 -3.450 1.00 13.02 C ATOM 864 CG1 VAL A 53 -5.048 -10.641 -3.069 1.00 62.44 C ATOM 865 CG2 VAL A 53 -6.653 -8.732 -3.416 1.00 43.44 C ATOM 0 H VAL A 53 -8.901 -10.433 -4.516 1.00 24.30 H new ATOM 0 HA VAL A 53 -6.167 -10.408 -5.589 1.00 72.23 H new ATOM 0 HB VAL A 53 -7.150 -10.686 -2.713 1.00 13.02 H new ATOM 0 HG11 VAL A 53 -4.808 -10.235 -2.086 1.00 62.44 H new ATOM 0 HG12 VAL A 53 -4.965 -11.728 -3.043 1.00 62.44 H new ATOM 0 HG13 VAL A 53 -4.352 -10.241 -3.806 1.00 62.44 H new ATOM 0 HG21 VAL A 53 -6.382 -8.356 -2.429 1.00 43.44 H new ATOM 0 HG22 VAL A 53 -6.010 -8.274 -4.168 1.00 43.44 H new ATOM 0 HG23 VAL A 53 -7.693 -8.482 -3.627 1.00 43.44 H new ATOM 875 N ASN A 54 -6.137 -12.908 -5.858 1.00 42.30 N ATOM 876 CA ASN A 54 -5.871 -14.351 -5.896 1.00 43.43 C ATOM 877 C ASN A 54 -4.414 -14.632 -5.492 1.00 42.23 C ATOM 878 O ASN A 54 -4.146 -15.307 -4.495 1.00 72.05 O ATOM 879 CB ASN A 54 -6.155 -14.919 -7.296 1.00 43.41 C ATOM 880 CG ASN A 54 -7.580 -14.666 -7.762 1.00 75.34 C ATOM 881 OD1 ASN A 54 -8.190 -13.652 -7.434 1.00 12.34 O ATOM 882 ND2 ASN A 54 -8.123 -15.578 -8.538 1.00 15.25 N ATOM 0 H ASN A 54 -5.826 -12.400 -6.686 1.00 42.30 H new ATOM 0 HA ASN A 54 -6.535 -14.843 -5.185 1.00 43.43 H new ATOM 0 HB2 ASN A 54 -5.461 -14.475 -8.010 1.00 43.41 H new ATOM 0 HB3 ASN A 54 -5.965 -15.992 -7.292 1.00 43.41 H new ATOM 0 HD21 ASN A 54 -9.074 -15.453 -8.884 1.00 15.25 H new ATOM 0 HD22 ASN A 54 -7.593 -16.411 -8.794 1.00 15.25 H new ATOM 889 N ARG A 55 -3.470 -14.104 -6.272 1.00 62.11 N ATOM 890 CA ARG A 55 -2.047 -14.208 -5.938 1.00 11.00 C ATOM 891 C ARG A 55 -1.582 -12.983 -5.137 1.00 51.13 C ATOM 892 O ARG A 55 -1.766 -11.838 -5.555 1.00 24.15 O ATOM 893 CB ARG A 55 -1.201 -14.375 -7.208 1.00 21.31 C ATOM 894 CG ARG A 55 -1.510 -15.647 -8.003 1.00 4.12 C ATOM 895 CD ARG A 55 -1.183 -16.926 -7.222 1.00 53.31 C ATOM 896 NE ARG A 55 -2.073 -17.128 -6.076 1.00 41.43 N ATOM 897 CZ ARG A 55 -1.785 -17.857 -5.031 1.00 45.53 C ATOM 898 NH1 ARG A 55 -0.675 -18.520 -4.966 1.00 11.43 N ATOM 899 NH2 ARG A 55 -2.632 -17.936 -4.062 1.00 2.31 N ATOM 0 H ARG A 55 -3.663 -13.601 -7.138 1.00 62.11 H new ATOM 0 HA ARG A 55 -1.911 -15.093 -5.316 1.00 11.00 H new ATOM 0 HB2 ARG A 55 -1.358 -13.510 -7.852 1.00 21.31 H new ATOM 0 HB3 ARG A 55 -0.147 -14.380 -6.931 1.00 21.31 H new ATOM 0 HG2 ARG A 55 -2.565 -15.653 -8.276 1.00 4.12 H new ATOM 0 HG3 ARG A 55 -0.940 -15.638 -8.932 1.00 4.12 H new ATOM 0 HD2 ARG A 55 -1.256 -17.784 -7.890 1.00 53.31 H new ATOM 0 HD3 ARG A 55 -0.151 -16.881 -6.873 1.00 53.31 H new ATOM 0 HE ARG A 55 -2.982 -16.666 -6.095 1.00 41.43 H new ATOM 0 HH11 ARG A 55 -0.010 -18.478 -5.738 1.00 11.43 H new ATOM 0 HH12 ARG A 55 -0.466 -19.084 -4.143 1.00 11.43 H new ATOM 0 HH21 ARG A 55 -3.517 -17.432 -4.116 1.00 2.31 H new ATOM 0 HH22 ARG A 55 -2.417 -18.503 -3.242 1.00 2.31 H new ATOM 913 N ILE A 56 -0.977 -13.243 -3.985 1.00 1.23 N ATOM 914 CA ILE A 56 -0.552 -12.187 -3.057 1.00 40.34 C ATOM 915 C ILE A 56 0.890 -11.722 -3.354 1.00 61.30 C ATOM 916 O ILE A 56 1.772 -12.547 -3.589 1.00 3.14 O ATOM 917 CB ILE A 56 -0.653 -12.707 -1.598 1.00 55.43 C ATOM 918 CG1 ILE A 56 -2.093 -13.175 -1.316 1.00 43.02 C ATOM 919 CG2 ILE A 56 -0.217 -11.639 -0.593 1.00 0.55 C ATOM 920 CD1 ILE A 56 -2.268 -13.874 0.016 1.00 43.35 C ATOM 0 H ILE A 56 -0.765 -14.187 -3.662 1.00 1.23 H new ATOM 0 HA ILE A 56 -1.212 -11.330 -3.189 1.00 40.34 H new ATOM 0 HB ILE A 56 0.025 -13.552 -1.482 1.00 55.43 H new ATOM 0 HG12 ILE A 56 -2.757 -12.311 -1.351 1.00 43.02 H new ATOM 0 HG13 ILE A 56 -2.406 -13.850 -2.112 1.00 43.02 H new ATOM 0 HG21 ILE A 56 -0.300 -12.036 0.419 1.00 0.55 H new ATOM 0 HG22 ILE A 56 0.817 -11.356 -0.788 1.00 0.55 H new ATOM 0 HG23 ILE A 56 -0.857 -10.763 -0.693 1.00 0.55 H new ATOM 0 HD11 ILE A 56 -3.310 -14.171 0.137 1.00 43.35 H new ATOM 0 HD12 ILE A 56 -1.632 -14.759 0.049 1.00 43.35 H new ATOM 0 HD13 ILE A 56 -1.988 -13.196 0.822 1.00 43.35 H new ATOM 932 N PRO A 57 1.142 -10.390 -3.354 1.00 25.34 N ATOM 933 CA PRO A 57 2.475 -9.820 -3.652 1.00 0.33 C ATOM 934 C PRO A 57 3.608 -10.408 -2.789 1.00 61.43 C ATOM 935 O PRO A 57 3.427 -10.696 -1.602 1.00 35.41 O ATOM 936 CB PRO A 57 2.305 -8.317 -3.365 1.00 65.35 C ATOM 937 CG PRO A 57 1.033 -8.200 -2.594 1.00 65.00 C ATOM 938 CD PRO A 57 0.161 -9.330 -3.066 1.00 65.14 C ATOM 0 HA PRO A 57 2.773 -10.046 -4.676 1.00 0.33 H new ATOM 0 HB2 PRO A 57 3.148 -7.929 -2.793 1.00 65.35 H new ATOM 0 HB3 PRO A 57 2.257 -7.744 -4.291 1.00 65.35 H new ATOM 0 HG2 PRO A 57 1.218 -8.270 -1.522 1.00 65.00 H new ATOM 0 HG3 PRO A 57 0.555 -7.237 -2.772 1.00 65.00 H new ATOM 0 HD2 PRO A 57 -0.555 -9.636 -2.303 1.00 65.14 H new ATOM 0 HD3 PRO A 57 -0.413 -9.057 -3.951 1.00 65.14 H new ATOM 946 N ILE A 58 4.788 -10.552 -3.396 1.00 63.12 N ATOM 947 CA ILE A 58 5.937 -11.192 -2.742 1.00 72.22 C ATOM 948 C ILE A 58 7.158 -10.256 -2.670 1.00 30.20 C ATOM 949 O ILE A 58 7.419 -9.479 -3.590 1.00 3.40 O ATOM 950 CB ILE A 58 6.329 -12.493 -3.495 1.00 41.52 C ATOM 951 CG1 ILE A 58 5.148 -13.481 -3.503 1.00 30.22 C ATOM 952 CG2 ILE A 58 7.569 -13.141 -2.880 1.00 21.52 C ATOM 953 CD1 ILE A 58 4.642 -13.844 -2.119 1.00 70.10 C ATOM 0 H ILE A 58 4.976 -10.232 -4.346 1.00 63.12 H new ATOM 0 HA ILE A 58 5.634 -11.430 -1.722 1.00 72.22 H new ATOM 0 HB ILE A 58 6.572 -12.227 -4.524 1.00 41.52 H new ATOM 0 HG12 ILE A 58 4.329 -13.048 -4.077 1.00 30.22 H new ATOM 0 HG13 ILE A 58 5.452 -14.392 -4.019 1.00 30.22 H new ATOM 0 HG21 ILE A 58 7.816 -14.049 -3.430 1.00 21.52 H new ATOM 0 HG22 ILE A 58 8.407 -12.446 -2.932 1.00 21.52 H new ATOM 0 HG23 ILE A 58 7.370 -13.391 -1.838 1.00 21.52 H new ATOM 0 HD11 ILE A 58 3.810 -14.543 -2.207 1.00 70.10 H new ATOM 0 HD12 ILE A 58 5.446 -14.307 -1.547 1.00 70.10 H new ATOM 0 HD13 ILE A 58 4.305 -12.943 -1.607 1.00 70.10 H new ATOM 965 N MET A 59 7.894 -10.333 -1.560 1.00 5.35 N ATOM 966 CA MET A 59 9.129 -9.563 -1.377 1.00 12.03 C ATOM 967 C MET A 59 10.079 -10.276 -0.399 1.00 2.55 C ATOM 968 O MET A 59 9.641 -10.824 0.611 1.00 20.20 O ATOM 969 CB MET A 59 8.809 -8.150 -0.863 1.00 5.24 C ATOM 970 CG MET A 59 10.044 -7.281 -0.650 1.00 43.13 C ATOM 971 SD MET A 59 10.997 -7.048 -2.167 1.00 25.33 S ATOM 972 CE MET A 59 9.805 -6.184 -3.186 1.00 14.33 C ATOM 0 H MET A 59 7.654 -10.927 -0.766 1.00 5.35 H new ATOM 0 HA MET A 59 9.624 -9.484 -2.345 1.00 12.03 H new ATOM 0 HB2 MET A 59 8.146 -7.656 -1.573 1.00 5.24 H new ATOM 0 HB3 MET A 59 8.265 -8.230 0.078 1.00 5.24 H new ATOM 0 HG2 MET A 59 9.738 -6.309 -0.264 1.00 43.13 H new ATOM 0 HG3 MET A 59 10.680 -7.739 0.108 1.00 43.13 H new ATOM 0 HE1 MET A 59 10.316 -5.723 -4.031 1.00 14.33 H new ATOM 0 HE2 MET A 59 9.060 -6.890 -3.553 1.00 14.33 H new ATOM 0 HE3 MET A 59 9.312 -5.412 -2.595 1.00 14.33 H new ATOM 982 N ALA A 60 11.378 -10.273 -0.711 1.00 64.23 N ATOM 983 CA ALA A 60 12.399 -10.882 0.157 1.00 63.52 C ATOM 984 C ALA A 60 12.166 -12.393 0.347 1.00 34.11 C ATOM 985 O ALA A 60 12.336 -12.927 1.448 1.00 63.12 O ATOM 986 CB ALA A 60 12.441 -10.165 1.506 1.00 21.31 C ATOM 0 H ALA A 60 11.752 -9.854 -1.562 1.00 64.23 H new ATOM 0 HA ALA A 60 13.365 -10.766 -0.335 1.00 63.52 H new ATOM 0 HB1 ALA A 60 13.200 -10.625 2.139 1.00 21.31 H new ATOM 0 HB2 ALA A 60 12.685 -9.114 1.352 1.00 21.31 H new ATOM 0 HB3 ALA A 60 11.468 -10.244 1.991 1.00 21.31 H new ATOM 992 N LYS A 61 11.780 -13.068 -0.740 1.00 35.01 N ATOM 993 CA LYS A 61 11.551 -14.526 -0.750 1.00 61.41 C ATOM 994 C LYS A 61 10.294 -14.937 0.044 1.00 51.12 C ATOM 995 O LYS A 61 9.961 -16.125 0.119 1.00 3.24 O ATOM 996 CB LYS A 61 12.783 -15.287 -0.218 1.00 45.20 C ATOM 997 CG LYS A 61 14.076 -15.018 -0.995 1.00 52.53 C ATOM 998 CD LYS A 61 13.961 -15.401 -2.469 1.00 2.01 C ATOM 999 CE LYS A 61 13.650 -16.883 -2.658 1.00 12.05 C ATOM 1000 NZ LYS A 61 14.703 -17.758 -2.081 1.00 10.22 N ATOM 0 H LYS A 61 11.616 -12.623 -1.643 1.00 35.01 H new ATOM 0 HA LYS A 61 11.384 -14.800 -1.792 1.00 61.41 H new ATOM 0 HB2 LYS A 61 12.938 -15.018 0.827 1.00 45.20 H new ATOM 0 HB3 LYS A 61 12.574 -16.356 -0.244 1.00 45.20 H new ATOM 0 HG2 LYS A 61 14.331 -13.961 -0.916 1.00 52.53 H new ATOM 0 HG3 LYS A 61 14.893 -15.578 -0.540 1.00 52.53 H new ATOM 0 HD2 LYS A 61 13.178 -14.805 -2.937 1.00 2.01 H new ATOM 0 HD3 LYS A 61 14.894 -15.159 -2.979 1.00 2.01 H new ATOM 0 HE2 LYS A 61 12.693 -17.114 -2.191 1.00 12.05 H new ATOM 0 HE3 LYS A 61 13.545 -17.097 -3.722 1.00 12.05 H new ATOM 0 HZ1 LYS A 61 14.519 -18.746 -2.350 1.00 10.22 H new ATOM 0 HZ2 LYS A 61 15.633 -17.467 -2.444 1.00 10.22 H new ATOM 0 HZ3 LYS A 61 14.694 -17.674 -1.044 1.00 10.22 H new ATOM 1014 N GLN A 62 9.586 -13.961 0.608 1.00 21.14 N ATOM 1015 CA GLN A 62 8.401 -14.235 1.434 1.00 3.15 C ATOM 1016 C GLN A 62 7.199 -13.383 1.005 1.00 70.01 C ATOM 1017 O GLN A 62 7.292 -12.556 0.100 1.00 62.23 O ATOM 1018 CB GLN A 62 8.712 -13.970 2.915 1.00 71.13 C ATOM 1019 CG GLN A 62 9.172 -12.542 3.203 1.00 31.14 C ATOM 1020 CD GLN A 62 9.307 -12.251 4.688 1.00 0.45 C ATOM 1021 OE1 GLN A 62 10.353 -12.487 5.289 1.00 60.24 O ATOM 1022 NE2 GLN A 62 8.259 -11.727 5.290 1.00 50.23 N ATOM 0 H GLN A 62 9.809 -12.970 0.511 1.00 21.14 H new ATOM 0 HA GLN A 62 8.143 -15.285 1.293 1.00 3.15 H new ATOM 0 HB2 GLN A 62 7.821 -14.181 3.507 1.00 71.13 H new ATOM 0 HB3 GLN A 62 9.485 -14.664 3.244 1.00 71.13 H new ATOM 0 HG2 GLN A 62 10.132 -12.370 2.716 1.00 31.14 H new ATOM 0 HG3 GLN A 62 8.461 -11.842 2.764 1.00 31.14 H new ATOM 0 HE21 GLN A 62 7.406 -11.544 4.762 1.00 50.23 H new ATOM 0 HE22 GLN A 62 8.301 -11.505 6.285 1.00 50.23 H new ATOM 1031 N VAL A 63 6.070 -13.600 1.670 1.00 21.01 N ATOM 1032 CA VAL A 63 4.850 -12.828 1.415 1.00 50.11 C ATOM 1033 C VAL A 63 5.002 -11.361 1.860 1.00 15.40 C ATOM 1034 O VAL A 63 5.699 -11.061 2.833 1.00 15.14 O ATOM 1035 CB VAL A 63 3.634 -13.460 2.143 1.00 53.52 C ATOM 1036 CG1 VAL A 63 3.851 -13.472 3.655 1.00 14.10 C ATOM 1037 CG2 VAL A 63 2.337 -12.735 1.782 1.00 64.00 C ATOM 0 H VAL A 63 5.970 -14.309 2.396 1.00 21.01 H new ATOM 0 HA VAL A 63 4.680 -12.849 0.339 1.00 50.11 H new ATOM 0 HB VAL A 63 3.542 -14.493 1.807 1.00 53.52 H new ATOM 0 HG11 VAL A 63 2.985 -13.920 4.143 1.00 14.10 H new ATOM 0 HG12 VAL A 63 4.742 -14.055 3.890 1.00 14.10 H new ATOM 0 HG13 VAL A 63 3.981 -12.450 4.012 1.00 14.10 H new ATOM 0 HG21 VAL A 63 1.502 -13.200 2.307 1.00 64.00 H new ATOM 0 HG22 VAL A 63 2.412 -11.688 2.075 1.00 64.00 H new ATOM 0 HG23 VAL A 63 2.171 -12.800 0.707 1.00 64.00 H new ATOM 1047 N LEU A 64 4.358 -10.452 1.130 1.00 14.11 N ATOM 1048 CA LEU A 64 4.346 -9.034 1.495 1.00 13.32 C ATOM 1049 C LEU A 64 3.165 -8.728 2.431 1.00 51.54 C ATOM 1050 O LEU A 64 2.002 -8.771 2.017 1.00 71.32 O ATOM 1051 CB LEU A 64 4.268 -8.164 0.229 1.00 63.41 C ATOM 1052 CG LEU A 64 4.337 -6.646 0.466 1.00 15.21 C ATOM 1053 CD1 LEU A 64 5.637 -6.266 1.167 1.00 73.01 C ATOM 1054 CD2 LEU A 64 4.189 -5.891 -0.856 1.00 22.35 C ATOM 0 H LEU A 64 3.837 -10.671 0.281 1.00 14.11 H new ATOM 0 HA LEU A 64 5.270 -8.802 2.024 1.00 13.32 H new ATOM 0 HB2 LEU A 64 5.083 -8.448 -0.437 1.00 63.41 H new ATOM 0 HB3 LEU A 64 3.337 -8.391 -0.291 1.00 63.41 H new ATOM 0 HG LEU A 64 3.510 -6.362 1.116 1.00 15.21 H new ATOM 0 HD11 LEU A 64 5.664 -5.188 1.324 1.00 73.01 H new ATOM 0 HD12 LEU A 64 5.694 -6.775 2.129 1.00 73.01 H new ATOM 0 HD13 LEU A 64 6.484 -6.564 0.549 1.00 73.01 H new ATOM 0 HD21 LEU A 64 4.240 -4.818 -0.670 1.00 22.35 H new ATOM 0 HD22 LEU A 64 4.993 -6.181 -1.532 1.00 22.35 H new ATOM 0 HD23 LEU A 64 3.228 -6.135 -1.309 1.00 22.35 H new ATOM 1066 N ASP A 65 3.468 -8.444 3.697 1.00 13.54 N ATOM 1067 CA ASP A 65 2.438 -8.153 4.701 1.00 45.40 C ATOM 1068 C ASP A 65 1.568 -6.947 4.297 1.00 72.42 C ATOM 1069 O ASP A 65 1.897 -5.805 4.613 1.00 30.15 O ATOM 1070 CB ASP A 65 3.095 -7.881 6.058 1.00 61.44 C ATOM 1071 CG ASP A 65 4.020 -9.002 6.491 1.00 30.20 C ATOM 1072 OD1 ASP A 65 5.218 -8.957 6.141 1.00 31.20 O ATOM 1073 OD2 ASP A 65 3.559 -9.926 7.189 1.00 1.42 O ATOM 0 H ASP A 65 4.422 -8.408 4.056 1.00 13.54 H new ATOM 0 HA ASP A 65 1.789 -9.026 4.770 1.00 45.40 H new ATOM 0 HB2 ASP A 65 3.659 -6.949 6.005 1.00 61.44 H new ATOM 0 HB3 ASP A 65 2.320 -7.742 6.812 1.00 61.44 H new ATOM 1078 N LEU A 66 0.464 -7.206 3.593 1.00 74.53 N ATOM 1079 CA LEU A 66 -0.450 -6.138 3.148 1.00 70.01 C ATOM 1080 C LEU A 66 -0.958 -5.277 4.318 1.00 40.31 C ATOM 1081 O LEU A 66 -0.968 -4.048 4.236 1.00 41.43 O ATOM 1082 CB LEU A 66 -1.641 -6.733 2.379 1.00 54.54 C ATOM 1083 CG LEU A 66 -1.293 -7.385 1.029 1.00 72.54 C ATOM 1084 CD1 LEU A 66 -2.549 -7.939 0.360 1.00 51.42 C ATOM 1085 CD2 LEU A 66 -0.587 -6.384 0.112 1.00 62.21 C ATOM 0 H LEU A 66 0.176 -8.145 3.316 1.00 74.53 H new ATOM 0 HA LEU A 66 0.121 -5.488 2.486 1.00 70.01 H new ATOM 0 HB2 LEU A 66 -2.124 -7.479 3.010 1.00 54.54 H new ATOM 0 HB3 LEU A 66 -2.371 -5.943 2.205 1.00 54.54 H new ATOM 0 HG LEU A 66 -0.611 -8.215 1.215 1.00 72.54 H new ATOM 0 HD11 LEU A 66 -2.282 -8.396 -0.593 1.00 51.42 H new ATOM 0 HD12 LEU A 66 -3.005 -8.689 1.007 1.00 51.42 H new ATOM 0 HD13 LEU A 66 -3.257 -7.129 0.188 1.00 51.42 H new ATOM 0 HD21 LEU A 66 -0.350 -6.865 -0.837 1.00 62.21 H new ATOM 0 HD22 LEU A 66 -1.241 -5.531 -0.067 1.00 62.21 H new ATOM 0 HD23 LEU A 66 0.333 -6.043 0.586 1.00 62.21 H new ATOM 1097 N PHE A 67 -1.376 -5.926 5.404 1.00 33.34 N ATOM 1098 CA PHE A 67 -1.864 -5.218 6.597 1.00 14.10 C ATOM 1099 C PHE A 67 -0.818 -4.212 7.111 1.00 12.20 C ATOM 1100 O PHE A 67 -1.109 -3.030 7.322 1.00 31.03 O ATOM 1101 CB PHE A 67 -2.201 -6.239 7.700 1.00 4.04 C ATOM 1102 CG PHE A 67 -2.811 -5.632 8.946 1.00 43.44 C ATOM 1103 CD1 PHE A 67 -2.007 -5.109 9.954 1.00 3.13 C ATOM 1104 CD2 PHE A 67 -4.189 -5.585 9.109 1.00 54.23 C ATOM 1105 CE1 PHE A 67 -2.567 -4.552 11.090 1.00 43.21 C ATOM 1106 CE2 PHE A 67 -4.752 -5.029 10.243 1.00 2.12 C ATOM 1107 CZ PHE A 67 -3.940 -4.512 11.235 1.00 41.20 C ATOM 0 H PHE A 67 -1.388 -6.943 5.487 1.00 33.34 H new ATOM 0 HA PHE A 67 -2.762 -4.662 6.327 1.00 14.10 H new ATOM 0 HB2 PHE A 67 -2.891 -6.979 7.295 1.00 4.04 H new ATOM 0 HB3 PHE A 67 -1.291 -6.770 7.977 1.00 4.04 H new ATOM 0 HD1 PHE A 67 -0.933 -5.138 9.848 1.00 3.13 H new ATOM 0 HD2 PHE A 67 -4.830 -5.988 8.339 1.00 54.23 H new ATOM 0 HE1 PHE A 67 -1.930 -4.148 11.863 1.00 43.21 H new ATOM 0 HE2 PHE A 67 -5.826 -4.999 10.354 1.00 2.12 H new ATOM 0 HZ PHE A 67 -4.378 -4.078 12.121 1.00 41.20 H new ATOM 1117 N MET A 68 0.414 -4.689 7.281 1.00 4.14 N ATOM 1118 CA MET A 68 1.506 -3.857 7.793 1.00 24.52 C ATOM 1119 C MET A 68 1.935 -2.802 6.760 1.00 51.11 C ATOM 1120 O MET A 68 2.202 -1.656 7.113 1.00 14.33 O ATOM 1121 CB MET A 68 2.703 -4.737 8.178 1.00 71.40 C ATOM 1122 CG MET A 68 2.359 -5.837 9.175 1.00 62.45 C ATOM 1123 SD MET A 68 1.724 -5.195 10.738 1.00 73.23 S ATOM 1124 CE MET A 68 3.131 -4.241 11.307 1.00 51.12 C ATOM 0 H MET A 68 0.683 -5.650 7.071 1.00 4.14 H new ATOM 0 HA MET A 68 1.145 -3.334 8.679 1.00 24.52 H new ATOM 0 HB2 MET A 68 3.113 -5.191 7.276 1.00 71.40 H new ATOM 0 HB3 MET A 68 3.485 -4.107 8.601 1.00 71.40 H new ATOM 0 HG2 MET A 68 1.617 -6.502 8.733 1.00 62.45 H new ATOM 0 HG3 MET A 68 3.249 -6.436 9.369 1.00 62.45 H new ATOM 0 HE1 MET A 68 3.032 -4.049 12.375 1.00 51.12 H new ATOM 0 HE2 MET A 68 4.048 -4.800 11.122 1.00 51.12 H new ATOM 0 HE3 MET A 68 3.169 -3.293 10.770 1.00 51.12 H new ATOM 1134 N LEU A 69 1.991 -3.201 5.487 1.00 75.25 N ATOM 1135 CA LEU A 69 2.352 -2.290 4.393 1.00 74.21 C ATOM 1136 C LEU A 69 1.437 -1.059 4.393 1.00 31.41 C ATOM 1137 O LEU A 69 1.899 0.079 4.285 1.00 71.21 O ATOM 1138 CB LEU A 69 2.251 -3.019 3.042 1.00 42.22 C ATOM 1139 CG LEU A 69 2.786 -2.241 1.828 1.00 3.30 C ATOM 1140 CD1 LEU A 69 4.294 -2.044 1.947 1.00 65.33 C ATOM 1141 CD2 LEU A 69 2.430 -2.958 0.526 1.00 24.04 C ATOM 0 H LEU A 69 1.790 -4.154 5.185 1.00 75.25 H new ATOM 0 HA LEU A 69 3.380 -1.960 4.544 1.00 74.21 H new ATOM 0 HB2 LEU A 69 2.794 -3.961 3.116 1.00 42.22 H new ATOM 0 HB3 LEU A 69 1.205 -3.267 2.860 1.00 42.22 H new ATOM 0 HG LEU A 69 2.313 -1.259 1.810 1.00 3.30 H new ATOM 0 HD11 LEU A 69 4.658 -1.492 1.081 1.00 65.33 H new ATOM 0 HD12 LEU A 69 4.517 -1.483 2.855 1.00 65.33 H new ATOM 0 HD13 LEU A 69 4.786 -3.016 1.991 1.00 65.33 H new ATOM 0 HD21 LEU A 69 2.818 -2.390 -0.320 1.00 24.04 H new ATOM 0 HD22 LEU A 69 2.871 -3.955 0.527 1.00 24.04 H new ATOM 0 HD23 LEU A 69 1.347 -3.041 0.441 1.00 24.04 H new ATOM 1153 N TYR A 70 0.133 -1.303 4.524 1.00 11.33 N ATOM 1154 CA TYR A 70 -0.853 -0.227 4.647 1.00 51.22 C ATOM 1155 C TYR A 70 -0.489 0.724 5.798 1.00 50.31 C ATOM 1156 O TYR A 70 -0.471 1.943 5.630 1.00 61.03 O ATOM 1157 CB TYR A 70 -2.253 -0.822 4.873 1.00 53.41 C ATOM 1158 CG TYR A 70 -3.346 0.213 5.099 1.00 44.53 C ATOM 1159 CD1 TYR A 70 -3.963 0.851 4.027 1.00 42.14 C ATOM 1160 CD2 TYR A 70 -3.768 0.542 6.385 1.00 34.53 C ATOM 1161 CE1 TYR A 70 -4.965 1.784 4.231 1.00 34.33 C ATOM 1162 CE2 TYR A 70 -4.767 1.474 6.594 1.00 74.12 C ATOM 1163 CZ TYR A 70 -5.362 2.092 5.515 1.00 21.11 C ATOM 1164 OH TYR A 70 -6.363 3.017 5.722 1.00 64.13 O ATOM 0 H TYR A 70 -0.267 -2.241 4.548 1.00 11.33 H new ATOM 0 HA TYR A 70 -0.853 0.347 3.720 1.00 51.22 H new ATOM 0 HB2 TYR A 70 -2.519 -1.432 4.009 1.00 53.41 H new ATOM 0 HB3 TYR A 70 -2.217 -1.489 5.735 1.00 53.41 H new ATOM 0 HD1 TYR A 70 -3.655 0.614 3.019 1.00 42.14 H new ATOM 0 HD2 TYR A 70 -3.306 0.060 7.234 1.00 34.53 H new ATOM 0 HE1 TYR A 70 -5.434 2.269 3.388 1.00 34.33 H new ATOM 0 HE2 TYR A 70 -5.080 1.717 7.599 1.00 74.12 H new ATOM 0 HH TYR A 70 -7.231 2.562 5.737 1.00 64.13 H new ATOM 1174 N VAL A 71 -0.195 0.159 6.967 1.00 33.23 N ATOM 1175 CA VAL A 71 0.196 0.959 8.137 1.00 44.41 C ATOM 1176 C VAL A 71 1.440 1.830 7.856 1.00 55.22 C ATOM 1177 O VAL A 71 1.396 3.053 8.000 1.00 3.12 O ATOM 1178 CB VAL A 71 0.473 0.056 9.366 1.00 74.30 C ATOM 1179 CG1 VAL A 71 0.901 0.887 10.577 1.00 74.55 C ATOM 1180 CG2 VAL A 71 -0.753 -0.798 9.693 1.00 25.14 C ATOM 0 H VAL A 71 -0.218 -0.847 7.134 1.00 33.23 H new ATOM 0 HA VAL A 71 -0.645 1.618 8.353 1.00 44.41 H new ATOM 0 HB VAL A 71 1.297 -0.612 9.116 1.00 74.30 H new ATOM 0 HG11 VAL A 71 1.088 0.227 11.424 1.00 74.55 H new ATOM 0 HG12 VAL A 71 1.811 1.437 10.338 1.00 74.55 H new ATOM 0 HG13 VAL A 71 0.109 1.590 10.834 1.00 74.55 H new ATOM 0 HG21 VAL A 71 -0.539 -1.425 10.559 1.00 25.14 H new ATOM 0 HG22 VAL A 71 -1.600 -0.149 9.916 1.00 25.14 H new ATOM 0 HG23 VAL A 71 -0.995 -1.430 8.838 1.00 25.14 H new ATOM 1190 N LEU A 72 2.534 1.190 7.437 1.00 51.33 N ATOM 1191 CA LEU A 72 3.813 1.885 7.199 1.00 23.33 C ATOM 1192 C LEU A 72 3.687 3.027 6.171 1.00 70.34 C ATOM 1193 O LEU A 72 4.335 4.066 6.307 1.00 31.24 O ATOM 1194 CB LEU A 72 4.896 0.886 6.742 1.00 4.53 C ATOM 1195 CG LEU A 72 5.610 0.095 7.862 1.00 55.15 C ATOM 1196 CD1 LEU A 72 6.369 1.036 8.793 1.00 52.24 C ATOM 1197 CD2 LEU A 72 4.626 -0.763 8.654 1.00 32.11 C ATOM 0 H LEU A 72 2.565 0.187 7.253 1.00 51.33 H new ATOM 0 HA LEU A 72 4.105 2.333 8.149 1.00 23.33 H new ATOM 0 HB2 LEU A 72 4.437 0.173 6.057 1.00 4.53 H new ATOM 0 HB3 LEU A 72 5.649 1.433 6.175 1.00 4.53 H new ATOM 0 HG LEU A 72 6.328 -0.573 7.385 1.00 55.15 H new ATOM 0 HD11 LEU A 72 6.863 0.456 9.573 1.00 52.24 H new ATOM 0 HD12 LEU A 72 7.116 1.588 8.223 1.00 52.24 H new ATOM 0 HD13 LEU A 72 5.671 1.737 9.250 1.00 52.24 H new ATOM 0 HD21 LEU A 72 5.162 -1.305 9.433 1.00 32.11 H new ATOM 0 HD22 LEU A 72 3.871 -0.123 9.111 1.00 32.11 H new ATOM 0 HD23 LEU A 72 4.142 -1.474 7.984 1.00 32.11 H new ATOM 1209 N VAL A 73 2.867 2.832 5.144 1.00 2.34 N ATOM 1210 CA VAL A 73 2.684 3.851 4.104 1.00 44.55 C ATOM 1211 C VAL A 73 1.756 4.993 4.568 1.00 72.15 C ATOM 1212 O VAL A 73 2.065 6.177 4.386 1.00 25.43 O ATOM 1213 CB VAL A 73 2.128 3.221 2.802 1.00 53.04 C ATOM 1214 CG1 VAL A 73 1.866 4.288 1.739 1.00 12.31 C ATOM 1215 CG2 VAL A 73 3.088 2.154 2.273 1.00 71.34 C ATOM 0 H VAL A 73 2.318 1.983 5.005 1.00 2.34 H new ATOM 0 HA VAL A 73 3.668 4.276 3.905 1.00 44.55 H new ATOM 0 HB VAL A 73 1.176 2.745 3.037 1.00 53.04 H new ATOM 0 HG11 VAL A 73 1.477 3.815 0.837 1.00 12.31 H new ATOM 0 HG12 VAL A 73 1.138 5.006 2.116 1.00 12.31 H new ATOM 0 HG13 VAL A 73 2.797 4.805 1.505 1.00 12.31 H new ATOM 0 HG21 VAL A 73 2.683 1.721 1.358 1.00 71.34 H new ATOM 0 HG22 VAL A 73 4.056 2.608 2.062 1.00 71.34 H new ATOM 0 HG23 VAL A 73 3.210 1.371 3.022 1.00 71.34 H new ATOM 1225 N THR A 74 0.621 4.640 5.174 1.00 73.42 N ATOM 1226 CA THR A 74 -0.358 5.648 5.619 1.00 12.51 C ATOM 1227 C THR A 74 0.189 6.533 6.751 1.00 63.02 C ATOM 1228 O THR A 74 -0.109 7.728 6.807 1.00 33.32 O ATOM 1229 CB THR A 74 -1.693 5.012 6.085 1.00 50.20 C ATOM 1230 OG1 THR A 74 -1.470 4.115 7.181 1.00 54.52 O ATOM 1231 CG2 THR A 74 -2.370 4.265 4.940 1.00 74.12 C ATOM 0 H THR A 74 0.354 3.675 5.369 1.00 73.42 H new ATOM 0 HA THR A 74 -0.548 6.267 4.742 1.00 12.51 H new ATOM 0 HB THR A 74 -2.348 5.819 6.413 1.00 50.20 H new ATOM 0 HG1 THR A 74 -1.096 3.274 6.845 1.00 54.52 H new ATOM 0 HG21 THR A 74 -3.304 3.828 5.293 1.00 74.12 H new ATOM 0 HG22 THR A 74 -2.579 4.959 4.126 1.00 74.12 H new ATOM 0 HG23 THR A 74 -1.712 3.473 4.582 1.00 74.12 H new ATOM 1239 N GLU A 75 0.995 5.955 7.646 1.00 60.21 N ATOM 1240 CA GLU A 75 1.595 6.722 8.754 1.00 71.11 C ATOM 1241 C GLU A 75 2.563 7.802 8.236 1.00 63.21 C ATOM 1242 O GLU A 75 2.857 8.777 8.934 1.00 64.22 O ATOM 1243 CB GLU A 75 2.347 5.796 9.723 1.00 54.43 C ATOM 1244 CG GLU A 75 3.613 5.180 9.132 1.00 44.13 C ATOM 1245 CD GLU A 75 4.560 4.604 10.175 1.00 55.14 C ATOM 1246 OE1 GLU A 75 4.284 4.732 11.386 1.00 53.25 O ATOM 1247 OE2 GLU A 75 5.615 4.065 9.780 1.00 33.14 O ATOM 0 H GLU A 75 1.249 4.967 7.631 1.00 60.21 H new ATOM 0 HA GLU A 75 0.774 7.208 9.281 1.00 71.11 H new ATOM 0 HB2 GLU A 75 2.612 6.360 10.617 1.00 54.43 H new ATOM 0 HB3 GLU A 75 1.678 4.995 10.038 1.00 54.43 H new ATOM 0 HG2 GLU A 75 3.331 4.390 8.436 1.00 44.13 H new ATOM 0 HG3 GLU A 75 4.141 5.940 8.556 1.00 44.13 H new ATOM 1254 N LYS A 76 3.073 7.603 7.022 1.00 4.21 N ATOM 1255 CA LYS A 76 4.003 8.551 6.397 1.00 32.31 C ATOM 1256 C LYS A 76 3.257 9.649 5.624 1.00 35.13 C ATOM 1257 O LYS A 76 3.814 10.711 5.343 1.00 23.22 O ATOM 1258 CB LYS A 76 4.965 7.798 5.465 1.00 52.43 C ATOM 1259 CG LYS A 76 5.914 6.848 6.195 1.00 4.04 C ATOM 1260 CD LYS A 76 6.904 7.611 7.074 1.00 2.43 C ATOM 1261 CE LYS A 76 7.847 6.679 7.830 1.00 71.13 C ATOM 1262 NZ LYS A 76 7.164 5.969 8.942 1.00 52.44 N ATOM 0 H LYS A 76 2.858 6.789 6.446 1.00 4.21 H new ATOM 0 HA LYS A 76 4.573 9.038 7.188 1.00 32.31 H new ATOM 0 HB2 LYS A 76 4.383 7.229 4.740 1.00 52.43 H new ATOM 0 HB3 LYS A 76 5.553 8.523 4.903 1.00 52.43 H new ATOM 0 HG2 LYS A 76 5.337 6.157 6.810 1.00 4.04 H new ATOM 0 HG3 LYS A 76 6.460 6.247 5.467 1.00 4.04 H new ATOM 0 HD2 LYS A 76 7.489 8.290 6.453 1.00 2.43 H new ATOM 0 HD3 LYS A 76 6.354 8.225 7.788 1.00 2.43 H new ATOM 0 HE2 LYS A 76 8.265 5.948 7.137 1.00 71.13 H new ATOM 0 HE3 LYS A 76 8.682 7.255 8.228 1.00 71.13 H new ATOM 0 HZ1 LYS A 76 7.874 5.596 9.604 1.00 52.44 H new ATOM 0 HZ2 LYS A 76 6.537 6.630 9.443 1.00 52.44 H new ATOM 0 HZ3 LYS A 76 6.602 5.183 8.558 1.00 52.44 H new ATOM 1276 N GLY A 77 1.993 9.391 5.282 1.00 54.22 N ATOM 1277 CA GLY A 77 1.187 10.392 4.583 1.00 61.02 C ATOM 1278 C GLY A 77 0.503 9.877 3.316 1.00 2.45 C ATOM 1279 O GLY A 77 -0.125 10.655 2.596 1.00 74.14 O ATOM 0 H GLY A 77 1.512 8.512 5.474 1.00 54.22 H new ATOM 0 HA2 GLY A 77 0.425 10.769 5.265 1.00 61.02 H new ATOM 0 HA3 GLY A 77 1.825 11.236 4.320 1.00 61.02 H new ATOM 1283 N GLY A 78 0.636 8.582 3.025 1.00 54.44 N ATOM 1284 CA GLY A 78 -0.028 7.998 1.855 1.00 71.20 C ATOM 1285 C GLY A 78 0.940 7.605 0.741 1.00 22.42 C ATOM 1286 O GLY A 78 2.118 7.968 0.776 1.00 5.44 O ATOM 0 H GLY A 78 1.189 7.924 3.574 1.00 54.44 H new ATOM 0 HA2 GLY A 78 -0.588 7.117 2.167 1.00 71.20 H new ATOM 0 HA3 GLY A 78 -0.751 8.713 1.462 1.00 71.20 H new ATOM 1290 N LEU A 79 0.438 6.872 -0.259 1.00 62.24 N ATOM 1291 CA LEU A 79 1.279 6.361 -1.357 1.00 21.11 C ATOM 1292 C LEU A 79 2.042 7.490 -2.071 1.00 12.14 C ATOM 1293 O LEU A 79 3.268 7.438 -2.204 1.00 14.11 O ATOM 1294 CB LEU A 79 0.420 5.585 -2.371 1.00 32.21 C ATOM 1295 CG LEU A 79 1.186 4.986 -3.568 1.00 45.23 C ATOM 1296 CD1 LEU A 79 2.265 4.013 -3.097 1.00 32.22 C ATOM 1297 CD2 LEU A 79 0.229 4.292 -4.534 1.00 54.55 C ATOM 0 H LEU A 79 -0.547 6.617 -0.334 1.00 62.24 H new ATOM 0 HA LEU A 79 2.016 5.690 -0.916 1.00 21.11 H new ATOM 0 HB2 LEU A 79 -0.089 4.777 -1.846 1.00 32.21 H new ATOM 0 HB3 LEU A 79 -0.352 6.253 -2.753 1.00 32.21 H new ATOM 0 HG LEU A 79 1.673 5.807 -4.095 1.00 45.23 H new ATOM 0 HD11 LEU A 79 2.790 3.605 -3.961 1.00 32.22 H new ATOM 0 HD12 LEU A 79 2.974 4.538 -2.457 1.00 32.22 H new ATOM 0 HD13 LEU A 79 1.803 3.200 -2.537 1.00 32.22 H new ATOM 0 HD21 LEU A 79 0.793 3.878 -5.370 1.00 54.55 H new ATOM 0 HD22 LEU A 79 -0.293 3.488 -4.015 1.00 54.55 H new ATOM 0 HD23 LEU A 79 -0.497 5.014 -4.908 1.00 54.55 H new ATOM 1309 N VAL A 80 1.313 8.511 -2.517 1.00 0.03 N ATOM 1310 CA VAL A 80 1.917 9.650 -3.220 1.00 75.11 C ATOM 1311 C VAL A 80 3.005 10.328 -2.370 1.00 34.24 C ATOM 1312 O VAL A 80 4.092 10.639 -2.863 1.00 0.04 O ATOM 1313 CB VAL A 80 0.838 10.690 -3.609 1.00 53.33 C ATOM 1314 CG1 VAL A 80 1.459 11.920 -4.265 1.00 53.42 C ATOM 1315 CG2 VAL A 80 -0.199 10.054 -4.530 1.00 62.13 C ATOM 0 H VAL A 80 0.301 8.576 -2.406 1.00 0.03 H new ATOM 0 HA VAL A 80 2.382 9.259 -4.125 1.00 75.11 H new ATOM 0 HB VAL A 80 0.343 11.020 -2.696 1.00 53.33 H new ATOM 0 HG11 VAL A 80 0.673 12.629 -4.525 1.00 53.42 H new ATOM 0 HG12 VAL A 80 2.156 12.389 -3.571 1.00 53.42 H new ATOM 0 HG13 VAL A 80 1.991 11.621 -5.168 1.00 53.42 H new ATOM 0 HG21 VAL A 80 -0.952 10.795 -4.796 1.00 62.13 H new ATOM 0 HG22 VAL A 80 0.290 9.693 -5.434 1.00 62.13 H new ATOM 0 HG23 VAL A 80 -0.677 9.219 -4.018 1.00 62.13 H new ATOM 1325 N GLU A 81 2.709 10.530 -1.089 1.00 52.15 N ATOM 1326 CA GLU A 81 3.659 11.145 -0.155 1.00 14.12 C ATOM 1327 C GLU A 81 4.976 10.351 -0.091 1.00 51.50 C ATOM 1328 O GLU A 81 6.061 10.899 -0.299 1.00 23.54 O ATOM 1329 CB GLU A 81 3.033 11.221 1.245 1.00 3.02 C ATOM 1330 CG GLU A 81 3.904 11.929 2.280 1.00 50.14 C ATOM 1331 CD GLU A 81 4.010 13.427 2.040 1.00 53.25 C ATOM 1332 OE1 GLU A 81 4.864 13.853 1.235 1.00 11.44 O ATOM 1333 OE2 GLU A 81 3.234 14.184 2.662 1.00 3.14 O ATOM 0 H GLU A 81 1.815 10.277 -0.668 1.00 52.15 H new ATOM 0 HA GLU A 81 3.885 12.149 -0.514 1.00 14.12 H new ATOM 0 HB2 GLU A 81 2.076 11.739 1.176 1.00 3.02 H new ATOM 0 HB3 GLU A 81 2.824 10.209 1.593 1.00 3.02 H new ATOM 0 HG2 GLU A 81 3.493 11.754 3.274 1.00 50.14 H new ATOM 0 HG3 GLU A 81 4.903 11.493 2.267 1.00 50.14 H new ATOM 1340 N VAL A 82 4.867 9.051 0.183 1.00 72.10 N ATOM 1341 CA VAL A 82 6.041 8.176 0.290 1.00 23.05 C ATOM 1342 C VAL A 82 6.871 8.183 -1.006 1.00 51.50 C ATOM 1343 O VAL A 82 8.107 8.156 -0.971 1.00 51.34 O ATOM 1344 CB VAL A 82 5.619 6.724 0.637 1.00 51.01 C ATOM 1345 CG1 VAL A 82 6.838 5.817 0.791 1.00 71.34 C ATOM 1346 CG2 VAL A 82 4.770 6.700 1.906 1.00 54.24 C ATOM 0 H VAL A 82 3.977 8.577 0.336 1.00 72.10 H new ATOM 0 HA VAL A 82 6.662 8.567 1.096 1.00 23.05 H new ATOM 0 HB VAL A 82 5.019 6.343 -0.189 1.00 51.01 H new ATOM 0 HG11 VAL A 82 6.511 4.806 1.034 1.00 71.34 H new ATOM 0 HG12 VAL A 82 7.400 5.802 -0.143 1.00 71.34 H new ATOM 0 HG13 VAL A 82 7.474 6.195 1.592 1.00 71.34 H new ATOM 0 HG21 VAL A 82 4.484 5.673 2.133 1.00 54.24 H new ATOM 0 HG22 VAL A 82 5.346 7.108 2.737 1.00 54.24 H new ATOM 0 HG23 VAL A 82 3.874 7.302 1.755 1.00 54.24 H new ATOM 1356 N ILE A 83 6.186 8.231 -2.150 1.00 55.32 N ATOM 1357 CA ILE A 83 6.855 8.305 -3.458 1.00 1.54 C ATOM 1358 C ILE A 83 7.602 9.642 -3.639 1.00 44.04 C ATOM 1359 O ILE A 83 8.705 9.679 -4.191 1.00 75.45 O ATOM 1360 CB ILE A 83 5.843 8.109 -4.620 1.00 12.43 C ATOM 1361 CG1 ILE A 83 5.216 6.705 -4.549 1.00 0.45 C ATOM 1362 CG2 ILE A 83 6.514 8.335 -5.978 1.00 43.34 C ATOM 1363 CD1 ILE A 83 4.174 6.441 -5.617 1.00 32.54 C ATOM 0 H ILE A 83 5.167 8.220 -2.201 1.00 55.32 H new ATOM 0 HA ILE A 83 7.584 7.495 -3.486 1.00 1.54 H new ATOM 0 HB ILE A 83 5.051 8.850 -4.513 1.00 12.43 H new ATOM 0 HG12 ILE A 83 6.007 5.960 -4.636 1.00 0.45 H new ATOM 0 HG13 ILE A 83 4.759 6.572 -3.569 1.00 0.45 H new ATOM 0 HG21 ILE A 83 5.783 8.191 -6.774 1.00 43.34 H new ATOM 0 HG22 ILE A 83 6.907 9.351 -6.025 1.00 43.34 H new ATOM 0 HG23 ILE A 83 7.331 7.624 -6.103 1.00 43.34 H new ATOM 0 HD11 ILE A 83 3.780 5.431 -5.499 1.00 32.54 H new ATOM 0 HD12 ILE A 83 3.362 7.161 -5.519 1.00 32.54 H new ATOM 0 HD13 ILE A 83 4.630 6.540 -6.602 1.00 32.54 H new ATOM 1375 N ASN A 84 7.001 10.732 -3.160 1.00 11.32 N ATOM 1376 CA ASN A 84 7.620 12.064 -3.243 1.00 45.14 C ATOM 1377 C ASN A 84 8.830 12.199 -2.300 1.00 3.43 C ATOM 1378 O ASN A 84 9.788 12.915 -2.605 1.00 20.14 O ATOM 1379 CB ASN A 84 6.589 13.150 -2.907 1.00 64.23 C ATOM 1380 CG ASN A 84 5.525 13.308 -3.981 1.00 23.15 C ATOM 1381 OD1 ASN A 84 5.780 13.107 -5.165 1.00 1.23 O ATOM 1382 ND2 ASN A 84 4.327 13.682 -3.582 1.00 24.33 N ATOM 0 H ASN A 84 6.086 10.723 -2.710 1.00 11.32 H new ATOM 0 HA ASN A 84 7.974 12.191 -4.266 1.00 45.14 H new ATOM 0 HB2 ASN A 84 6.108 12.907 -1.959 1.00 64.23 H new ATOM 0 HB3 ASN A 84 7.103 14.101 -2.769 1.00 64.23 H new ATOM 0 HD21 ASN A 84 3.580 13.812 -4.264 1.00 24.33 H new ATOM 0 HD22 ASN A 84 4.146 13.841 -2.591 1.00 24.33 H new ATOM 1389 N LYS A 85 8.776 11.521 -1.152 1.00 72.03 N ATOM 1390 CA LYS A 85 9.852 11.597 -0.151 1.00 23.13 C ATOM 1391 C LYS A 85 10.918 10.498 -0.354 1.00 52.24 C ATOM 1392 O LYS A 85 12.015 10.586 0.197 1.00 50.41 O ATOM 1393 CB LYS A 85 9.256 11.486 1.259 1.00 72.24 C ATOM 1394 CG LYS A 85 8.136 12.483 1.550 1.00 74.20 C ATOM 1395 CD LYS A 85 7.523 12.259 2.935 1.00 4.34 C ATOM 1396 CE LYS A 85 8.463 12.680 4.059 1.00 54.25 C ATOM 1397 NZ LYS A 85 8.695 14.148 4.064 1.00 73.32 N ATOM 0 H LYS A 85 8.001 10.912 -0.889 1.00 72.03 H new ATOM 0 HA LYS A 85 10.347 12.560 -0.274 1.00 23.13 H new ATOM 0 HB2 LYS A 85 8.872 10.476 1.400 1.00 72.24 H new ATOM 0 HB3 LYS A 85 10.052 11.629 1.989 1.00 72.24 H new ATOM 0 HG2 LYS A 85 8.527 13.498 1.485 1.00 74.20 H new ATOM 0 HG3 LYS A 85 7.360 12.391 0.790 1.00 74.20 H new ATOM 0 HD2 LYS A 85 6.592 12.821 3.013 1.00 4.34 H new ATOM 0 HD3 LYS A 85 7.270 11.205 3.052 1.00 4.34 H new ATOM 0 HE2 LYS A 85 8.043 12.375 5.017 1.00 54.25 H new ATOM 0 HE3 LYS A 85 9.416 12.162 3.949 1.00 54.25 H new ATOM 0 HZ1 LYS A 85 9.136 14.427 4.964 1.00 73.32 H new ATOM 0 HZ2 LYS A 85 9.325 14.403 3.277 1.00 73.32 H new ATOM 0 HZ3 LYS A 85 7.787 14.643 3.955 1.00 73.32 H new ATOM 1411 N LYS A 86 10.581 9.460 -1.131 1.00 23.11 N ATOM 1412 CA LYS A 86 11.514 8.353 -1.452 1.00 64.34 C ATOM 1413 C LYS A 86 11.996 7.575 -0.207 1.00 53.30 C ATOM 1414 O LYS A 86 12.936 6.787 -0.298 1.00 35.12 O ATOM 1415 CB LYS A 86 12.748 8.863 -2.229 1.00 31.33 C ATOM 1416 CG LYS A 86 12.474 9.329 -3.659 1.00 1.34 C ATOM 1417 CD LYS A 86 11.745 10.669 -3.710 1.00 11.21 C ATOM 1418 CE LYS A 86 11.656 11.202 -5.133 1.00 53.51 C ATOM 1419 NZ LYS A 86 13.001 11.458 -5.714 1.00 25.41 N ATOM 0 H LYS A 86 9.660 9.357 -1.557 1.00 23.11 H new ATOM 0 HA LYS A 86 10.938 7.667 -2.073 1.00 64.34 H new ATOM 0 HB2 LYS A 86 13.190 9.690 -1.673 1.00 31.33 H new ATOM 0 HB3 LYS A 86 13.492 8.067 -2.260 1.00 31.33 H new ATOM 0 HG2 LYS A 86 13.418 9.413 -4.197 1.00 1.34 H new ATOM 0 HG3 LYS A 86 11.879 8.576 -4.175 1.00 1.34 H new ATOM 0 HD2 LYS A 86 10.742 10.554 -3.300 1.00 11.21 H new ATOM 0 HD3 LYS A 86 12.265 11.392 -3.082 1.00 11.21 H new ATOM 0 HE2 LYS A 86 11.122 10.485 -5.756 1.00 53.51 H new ATOM 0 HE3 LYS A 86 11.076 12.125 -5.140 1.00 53.51 H new ATOM 0 HZ1 LYS A 86 12.897 11.852 -6.671 1.00 25.41 H new ATOM 0 HZ2 LYS A 86 13.515 12.135 -5.115 1.00 25.41 H new ATOM 0 HZ3 LYS A 86 13.533 10.566 -5.763 1.00 25.41 H new ATOM 1433 N LEU A 87 11.337 7.758 0.935 1.00 62.33 N ATOM 1434 CA LEU A 87 11.790 7.152 2.206 1.00 70.25 C ATOM 1435 C LEU A 87 11.324 5.684 2.363 1.00 33.33 C ATOM 1436 O LEU A 87 11.066 5.213 3.475 1.00 2.04 O ATOM 1437 CB LEU A 87 11.313 8.009 3.398 1.00 62.21 C ATOM 1438 CG LEU A 87 9.825 7.891 3.807 1.00 74.24 C ATOM 1439 CD1 LEU A 87 9.474 8.946 4.848 1.00 35.54 C ATOM 1440 CD2 LEU A 87 8.893 8.002 2.609 1.00 53.42 C ATOM 0 H LEU A 87 10.488 8.318 1.017 1.00 62.33 H new ATOM 0 HA LEU A 87 12.880 7.132 2.189 1.00 70.25 H new ATOM 0 HB2 LEU A 87 11.922 7.751 4.264 1.00 62.21 H new ATOM 0 HB3 LEU A 87 11.517 9.054 3.165 1.00 62.21 H new ATOM 0 HG LEU A 87 9.685 6.900 4.240 1.00 74.24 H new ATOM 0 HD11 LEU A 87 8.424 8.849 5.125 1.00 35.54 H new ATOM 0 HD12 LEU A 87 10.097 8.806 5.732 1.00 35.54 H new ATOM 0 HD13 LEU A 87 9.650 9.939 4.434 1.00 35.54 H new ATOM 0 HD21 LEU A 87 7.859 7.914 2.943 1.00 53.42 H new ATOM 0 HD22 LEU A 87 9.037 8.968 2.125 1.00 53.42 H new ATOM 0 HD23 LEU A 87 9.115 7.204 1.900 1.00 53.42 H new ATOM 1452 N TRP A 88 11.281 4.947 1.252 1.00 64.25 N ATOM 1453 CA TRP A 88 10.783 3.563 1.248 1.00 35.32 C ATOM 1454 C TRP A 88 11.615 2.617 2.142 1.00 62.03 C ATOM 1455 O TRP A 88 11.171 1.510 2.451 1.00 75.03 O ATOM 1456 CB TRP A 88 10.723 3.022 -0.190 1.00 20.31 C ATOM 1457 CG TRP A 88 9.564 3.566 -0.982 1.00 70.43 C ATOM 1458 CD1 TRP A 88 9.562 4.647 -1.822 1.00 32.45 C ATOM 1459 CD2 TRP A 88 8.230 3.044 -0.997 1.00 63.53 C ATOM 1460 NE1 TRP A 88 8.306 4.824 -2.356 1.00 54.20 N ATOM 1461 CE2 TRP A 88 7.472 3.856 -1.859 1.00 21.51 C ATOM 1462 CE3 TRP A 88 7.604 1.970 -0.357 1.00 33.05 C ATOM 1463 CZ2 TRP A 88 6.120 3.623 -2.099 1.00 44.30 C ATOM 1464 CZ3 TRP A 88 6.263 1.741 -0.595 1.00 15.41 C ATOM 1465 CH2 TRP A 88 5.534 2.564 -1.458 1.00 15.43 C ATOM 0 H TRP A 88 11.585 5.283 0.338 1.00 64.25 H new ATOM 0 HA TRP A 88 9.779 3.591 1.672 1.00 35.32 H new ATOM 0 HB2 TRP A 88 11.653 3.269 -0.703 1.00 20.31 H new ATOM 0 HB3 TRP A 88 10.655 1.935 -0.159 1.00 20.31 H new ATOM 0 HD1 TRP A 88 10.419 5.269 -2.034 1.00 32.45 H new ATOM 0 HE1 TRP A 88 8.039 5.556 -3.014 1.00 54.20 H new ATOM 0 HE3 TRP A 88 8.160 1.330 0.312 1.00 33.05 H new ATOM 0 HZ2 TRP A 88 5.554 4.255 -2.767 1.00 44.30 H new ATOM 0 HZ3 TRP A 88 5.770 0.913 -0.107 1.00 15.41 H new ATOM 0 HH2 TRP A 88 4.486 2.361 -1.623 1.00 15.43 H new ATOM 1476 N ARG A 89 12.808 3.048 2.564 1.00 73.24 N ATOM 1477 CA ARG A 89 13.637 2.240 3.475 1.00 33.11 C ATOM 1478 C ARG A 89 12.903 1.979 4.805 1.00 61.50 C ATOM 1479 O ARG A 89 13.043 0.916 5.413 1.00 40.10 O ATOM 1480 CB ARG A 89 14.977 2.941 3.758 1.00 62.21 C ATOM 1481 CG ARG A 89 14.854 4.157 4.676 1.00 3.40 C ATOM 1482 CD ARG A 89 16.207 4.767 5.013 1.00 43.14 C ATOM 1483 NE ARG A 89 16.102 5.769 6.076 1.00 34.23 N ATOM 1484 CZ ARG A 89 17.020 6.662 6.337 1.00 23.14 C ATOM 1485 NH1 ARG A 89 18.073 6.760 5.592 1.00 51.13 N ATOM 1486 NH2 ARG A 89 16.877 7.474 7.336 1.00 73.40 N ATOM 0 H ARG A 89 13.221 3.941 2.295 1.00 73.24 H new ATOM 0 HA ARG A 89 13.829 1.285 2.985 1.00 33.11 H new ATOM 0 HB2 ARG A 89 15.663 2.224 4.209 1.00 62.21 H new ATOM 0 HB3 ARG A 89 15.420 3.254 2.812 1.00 62.21 H new ATOM 0 HG2 ARG A 89 14.228 4.910 4.196 1.00 3.40 H new ATOM 0 HG3 ARG A 89 14.351 3.864 5.597 1.00 3.40 H new ATOM 0 HD2 ARG A 89 16.894 3.979 5.322 1.00 43.14 H new ATOM 0 HD3 ARG A 89 16.631 5.227 4.120 1.00 43.14 H new ATOM 0 HE ARG A 89 15.258 5.770 6.649 1.00 34.23 H new ATOM 0 HH11 ARG A 89 18.192 6.137 4.793 1.00 51.13 H new ATOM 0 HH12 ARG A 89 18.784 7.460 5.804 1.00 51.13 H new ATOM 0 HH21 ARG A 89 16.045 7.418 7.923 1.00 73.40 H new ATOM 0 HH22 ARG A 89 17.596 8.169 7.535 1.00 73.40 H new ATOM 1500 N GLU A 90 12.118 2.964 5.246 1.00 30.31 N ATOM 1501 CA GLU A 90 11.337 2.846 6.482 1.00 21.13 C ATOM 1502 C GLU A 90 10.235 1.793 6.333 1.00 4.35 C ATOM 1503 O GLU A 90 9.860 1.121 7.296 1.00 0.41 O ATOM 1504 CB GLU A 90 10.715 4.200 6.851 1.00 54.41 C ATOM 1505 CG GLU A 90 11.733 5.317 7.070 1.00 14.34 C ATOM 1506 CD GLU A 90 12.711 5.017 8.197 1.00 62.43 C ATOM 1507 OE1 GLU A 90 12.262 4.833 9.348 1.00 73.20 O ATOM 1508 OE2 GLU A 90 13.936 4.979 7.943 1.00 12.21 O ATOM 0 H GLU A 90 12.005 3.856 4.764 1.00 30.31 H new ATOM 0 HA GLU A 90 12.012 2.533 7.279 1.00 21.13 H new ATOM 0 HB2 GLU A 90 10.028 4.500 6.059 1.00 54.41 H new ATOM 0 HB3 GLU A 90 10.123 4.080 7.758 1.00 54.41 H new ATOM 0 HG2 GLU A 90 12.290 5.480 6.147 1.00 14.34 H new ATOM 0 HG3 GLU A 90 11.205 6.244 7.292 1.00 14.34 H new ATOM 1515 N ILE A 91 9.726 1.656 5.111 1.00 53.03 N ATOM 1516 CA ILE A 91 8.662 0.696 4.812 1.00 4.44 C ATOM 1517 C ILE A 91 9.187 -0.745 4.906 1.00 51.24 C ATOM 1518 O ILE A 91 8.637 -1.571 5.637 1.00 14.35 O ATOM 1519 CB ILE A 91 8.071 0.939 3.400 1.00 53.13 C ATOM 1520 CG1 ILE A 91 7.718 2.429 3.208 1.00 42.35 C ATOM 1521 CG2 ILE A 91 6.845 0.055 3.170 1.00 10.22 C ATOM 1522 CD1 ILE A 91 6.733 2.972 4.223 1.00 73.34 C ATOM 0 H ILE A 91 10.035 2.201 4.306 1.00 53.03 H new ATOM 0 HA ILE A 91 7.875 0.840 5.552 1.00 4.44 H new ATOM 0 HB ILE A 91 8.826 0.671 2.661 1.00 53.13 H new ATOM 0 HG12 ILE A 91 8.635 3.017 3.258 1.00 42.35 H new ATOM 0 HG13 ILE A 91 7.305 2.567 2.209 1.00 42.35 H new ATOM 0 HG21 ILE A 91 6.445 0.240 2.173 1.00 10.22 H new ATOM 0 HG22 ILE A 91 7.131 -0.993 3.257 1.00 10.22 H new ATOM 0 HG23 ILE A 91 6.084 0.287 3.915 1.00 10.22 H new ATOM 0 HD11 ILE A 91 6.540 4.025 4.016 1.00 73.34 H new ATOM 0 HD12 ILE A 91 5.800 2.413 4.159 1.00 73.34 H new ATOM 0 HD13 ILE A 91 7.150 2.870 5.225 1.00 73.34 H new ATOM 1534 N THR A 92 10.269 -1.034 4.180 1.00 42.43 N ATOM 1535 CA THR A 92 10.906 -2.359 4.225 1.00 45.02 C ATOM 1536 C THR A 92 11.365 -2.706 5.646 1.00 62.05 C ATOM 1537 O THR A 92 11.076 -3.789 6.159 1.00 60.14 O ATOM 1538 CB THR A 92 12.130 -2.444 3.278 1.00 42.22 C ATOM 1539 OG1 THR A 92 13.042 -1.371 3.553 1.00 72.34 O ATOM 1540 CG2 THR A 92 11.705 -2.394 1.814 1.00 64.21 C ATOM 0 H THR A 92 10.725 -0.371 3.553 1.00 42.43 H new ATOM 0 HA THR A 92 10.150 -3.073 3.896 1.00 45.02 H new ATOM 0 HB THR A 92 12.624 -3.399 3.458 1.00 42.22 H new ATOM 0 HG1 THR A 92 13.813 -1.434 2.951 1.00 72.34 H new ATOM 0 HG21 THR A 92 12.587 -2.456 1.177 1.00 64.21 H new ATOM 0 HG22 THR A 92 11.042 -3.232 1.599 1.00 64.21 H new ATOM 0 HG23 THR A 92 11.181 -1.458 1.619 1.00 64.21 H new ATOM 1548 N LYS A 93 12.069 -1.770 6.283 1.00 44.10 N ATOM 1549 CA LYS A 93 12.564 -1.959 7.653 1.00 71.22 C ATOM 1550 C LYS A 93 11.402 -2.239 8.629 1.00 24.42 C ATOM 1551 O LYS A 93 11.521 -3.062 9.539 1.00 33.13 O ATOM 1552 CB LYS A 93 13.354 -0.717 8.101 1.00 13.25 C ATOM 1553 CG LYS A 93 14.248 -0.938 9.320 1.00 20.31 C ATOM 1554 CD LYS A 93 15.368 -1.938 9.031 1.00 43.02 C ATOM 1555 CE LYS A 93 16.391 -1.984 10.162 1.00 35.10 C ATOM 1556 NZ LYS A 93 17.507 -2.921 9.868 1.00 1.53 N ATOM 0 H LYS A 93 12.312 -0.868 5.873 1.00 44.10 H new ATOM 0 HA LYS A 93 13.226 -2.825 7.663 1.00 71.22 H new ATOM 0 HB2 LYS A 93 13.972 -0.377 7.270 1.00 13.25 H new ATOM 0 HB3 LYS A 93 12.650 0.085 8.324 1.00 13.25 H new ATOM 0 HG2 LYS A 93 14.681 0.013 9.630 1.00 20.31 H new ATOM 0 HG3 LYS A 93 13.644 -1.299 10.152 1.00 20.31 H new ATOM 0 HD2 LYS A 93 14.941 -2.930 8.886 1.00 43.02 H new ATOM 0 HD3 LYS A 93 15.867 -1.667 8.100 1.00 43.02 H new ATOM 0 HE2 LYS A 93 16.792 -0.984 10.329 1.00 35.10 H new ATOM 0 HE3 LYS A 93 15.897 -2.287 11.085 1.00 35.10 H new ATOM 0 HZ1 LYS A 93 18.179 -2.921 10.662 1.00 1.53 H new ATOM 0 HZ2 LYS A 93 17.129 -3.880 9.734 1.00 1.53 H new ATOM 0 HZ3 LYS A 93 17.996 -2.618 9.002 1.00 1.53 H new ATOM 1570 N GLY A 94 10.275 -1.559 8.415 1.00 30.24 N ATOM 1571 CA GLY A 94 9.086 -1.779 9.238 1.00 61.34 C ATOM 1572 C GLY A 94 8.496 -3.180 9.078 1.00 54.33 C ATOM 1573 O GLY A 94 7.893 -3.721 10.005 1.00 52.24 O ATOM 0 H GLY A 94 10.161 -0.856 7.684 1.00 30.24 H new ATOM 0 HA2 GLY A 94 9.341 -1.616 10.285 1.00 61.34 H new ATOM 0 HA3 GLY A 94 8.329 -1.040 8.976 1.00 61.34 H new ATOM 1577 N LEU A 95 8.679 -3.770 7.898 1.00 50.41 N ATOM 1578 CA LEU A 95 8.200 -5.129 7.616 1.00 14.20 C ATOM 1579 C LEU A 95 9.291 -6.173 7.924 1.00 3.01 C ATOM 1580 O LEU A 95 9.116 -7.365 7.658 1.00 60.35 O ATOM 1581 CB LEU A 95 7.779 -5.237 6.143 1.00 15.53 C ATOM 1582 CG LEU A 95 6.805 -4.156 5.646 1.00 72.11 C ATOM 1583 CD1 LEU A 95 6.458 -4.371 4.175 1.00 14.33 C ATOM 1584 CD2 LEU A 95 5.543 -4.129 6.501 1.00 15.42 C ATOM 0 H LEU A 95 9.159 -3.327 7.114 1.00 50.41 H new ATOM 0 HA LEU A 95 7.341 -5.330 8.257 1.00 14.20 H new ATOM 0 HB2 LEU A 95 8.676 -5.204 5.525 1.00 15.53 H new ATOM 0 HB3 LEU A 95 7.320 -6.213 5.986 1.00 15.53 H new ATOM 0 HG LEU A 95 7.299 -3.189 5.739 1.00 72.11 H new ATOM 0 HD11 LEU A 95 5.768 -3.594 3.847 1.00 14.33 H new ATOM 0 HD12 LEU A 95 7.368 -4.325 3.576 1.00 14.33 H new ATOM 0 HD13 LEU A 95 5.991 -5.348 4.050 1.00 14.33 H new ATOM 0 HD21 LEU A 95 4.869 -3.357 6.131 1.00 15.42 H new ATOM 0 HD22 LEU A 95 5.047 -5.098 6.449 1.00 15.42 H new ATOM 0 HD23 LEU A 95 5.809 -3.913 7.536 1.00 15.42 H new ATOM 1596 N ASN A 96 10.416 -5.702 8.477 1.00 54.50 N ATOM 1597 CA ASN A 96 11.579 -6.550 8.791 1.00 23.43 C ATOM 1598 C ASN A 96 12.242 -7.090 7.506 1.00 72.13 C ATOM 1599 O ASN A 96 12.987 -8.070 7.533 1.00 10.41 O ATOM 1600 CB ASN A 96 11.178 -7.697 9.735 1.00 34.11 C ATOM 1601 CG ASN A 96 12.378 -8.377 10.375 1.00 34.31 C ATOM 1602 OD1 ASN A 96 12.901 -9.368 9.872 1.00 4.23 O ATOM 1603 ND2 ASN A 96 12.832 -7.842 11.488 1.00 32.25 N ATOM 0 H ASN A 96 10.548 -4.720 8.721 1.00 54.50 H new ATOM 0 HA ASN A 96 12.316 -5.933 9.304 1.00 23.43 H new ATOM 0 HB2 ASN A 96 10.526 -7.307 10.517 1.00 34.11 H new ATOM 0 HB3 ASN A 96 10.601 -8.436 9.178 1.00 34.11 H new ATOM 0 HD21 ASN A 96 13.640 -8.251 11.958 1.00 32.25 H new ATOM 0 HD22 ASN A 96 12.376 -7.019 11.881 1.00 32.25 H new ATOM 1610 N LEU A 97 11.991 -6.422 6.386 1.00 34.34 N ATOM 1611 CA LEU A 97 12.584 -6.802 5.099 1.00 33.24 C ATOM 1612 C LEU A 97 13.954 -6.130 4.908 1.00 20.12 C ATOM 1613 O LEU A 97 14.178 -5.021 5.400 1.00 64.14 O ATOM 1614 CB LEU A 97 11.645 -6.406 3.948 1.00 60.24 C ATOM 1615 CG LEU A 97 10.202 -6.918 4.071 1.00 10.22 C ATOM 1616 CD1 LEU A 97 9.379 -6.530 2.845 1.00 64.34 C ATOM 1617 CD2 LEU A 97 10.171 -8.428 4.292 1.00 3.11 C ATOM 0 H LEU A 97 11.377 -5.609 6.339 1.00 34.34 H new ATOM 0 HA LEU A 97 12.725 -7.883 5.094 1.00 33.24 H new ATOM 0 HB2 LEU A 97 11.622 -5.319 3.878 1.00 60.24 H new ATOM 0 HB3 LEU A 97 12.066 -6.777 3.014 1.00 60.24 H new ATOM 0 HG LEU A 97 9.753 -6.443 4.943 1.00 10.22 H new ATOM 0 HD11 LEU A 97 8.361 -6.904 2.957 1.00 64.34 H new ATOM 0 HD12 LEU A 97 9.358 -5.444 2.750 1.00 64.34 H new ATOM 0 HD13 LEU A 97 9.829 -6.964 1.952 1.00 64.34 H new ATOM 0 HD21 LEU A 97 9.137 -8.762 4.375 1.00 3.11 H new ATOM 0 HD22 LEU A 97 10.647 -8.929 3.449 1.00 3.11 H new ATOM 0 HD23 LEU A 97 10.706 -8.673 5.209 1.00 3.11 H new ATOM 1629 N PRO A 98 14.887 -6.783 4.187 1.00 25.23 N ATOM 1630 CA PRO A 98 16.228 -6.223 3.947 1.00 51.23 C ATOM 1631 C PRO A 98 16.186 -4.911 3.140 1.00 42.40 C ATOM 1632 O PRO A 98 15.516 -4.818 2.114 1.00 14.10 O ATOM 1633 CB PRO A 98 16.948 -7.329 3.155 1.00 72.15 C ATOM 1634 CG PRO A 98 15.856 -8.161 2.568 1.00 1.11 C ATOM 1635 CD PRO A 98 14.718 -8.103 3.553 1.00 12.43 C ATOM 0 HA PRO A 98 16.728 -5.960 4.879 1.00 51.23 H new ATOM 0 HB2 PRO A 98 17.583 -6.907 2.377 1.00 72.15 H new ATOM 0 HB3 PRO A 98 17.591 -7.924 3.804 1.00 72.15 H new ATOM 0 HG2 PRO A 98 15.551 -7.775 1.595 1.00 1.11 H new ATOM 0 HG3 PRO A 98 16.187 -9.188 2.414 1.00 1.11 H new ATOM 0 HD2 PRO A 98 13.751 -8.190 3.057 1.00 12.43 H new ATOM 0 HD3 PRO A 98 14.776 -8.910 4.283 1.00 12.43 H new ATOM 1643 N THR A 99 16.920 -3.901 3.602 1.00 41.34 N ATOM 1644 CA THR A 99 16.924 -2.584 2.942 1.00 14.43 C ATOM 1645 C THR A 99 17.851 -2.558 1.715 1.00 72.34 C ATOM 1646 O THR A 99 17.895 -1.571 0.982 1.00 53.44 O ATOM 1647 CB THR A 99 17.341 -1.458 3.924 1.00 4.21 C ATOM 1648 OG1 THR A 99 17.296 -0.172 3.279 1.00 13.41 O ATOM 1649 CG2 THR A 99 18.740 -1.696 4.486 1.00 25.04 C ATOM 0 H THR A 99 17.519 -3.962 4.426 1.00 41.34 H new ATOM 0 HA THR A 99 15.902 -2.406 2.609 1.00 14.43 H new ATOM 0 HB THR A 99 16.628 -1.471 4.748 1.00 4.21 H new ATOM 0 HG1 THR A 99 17.391 -0.288 2.311 1.00 13.41 H new ATOM 0 HG21 THR A 99 19.000 -0.888 5.170 1.00 25.04 H new ATOM 0 HG22 THR A 99 18.760 -2.645 5.021 1.00 25.04 H new ATOM 0 HG23 THR A 99 19.460 -1.725 3.669 1.00 25.04 H new ATOM 1657 N SER A 100 18.589 -3.647 1.494 1.00 11.13 N ATOM 1658 CA SER A 100 19.531 -3.737 0.362 1.00 20.45 C ATOM 1659 C SER A 100 18.855 -4.265 -0.919 1.00 11.20 C ATOM 1660 O SER A 100 19.525 -4.539 -1.923 1.00 24.33 O ATOM 1661 CB SER A 100 20.716 -4.642 0.733 1.00 34.52 C ATOM 1662 OG SER A 100 21.744 -4.584 -0.246 1.00 30.42 O ATOM 0 H SER A 100 18.557 -4.482 2.080 1.00 11.13 H new ATOM 0 HA SER A 100 19.886 -2.727 0.156 1.00 20.45 H new ATOM 0 HB2 SER A 100 21.117 -4.340 1.701 1.00 34.52 H new ATOM 0 HB3 SER A 100 20.370 -5.670 0.838 1.00 34.52 H new ATOM 0 HG SER A 100 21.343 -4.551 -1.140 1.00 30.42 H new ATOM 1668 N ILE A 101 17.525 -4.403 -0.890 1.00 13.31 N ATOM 1669 CA ILE A 101 16.773 -4.872 -2.065 1.00 64.10 C ATOM 1670 C ILE A 101 16.944 -3.911 -3.254 1.00 54.21 C ATOM 1671 O ILE A 101 16.678 -2.713 -3.147 1.00 1.42 O ATOM 1672 CB ILE A 101 15.265 -5.056 -1.758 1.00 3.42 C ATOM 1673 CG1 ILE A 101 15.070 -6.091 -0.638 1.00 71.25 C ATOM 1674 CG2 ILE A 101 14.508 -5.484 -3.018 1.00 4.00 C ATOM 1675 CD1 ILE A 101 13.636 -6.226 -0.167 1.00 4.20 C ATOM 0 H ILE A 101 16.948 -4.199 -0.074 1.00 13.31 H new ATOM 0 HA ILE A 101 17.187 -5.845 -2.329 1.00 64.10 H new ATOM 0 HB ILE A 101 14.862 -4.100 -1.423 1.00 3.42 H new ATOM 0 HG12 ILE A 101 15.419 -7.062 -0.990 1.00 71.25 H new ATOM 0 HG13 ILE A 101 15.696 -5.815 0.211 1.00 71.25 H new ATOM 0 HG21 ILE A 101 13.451 -5.608 -2.783 1.00 4.00 H new ATOM 0 HG22 ILE A 101 14.621 -4.720 -3.788 1.00 4.00 H new ATOM 0 HG23 ILE A 101 14.912 -6.429 -3.382 1.00 4.00 H new ATOM 0 HD11 ILE A 101 13.582 -6.975 0.623 1.00 4.20 H new ATOM 0 HD12 ILE A 101 13.287 -5.267 0.217 1.00 4.20 H new ATOM 0 HD13 ILE A 101 13.006 -6.533 -1.002 1.00 4.20 H new ATOM 1687 N THR A 102 17.353 -4.469 -4.389 1.00 51.04 N ATOM 1688 CA THR A 102 17.788 -3.691 -5.558 1.00 62.34 C ATOM 1689 C THR A 102 16.749 -2.655 -6.041 1.00 45.45 C ATOM 1690 O THR A 102 17.119 -1.574 -6.508 1.00 52.25 O ATOM 1691 CB THR A 102 18.144 -4.641 -6.727 1.00 43.15 C ATOM 1692 OG1 THR A 102 18.899 -5.761 -6.230 1.00 52.34 O ATOM 1693 CG2 THR A 102 18.964 -3.924 -7.790 1.00 31.43 C ATOM 0 H THR A 102 17.395 -5.478 -4.531 1.00 51.04 H new ATOM 0 HA THR A 102 18.665 -3.130 -5.234 1.00 62.34 H new ATOM 0 HB THR A 102 17.212 -4.984 -7.177 1.00 43.15 H new ATOM 0 HG1 THR A 102 19.121 -6.361 -6.972 1.00 52.34 H new ATOM 0 HG21 THR A 102 19.198 -4.617 -8.598 1.00 31.43 H new ATOM 0 HG22 THR A 102 18.392 -3.085 -8.186 1.00 31.43 H new ATOM 0 HG23 THR A 102 19.890 -3.555 -7.348 1.00 31.43 H new ATOM 1701 N SER A 103 15.459 -2.988 -5.942 1.00 41.12 N ATOM 1702 CA SER A 103 14.381 -2.065 -6.362 1.00 60.14 C ATOM 1703 C SER A 103 13.078 -2.312 -5.585 1.00 13.42 C ATOM 1704 O SER A 103 11.999 -2.457 -6.174 1.00 1.03 O ATOM 1705 CB SER A 103 14.115 -2.174 -7.876 1.00 15.54 C ATOM 1706 OG SER A 103 15.190 -1.637 -8.631 1.00 42.04 O ATOM 0 H SER A 103 15.129 -3.882 -5.578 1.00 41.12 H new ATOM 0 HA SER A 103 14.725 -1.056 -6.134 1.00 60.14 H new ATOM 0 HB2 SER A 103 13.965 -3.219 -8.146 1.00 15.54 H new ATOM 0 HB3 SER A 103 13.195 -1.646 -8.124 1.00 15.54 H new ATOM 0 HG SER A 103 15.684 -2.366 -9.061 1.00 42.04 H new ATOM 1712 N ALA A 104 13.176 -2.332 -4.259 1.00 62.22 N ATOM 1713 CA ALA A 104 12.000 -2.506 -3.400 1.00 24.00 C ATOM 1714 C ALA A 104 11.043 -1.314 -3.527 1.00 50.44 C ATOM 1715 O ALA A 104 9.832 -1.487 -3.654 1.00 53.24 O ATOM 1716 CB ALA A 104 12.427 -2.688 -1.949 1.00 10.12 C ATOM 0 H ALA A 104 14.055 -2.230 -3.752 1.00 62.22 H new ATOM 0 HA ALA A 104 11.472 -3.401 -3.728 1.00 24.00 H new ATOM 0 HB1 ALA A 104 11.544 -2.816 -1.323 1.00 10.12 H new ATOM 0 HB2 ALA A 104 13.062 -3.570 -1.865 1.00 10.12 H new ATOM 0 HB3 ALA A 104 12.981 -1.809 -1.620 1.00 10.12 H new ATOM 1722 N ALA A 105 11.607 -0.107 -3.522 1.00 44.43 N ATOM 1723 CA ALA A 105 10.824 1.132 -3.608 1.00 65.02 C ATOM 1724 C ALA A 105 9.839 1.128 -4.790 1.00 35.45 C ATOM 1725 O ALA A 105 8.696 1.575 -4.662 1.00 72.53 O ATOM 1726 CB ALA A 105 11.765 2.328 -3.718 1.00 50.44 C ATOM 0 H ALA A 105 12.614 0.043 -3.459 1.00 44.43 H new ATOM 0 HA ALA A 105 10.230 1.205 -2.697 1.00 65.02 H new ATOM 0 HB1 ALA A 105 11.181 3.246 -3.782 1.00 50.44 H new ATOM 0 HB2 ALA A 105 12.408 2.367 -2.839 1.00 50.44 H new ATOM 0 HB3 ALA A 105 12.380 2.226 -4.612 1.00 50.44 H new ATOM 1732 N PHE A 106 10.293 0.634 -5.941 1.00 21.35 N ATOM 1733 CA PHE A 106 9.465 0.597 -7.153 1.00 64.42 C ATOM 1734 C PHE A 106 8.417 -0.530 -7.099 1.00 54.10 C ATOM 1735 O PHE A 106 7.250 -0.330 -7.445 1.00 31.12 O ATOM 1736 CB PHE A 106 10.352 0.435 -8.396 1.00 20.20 C ATOM 1737 CG PHE A 106 9.597 0.564 -9.698 1.00 54.51 C ATOM 1738 CD1 PHE A 106 9.181 1.811 -10.148 1.00 4.15 C ATOM 1739 CD2 PHE A 106 9.301 -0.554 -10.468 1.00 45.33 C ATOM 1740 CE1 PHE A 106 8.490 1.938 -11.338 1.00 30.42 C ATOM 1741 CE2 PHE A 106 8.610 -0.429 -11.659 1.00 54.42 C ATOM 1742 CZ PHE A 106 8.205 0.818 -12.094 1.00 61.14 C ATOM 0 H PHE A 106 11.231 0.252 -6.063 1.00 21.35 H new ATOM 0 HA PHE A 106 8.928 1.544 -7.213 1.00 64.42 H new ATOM 0 HB2 PHE A 106 11.143 1.185 -8.368 1.00 20.20 H new ATOM 0 HB3 PHE A 106 10.837 -0.541 -8.362 1.00 20.20 H new ATOM 0 HD1 PHE A 106 9.400 2.691 -9.561 1.00 4.15 H new ATOM 0 HD2 PHE A 106 9.614 -1.532 -10.132 1.00 45.33 H new ATOM 0 HE1 PHE A 106 8.173 2.913 -11.677 1.00 30.42 H new ATOM 0 HE2 PHE A 106 8.387 -1.306 -12.249 1.00 54.42 H new ATOM 0 HZ PHE A 106 7.666 0.917 -13.025 1.00 61.14 H new ATOM 1752 N THR A 107 8.838 -1.717 -6.668 1.00 52.33 N ATOM 1753 CA THR A 107 7.943 -2.885 -6.610 1.00 64.33 C ATOM 1754 C THR A 107 6.827 -2.702 -5.566 1.00 0.34 C ATOM 1755 O THR A 107 5.654 -2.959 -5.847 1.00 54.23 O ATOM 1756 CB THR A 107 8.725 -4.187 -6.299 1.00 32.41 C ATOM 1757 OG1 THR A 107 9.747 -4.394 -7.289 1.00 21.12 O ATOM 1758 CG2 THR A 107 7.798 -5.402 -6.271 1.00 45.24 C ATOM 0 H THR A 107 9.790 -1.902 -6.353 1.00 52.33 H new ATOM 0 HA THR A 107 7.488 -2.970 -7.597 1.00 64.33 H new ATOM 0 HB THR A 107 9.178 -4.075 -5.314 1.00 32.41 H new ATOM 0 HG1 THR A 107 10.534 -3.856 -7.064 1.00 21.12 H new ATOM 0 HG21 THR A 107 8.379 -6.298 -6.050 1.00 45.24 H new ATOM 0 HG22 THR A 107 7.039 -5.263 -5.501 1.00 45.24 H new ATOM 0 HG23 THR A 107 7.314 -5.513 -7.242 1.00 45.24 H new ATOM 1766 N LEU A 108 7.195 -2.240 -4.370 1.00 43.05 N ATOM 1767 CA LEU A 108 6.233 -2.055 -3.274 1.00 12.43 C ATOM 1768 C LEU A 108 5.096 -1.094 -3.661 1.00 2.24 C ATOM 1769 O LEU A 108 3.923 -1.396 -3.448 1.00 31.01 O ATOM 1770 CB LEU A 108 6.942 -1.532 -2.015 1.00 73.11 C ATOM 1771 CG LEU A 108 7.996 -2.472 -1.406 1.00 12.25 C ATOM 1772 CD1 LEU A 108 8.669 -1.817 -0.201 1.00 75.14 C ATOM 1773 CD2 LEU A 108 7.369 -3.810 -1.015 1.00 42.20 C ATOM 0 H LEU A 108 8.154 -1.986 -4.132 1.00 43.05 H new ATOM 0 HA LEU A 108 5.795 -3.031 -3.067 1.00 12.43 H new ATOM 0 HB2 LEU A 108 7.423 -0.585 -2.258 1.00 73.11 H new ATOM 0 HB3 LEU A 108 6.188 -1.321 -1.257 1.00 73.11 H new ATOM 0 HG LEU A 108 8.758 -2.664 -2.161 1.00 12.25 H new ATOM 0 HD11 LEU A 108 9.411 -2.498 0.216 1.00 75.14 H new ATOM 0 HD12 LEU A 108 9.158 -0.895 -0.514 1.00 75.14 H new ATOM 0 HD13 LEU A 108 7.919 -1.591 0.556 1.00 75.14 H new ATOM 0 HD21 LEU A 108 8.133 -4.459 -0.587 1.00 42.20 H new ATOM 0 HD22 LEU A 108 6.582 -3.642 -0.280 1.00 42.20 H new ATOM 0 HD23 LEU A 108 6.944 -4.285 -1.899 1.00 42.20 H new ATOM 1785 N ARG A 109 5.447 0.058 -4.234 1.00 34.21 N ATOM 1786 CA ARG A 109 4.444 1.062 -4.621 1.00 30.34 C ATOM 1787 C ARG A 109 3.488 0.518 -5.693 1.00 4.33 C ATOM 1788 O ARG A 109 2.302 0.835 -5.693 1.00 50.24 O ATOM 1789 CB ARG A 109 5.123 2.342 -5.134 1.00 70.33 C ATOM 1790 CG ARG A 109 5.830 2.179 -6.474 1.00 53.33 C ATOM 1791 CD ARG A 109 6.563 3.446 -6.890 1.00 22.11 C ATOM 1792 NE ARG A 109 7.612 3.806 -5.938 1.00 3.33 N ATOM 1793 CZ ARG A 109 8.315 4.898 -6.006 1.00 54.43 C ATOM 1794 NH1 ARG A 109 8.106 5.749 -6.954 1.00 41.01 N ATOM 1795 NH2 ARG A 109 9.227 5.139 -5.119 1.00 51.55 N ATOM 0 H ARG A 109 6.410 0.322 -4.441 1.00 34.21 H new ATOM 0 HA ARG A 109 3.863 1.299 -3.730 1.00 30.34 H new ATOM 0 HB2 ARG A 109 4.372 3.127 -5.225 1.00 70.33 H new ATOM 0 HB3 ARG A 109 5.847 2.678 -4.392 1.00 70.33 H new ATOM 0 HG2 ARG A 109 6.539 1.354 -6.412 1.00 53.33 H new ATOM 0 HG3 ARG A 109 5.100 1.915 -7.239 1.00 53.33 H new ATOM 0 HD2 ARG A 109 7.002 3.304 -7.877 1.00 22.11 H new ATOM 0 HD3 ARG A 109 5.851 4.267 -6.973 1.00 22.11 H new ATOM 0 HE ARG A 109 7.805 3.160 -5.172 1.00 3.33 H new ATOM 0 HH11 ARG A 109 7.387 5.566 -7.654 1.00 41.01 H new ATOM 0 HH12 ARG A 109 8.660 6.604 -7.003 1.00 41.01 H new ATOM 0 HH21 ARG A 109 9.395 4.472 -4.366 1.00 51.55 H new ATOM 0 HH22 ARG A 109 9.778 5.996 -5.174 1.00 51.55 H new ATOM 1809 N THR A 110 4.016 -0.306 -6.599 1.00 22.34 N ATOM 1810 CA THR A 110 3.210 -0.903 -7.673 1.00 65.42 C ATOM 1811 C THR A 110 2.187 -1.900 -7.106 1.00 44.22 C ATOM 1812 O THR A 110 1.019 -1.902 -7.495 1.00 42.15 O ATOM 1813 CB THR A 110 4.108 -1.616 -8.718 1.00 65.11 C ATOM 1814 OG1 THR A 110 5.033 -0.673 -9.291 1.00 73.43 O ATOM 1815 CG2 THR A 110 3.279 -2.250 -9.832 1.00 10.32 C ATOM 0 H THR A 110 4.999 -0.577 -6.613 1.00 22.34 H new ATOM 0 HA THR A 110 2.676 -0.091 -8.166 1.00 65.42 H new ATOM 0 HB THR A 110 4.651 -2.408 -8.203 1.00 65.11 H new ATOM 0 HG1 THR A 110 5.788 -0.543 -8.680 1.00 73.43 H new ATOM 0 HG21 THR A 110 3.942 -2.740 -10.545 1.00 10.32 H new ATOM 0 HG22 THR A 110 2.598 -2.986 -9.405 1.00 10.32 H new ATOM 0 HG23 THR A 110 2.704 -1.477 -10.343 1.00 10.32 H new ATOM 1823 N GLN A 111 2.633 -2.736 -6.170 1.00 71.53 N ATOM 1824 CA GLN A 111 1.744 -3.695 -5.505 1.00 41.22 C ATOM 1825 C GLN A 111 0.718 -2.968 -4.619 1.00 32.53 C ATOM 1826 O GLN A 111 -0.482 -3.252 -4.671 1.00 30.25 O ATOM 1827 CB GLN A 111 2.568 -4.687 -4.671 1.00 23.35 C ATOM 1828 CG GLN A 111 3.576 -5.490 -5.492 1.00 65.10 C ATOM 1829 CD GLN A 111 2.925 -6.319 -6.588 1.00 2.11 C ATOM 1830 OE1 GLN A 111 1.794 -6.773 -6.460 1.00 63.21 O ATOM 1831 NE2 GLN A 111 3.634 -6.516 -7.682 1.00 23.54 N ATOM 0 H GLN A 111 3.602 -2.771 -5.853 1.00 71.53 H new ATOM 0 HA GLN A 111 1.198 -4.247 -6.270 1.00 41.22 H new ATOM 0 HB2 GLN A 111 3.100 -4.140 -3.893 1.00 23.35 H new ATOM 0 HB3 GLN A 111 1.890 -5.377 -4.169 1.00 23.35 H new ATOM 0 HG2 GLN A 111 4.297 -4.807 -5.941 1.00 65.10 H new ATOM 0 HG3 GLN A 111 4.133 -6.150 -4.828 1.00 65.10 H new ATOM 0 HE21 GLN A 111 4.573 -6.125 -7.759 1.00 23.54 H new ATOM 0 HE22 GLN A 111 3.244 -7.059 -8.452 1.00 23.54 H new ATOM 1840 N TYR A 112 1.199 -2.018 -3.816 1.00 71.12 N ATOM 1841 CA TYR A 112 0.326 -1.169 -2.997 1.00 44.22 C ATOM 1842 C TYR A 112 -0.739 -0.496 -3.879 1.00 55.55 C ATOM 1843 O TYR A 112 -1.916 -0.441 -3.522 1.00 55.31 O ATOM 1844 CB TYR A 112 1.165 -0.100 -2.274 1.00 32.23 C ATOM 1845 CG TYR A 112 0.397 0.716 -1.245 1.00 53.21 C ATOM 1846 CD1 TYR A 112 -0.312 1.859 -1.610 1.00 42.13 C ATOM 1847 CD2 TYR A 112 0.389 0.347 0.096 1.00 0.21 C ATOM 1848 CE1 TYR A 112 -1.000 2.604 -0.671 1.00 20.03 C ATOM 1849 CE2 TYR A 112 -0.299 1.086 1.039 1.00 42.13 C ATOM 1850 CZ TYR A 112 -0.992 2.212 0.651 1.00 65.21 C ATOM 1851 OH TYR A 112 -1.673 2.951 1.591 1.00 4.10 O ATOM 0 H TYR A 112 2.193 -1.815 -3.714 1.00 71.12 H new ATOM 0 HA TYR A 112 -0.176 -1.790 -2.255 1.00 44.22 H new ATOM 0 HB2 TYR A 112 2.004 -0.589 -1.779 1.00 32.23 H new ATOM 0 HB3 TYR A 112 1.585 0.578 -3.017 1.00 32.23 H new ATOM 0 HD1 TYR A 112 -0.324 2.168 -2.645 1.00 42.13 H new ATOM 0 HD2 TYR A 112 0.931 -0.534 0.406 1.00 0.21 H new ATOM 0 HE1 TYR A 112 -1.541 3.489 -0.971 1.00 20.03 H new ATOM 0 HE2 TYR A 112 -0.294 0.783 2.075 1.00 42.13 H new ATOM 0 HH TYR A 112 -1.566 2.537 2.473 1.00 4.10 H new ATOM 1861 N MET A 113 -0.302 -0.008 -5.040 1.00 4.42 N ATOM 1862 CA MET A 113 -1.184 0.639 -6.020 1.00 45.42 C ATOM 1863 C MET A 113 -2.337 -0.286 -6.450 1.00 52.25 C ATOM 1864 O MET A 113 -3.477 0.155 -6.605 1.00 53.04 O ATOM 1865 CB MET A 113 -0.364 1.050 -7.249 1.00 62.03 C ATOM 1866 CG MET A 113 -1.131 1.872 -8.270 1.00 54.43 C ATOM 1867 SD MET A 113 -0.181 2.134 -9.783 1.00 40.13 S ATOM 1868 CE MET A 113 1.307 2.886 -9.125 1.00 33.24 C ATOM 0 H MET A 113 0.675 -0.049 -5.331 1.00 4.42 H new ATOM 0 HA MET A 113 -1.623 1.519 -5.550 1.00 45.42 H new ATOM 0 HB2 MET A 113 0.503 1.622 -6.917 1.00 62.03 H new ATOM 0 HB3 MET A 113 0.015 0.151 -7.735 1.00 62.03 H new ATOM 0 HG2 MET A 113 -2.066 1.367 -8.512 1.00 54.43 H new ATOM 0 HG3 MET A 113 -1.393 2.837 -7.835 1.00 54.43 H new ATOM 0 HE1 MET A 113 1.932 3.236 -9.947 1.00 33.24 H new ATOM 0 HE2 MET A 113 1.038 3.729 -8.489 1.00 33.24 H new ATOM 0 HE3 MET A 113 1.858 2.151 -8.538 1.00 33.24 H new ATOM 1878 N LYS A 114 -2.030 -1.568 -6.646 1.00 10.41 N ATOM 1879 CA LYS A 114 -3.039 -2.547 -7.066 1.00 1.11 C ATOM 1880 C LYS A 114 -4.069 -2.836 -5.961 1.00 73.05 C ATOM 1881 O LYS A 114 -5.276 -2.746 -6.185 1.00 1.42 O ATOM 1882 CB LYS A 114 -2.370 -3.870 -7.462 1.00 42.54 C ATOM 1883 CG LYS A 114 -1.433 -3.780 -8.661 1.00 44.15 C ATOM 1884 CD LYS A 114 -0.792 -5.135 -8.961 1.00 54.43 C ATOM 1885 CE LYS A 114 -1.844 -6.207 -9.249 1.00 15.30 C ATOM 1886 NZ LYS A 114 -1.244 -7.561 -9.406 1.00 70.43 N ATOM 0 H LYS A 114 -1.094 -1.955 -6.522 1.00 10.41 H new ATOM 0 HA LYS A 114 -3.558 -2.110 -7.919 1.00 1.11 H new ATOM 0 HB2 LYS A 114 -1.808 -4.247 -6.607 1.00 42.54 H new ATOM 0 HB3 LYS A 114 -3.147 -4.603 -7.680 1.00 42.54 H new ATOM 0 HG2 LYS A 114 -1.987 -3.435 -9.534 1.00 44.15 H new ATOM 0 HG3 LYS A 114 -0.655 -3.042 -8.464 1.00 44.15 H new ATOM 0 HD2 LYS A 114 -0.125 -5.040 -9.818 1.00 54.43 H new ATOM 0 HD3 LYS A 114 -0.180 -5.444 -8.113 1.00 54.43 H new ATOM 0 HE2 LYS A 114 -2.571 -6.226 -8.437 1.00 15.30 H new ATOM 0 HE3 LYS A 114 -2.387 -5.945 -10.157 1.00 15.30 H new ATOM 0 HZ1 LYS A 114 -1.906 -8.177 -9.919 1.00 70.43 H new ATOM 0 HZ2 LYS A 114 -0.355 -7.487 -9.941 1.00 70.43 H new ATOM 0 HZ3 LYS A 114 -1.051 -7.966 -8.468 1.00 70.43 H new ATOM 1900 N TYR A 115 -3.583 -3.173 -4.769 1.00 14.45 N ATOM 1901 CA TYR A 115 -4.444 -3.735 -3.720 1.00 45.33 C ATOM 1902 C TYR A 115 -4.841 -2.703 -2.647 1.00 54.13 C ATOM 1903 O TYR A 115 -6.019 -2.548 -2.326 1.00 21.20 O ATOM 1904 CB TYR A 115 -3.731 -4.930 -3.061 1.00 2.03 C ATOM 1905 CG TYR A 115 -3.106 -5.894 -4.063 1.00 3.21 C ATOM 1906 CD1 TYR A 115 -3.885 -6.796 -4.782 1.00 1.10 C ATOM 1907 CD2 TYR A 115 -1.735 -5.888 -4.300 1.00 71.33 C ATOM 1908 CE1 TYR A 115 -3.317 -7.658 -5.704 1.00 70.13 C ATOM 1909 CE2 TYR A 115 -1.162 -6.747 -5.217 1.00 32.33 C ATOM 1910 CZ TYR A 115 -1.955 -7.628 -5.919 1.00 14.01 C ATOM 1911 OH TYR A 115 -1.382 -8.479 -6.841 1.00 72.41 O ATOM 0 H TYR A 115 -2.604 -3.069 -4.502 1.00 14.45 H new ATOM 0 HA TYR A 115 -5.368 -4.058 -4.199 1.00 45.33 H new ATOM 0 HB2 TYR A 115 -2.953 -4.556 -2.395 1.00 2.03 H new ATOM 0 HB3 TYR A 115 -4.446 -5.474 -2.443 1.00 2.03 H new ATOM 0 HD1 TYR A 115 -4.952 -6.824 -4.617 1.00 1.10 H new ATOM 0 HD2 TYR A 115 -1.107 -5.198 -3.756 1.00 71.33 H new ATOM 0 HE1 TYR A 115 -3.938 -8.351 -6.253 1.00 70.13 H new ATOM 0 HE2 TYR A 115 -0.095 -6.728 -5.383 1.00 32.33 H new ATOM 0 HH TYR A 115 -2.079 -9.031 -7.254 1.00 72.41 H new ATOM 1921 N LEU A 116 -3.862 -1.987 -2.108 1.00 4.12 N ATOM 1922 CA LEU A 116 -4.089 -1.135 -0.932 1.00 22.42 C ATOM 1923 C LEU A 116 -4.415 0.328 -1.289 1.00 12.44 C ATOM 1924 O LEU A 116 -4.954 1.064 -0.458 1.00 12.34 O ATOM 1925 CB LEU A 116 -2.860 -1.191 -0.020 1.00 50.52 C ATOM 1926 CG LEU A 116 -2.517 -2.590 0.525 1.00 72.21 C ATOM 1927 CD1 LEU A 116 -1.193 -2.568 1.284 1.00 22.21 C ATOM 1928 CD2 LEU A 116 -3.639 -3.110 1.421 1.00 14.33 C ATOM 0 H LEU A 116 -2.905 -1.974 -2.460 1.00 4.12 H new ATOM 0 HA LEU A 116 -4.967 -1.527 -0.418 1.00 22.42 H new ATOM 0 HB2 LEU A 116 -2.000 -0.811 -0.571 1.00 50.52 H new ATOM 0 HB3 LEU A 116 -3.021 -0.519 0.823 1.00 50.52 H new ATOM 0 HG LEU A 116 -2.412 -3.266 -0.323 1.00 72.21 H new ATOM 0 HD11 LEU A 116 -0.972 -3.567 1.659 1.00 22.21 H new ATOM 0 HD12 LEU A 116 -0.395 -2.247 0.614 1.00 22.21 H new ATOM 0 HD13 LEU A 116 -1.265 -1.874 2.121 1.00 22.21 H new ATOM 0 HD21 LEU A 116 -3.377 -4.099 1.795 1.00 14.33 H new ATOM 0 HD22 LEU A 116 -3.779 -2.429 2.261 1.00 14.33 H new ATOM 0 HD23 LEU A 116 -4.564 -3.173 0.847 1.00 14.33 H new ATOM 1940 N TYR A 117 -4.097 0.753 -2.513 1.00 24.20 N ATOM 1941 CA TYR A 117 -4.351 2.141 -2.932 1.00 32.33 C ATOM 1942 C TYR A 117 -5.855 2.487 -2.893 1.00 65.31 C ATOM 1943 O TYR A 117 -6.238 3.497 -2.297 1.00 30.43 O ATOM 1944 CB TYR A 117 -3.769 2.417 -4.328 1.00 70.51 C ATOM 1945 CG TYR A 117 -4.030 3.829 -4.823 1.00 4.13 C ATOM 1946 CD1 TYR A 117 -3.273 4.902 -4.358 1.00 40.13 C ATOM 1947 CD2 TYR A 117 -5.042 4.091 -5.743 1.00 62.53 C ATOM 1948 CE1 TYR A 117 -3.515 6.190 -4.798 1.00 14.31 C ATOM 1949 CE2 TYR A 117 -5.288 5.376 -6.185 1.00 33.54 C ATOM 1950 CZ TYR A 117 -4.525 6.421 -5.709 1.00 13.54 C ATOM 1951 OH TYR A 117 -4.773 7.700 -6.147 1.00 2.23 O ATOM 0 H TYR A 117 -3.667 0.166 -3.228 1.00 24.20 H new ATOM 0 HA TYR A 117 -3.844 2.787 -2.215 1.00 32.33 H new ATOM 0 HB2 TYR A 117 -2.694 2.241 -4.306 1.00 70.51 H new ATOM 0 HB3 TYR A 117 -4.194 1.707 -5.037 1.00 70.51 H new ATOM 0 HD1 TYR A 117 -2.484 4.725 -3.642 1.00 40.13 H new ATOM 0 HD2 TYR A 117 -5.644 3.276 -6.117 1.00 62.53 H new ATOM 0 HE1 TYR A 117 -2.917 7.011 -4.431 1.00 14.31 H new ATOM 0 HE2 TYR A 117 -6.075 5.562 -6.901 1.00 33.54 H new ATOM 0 HH TYR A 117 -5.516 7.689 -6.786 1.00 2.23 H new ATOM 1961 N PRO A 118 -6.743 1.664 -3.512 1.00 14.02 N ATOM 1962 CA PRO A 118 -8.196 1.891 -3.422 1.00 50.32 C ATOM 1963 C PRO A 118 -8.666 2.037 -1.966 1.00 23.31 C ATOM 1964 O PRO A 118 -9.575 2.809 -1.663 1.00 72.24 O ATOM 1965 CB PRO A 118 -8.797 0.626 -4.056 1.00 45.20 C ATOM 1966 CG PRO A 118 -7.740 0.125 -4.980 1.00 72.14 C ATOM 1967 CD PRO A 118 -6.423 0.473 -4.336 1.00 14.13 C ATOM 0 HA PRO A 118 -8.499 2.813 -3.918 1.00 50.32 H new ATOM 0 HB2 PRO A 118 -9.045 -0.117 -3.298 1.00 45.20 H new ATOM 0 HB3 PRO A 118 -9.718 0.852 -4.594 1.00 45.20 H new ATOM 0 HG2 PRO A 118 -7.829 -0.951 -5.127 1.00 72.14 H new ATOM 0 HG3 PRO A 118 -7.829 0.590 -5.962 1.00 72.14 H new ATOM 0 HD2 PRO A 118 -6.046 -0.347 -3.726 1.00 14.13 H new ATOM 0 HD3 PRO A 118 -5.658 0.694 -5.081 1.00 14.13 H new ATOM 1975 N TYR A 119 -8.014 1.299 -1.070 1.00 10.12 N ATOM 1976 CA TYR A 119 -8.372 1.286 0.348 1.00 41.13 C ATOM 1977 C TYR A 119 -7.937 2.583 1.058 1.00 45.32 C ATOM 1978 O TYR A 119 -8.672 3.118 1.892 1.00 12.24 O ATOM 1979 CB TYR A 119 -7.736 0.064 1.028 1.00 15.14 C ATOM 1980 CG TYR A 119 -8.430 -0.377 2.308 1.00 15.04 C ATOM 1981 CD1 TYR A 119 -9.556 -1.194 2.257 1.00 73.42 C ATOM 1982 CD2 TYR A 119 -7.962 0.009 3.561 1.00 33.32 C ATOM 1983 CE1 TYR A 119 -10.191 -1.614 3.409 1.00 50.12 C ATOM 1984 CE2 TYR A 119 -8.593 -0.410 4.719 1.00 12.02 C ATOM 1985 CZ TYR A 119 -9.706 -1.220 4.637 1.00 1.35 C ATOM 1986 OH TYR A 119 -10.334 -1.642 5.786 1.00 44.21 O ATOM 0 H TYR A 119 -7.226 0.695 -1.304 1.00 10.12 H new ATOM 0 HA TYR A 119 -9.457 1.223 0.424 1.00 41.13 H new ATOM 0 HB2 TYR A 119 -7.736 -0.768 0.324 1.00 15.14 H new ATOM 0 HB3 TYR A 119 -6.694 0.291 1.254 1.00 15.14 H new ATOM 0 HD1 TYR A 119 -9.941 -1.506 1.297 1.00 73.42 H new ATOM 0 HD2 TYR A 119 -7.092 0.646 3.630 1.00 33.32 H new ATOM 0 HE1 TYR A 119 -11.063 -2.248 3.348 1.00 50.12 H new ATOM 0 HE2 TYR A 119 -8.215 -0.104 5.683 1.00 12.02 H new ATOM 0 HH TYR A 119 -9.664 -1.950 6.431 1.00 44.21 H new ATOM 1996 N GLU A 120 -6.743 3.091 0.731 1.00 53.20 N ATOM 1997 CA GLU A 120 -6.243 4.327 1.355 1.00 40.42 C ATOM 1998 C GLU A 120 -7.019 5.554 0.855 1.00 33.13 C ATOM 1999 O GLU A 120 -7.281 6.481 1.619 1.00 24.34 O ATOM 2000 CB GLU A 120 -4.723 4.503 1.123 1.00 35.54 C ATOM 2001 CG GLU A 120 -4.313 4.974 -0.280 1.00 63.24 C ATOM 2002 CD GLU A 120 -3.885 6.443 -0.328 1.00 45.03 C ATOM 2003 OE1 GLU A 120 -4.764 7.322 -0.482 1.00 64.32 O ATOM 2004 OE2 GLU A 120 -2.668 6.722 -0.214 1.00 32.32 O ATOM 0 H GLU A 120 -6.111 2.674 0.048 1.00 53.20 H new ATOM 0 HA GLU A 120 -6.407 4.240 2.429 1.00 40.42 H new ATOM 0 HB2 GLU A 120 -4.344 5.219 1.852 1.00 35.54 H new ATOM 0 HB3 GLU A 120 -4.231 3.552 1.325 1.00 35.54 H new ATOM 0 HG2 GLU A 120 -3.492 4.352 -0.638 1.00 63.24 H new ATOM 0 HG3 GLU A 120 -5.148 4.824 -0.964 1.00 63.24 H new ATOM 2011 N CYS A 121 -7.393 5.551 -0.423 1.00 34.43 N ATOM 2012 CA CYS A 121 -8.195 6.641 -0.998 1.00 5.00 C ATOM 2013 C CYS A 121 -9.649 6.594 -0.504 1.00 42.45 C ATOM 2014 O CYS A 121 -10.312 7.627 -0.385 1.00 61.21 O ATOM 2015 CB CYS A 121 -8.172 6.574 -2.530 1.00 23.04 C ATOM 2016 SG CYS A 121 -6.525 6.749 -3.252 1.00 63.44 S ATOM 0 H CYS A 121 -7.157 4.810 -1.083 1.00 34.43 H new ATOM 0 HA CYS A 121 -7.751 7.580 -0.668 1.00 5.00 H new ATOM 0 HB2 CYS A 121 -8.597 5.622 -2.848 1.00 23.04 H new ATOM 0 HB3 CYS A 121 -8.816 7.359 -2.927 1.00 23.04 H new ATOM 0 HG CYS A 121 -6.501 6.180 -4.420 1.00 63.44 H new ATOM 2022 N GLU A 122 -10.143 5.393 -0.219 1.00 21.12 N ATOM 2023 CA GLU A 122 -11.521 5.217 0.249 1.00 33.24 C ATOM 2024 C GLU A 122 -11.639 5.378 1.774 1.00 34.03 C ATOM 2025 O GLU A 122 -12.186 6.365 2.263 1.00 14.12 O ATOM 2026 CB GLU A 122 -12.046 3.839 -0.177 1.00 40.22 C ATOM 2027 CG GLU A 122 -13.481 3.556 0.255 1.00 21.05 C ATOM 2028 CD GLU A 122 -14.460 4.618 -0.227 1.00 74.30 C ATOM 2029 OE1 GLU A 122 -14.480 4.909 -1.443 1.00 2.14 O ATOM 2030 OE2 GLU A 122 -15.211 5.164 0.605 1.00 41.01 O ATOM 0 H GLU A 122 -9.613 4.525 -0.303 1.00 21.12 H new ATOM 0 HA GLU A 122 -12.127 5.999 -0.210 1.00 33.24 H new ATOM 0 HB2 GLU A 122 -11.982 3.758 -1.262 1.00 40.22 H new ATOM 0 HB3 GLU A 122 -11.395 3.070 0.239 1.00 40.22 H new ATOM 0 HG2 GLU A 122 -13.787 2.584 -0.131 1.00 21.05 H new ATOM 0 HG3 GLU A 122 -13.523 3.495 1.342 1.00 21.05 H new ATOM 2037 N LYS A 123 -11.103 4.411 2.515 1.00 12.22 N ATOM 2038 CA LYS A 123 -11.269 4.357 3.974 1.00 50.40 C ATOM 2039 C LYS A 123 -10.497 5.471 4.703 1.00 11.23 C ATOM 2040 O LYS A 123 -10.899 5.910 5.782 1.00 71.35 O ATOM 2041 CB LYS A 123 -10.811 2.985 4.492 1.00 72.32 C ATOM 2042 CG LYS A 123 -11.607 1.807 3.929 1.00 25.45 C ATOM 2043 CD LYS A 123 -13.072 1.839 4.362 1.00 13.21 C ATOM 2044 CE LYS A 123 -13.836 0.611 3.872 1.00 10.22 C ATOM 2045 NZ LYS A 123 -15.253 0.608 4.329 1.00 71.00 N ATOM 0 H LYS A 123 -10.546 3.648 2.131 1.00 12.22 H new ATOM 0 HA LYS A 123 -12.327 4.511 4.185 1.00 50.40 H new ATOM 0 HB2 LYS A 123 -9.758 2.849 4.246 1.00 72.32 H new ATOM 0 HB3 LYS A 123 -10.888 2.975 5.579 1.00 72.32 H new ATOM 0 HG2 LYS A 123 -11.552 1.821 2.840 1.00 25.45 H new ATOM 0 HG3 LYS A 123 -11.153 0.873 4.260 1.00 25.45 H new ATOM 0 HD2 LYS A 123 -13.128 1.892 5.449 1.00 13.21 H new ATOM 0 HD3 LYS A 123 -13.546 2.741 3.974 1.00 13.21 H new ATOM 0 HE2 LYS A 123 -13.808 0.579 2.783 1.00 10.22 H new ATOM 0 HE3 LYS A 123 -13.339 -0.290 4.230 1.00 10.22 H new ATOM 0 HZ1 LYS A 123 -15.731 -0.244 3.972 1.00 71.00 H new ATOM 0 HZ2 LYS A 123 -15.282 0.612 5.369 1.00 71.00 H new ATOM 0 HZ3 LYS A 123 -15.737 1.454 3.966 1.00 71.00 H new ATOM 2059 N ARG A 124 -9.387 5.923 4.117 1.00 32.33 N ATOM 2060 CA ARG A 124 -8.526 6.921 4.772 1.00 32.32 C ATOM 2061 C ARG A 124 -8.641 8.304 4.102 1.00 22.50 C ATOM 2062 O ARG A 124 -8.681 9.332 4.781 1.00 42.50 O ATOM 2063 CB ARG A 124 -7.064 6.443 4.750 1.00 75.41 C ATOM 2064 CG ARG A 124 -6.182 7.078 5.822 1.00 15.41 C ATOM 2065 CD ARG A 124 -6.635 6.693 7.225 1.00 21.22 C ATOM 2066 NE ARG A 124 -6.726 5.242 7.385 1.00 44.34 N ATOM 2067 CZ ARG A 124 -7.575 4.641 8.173 1.00 21.43 C ATOM 2068 NH1 ARG A 124 -8.428 5.319 8.870 1.00 20.41 N ATOM 2069 NH2 ARG A 124 -7.577 3.351 8.241 1.00 15.15 N ATOM 0 H ARG A 124 -9.061 5.620 3.199 1.00 32.33 H new ATOM 0 HA ARG A 124 -8.862 7.026 5.804 1.00 32.32 H new ATOM 0 HB2 ARG A 124 -7.046 5.360 4.875 1.00 75.41 H new ATOM 0 HB3 ARG A 124 -6.638 6.658 3.770 1.00 75.41 H new ATOM 0 HG2 ARG A 124 -5.148 6.766 5.675 1.00 15.41 H new ATOM 0 HG3 ARG A 124 -6.205 8.163 5.717 1.00 15.41 H new ATOM 0 HD2 ARG A 124 -5.935 7.097 7.957 1.00 21.22 H new ATOM 0 HD3 ARG A 124 -7.606 7.143 7.430 1.00 21.22 H new ATOM 0 HE ARG A 124 -6.084 4.662 6.845 1.00 44.34 H new ATOM 0 HH11 ARG A 124 -8.443 6.337 8.808 1.00 20.41 H new ATOM 0 HH12 ARG A 124 -9.086 4.836 9.482 1.00 20.41 H new ATOM 0 HH21 ARG A 124 -6.918 2.810 7.681 1.00 15.15 H new ATOM 0 HH22 ARG A 124 -8.237 2.874 8.855 1.00 15.15 H new ATOM 2083 N GLY A 125 -8.697 8.314 2.770 1.00 42.45 N ATOM 2084 CA GLY A 125 -8.771 9.564 2.015 1.00 15.52 C ATOM 2085 C GLY A 125 -7.475 10.374 2.065 1.00 51.11 C ATOM 2086 O GLY A 125 -7.476 11.530 2.497 1.00 63.12 O ATOM 0 H GLY A 125 -8.693 7.473 2.193 1.00 42.45 H new ATOM 0 HA2 GLY A 125 -9.012 9.340 0.976 1.00 15.52 H new ATOM 0 HA3 GLY A 125 -9.587 10.171 2.408 1.00 15.52 H new ATOM 2090 N LEU A 126 -6.368 9.775 1.615 1.00 33.23 N ATOM 2091 CA LEU A 126 -5.049 10.420 1.695 1.00 74.13 C ATOM 2092 C LEU A 126 -4.631 11.086 0.377 1.00 11.34 C ATOM 2093 O LEU A 126 -4.433 12.302 0.330 1.00 0.20 O ATOM 2094 CB LEU A 126 -3.981 9.402 2.117 1.00 52.14 C ATOM 2095 CG LEU A 126 -4.138 8.839 3.536 1.00 32.11 C ATOM 2096 CD1 LEU A 126 -3.060 7.799 3.825 1.00 51.43 C ATOM 2097 CD2 LEU A 126 -4.094 9.965 4.567 1.00 20.30 C ATOM 0 H LEU A 126 -6.356 8.847 1.192 1.00 33.23 H new ATOM 0 HA LEU A 126 -5.133 11.206 2.446 1.00 74.13 H new ATOM 0 HB2 LEU A 126 -3.994 8.572 1.411 1.00 52.14 H new ATOM 0 HB3 LEU A 126 -3.001 9.873 2.037 1.00 52.14 H new ATOM 0 HG LEU A 126 -5.109 8.349 3.606 1.00 32.11 H new ATOM 0 HD11 LEU A 126 -3.189 7.412 4.836 1.00 51.43 H new ATOM 0 HD12 LEU A 126 -3.143 6.980 3.110 1.00 51.43 H new ATOM 0 HD13 LEU A 126 -2.076 8.260 3.736 1.00 51.43 H new ATOM 0 HD21 LEU A 126 -4.207 9.547 5.567 1.00 20.30 H new ATOM 0 HD22 LEU A 126 -3.139 10.485 4.497 1.00 20.30 H new ATOM 0 HD23 LEU A 126 -4.905 10.667 4.374 1.00 20.30 H new ATOM 2109 N SER A 127 -4.493 10.297 -0.688 1.00 0.25 N ATOM 2110 CA SER A 127 -3.934 10.802 -1.956 1.00 22.24 C ATOM 2111 C SER A 127 -5.005 11.004 -3.047 1.00 11.40 C ATOM 2112 O SER A 127 -6.184 10.702 -2.850 1.00 23.02 O ATOM 2113 CB SER A 127 -2.863 9.831 -2.478 1.00 41.21 C ATOM 2114 OG SER A 127 -1.910 9.500 -1.474 1.00 22.24 O ATOM 0 H SER A 127 -4.756 9.312 -0.706 1.00 0.25 H new ATOM 0 HA SER A 127 -3.498 11.777 -1.739 1.00 22.24 H new ATOM 0 HB2 SER A 127 -3.343 8.920 -2.837 1.00 41.21 H new ATOM 0 HB3 SER A 127 -2.352 10.279 -3.330 1.00 41.21 H new ATOM 0 HG SER A 127 -2.132 8.628 -1.087 1.00 22.24 H new ATOM 2120 N ASN A 128 -4.578 11.544 -4.197 1.00 41.20 N ATOM 2121 CA ASN A 128 -5.442 11.667 -5.384 1.00 41.24 C ATOM 2122 C ASN A 128 -4.799 10.968 -6.598 1.00 73.24 C ATOM 2123 O ASN A 128 -3.573 10.976 -6.748 1.00 54.14 O ATOM 2124 CB ASN A 128 -5.678 13.140 -5.750 1.00 62.45 C ATOM 2125 CG ASN A 128 -6.081 14.004 -4.573 1.00 74.50 C ATOM 2126 OD1 ASN A 128 -7.259 14.139 -4.252 1.00 11.45 O ATOM 2127 ND2 ASN A 128 -5.102 14.611 -3.936 1.00 51.33 N ATOM 0 H ASN A 128 -3.634 11.905 -4.332 1.00 41.20 H new ATOM 0 HA ASN A 128 -6.393 11.195 -5.138 1.00 41.24 H new ATOM 0 HB2 ASN A 128 -4.768 13.545 -6.192 1.00 62.45 H new ATOM 0 HB3 ASN A 128 -6.455 13.196 -6.513 1.00 62.45 H new ATOM 0 HD21 ASN A 128 -5.309 15.220 -3.144 1.00 51.33 H new ATOM 0 HD22 ASN A 128 -4.136 14.472 -4.234 1.00 51.33 H new ATOM 2134 N PRO A 129 -5.613 10.385 -7.504 1.00 51.02 N ATOM 2135 CA PRO A 129 -5.101 9.738 -8.729 1.00 42.24 C ATOM 2136 C PRO A 129 -4.356 10.721 -9.655 1.00 44.13 C ATOM 2137 O PRO A 129 -3.493 10.320 -10.439 1.00 32.21 O ATOM 2138 CB PRO A 129 -6.373 9.193 -9.409 1.00 52.34 C ATOM 2139 CG PRO A 129 -7.498 9.977 -8.813 1.00 53.30 C ATOM 2140 CD PRO A 129 -7.081 10.291 -7.403 1.00 25.23 C ATOM 0 HA PRO A 129 -4.365 8.966 -8.502 1.00 42.24 H new ATOM 0 HB2 PRO A 129 -6.330 9.325 -10.490 1.00 52.34 H new ATOM 0 HB3 PRO A 129 -6.494 8.126 -9.223 1.00 52.34 H new ATOM 0 HG2 PRO A 129 -7.680 10.891 -9.379 1.00 53.30 H new ATOM 0 HG3 PRO A 129 -8.425 9.403 -8.828 1.00 53.30 H new ATOM 0 HD2 PRO A 129 -7.522 11.223 -7.050 1.00 25.23 H new ATOM 0 HD3 PRO A 129 -7.388 9.510 -6.708 1.00 25.23 H new ATOM 2148 N ASN A 130 -4.684 12.010 -9.552 1.00 53.03 N ATOM 2149 CA ASN A 130 -4.021 13.044 -10.358 1.00 13.10 C ATOM 2150 C ASN A 130 -2.546 13.203 -9.953 1.00 32.22 C ATOM 2151 O ASN A 130 -1.639 12.925 -10.742 1.00 71.03 O ATOM 2152 CB ASN A 130 -4.745 14.388 -10.203 1.00 21.15 C ATOM 2153 CG ASN A 130 -6.195 14.329 -10.648 1.00 70.13 C ATOM 2154 OD1 ASN A 130 -6.559 13.566 -11.539 1.00 3.21 O ATOM 2155 ND2 ASN A 130 -7.034 15.135 -10.031 1.00 32.41 N ATOM 0 H ASN A 130 -5.402 12.365 -8.921 1.00 53.03 H new ATOM 0 HA ASN A 130 -4.062 12.729 -11.401 1.00 13.10 H new ATOM 0 HB2 ASN A 130 -4.702 14.700 -9.160 1.00 21.15 H new ATOM 0 HB3 ASN A 130 -4.222 15.147 -10.785 1.00 21.15 H new ATOM 0 HD21 ASN A 130 -8.021 15.138 -10.289 1.00 32.41 H new ATOM 0 HD22 ASN A 130 -6.697 15.756 -9.295 1.00 32.41 H new ATOM 2162 N GLU A 131 -2.319 13.631 -8.711 1.00 10.45 N ATOM 2163 CA GLU A 131 -0.963 13.856 -8.189 1.00 33.34 C ATOM 2164 C GLU A 131 -0.103 12.577 -8.246 1.00 34.41 C ATOM 2165 O GLU A 131 1.112 12.641 -8.448 1.00 64.23 O ATOM 2166 CB GLU A 131 -1.039 14.392 -6.751 1.00 2.41 C ATOM 2167 CG GLU A 131 -1.613 13.404 -5.743 1.00 55.31 C ATOM 2168 CD GLU A 131 -1.801 14.004 -4.357 1.00 4.23 C ATOM 2169 OE1 GLU A 131 -1.168 15.035 -4.050 1.00 74.32 O ATOM 2170 OE2 GLU A 131 -2.593 13.453 -3.573 1.00 12.33 O ATOM 0 H GLU A 131 -3.061 13.831 -8.040 1.00 10.45 H new ATOM 0 HA GLU A 131 -0.479 14.597 -8.825 1.00 33.34 H new ATOM 0 HB2 GLU A 131 -0.038 14.680 -6.430 1.00 2.41 H new ATOM 0 HB3 GLU A 131 -1.649 15.295 -6.744 1.00 2.41 H new ATOM 0 HG2 GLU A 131 -2.573 13.039 -6.108 1.00 55.31 H new ATOM 0 HG3 GLU A 131 -0.951 12.541 -5.672 1.00 55.31 H new ATOM 2177 N LEU A 132 -0.746 11.418 -8.070 1.00 70.21 N ATOM 2178 CA LEU A 132 -0.060 10.118 -8.092 1.00 62.33 C ATOM 2179 C LEU A 132 0.861 9.952 -9.320 1.00 31.31 C ATOM 2180 O LEU A 132 2.042 9.629 -9.183 1.00 13.41 O ATOM 2181 CB LEU A 132 -1.100 8.985 -8.063 1.00 74.54 C ATOM 2182 CG LEU A 132 -0.533 7.554 -8.056 1.00 0.23 C ATOM 2183 CD1 LEU A 132 0.289 7.298 -6.794 1.00 22.31 C ATOM 2184 CD2 LEU A 132 -1.659 6.527 -8.186 1.00 0.30 C ATOM 0 H LEU A 132 -1.751 11.352 -7.909 1.00 70.21 H new ATOM 0 HA LEU A 132 0.575 10.071 -7.207 1.00 62.33 H new ATOM 0 HB2 LEU A 132 -1.724 9.113 -7.178 1.00 74.54 H new ATOM 0 HB3 LEU A 132 -1.751 9.093 -8.930 1.00 74.54 H new ATOM 0 HG LEU A 132 0.128 7.448 -8.916 1.00 0.23 H new ATOM 0 HD11 LEU A 132 0.678 6.280 -6.814 1.00 22.31 H new ATOM 0 HD12 LEU A 132 1.119 8.003 -6.751 1.00 22.31 H new ATOM 0 HD13 LEU A 132 -0.343 7.428 -5.916 1.00 22.31 H new ATOM 0 HD21 LEU A 132 -1.237 5.522 -8.179 1.00 0.30 H new ATOM 0 HD22 LEU A 132 -2.350 6.637 -7.350 1.00 0.30 H new ATOM 0 HD23 LEU A 132 -2.194 6.690 -9.122 1.00 0.30 H new ATOM 2196 N GLN A 133 0.319 10.179 -10.518 1.00 13.12 N ATOM 2197 CA GLN A 133 1.093 10.014 -11.757 1.00 71.41 C ATOM 2198 C GLN A 133 2.288 10.984 -11.814 1.00 10.30 C ATOM 2199 O GLN A 133 3.354 10.632 -12.318 1.00 12.04 O ATOM 2200 CB GLN A 133 0.187 10.200 -12.984 1.00 41.24 C ATOM 2201 CG GLN A 133 0.896 10.027 -14.331 1.00 22.22 C ATOM 2202 CD GLN A 133 1.584 8.675 -14.490 1.00 40.31 C ATOM 2203 OE1 GLN A 133 2.860 8.613 -14.163 1.00 41.41 O flip ATOM 2204 NE2 GLN A 133 0.982 7.701 -14.924 1.00 53.15 N flip ATOM 0 H GLN A 133 -0.646 10.476 -10.660 1.00 13.12 H new ATOM 0 HA GLN A 133 1.493 9.000 -11.765 1.00 71.41 H new ATOM 0 HB2 GLN A 133 -0.633 9.485 -12.925 1.00 41.24 H new ATOM 0 HB3 GLN A 133 -0.255 11.196 -12.946 1.00 41.24 H new ATOM 0 HG2 GLN A 133 0.169 10.152 -15.133 1.00 22.22 H new ATOM 0 HG3 GLN A 133 1.637 10.818 -14.446 1.00 22.22 H new ATOM 0 HE21 GLN A 133 -0.005 7.779 -15.169 1.00 53.15 H new ATOM 0 HE22 GLN A 133 1.468 6.812 -15.041 1.00 53.15 H new ATOM 2213 N ALA A 134 2.113 12.196 -11.284 1.00 23.41 N ATOM 2214 CA ALA A 134 3.210 13.171 -11.219 1.00 0.21 C ATOM 2215 C ALA A 134 4.355 12.657 -10.335 1.00 25.51 C ATOM 2216 O ALA A 134 5.532 12.779 -10.684 1.00 11.12 O ATOM 2217 CB ALA A 134 2.702 14.511 -10.701 1.00 63.31 C ATOM 0 H ALA A 134 1.230 12.527 -10.895 1.00 23.41 H new ATOM 0 HA ALA A 134 3.597 13.309 -12.229 1.00 0.21 H new ATOM 0 HB1 ALA A 134 3.528 15.222 -10.659 1.00 63.31 H new ATOM 0 HB2 ALA A 134 1.930 14.891 -11.370 1.00 63.31 H new ATOM 0 HB3 ALA A 134 2.285 14.381 -9.703 1.00 63.31 H new ATOM 2223 N ALA A 135 3.994 12.081 -9.192 1.00 71.13 N ATOM 2224 CA ALA A 135 4.967 11.491 -8.265 1.00 32.12 C ATOM 2225 C ALA A 135 5.768 10.357 -8.924 1.00 75.25 C ATOM 2226 O ALA A 135 7.004 10.350 -8.916 1.00 4.20 O ATOM 2227 CB ALA A 135 4.239 10.963 -7.032 1.00 73.34 C ATOM 0 H ALA A 135 3.026 12.008 -8.879 1.00 71.13 H new ATOM 0 HA ALA A 135 5.673 12.269 -7.977 1.00 32.12 H new ATOM 0 HB1 ALA A 135 4.961 10.525 -6.343 1.00 73.34 H new ATOM 0 HB2 ALA A 135 3.718 11.783 -6.538 1.00 73.34 H new ATOM 0 HB3 ALA A 135 3.517 10.204 -7.333 1.00 73.34 H new ATOM 2233 N ILE A 136 5.041 9.401 -9.492 1.00 13.20 N ATOM 2234 CA ILE A 136 5.639 8.220 -10.122 1.00 75.33 C ATOM 2235 C ILE A 136 6.490 8.587 -11.346 1.00 3.11 C ATOM 2236 O ILE A 136 7.631 8.141 -11.474 1.00 1.51 O ATOM 2237 CB ILE A 136 4.533 7.224 -10.545 1.00 75.23 C ATOM 2238 CG1 ILE A 136 3.660 6.866 -9.333 1.00 11.12 C ATOM 2239 CG2 ILE A 136 5.138 5.965 -11.169 1.00 51.42 C ATOM 2240 CD1 ILE A 136 2.387 6.133 -9.688 1.00 5.01 C ATOM 0 H ILE A 136 4.022 9.419 -9.531 1.00 13.20 H new ATOM 0 HA ILE A 136 6.294 7.758 -9.383 1.00 75.33 H new ATOM 0 HB ILE A 136 3.908 7.700 -11.300 1.00 75.23 H new ATOM 0 HG12 ILE A 136 4.243 6.250 -8.648 1.00 11.12 H new ATOM 0 HG13 ILE A 136 3.404 7.781 -8.800 1.00 11.12 H new ATOM 0 HG21 ILE A 136 4.339 5.282 -11.457 1.00 51.42 H new ATOM 0 HG22 ILE A 136 5.718 6.238 -12.051 1.00 51.42 H new ATOM 0 HG23 ILE A 136 5.789 5.476 -10.444 1.00 51.42 H new ATOM 0 HD11 ILE A 136 1.826 5.916 -8.779 1.00 5.01 H new ATOM 0 HD12 ILE A 136 1.782 6.754 -10.348 1.00 5.01 H new ATOM 0 HD13 ILE A 136 2.634 5.199 -10.194 1.00 5.01 H new ATOM 2252 N ASP A 137 5.936 9.408 -12.236 1.00 22.41 N ATOM 2253 CA ASP A 137 6.625 9.786 -13.472 1.00 13.32 C ATOM 2254 C ASP A 137 7.935 10.538 -13.173 1.00 33.41 C ATOM 2255 O ASP A 137 8.919 10.405 -13.903 1.00 63.43 O ATOM 2256 CB ASP A 137 5.699 10.632 -14.354 1.00 51.05 C ATOM 2257 CG ASP A 137 6.190 10.718 -15.788 1.00 33.12 C ATOM 2258 OD1 ASP A 137 6.047 9.724 -16.532 1.00 10.53 O ATOM 2259 OD2 ASP A 137 6.714 11.777 -16.184 1.00 13.45 O ATOM 0 H ASP A 137 5.012 9.825 -12.126 1.00 22.41 H new ATOM 0 HA ASP A 137 6.885 8.875 -14.011 1.00 13.32 H new ATOM 0 HB2 ASP A 137 4.697 10.204 -14.340 1.00 51.05 H new ATOM 0 HB3 ASP A 137 5.622 11.636 -13.938 1.00 51.05 H new ATOM 2264 N SER A 138 7.945 11.318 -12.091 1.00 52.13 N ATOM 2265 CA SER A 138 9.173 11.980 -11.627 1.00 63.34 C ATOM 2266 C SER A 138 10.255 10.944 -11.288 1.00 23.41 C ATOM 2267 O SER A 138 11.410 11.089 -11.683 1.00 33.22 O ATOM 2268 CB SER A 138 8.893 12.860 -10.401 1.00 71.24 C ATOM 2269 OG SER A 138 7.986 13.909 -10.710 1.00 52.15 O ATOM 0 H SER A 138 7.122 11.509 -11.519 1.00 52.13 H new ATOM 0 HA SER A 138 9.533 12.614 -12.437 1.00 63.34 H new ATOM 0 HB2 SER A 138 8.483 12.247 -9.598 1.00 71.24 H new ATOM 0 HB3 SER A 138 9.828 13.282 -10.034 1.00 71.24 H new ATOM 0 HG SER A 138 7.067 13.574 -10.655 1.00 52.15 H new ATOM 2275 N ASN A 139 9.863 9.889 -10.566 1.00 30.25 N ATOM 2276 CA ASN A 139 10.784 8.790 -10.232 1.00 75.10 C ATOM 2277 C ASN A 139 11.226 8.042 -11.502 1.00 55.14 C ATOM 2278 O ASN A 139 12.344 7.540 -11.583 1.00 41.45 O ATOM 2279 CB ASN A 139 10.126 7.815 -9.244 1.00 13.24 C ATOM 2280 CG ASN A 139 9.964 8.388 -7.841 1.00 33.02 C ATOM 2281 OD1 ASN A 139 9.959 7.651 -6.858 1.00 55.34 O ATOM 2282 ND2 ASN A 139 9.824 9.693 -7.724 1.00 73.43 N ATOM 0 H ASN A 139 8.918 9.770 -10.201 1.00 30.25 H new ATOM 0 HA ASN A 139 11.667 9.221 -9.761 1.00 75.10 H new ATOM 0 HB2 ASN A 139 9.146 7.529 -9.626 1.00 13.24 H new ATOM 0 HB3 ASN A 139 10.725 6.906 -9.190 1.00 13.24 H new ATOM 0 HD21 ASN A 139 9.708 10.113 -6.802 1.00 73.43 H new ATOM 0 HD22 ASN A 139 9.832 10.283 -8.556 1.00 73.43 H new ATOM 2289 N ARG A 140 10.333 7.970 -12.490 1.00 44.41 N ATOM 2290 CA ARG A 140 10.665 7.387 -13.797 1.00 70.43 C ATOM 2291 C ARG A 140 11.749 8.208 -14.520 1.00 53.44 C ATOM 2292 O ARG A 140 12.559 7.665 -15.275 1.00 44.12 O ATOM 2293 CB ARG A 140 9.409 7.305 -14.676 1.00 62.21 C ATOM 2294 CG ARG A 140 8.359 6.314 -14.182 1.00 33.32 C ATOM 2295 CD ARG A 140 8.806 4.862 -14.355 1.00 62.53 C ATOM 2296 NE ARG A 140 9.170 4.552 -15.740 1.00 64.10 N ATOM 2297 CZ ARG A 140 8.326 4.522 -16.742 1.00 41.22 C ATOM 2298 NH1 ARG A 140 7.075 4.813 -16.571 1.00 4.40 N ATOM 2299 NH2 ARG A 140 8.743 4.210 -17.925 1.00 22.23 N ATOM 0 H ARG A 140 9.373 8.307 -12.413 1.00 44.41 H new ATOM 0 HA ARG A 140 11.054 6.384 -13.623 1.00 70.43 H new ATOM 0 HB2 ARG A 140 8.957 8.295 -14.736 1.00 62.21 H new ATOM 0 HB3 ARG A 140 9.705 7.028 -15.688 1.00 62.21 H new ATOM 0 HG2 ARG A 140 8.149 6.505 -13.129 1.00 33.32 H new ATOM 0 HG3 ARG A 140 7.428 6.473 -14.726 1.00 33.32 H new ATOM 0 HD2 ARG A 140 9.659 4.667 -13.705 1.00 62.53 H new ATOM 0 HD3 ARG A 140 8.004 4.197 -14.035 1.00 62.53 H new ATOM 0 HE ARG A 140 10.149 4.345 -15.938 1.00 64.10 H new ATOM 0 HH11 ARG A 140 6.733 5.071 -15.645 1.00 4.40 H new ATOM 0 HH12 ARG A 140 6.432 4.785 -17.362 1.00 4.40 H new ATOM 0 HH21 ARG A 140 9.727 3.988 -18.077 1.00 22.23 H new ATOM 0 HH22 ARG A 140 8.088 4.186 -18.707 1.00 22.23 H new ATOM 2313 N ARG A 141 11.743 9.522 -14.291 1.00 63.11 N ATOM 2314 CA ARG A 141 12.747 10.429 -14.865 1.00 14.25 C ATOM 2315 C ARG A 141 14.074 10.362 -14.083 1.00 3.25 C ATOM 2316 O ARG A 141 15.104 10.880 -14.526 1.00 20.02 O ATOM 2317 CB ARG A 141 12.193 11.866 -14.874 1.00 72.55 C ATOM 2318 CG ARG A 141 13.157 12.913 -15.431 1.00 42.42 C ATOM 2319 CD ARG A 141 12.535 14.306 -15.452 1.00 3.33 C ATOM 2320 NE ARG A 141 13.508 15.339 -15.808 1.00 3.43 N ATOM 2321 CZ ARG A 141 13.194 16.529 -16.241 1.00 43.51 C ATOM 2322 NH1 ARG A 141 11.958 16.862 -16.426 1.00 25.24 N ATOM 2323 NH2 ARG A 141 14.117 17.389 -16.503 1.00 4.02 N ATOM 0 H ARG A 141 11.049 9.988 -13.707 1.00 63.11 H new ATOM 0 HA ARG A 141 12.956 10.116 -15.888 1.00 14.25 H new ATOM 0 HB2 ARG A 141 11.276 11.885 -15.463 1.00 72.55 H new ATOM 0 HB3 ARG A 141 11.923 12.144 -13.855 1.00 72.55 H new ATOM 0 HG2 ARG A 141 14.064 12.930 -14.826 1.00 42.42 H new ATOM 0 HG3 ARG A 141 13.453 12.632 -16.442 1.00 42.42 H new ATOM 0 HD2 ARG A 141 11.711 14.324 -16.165 1.00 3.33 H new ATOM 0 HD3 ARG A 141 12.113 14.529 -14.472 1.00 3.33 H new ATOM 0 HE ARG A 141 14.498 15.114 -15.711 1.00 3.43 H new ATOM 0 HH11 ARG A 141 11.215 16.191 -16.233 1.00 25.24 H new ATOM 0 HH12 ARG A 141 11.727 17.796 -16.765 1.00 25.24 H new ATOM 0 HH21 ARG A 141 15.098 17.141 -16.372 1.00 4.02 H new ATOM 0 HH22 ARG A 141 13.867 18.318 -16.841 1.00 4.02 H new ATOM 2337 N GLU A 142 14.047 9.716 -12.920 1.00 71.15 N ATOM 2338 CA GLU A 142 15.244 9.560 -12.091 1.00 33.12 C ATOM 2339 C GLU A 142 15.909 8.190 -12.316 1.00 33.52 C ATOM 2340 O GLU A 142 15.406 7.147 -11.890 1.00 74.41 O ATOM 2341 CB GLU A 142 14.893 9.757 -10.610 1.00 2.31 C ATOM 2342 CG GLU A 142 14.403 11.166 -10.289 1.00 72.31 C ATOM 2343 CD GLU A 142 14.109 11.371 -8.814 1.00 55.54 C ATOM 2344 OE1 GLU A 142 15.072 11.454 -8.020 1.00 50.14 O ATOM 2345 OE2 GLU A 142 12.922 11.471 -8.439 1.00 41.42 O ATOM 0 H GLU A 142 13.207 9.290 -12.528 1.00 71.15 H new ATOM 0 HA GLU A 142 15.962 10.325 -12.386 1.00 33.12 H new ATOM 0 HB2 GLU A 142 14.123 9.039 -10.327 1.00 2.31 H new ATOM 0 HB3 GLU A 142 15.772 9.538 -10.003 1.00 2.31 H new ATOM 0 HG2 GLU A 142 15.155 11.888 -10.607 1.00 72.31 H new ATOM 0 HG3 GLU A 142 13.501 11.371 -10.865 1.00 72.31 H new ATOM 2352 N GLY A 143 17.050 8.216 -12.997 1.00 43.24 N ATOM 2353 CA GLY A 143 17.768 6.991 -13.338 1.00 61.13 C ATOM 2354 C GLY A 143 18.562 7.132 -14.633 1.00 44.35 C ATOM 2355 O GLY A 143 18.535 6.244 -15.491 1.00 21.20 O ATOM 0 H GLY A 143 17.498 9.072 -13.324 1.00 43.24 H new ATOM 0 HA2 GLY A 143 18.445 6.730 -12.525 1.00 61.13 H new ATOM 0 HA3 GLY A 143 17.057 6.170 -13.437 1.00 61.13 H new ATOM 2359 N ARG A 144 19.271 8.254 -14.769 1.00 61.41 N ATOM 2360 CA ARG A 144 20.056 8.552 -15.973 1.00 64.32 C ATOM 2361 C ARG A 144 21.451 9.081 -15.617 1.00 74.33 C ATOM 2362 O ARG A 144 21.628 9.776 -14.614 1.00 30.13 O ATOM 2363 CB ARG A 144 19.329 9.582 -16.852 1.00 44.51 C ATOM 2364 CG ARG A 144 18.054 9.055 -17.501 1.00 1.45 C ATOM 2365 CD ARG A 144 17.416 10.093 -18.418 1.00 71.43 C ATOM 2366 NE ARG A 144 16.317 9.536 -19.208 1.00 25.45 N ATOM 2367 CZ ARG A 144 15.394 10.255 -19.787 1.00 55.12 C ATOM 2368 NH1 ARG A 144 15.347 11.538 -19.604 1.00 12.35 N ATOM 2369 NH2 ARG A 144 14.502 9.685 -20.533 1.00 1.31 N ATOM 0 H ARG A 144 19.319 8.979 -14.053 1.00 61.41 H new ATOM 0 HA ARG A 144 20.169 7.619 -16.525 1.00 64.32 H new ATOM 0 HB2 ARG A 144 19.082 10.453 -16.244 1.00 44.51 H new ATOM 0 HB3 ARG A 144 20.009 9.921 -17.634 1.00 44.51 H new ATOM 0 HG2 ARG A 144 18.282 8.156 -18.073 1.00 1.45 H new ATOM 0 HG3 ARG A 144 17.343 8.768 -16.726 1.00 1.45 H new ATOM 0 HD2 ARG A 144 17.045 10.924 -17.819 1.00 71.43 H new ATOM 0 HD3 ARG A 144 18.174 10.497 -19.089 1.00 71.43 H new ATOM 0 HE ARG A 144 16.269 8.523 -19.313 1.00 25.45 H new ATOM 0 HH11 ARG A 144 16.035 11.993 -19.004 1.00 12.35 H new ATOM 0 HH12 ARG A 144 14.622 12.092 -20.060 1.00 12.35 H new ATOM 0 HH21 ARG A 144 14.521 8.674 -20.668 1.00 1.31 H new ATOM 0 HH22 ARG A 144 13.781 10.247 -20.985 1.00 1.31 H new ATOM 2383 N ARG A 145 22.433 8.758 -16.455 1.00 64.14 N ATOM 2384 CA ARG A 145 23.820 9.212 -16.247 1.00 10.43 C ATOM 2385 C ARG A 145 24.134 10.521 -17.012 1.00 35.43 C ATOM 2386 O ARG A 145 24.211 11.586 -16.358 1.00 37.85 O ATOM 2387 CB ARG A 145 24.830 8.089 -16.590 1.00 31.21 C ATOM 2388 CG ARG A 145 24.375 7.061 -17.640 1.00 24.24 C ATOM 2389 CD ARG A 145 24.455 7.579 -19.081 1.00 70.34 C ATOM 2390 NE ARG A 145 23.172 8.080 -19.577 1.00 32.30 N ATOM 2391 CZ ARG A 145 23.025 8.730 -20.700 1.00 73.32 C ATOM 2392 NH1 ARG A 145 24.046 9.018 -21.443 1.00 52.31 N ATOM 2393 NH2 ARG A 145 21.847 9.092 -21.081 1.00 61.05 N ATOM 2394 OXT ARG A 145 24.275 10.491 -18.252 1.00 37.85 O ATOM 0 H ARG A 145 22.301 8.183 -17.287 1.00 64.14 H new ATOM 0 HA ARG A 145 23.926 9.444 -15.187 1.00 10.43 H new ATOM 0 HB2 ARG A 145 25.751 8.553 -16.942 1.00 31.21 H new ATOM 0 HB3 ARG A 145 25.073 7.555 -15.671 1.00 31.21 H new ATOM 0 HG2 ARG A 145 24.990 6.166 -17.550 1.00 24.24 H new ATOM 0 HG3 ARG A 145 23.348 6.765 -17.426 1.00 24.24 H new ATOM 0 HD2 ARG A 145 25.196 8.376 -19.135 1.00 70.34 H new ATOM 0 HD3 ARG A 145 24.802 6.777 -19.732 1.00 70.34 H new ATOM 0 HE ARG A 145 22.341 7.911 -19.010 1.00 32.30 H new ATOM 0 HH11 ARG A 145 24.983 8.736 -21.154 1.00 52.31 H new ATOM 0 HH12 ARG A 145 23.913 9.526 -22.317 1.00 52.31 H new ATOM 0 HH21 ARG A 145 21.034 8.870 -20.506 1.00 61.05 H new ATOM 0 HH22 ARG A 145 21.728 9.600 -21.958 1.00 61.05 H new TER 2408 ARG A 145