USER MOD reduce.3.24.130724 H: found=0, std=0, add=1339, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1336 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 157 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 159 ASN : amide:sc= -1.79 K(o=-1.8,f=-8.1!) USER MOD Set 2.1: A 91 HIS : no HD1:sc= -3.42 K(o=-3.4,f=-4!) USER MOD Set 2.2: A 92 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 58 HIS :FLIP no HE2:sc= -1.26 F(o=-2.1,f=-1.3) USER MOD Set 3.2: A 59 SER OG : rot 180:sc= 0.00266 USER MOD Single : A 1 GLY N :NH3+ -107:sc= 0.0611 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot -170:sc= -0.62 USER MOD Single : A 14 SER OG : rot 170:sc= 0.049 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN :FLIP amide:sc= -1.39 F(o=-2.1!,f=-1.4) USER MOD Single : A 23 LYS NZ :NH3+ -153:sc= 0.00703 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0.122 USER MOD Single : A 29 HIS :FLIP no HD1:sc= -0.362 F(o=-0.97,f=-0.36) USER MOD Single : A 30 GLN : amide:sc= -0.189 K(o=-0.19,f=-1.7!) USER MOD Single : A 36 THR OG1 : rot 180:sc= -1.38 USER MOD Single : A 39 SER OG : rot 26:sc= 0.0226 USER MOD Single : A 40 ASN : amide:sc= -0.0997 K(o=-0.1,f=-2.4) USER MOD Single : A 41 CYS SG : rot -4:sc= -0.578 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -1.42 K(o=-1.4,f=-4.2!) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.278 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 CYS SG : rot 33:sc= -0.0924 USER MOD Single : A 61 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0685) USER MOD Single : A 64 CYS SG : rot -140:sc= -1.77 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0592 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 76 CYS SG : rot 80:sc= -2.53 USER MOD Single : A 77 SER OG : rot 180:sc=-0.00261 USER MOD Single : A 79 CYS SG : rot -16:sc= 0.583 USER MOD Single : A 85 CYS SG : rot -73:sc= -2.6! USER MOD Single : A 86 GLN : amide:sc= -0.246 X(o=-0.25,f=0) USER MOD Single : A 87 GLN : amide:sc= -0.195 K(o=-0.19,f=-3.8!) USER MOD Single : A 93 THR OG1 : rot -110:sc= -1.52 USER MOD Single : A 94 LYS NZ :NH3+ 156:sc= -0.0114 (180deg=-0.234) USER MOD Single : A 96 THR OG1 : rot 90:sc= -0.996 USER MOD Single : A 101 GLN : amide:sc= -1.03 K(o=-1,f=-3!) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.389 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 111 CYS SG : rot 32:sc= -0.532 USER MOD Single : A 112 SER OG : rot -0:sc= 1.03 USER MOD Single : A 115 GLN : amide:sc= -2.34 K(o=-2.3,f=-5.6!) USER MOD Single : A 119 TYR OH : rot -101:sc= 0.976 USER MOD Single : A 120 THR OG1 : rot 48:sc= 1.23 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 25:sc= -0.321 USER MOD Single : A 138 SER OG : rot -55:sc= 0.0207 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 ASN :FLIP amide:sc= -0.0882 F(o=-0.68,f=-0.088) USER MOD Single : A 141 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 ASN : amide:sc= -0.224 K(o=-0.22,f=-1.9!) USER MOD Single : A 149 ASN : amide:sc= -0.438 K(o=-0.44,f=-1.3) USER MOD Single : A 155 MET CE :methyl -161:sc= -0.0808 (180deg=-0.4) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 GLN : amide:sc= -0.204 X(o=-0.2,f=0) USER MOD Single : A 174 SER OG : rot 40:sc= 0.63 USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 178 SER OG : rot 52:sc= 1.14 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.189 -15.509 14.172 1.00 0.00 N ATOM 2 CA GLY A 1 -13.296 -16.476 13.928 1.00 0.00 C ATOM 3 C GLY A 1 -12.845 -17.684 13.131 1.00 0.00 C ATOM 4 O GLY A 1 -11.788 -17.662 12.500 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.898 -15.559 15.169 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.380 -15.746 13.563 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.515 -14.546 13.955 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.703 -16.806 14.884 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.103 -15.973 13.395 1.00 0.00 H new ATOM 10 N SER A 2 -13.648 -18.742 13.159 1.00 0.00 N ATOM 11 CA SER A 2 -13.327 -19.966 12.434 1.00 0.00 C ATOM 12 C SER A 2 -13.704 -19.842 10.961 1.00 0.00 C ATOM 13 O SER A 2 -14.519 -18.998 10.588 1.00 0.00 O ATOM 14 CB SER A 2 -14.052 -21.159 13.058 1.00 0.00 C ATOM 15 OG SER A 2 -13.342 -22.365 12.830 1.00 0.00 O ATOM 0 H SER A 2 -14.526 -18.777 13.676 1.00 0.00 H new ATOM 0 HA SER A 2 -12.251 -20.126 12.503 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.167 -20.998 14.130 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.055 -21.239 12.638 1.00 0.00 H new ATOM 0 HG SER A 2 -13.826 -23.112 13.240 1.00 0.00 H new ATOM 21 N SER A 3 -13.105 -20.686 10.129 1.00 0.00 N ATOM 22 CA SER A 3 -13.378 -20.671 8.696 1.00 0.00 C ATOM 23 C SER A 3 -13.237 -22.068 8.101 1.00 0.00 C ATOM 24 O SER A 3 -12.857 -22.224 6.941 1.00 0.00 O ATOM 25 CB SER A 3 -12.432 -19.703 7.986 1.00 0.00 C ATOM 26 OG SER A 3 -11.077 -20.031 8.244 1.00 0.00 O ATOM 0 H SER A 3 -12.427 -21.390 10.422 1.00 0.00 H new ATOM 0 HA SER A 3 -14.405 -20.336 8.550 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.618 -19.730 6.912 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.632 -18.684 8.318 1.00 0.00 H new ATOM 0 HG SER A 3 -10.493 -19.398 7.777 1.00 0.00 H new ATOM 32 N GLY A 4 -13.546 -23.082 8.903 1.00 0.00 N ATOM 33 CA GLY A 4 -13.447 -24.453 8.437 1.00 0.00 C ATOM 34 C GLY A 4 -14.804 -25.068 8.154 1.00 0.00 C ATOM 35 O GLY A 4 -15.162 -26.092 8.736 1.00 0.00 O ATOM 0 H GLY A 4 -13.863 -22.979 9.867 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.842 -24.483 7.531 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.929 -25.052 9.186 1.00 0.00 H new ATOM 39 N SER A 5 -15.560 -24.442 7.258 1.00 0.00 N ATOM 40 CA SER A 5 -16.884 -24.935 6.898 1.00 0.00 C ATOM 41 C SER A 5 -17.269 -24.484 5.492 1.00 0.00 C ATOM 42 O SER A 5 -16.769 -23.474 4.995 1.00 0.00 O ATOM 43 CB SER A 5 -17.925 -24.445 7.906 1.00 0.00 C ATOM 44 OG SER A 5 -17.691 -23.095 8.264 1.00 0.00 O ATOM 0 H SER A 5 -15.278 -23.593 6.768 1.00 0.00 H new ATOM 0 HA SER A 5 -16.856 -26.024 6.916 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.923 -24.544 7.480 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.896 -25.071 8.798 1.00 0.00 H new ATOM 0 HG SER A 5 -18.371 -22.805 8.908 1.00 0.00 H new ATOM 50 N SER A 6 -18.159 -25.239 4.856 1.00 0.00 N ATOM 51 CA SER A 6 -18.611 -24.916 3.508 1.00 0.00 C ATOM 52 C SER A 6 -19.355 -23.584 3.487 1.00 0.00 C ATOM 53 O SER A 6 -20.358 -23.412 4.179 1.00 0.00 O ATOM 54 CB SER A 6 -19.515 -26.027 2.971 1.00 0.00 C ATOM 55 OG SER A 6 -18.768 -26.987 2.244 1.00 0.00 O ATOM 0 H SER A 6 -18.581 -26.079 5.253 1.00 0.00 H new ATOM 0 HA SER A 6 -17.733 -24.830 2.868 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.029 -26.514 3.800 1.00 0.00 H new ATOM 0 HB3 SER A 6 -20.283 -25.596 2.328 1.00 0.00 H new ATOM 0 HG SER A 6 -19.369 -27.687 1.913 1.00 0.00 H new ATOM 61 N GLY A 7 -18.855 -22.647 2.689 1.00 0.00 N ATOM 62 CA GLY A 7 -19.485 -21.342 2.593 1.00 0.00 C ATOM 63 C GLY A 7 -18.552 -20.288 2.031 1.00 0.00 C ATOM 64 O GLY A 7 -17.360 -20.536 1.851 1.00 0.00 O ATOM 0 H GLY A 7 -18.026 -22.767 2.107 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -20.369 -21.415 1.960 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -19.825 -21.032 3.581 1.00 0.00 H new ATOM 68 N SER A 8 -19.097 -19.107 1.753 1.00 0.00 N ATOM 69 CA SER A 8 -18.305 -18.010 1.207 1.00 0.00 C ATOM 70 C SER A 8 -18.171 -16.879 2.222 1.00 0.00 C ATOM 71 O SER A 8 -18.953 -15.928 2.214 1.00 0.00 O ATOM 72 CB SER A 8 -18.943 -17.484 -0.079 1.00 0.00 C ATOM 73 OG SER A 8 -17.985 -16.833 -0.894 1.00 0.00 O ATOM 0 H SER A 8 -20.082 -18.886 1.897 1.00 0.00 H new ATOM 0 HA SER A 8 -17.309 -18.391 0.980 1.00 0.00 H new ATOM 0 HB2 SER A 8 -19.393 -18.310 -0.630 1.00 0.00 H new ATOM 0 HB3 SER A 8 -19.747 -16.790 0.167 1.00 0.00 H new ATOM 0 HG SER A 8 -18.418 -16.507 -1.711 1.00 0.00 H new ATOM 79 N TRP A 9 -17.176 -16.989 3.095 1.00 0.00 N ATOM 80 CA TRP A 9 -16.938 -15.975 4.117 1.00 0.00 C ATOM 81 C TRP A 9 -15.592 -15.291 3.902 1.00 0.00 C ATOM 82 O TRP A 9 -15.530 -14.148 3.452 1.00 0.00 O ATOM 83 CB TRP A 9 -16.987 -16.604 5.510 1.00 0.00 C ATOM 84 CG TRP A 9 -18.370 -16.994 5.937 1.00 0.00 C ATOM 85 CD1 TRP A 9 -18.778 -18.224 6.368 1.00 0.00 C ATOM 86 CD2 TRP A 9 -19.526 -16.152 5.972 1.00 0.00 C ATOM 87 NE1 TRP A 9 -20.118 -18.197 6.671 1.00 0.00 N ATOM 88 CE2 TRP A 9 -20.600 -16.936 6.436 1.00 0.00 C ATOM 89 CE3 TRP A 9 -19.760 -14.809 5.659 1.00 0.00 C ATOM 90 CZ2 TRP A 9 -21.885 -16.422 6.592 1.00 0.00 C ATOM 91 CZ3 TRP A 9 -21.035 -14.300 5.816 1.00 0.00 C ATOM 92 CH2 TRP A 9 -22.083 -15.105 6.279 1.00 0.00 C ATOM 0 H TRP A 9 -16.521 -17.770 3.116 1.00 0.00 H new ATOM 0 HA TRP A 9 -17.723 -15.223 4.038 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -16.347 -17.486 5.525 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -16.576 -15.900 6.233 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -18.141 -19.091 6.458 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -20.665 -18.987 7.015 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -18.958 -14.181 5.301 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -22.696 -17.041 6.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -21.226 -13.264 5.578 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -23.068 -14.677 6.391 1.00 0.00 H new ATOM 103 N VAL A 10 -14.515 -16.001 4.228 1.00 0.00 N ATOM 104 CA VAL A 10 -13.170 -15.463 4.071 1.00 0.00 C ATOM 105 C VAL A 10 -12.763 -15.419 2.602 1.00 0.00 C ATOM 106 O VAL A 10 -13.212 -16.236 1.799 1.00 0.00 O ATOM 107 CB VAL A 10 -12.137 -16.296 4.853 1.00 0.00 C ATOM 108 CG1 VAL A 10 -12.291 -16.072 6.349 1.00 0.00 C ATOM 109 CG2 VAL A 10 -12.271 -17.771 4.509 1.00 0.00 C ATOM 0 H VAL A 10 -14.549 -16.949 4.602 1.00 0.00 H new ATOM 0 HA VAL A 10 -13.187 -14.449 4.471 1.00 0.00 H new ATOM 0 HB VAL A 10 -11.139 -15.969 4.563 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -11.553 -16.669 6.884 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -12.139 -15.017 6.577 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -13.292 -16.369 6.660 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -11.533 -18.344 5.071 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -13.272 -18.116 4.768 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -12.104 -17.912 3.441 1.00 0.00 H new ATOM 119 N CYS A 11 -11.910 -14.460 2.258 1.00 0.00 N ATOM 120 CA CYS A 11 -11.442 -14.311 0.885 1.00 0.00 C ATOM 121 C CYS A 11 -10.008 -14.809 0.741 1.00 0.00 C ATOM 122 O CYS A 11 -9.345 -15.116 1.731 1.00 0.00 O ATOM 123 CB CYS A 11 -11.531 -12.846 0.451 1.00 0.00 C ATOM 124 SG CYS A 11 -13.210 -12.177 0.451 1.00 0.00 S ATOM 0 H CYS A 11 -11.529 -13.775 2.911 1.00 0.00 H new ATOM 0 HA CYS A 11 -12.083 -14.914 0.242 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -10.911 -12.243 1.115 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -11.113 -12.749 -0.551 1.00 0.00 H new ATOM 0 HG CYS A 11 -13.213 -11.011 -0.124 1.00 0.00 H new ATOM 130 N GLY A 12 -9.536 -14.887 -0.499 1.00 0.00 N ATOM 131 CA GLY A 12 -8.183 -15.349 -0.749 1.00 0.00 C ATOM 132 C GLY A 12 -7.962 -15.738 -2.198 1.00 0.00 C ATOM 133 O GLY A 12 -8.563 -16.694 -2.690 1.00 0.00 O ATOM 0 H GLY A 12 -10.066 -14.639 -1.335 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -7.478 -14.564 -0.475 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -7.971 -16.206 -0.109 1.00 0.00 H new ATOM 137 N PHE A 13 -7.096 -14.997 -2.882 1.00 0.00 N ATOM 138 CA PHE A 13 -6.796 -15.269 -4.283 1.00 0.00 C ATOM 139 C PHE A 13 -5.306 -15.107 -4.560 1.00 0.00 C ATOM 140 O PHE A 13 -4.760 -14.008 -4.457 1.00 0.00 O ATOM 141 CB PHE A 13 -7.600 -14.334 -5.189 1.00 0.00 C ATOM 142 CG PHE A 13 -8.928 -14.898 -5.606 1.00 0.00 C ATOM 143 CD1 PHE A 13 -9.010 -16.149 -6.196 1.00 0.00 C ATOM 144 CD2 PHE A 13 -10.095 -14.177 -5.408 1.00 0.00 C ATOM 145 CE1 PHE A 13 -10.231 -16.671 -6.582 1.00 0.00 C ATOM 146 CE2 PHE A 13 -11.318 -14.694 -5.791 1.00 0.00 C ATOM 147 CZ PHE A 13 -11.386 -15.942 -6.378 1.00 0.00 C ATOM 0 H PHE A 13 -6.590 -14.204 -2.489 1.00 0.00 H new ATOM 0 HA PHE A 13 -7.077 -16.300 -4.496 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -7.762 -13.389 -4.670 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -7.013 -14.111 -6.080 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -8.110 -16.723 -6.356 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -10.048 -13.200 -4.949 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -10.281 -17.647 -7.042 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -12.220 -14.122 -5.631 1.00 0.00 H new ATOM 0 HZ PHE A 13 -12.341 -16.347 -6.677 1.00 0.00 H new ATOM 157 N SER A 14 -4.651 -16.208 -4.915 1.00 0.00 N ATOM 158 CA SER A 14 -3.222 -16.187 -5.207 1.00 0.00 C ATOM 159 C SER A 14 -2.888 -17.134 -6.355 1.00 0.00 C ATOM 160 O SER A 14 -3.724 -17.933 -6.777 1.00 0.00 O ATOM 161 CB SER A 14 -2.420 -16.571 -3.962 1.00 0.00 C ATOM 162 OG SER A 14 -2.658 -15.662 -2.901 1.00 0.00 O ATOM 0 H SER A 14 -5.087 -17.126 -5.007 1.00 0.00 H new ATOM 0 HA SER A 14 -2.952 -15.174 -5.506 1.00 0.00 H new ATOM 0 HB2 SER A 14 -2.690 -17.579 -3.648 1.00 0.00 H new ATOM 0 HB3 SER A 14 -1.357 -16.586 -4.201 1.00 0.00 H new ATOM 0 HG SER A 14 -2.266 -16.014 -2.075 1.00 0.00 H new ATOM 168 N ASN A 15 -1.660 -17.040 -6.854 1.00 0.00 N ATOM 169 CA ASN A 15 -1.214 -17.888 -7.953 1.00 0.00 C ATOM 170 C ASN A 15 -2.060 -17.653 -9.200 1.00 0.00 C ATOM 171 O ASN A 15 -2.270 -18.565 -10.001 1.00 0.00 O ATOM 172 CB ASN A 15 -1.278 -19.362 -7.544 1.00 0.00 C ATOM 173 CG ASN A 15 0.027 -20.090 -7.798 1.00 0.00 C ATOM 174 OD1 ASN A 15 0.425 -20.293 -8.945 1.00 0.00 O ATOM 175 ND2 ASN A 15 0.700 -20.491 -6.725 1.00 0.00 N ATOM 0 H ASN A 15 -0.956 -16.385 -6.515 1.00 0.00 H new ATOM 0 HA ASN A 15 -0.181 -17.628 -8.186 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -1.530 -19.432 -6.486 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -2.079 -19.855 -8.095 1.00 0.00 H new ATOM 0 HD21 ASN A 15 1.584 -20.988 -6.834 1.00 0.00 H new ATOM 0 HD22 ASN A 15 0.333 -20.301 -5.792 1.00 0.00 H new ATOM 182 N LEU A 16 -2.543 -16.425 -9.360 1.00 0.00 N ATOM 183 CA LEU A 16 -3.366 -16.069 -10.509 1.00 0.00 C ATOM 184 C LEU A 16 -2.637 -15.084 -11.417 1.00 0.00 C ATOM 185 O LEU A 16 -1.729 -14.376 -10.980 1.00 0.00 O ATOM 186 CB LEU A 16 -4.694 -15.468 -10.046 1.00 0.00 C ATOM 187 CG LEU A 16 -5.433 -16.277 -8.979 1.00 0.00 C ATOM 188 CD1 LEU A 16 -6.591 -15.473 -8.407 1.00 0.00 C ATOM 189 CD2 LEU A 16 -5.931 -17.592 -9.560 1.00 0.00 C ATOM 0 H LEU A 16 -2.378 -15.659 -8.707 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.566 -16.978 -11.076 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -4.506 -14.467 -9.657 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.346 -15.356 -10.912 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.737 -16.499 -8.170 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.105 -16.064 -7.649 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.210 -14.557 -7.955 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.289 -15.221 -9.206 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.455 -18.156 -8.788 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.612 -17.390 -10.387 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.083 -18.174 -9.922 1.00 0.00 H new ATOM 201 N GLU A 17 -3.042 -15.041 -12.682 1.00 0.00 N ATOM 202 CA GLU A 17 -2.430 -14.141 -13.652 1.00 0.00 C ATOM 203 C GLU A 17 -3.368 -13.887 -14.827 1.00 0.00 C ATOM 204 O GLU A 17 -3.940 -14.820 -15.390 1.00 0.00 O ATOM 205 CB GLU A 17 -1.107 -14.723 -14.157 1.00 0.00 C ATOM 206 CG GLU A 17 -0.202 -13.695 -14.815 1.00 0.00 C ATOM 207 CD GLU A 17 0.841 -14.330 -15.715 1.00 0.00 C ATOM 208 OE1 GLU A 17 0.461 -15.147 -16.580 1.00 0.00 O ATOM 209 OE2 GLU A 17 2.037 -14.007 -15.555 1.00 0.00 O ATOM 0 H GLU A 17 -3.792 -15.620 -13.059 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.235 -13.191 -13.155 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -0.577 -15.179 -13.320 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.319 -15.519 -14.871 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -0.808 -13.003 -15.399 1.00 0.00 H new ATOM 0 HG3 GLU A 17 0.297 -13.108 -14.044 1.00 0.00 H new ATOM 216 N SER A 18 -3.520 -12.619 -15.192 1.00 0.00 N ATOM 217 CA SER A 18 -4.390 -12.241 -16.301 1.00 0.00 C ATOM 218 C SER A 18 -5.829 -12.666 -16.032 1.00 0.00 C ATOM 219 O SER A 18 -6.553 -13.059 -16.948 1.00 0.00 O ATOM 220 CB SER A 18 -3.894 -12.871 -17.603 1.00 0.00 C ATOM 221 OG SER A 18 -2.960 -12.029 -18.256 1.00 0.00 O ATOM 0 H SER A 18 -3.052 -11.835 -14.737 1.00 0.00 H new ATOM 0 HA SER A 18 -4.363 -11.156 -16.398 1.00 0.00 H new ATOM 0 HB2 SER A 18 -3.432 -13.835 -17.391 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.740 -13.061 -18.263 1.00 0.00 H new ATOM 0 HG SER A 18 -2.658 -12.456 -19.084 1.00 0.00 H new ATOM 227 N GLN A 19 -6.240 -12.584 -14.771 1.00 0.00 N ATOM 228 CA GLN A 19 -7.594 -12.959 -14.381 1.00 0.00 C ATOM 229 C GLN A 19 -8.360 -11.753 -13.847 1.00 0.00 C ATOM 230 O GLN A 19 -7.778 -10.696 -13.598 1.00 0.00 O ATOM 231 CB GLN A 19 -7.554 -14.062 -13.322 1.00 0.00 C ATOM 232 CG GLN A 19 -6.617 -15.207 -13.671 1.00 0.00 C ATOM 233 CD GLN A 19 -7.142 -16.553 -13.213 1.00 0.00 C ATOM 234 OE1 GLN A 19 -6.273 -17.353 -12.606 1.00 0.00 O flip ATOM 235 NE2 GLN A 19 -8.317 -16.871 -13.403 1.00 0.00 N flip ATOM 0 H GLN A 19 -5.654 -12.261 -14.001 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.110 -13.332 -15.265 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.246 -13.629 -12.370 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -8.560 -14.457 -13.182 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.464 -15.229 -14.750 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -5.644 -15.027 -13.214 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -8.950 -16.225 -13.874 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -8.656 -17.780 -13.089 1.00 0.00 H new ATOM 244 N VAL A 20 -9.667 -11.918 -13.672 1.00 0.00 N ATOM 245 CA VAL A 20 -10.512 -10.842 -13.168 1.00 0.00 C ATOM 246 C VAL A 20 -11.364 -11.315 -11.996 1.00 0.00 C ATOM 247 O VAL A 20 -12.278 -12.123 -12.165 1.00 0.00 O ATOM 248 CB VAL A 20 -11.436 -10.290 -14.269 1.00 0.00 C ATOM 249 CG1 VAL A 20 -12.164 -9.046 -13.785 1.00 0.00 C ATOM 250 CG2 VAL A 20 -10.644 -9.995 -15.533 1.00 0.00 C ATOM 0 H VAL A 20 -10.164 -12.786 -13.872 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.845 -10.048 -12.832 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.182 -11.049 -14.504 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -12.812 -8.672 -14.578 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -12.766 -9.294 -12.911 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -11.437 -8.279 -13.519 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -11.314 -9.606 -16.300 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.873 -9.256 -15.315 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.176 -10.912 -15.892 1.00 0.00 H new ATOM 260 N LEU A 21 -11.060 -10.807 -10.806 1.00 0.00 N ATOM 261 CA LEU A 21 -11.800 -11.178 -9.604 1.00 0.00 C ATOM 262 C LEU A 21 -12.666 -10.020 -9.120 1.00 0.00 C ATOM 263 O LEU A 21 -12.266 -8.858 -9.195 1.00 0.00 O ATOM 264 CB LEU A 21 -10.835 -11.606 -8.497 1.00 0.00 C ATOM 265 CG LEU A 21 -9.705 -12.535 -8.943 1.00 0.00 C ATOM 266 CD1 LEU A 21 -8.544 -12.472 -7.964 1.00 0.00 C ATOM 267 CD2 LEU A 21 -10.214 -13.963 -9.079 1.00 0.00 C ATOM 0 H LEU A 21 -10.307 -10.138 -10.648 1.00 0.00 H new ATOM 0 HA LEU A 21 -12.451 -12.016 -9.852 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.396 -10.712 -8.054 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -11.405 -12.104 -7.712 1.00 0.00 H new ATOM 0 HG LEU A 21 -9.349 -12.202 -9.918 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -7.750 -13.140 -8.298 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -8.164 -11.452 -7.916 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -8.885 -12.780 -6.975 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.398 -14.611 -9.397 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -10.596 -14.306 -8.118 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -11.013 -13.995 -9.820 1.00 0.00 H new ATOM 279 N GLU A 22 -13.854 -10.346 -8.621 1.00 0.00 N ATOM 280 CA GLU A 22 -14.777 -9.335 -8.121 1.00 0.00 C ATOM 281 C GLU A 22 -15.495 -9.827 -6.868 1.00 0.00 C ATOM 282 O GLU A 22 -15.973 -10.960 -6.819 1.00 0.00 O ATOM 283 CB GLU A 22 -15.798 -8.968 -9.202 1.00 0.00 C ATOM 284 CG GLU A 22 -15.621 -7.563 -9.754 1.00 0.00 C ATOM 285 CD GLU A 22 -16.722 -6.618 -9.315 1.00 0.00 C ATOM 286 OE1 GLU A 22 -17.894 -7.048 -9.283 1.00 0.00 O ATOM 287 OE2 GLU A 22 -16.412 -5.449 -9.002 1.00 0.00 O ATOM 0 H GLU A 22 -14.200 -11.303 -8.552 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.201 -8.447 -7.861 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -15.721 -9.683 -10.021 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.802 -9.063 -8.789 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.658 -7.168 -9.429 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -15.597 -7.605 -10.843 1.00 0.00 H new ATOM 294 N LYS A 23 -15.565 -8.968 -5.855 1.00 0.00 N ATOM 295 CA LYS A 23 -16.224 -9.316 -4.602 1.00 0.00 C ATOM 296 C LYS A 23 -17.275 -8.274 -4.231 1.00 0.00 C ATOM 297 O LYS A 23 -17.253 -7.151 -4.734 1.00 0.00 O ATOM 298 CB LYS A 23 -15.193 -9.442 -3.478 1.00 0.00 C ATOM 299 CG LYS A 23 -14.058 -10.400 -3.798 1.00 0.00 C ATOM 300 CD LYS A 23 -14.269 -11.755 -3.140 1.00 0.00 C ATOM 301 CE LYS A 23 -13.780 -12.888 -4.029 1.00 0.00 C ATOM 302 NZ LYS A 23 -13.789 -14.196 -3.317 1.00 0.00 N ATOM 0 H LYS A 23 -15.173 -8.026 -5.878 1.00 0.00 H new ATOM 0 HA LYS A 23 -16.723 -10.275 -4.737 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -14.777 -8.457 -3.266 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -15.696 -9.778 -2.571 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -13.981 -10.527 -4.878 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -13.114 -9.973 -3.459 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -13.740 -11.784 -2.187 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -15.328 -11.894 -2.921 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -14.412 -12.953 -4.915 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -12.769 -12.669 -4.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -13.069 -14.822 -3.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -13.578 -14.045 -2.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -14.726 -14.636 -3.412 1.00 0.00 H new ATOM 316 N ARG A 24 -18.194 -8.655 -3.349 1.00 0.00 N ATOM 317 CA ARG A 24 -19.254 -7.754 -2.912 1.00 0.00 C ATOM 318 C ARG A 24 -19.248 -7.601 -1.394 1.00 0.00 C ATOM 319 O ARG A 24 -18.508 -8.291 -0.692 1.00 0.00 O ATOM 320 CB ARG A 24 -20.616 -8.273 -3.378 1.00 0.00 C ATOM 321 CG ARG A 24 -21.019 -7.770 -4.755 1.00 0.00 C ATOM 322 CD ARG A 24 -22.371 -7.074 -4.723 1.00 0.00 C ATOM 323 NE ARG A 24 -22.970 -6.980 -6.053 1.00 0.00 N ATOM 324 CZ ARG A 24 -23.597 -7.987 -6.655 1.00 0.00 C ATOM 325 NH1 ARG A 24 -23.712 -9.165 -6.052 1.00 0.00 N ATOM 326 NH2 ARG A 24 -24.113 -7.817 -7.865 1.00 0.00 N ATOM 0 H ARG A 24 -18.226 -9.581 -2.923 1.00 0.00 H new ATOM 0 HA ARG A 24 -19.072 -6.776 -3.358 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -20.596 -9.363 -3.390 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -21.376 -7.976 -2.655 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -20.262 -7.079 -5.127 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -21.056 -8.607 -5.452 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -23.043 -7.619 -4.060 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -22.254 -6.074 -4.307 1.00 0.00 H new ATOM 0 HE ARG A 24 -22.903 -6.091 -6.548 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -23.318 -9.302 -5.121 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -24.194 -9.932 -6.520 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -24.029 -6.915 -8.333 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -24.594 -8.589 -8.327 1.00 0.00 H new ATOM 340 N ALA A 25 -20.078 -6.691 -0.894 1.00 0.00 N ATOM 341 CA ALA A 25 -20.169 -6.447 0.540 1.00 0.00 C ATOM 342 C ALA A 25 -20.716 -7.668 1.272 1.00 0.00 C ATOM 343 O ALA A 25 -20.377 -7.914 2.429 1.00 0.00 O ATOM 344 CB ALA A 25 -21.044 -5.231 0.812 1.00 0.00 C ATOM 0 H ALA A 25 -20.697 -6.111 -1.461 1.00 0.00 H new ATOM 0 HA ALA A 25 -19.164 -6.252 0.915 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -21.104 -5.059 1.887 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -20.611 -4.356 0.328 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -22.044 -5.407 0.416 1.00 0.00 H new ATOM 350 N SER A 26 -21.565 -8.430 0.589 1.00 0.00 N ATOM 351 CA SER A 26 -22.159 -9.626 1.175 1.00 0.00 C ATOM 352 C SER A 26 -21.134 -10.752 1.271 1.00 0.00 C ATOM 353 O SER A 26 -21.187 -11.575 2.185 1.00 0.00 O ATOM 354 CB SER A 26 -23.360 -10.083 0.343 1.00 0.00 C ATOM 355 OG SER A 26 -23.247 -9.646 -1.000 1.00 0.00 O ATOM 0 H SER A 26 -21.857 -8.240 -0.370 1.00 0.00 H new ATOM 0 HA SER A 26 -22.495 -9.379 2.182 1.00 0.00 H new ATOM 0 HB2 SER A 26 -23.432 -11.170 0.370 1.00 0.00 H new ATOM 0 HB3 SER A 26 -24.279 -9.692 0.780 1.00 0.00 H new ATOM 0 HG SER A 26 -24.026 -9.952 -1.510 1.00 0.00 H new ATOM 361 N GLU A 27 -20.202 -10.779 0.324 1.00 0.00 N ATOM 362 CA GLU A 27 -19.164 -11.804 0.304 1.00 0.00 C ATOM 363 C GLU A 27 -18.124 -11.546 1.389 1.00 0.00 C ATOM 364 O GLU A 27 -17.593 -12.483 1.987 1.00 0.00 O ATOM 365 CB GLU A 27 -18.490 -11.848 -1.069 1.00 0.00 C ATOM 366 CG GLU A 27 -19.071 -12.899 -2.000 1.00 0.00 C ATOM 367 CD GLU A 27 -19.116 -12.440 -3.443 1.00 0.00 C ATOM 368 OE1 GLU A 27 -18.045 -12.392 -4.085 1.00 0.00 O ATOM 369 OE2 GLU A 27 -20.222 -12.127 -3.933 1.00 0.00 O ATOM 0 H GLU A 27 -20.144 -10.104 -0.439 1.00 0.00 H new ATOM 0 HA GLU A 27 -19.634 -12.768 0.501 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -18.579 -10.869 -1.540 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -17.426 -12.042 -0.936 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -18.475 -13.809 -1.931 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -20.079 -13.152 -1.672 1.00 0.00 H new ATOM 376 N LEU A 28 -17.836 -10.273 1.637 1.00 0.00 N ATOM 377 CA LEU A 28 -16.858 -9.894 2.649 1.00 0.00 C ATOM 378 C LEU A 28 -17.542 -9.586 3.978 1.00 0.00 C ATOM 379 O LEU A 28 -17.425 -10.348 4.938 1.00 0.00 O ATOM 380 CB LEU A 28 -16.055 -8.678 2.184 1.00 0.00 C ATOM 381 CG LEU A 28 -15.186 -8.913 0.944 1.00 0.00 C ATOM 382 CD1 LEU A 28 -15.611 -7.992 -0.191 1.00 0.00 C ATOM 383 CD2 LEU A 28 -13.714 -8.709 1.275 1.00 0.00 C ATOM 0 H LEU A 28 -18.266 -9.486 1.151 1.00 0.00 H new ATOM 0 HA LEU A 28 -16.180 -10.735 2.795 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -16.747 -7.862 1.975 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -15.414 -8.350 3.002 1.00 0.00 H new ATOM 0 HG LEU A 28 -15.325 -9.944 0.619 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -14.982 -8.174 -1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -16.652 -8.188 -0.448 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -15.504 -6.954 0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -13.113 -8.880 0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -13.558 -7.689 1.627 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -13.415 -9.411 2.053 1.00 0.00 H new ATOM 395 N HIS A 29 -18.255 -8.466 4.026 1.00 0.00 N ATOM 396 CA HIS A 29 -18.957 -8.058 5.237 1.00 0.00 C ATOM 397 C HIS A 29 -17.978 -7.853 6.390 1.00 0.00 C ATOM 398 O HIS A 29 -18.174 -8.376 7.487 1.00 0.00 O ATOM 399 CB HIS A 29 -20.007 -9.102 5.620 1.00 0.00 C ATOM 400 CG HIS A 29 -20.920 -8.656 6.719 1.00 0.00 C ATOM 401 ND1 HIS A 29 -20.921 -7.507 7.444 1.00 0.00 N flip ATOM 402 CD2 HIS A 29 -21.974 -9.405 7.195 1.00 0.00 C flip ATOM 403 CE1 HIS A 29 -21.968 -7.546 8.360 1.00 0.00 C flip ATOM 404 NE2 HIS A 29 -22.569 -8.705 8.170 1.00 0.00 N flip ATOM 0 H HIS A 29 -18.362 -7.825 3.240 1.00 0.00 H new ATOM 0 HA HIS A 29 -19.456 -7.110 5.036 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -20.603 -9.346 4.740 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -19.502 -10.018 5.927 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -22.268 -10.383 6.844 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -22.234 -6.785 9.078 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -23.381 -9.026 8.697 1.00 0.00 H new ATOM 412 N GLN A 30 -16.922 -7.087 6.133 1.00 0.00 N ATOM 413 CA GLN A 30 -15.913 -6.812 7.148 1.00 0.00 C ATOM 414 C GLN A 30 -15.247 -8.103 7.615 1.00 0.00 C ATOM 415 O GLN A 30 -15.699 -8.737 8.568 1.00 0.00 O ATOM 416 CB GLN A 30 -16.541 -6.084 8.339 1.00 0.00 C ATOM 417 CG GLN A 30 -16.117 -4.630 8.455 1.00 0.00 C ATOM 418 CD GLN A 30 -17.195 -3.669 7.993 1.00 0.00 C ATOM 419 OE1 GLN A 30 -18.157 -4.066 7.338 1.00 0.00 O ATOM 420 NE2 GLN A 30 -17.038 -2.394 8.334 1.00 0.00 N ATOM 0 H GLN A 30 -16.744 -6.646 5.231 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.150 -6.172 6.704 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -17.626 -6.131 8.252 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -16.272 -6.607 9.257 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -15.861 -4.412 9.492 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -15.215 -4.470 7.864 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -16.224 -2.108 8.878 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -17.731 -1.701 8.051 1.00 0.00 H new ATOM 429 N ARG A 31 -14.170 -8.485 6.936 1.00 0.00 N ATOM 430 CA ARG A 31 -13.441 -9.700 7.282 1.00 0.00 C ATOM 431 C ARG A 31 -11.993 -9.618 6.810 1.00 0.00 C ATOM 432 O ARG A 31 -11.621 -8.706 6.071 1.00 0.00 O ATOM 433 CB ARG A 31 -14.122 -10.922 6.662 1.00 0.00 C ATOM 434 CG ARG A 31 -15.331 -11.407 7.446 1.00 0.00 C ATOM 435 CD ARG A 31 -15.910 -12.679 6.847 1.00 0.00 C ATOM 436 NE ARG A 31 -17.226 -12.993 7.398 1.00 0.00 N ATOM 437 CZ ARG A 31 -17.416 -13.563 8.586 1.00 0.00 C ATOM 438 NH1 ARG A 31 -16.380 -13.880 9.351 1.00 0.00 N ATOM 439 NH2 ARG A 31 -18.648 -13.815 9.010 1.00 0.00 N ATOM 0 H ARG A 31 -13.783 -7.972 6.144 1.00 0.00 H new ATOM 0 HA ARG A 31 -13.446 -9.801 8.367 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.432 -10.678 5.646 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -13.398 -11.733 6.588 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -15.045 -11.589 8.482 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -16.094 -10.629 7.458 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.987 -12.568 5.765 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.230 -13.510 7.035 1.00 0.00 H new ATOM 0 HE ARG A 31 -18.048 -12.762 6.840 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -15.431 -13.687 9.030 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -16.532 -14.317 10.260 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.448 -13.572 8.426 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -18.795 -14.252 9.920 1.00 0.00 H new ATOM 453 N ASP A 32 -11.178 -10.574 7.244 1.00 0.00 N ATOM 454 CA ASP A 32 -9.770 -10.609 6.866 1.00 0.00 C ATOM 455 C ASP A 32 -9.605 -11.087 5.427 1.00 0.00 C ATOM 456 O ASP A 32 -10.206 -12.081 5.020 1.00 0.00 O ATOM 457 CB ASP A 32 -8.990 -11.522 7.813 1.00 0.00 C ATOM 458 CG ASP A 32 -7.491 -11.396 7.630 1.00 0.00 C ATOM 459 OD1 ASP A 32 -7.024 -10.286 7.302 1.00 0.00 O ATOM 460 OD2 ASP A 32 -6.782 -12.408 7.817 1.00 0.00 O ATOM 0 H ASP A 32 -11.469 -11.335 7.858 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.373 -9.596 6.940 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.249 -11.279 8.843 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.289 -12.557 7.644 1.00 0.00 H new ATOM 465 N VAL A 33 -8.787 -10.373 4.662 1.00 0.00 N ATOM 466 CA VAL A 33 -8.542 -10.724 3.268 1.00 0.00 C ATOM 467 C VAL A 33 -7.048 -10.803 2.974 1.00 0.00 C ATOM 468 O VAL A 33 -6.250 -10.080 3.570 1.00 0.00 O ATOM 469 CB VAL A 33 -9.189 -9.707 2.310 1.00 0.00 C ATOM 470 CG1 VAL A 33 -9.089 -10.189 0.871 1.00 0.00 C ATOM 471 CG2 VAL A 33 -10.638 -9.455 2.696 1.00 0.00 C ATOM 0 H VAL A 33 -8.282 -9.547 4.984 1.00 0.00 H new ATOM 0 HA VAL A 33 -8.993 -11.703 3.106 1.00 0.00 H new ATOM 0 HB VAL A 33 -8.647 -8.765 2.391 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -9.552 -9.457 0.209 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -8.040 -10.311 0.600 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -9.603 -11.145 0.771 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -11.078 -8.734 2.007 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.196 -10.390 2.647 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.681 -9.060 3.711 1.00 0.00 H new ATOM 481 N LEU A 34 -6.678 -11.686 2.053 1.00 0.00 N ATOM 482 CA LEU A 34 -5.279 -11.861 1.679 1.00 0.00 C ATOM 483 C LEU A 34 -5.143 -12.113 0.181 1.00 0.00 C ATOM 484 O LEU A 34 -5.862 -12.935 -0.387 1.00 0.00 O ATOM 485 CB LEU A 34 -4.661 -13.021 2.461 1.00 0.00 C ATOM 486 CG LEU A 34 -3.142 -13.151 2.337 1.00 0.00 C ATOM 487 CD1 LEU A 34 -2.448 -12.377 3.446 1.00 0.00 C ATOM 488 CD2 LEU A 34 -2.728 -14.615 2.366 1.00 0.00 C ATOM 0 H LEU A 34 -7.327 -12.292 1.551 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.746 -10.942 1.924 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.915 -12.905 3.515 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -5.118 -13.951 2.123 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.837 -12.727 1.380 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.368 -12.481 3.342 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.719 -11.323 3.379 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.759 -12.771 4.414 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.644 -14.688 2.277 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.046 -15.064 3.307 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.197 -15.142 1.535 1.00 0.00 H new ATOM 500 N LEU A 35 -4.219 -11.399 -0.452 1.00 0.00 N ATOM 501 CA LEU A 35 -3.989 -11.544 -1.885 1.00 0.00 C ATOM 502 C LEU A 35 -2.503 -11.433 -2.211 1.00 0.00 C ATOM 503 O LEU A 35 -1.904 -10.368 -2.064 1.00 0.00 O ATOM 504 CB LEU A 35 -4.774 -10.484 -2.659 1.00 0.00 C ATOM 505 CG LEU A 35 -6.296 -10.560 -2.501 1.00 0.00 C ATOM 506 CD1 LEU A 35 -6.868 -9.199 -2.136 1.00 0.00 C ATOM 507 CD2 LEU A 35 -6.940 -11.085 -3.777 1.00 0.00 C ATOM 0 H LEU A 35 -3.617 -10.714 0.004 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.336 -12.533 -2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -4.439 -9.498 -2.336 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.529 -10.573 -3.717 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.521 -11.253 -1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.950 -9.276 -2.029 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.433 -8.862 -1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.631 -8.482 -2.922 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -8.021 -11.132 -3.646 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -6.704 -10.417 -4.605 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.557 -12.082 -3.994 1.00 0.00 H new ATOM 519 N THR A 36 -1.916 -12.538 -2.656 1.00 0.00 N ATOM 520 CA THR A 36 -0.499 -12.563 -3.003 1.00 0.00 C ATOM 521 C THR A 36 -0.250 -13.462 -4.210 1.00 0.00 C ATOM 522 O THR A 36 -1.138 -14.194 -4.647 1.00 0.00 O ATOM 523 CB THR A 36 0.331 -13.046 -1.812 1.00 0.00 C ATOM 524 OG1 THR A 36 1.661 -13.325 -2.209 1.00 0.00 O ATOM 525 CG2 THR A 36 -0.225 -14.294 -1.162 1.00 0.00 C ATOM 0 H THR A 36 -2.398 -13.428 -2.785 1.00 0.00 H new ATOM 0 HA THR A 36 -0.196 -11.548 -3.260 1.00 0.00 H new ATOM 0 HB THR A 36 0.297 -12.233 -1.087 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.177 -13.631 -1.434 1.00 0.00 H new ATOM 0 HG21 THR A 36 0.411 -14.582 -0.325 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.234 -14.097 -0.800 1.00 0.00 H new ATOM 0 HG23 THR A 36 -0.253 -15.103 -1.892 1.00 0.00 H new ATOM 533 N GLU A 37 0.965 -13.402 -4.744 1.00 0.00 N ATOM 534 CA GLU A 37 1.334 -14.211 -5.900 1.00 0.00 C ATOM 535 C GLU A 37 0.458 -13.872 -7.103 1.00 0.00 C ATOM 536 O GLU A 37 0.057 -14.755 -7.861 1.00 0.00 O ATOM 537 CB GLU A 37 1.211 -15.700 -5.568 1.00 0.00 C ATOM 538 CG GLU A 37 2.465 -16.288 -4.941 1.00 0.00 C ATOM 539 CD GLU A 37 2.501 -17.802 -5.021 1.00 0.00 C ATOM 540 OE1 GLU A 37 2.984 -18.331 -6.044 1.00 0.00 O ATOM 541 OE2 GLU A 37 2.048 -18.458 -4.060 1.00 0.00 O ATOM 0 H GLU A 37 1.712 -12.801 -4.395 1.00 0.00 H new ATOM 0 HA GLU A 37 2.370 -13.987 -6.153 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.372 -15.844 -4.887 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.979 -16.249 -6.480 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.343 -15.880 -5.442 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.523 -15.981 -3.897 1.00 0.00 H new ATOM 548 N LEU A 38 0.163 -12.587 -7.269 1.00 0.00 N ATOM 549 CA LEU A 38 -0.665 -12.130 -8.379 1.00 0.00 C ATOM 550 C LEU A 38 0.176 -11.396 -9.419 1.00 0.00 C ATOM 551 O LEU A 38 1.139 -10.710 -9.081 1.00 0.00 O ATOM 552 CB LEU A 38 -1.778 -11.213 -7.868 1.00 0.00 C ATOM 553 CG LEU A 38 -2.775 -11.874 -6.914 1.00 0.00 C ATOM 554 CD1 LEU A 38 -3.658 -10.825 -6.255 1.00 0.00 C ATOM 555 CD2 LEU A 38 -3.623 -12.897 -7.657 1.00 0.00 C ATOM 0 H LEU A 38 0.485 -11.844 -6.649 1.00 0.00 H new ATOM 0 HA LEU A 38 -1.112 -13.005 -8.851 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.323 -10.362 -7.361 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -2.325 -10.819 -8.724 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.216 -12.391 -6.134 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.361 -11.313 -5.580 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.037 -10.129 -5.691 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.210 -10.280 -7.021 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.327 -13.358 -6.964 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.173 -12.401 -8.457 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.977 -13.665 -8.082 1.00 0.00 H new ATOM 567 N SER A 39 -0.196 -11.548 -10.686 1.00 0.00 N ATOM 568 CA SER A 39 0.523 -10.900 -11.776 1.00 0.00 C ATOM 569 C SER A 39 -0.433 -10.495 -12.893 1.00 0.00 C ATOM 570 O SER A 39 -1.037 -11.346 -13.545 1.00 0.00 O ATOM 571 CB SER A 39 1.604 -11.832 -12.327 1.00 0.00 C ATOM 572 OG SER A 39 2.827 -11.664 -11.631 1.00 0.00 O ATOM 0 H SER A 39 -0.991 -12.114 -10.983 1.00 0.00 H new ATOM 0 HA SER A 39 0.995 -10.000 -11.382 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.273 -12.867 -12.242 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.755 -11.631 -13.388 1.00 0.00 H new ATOM 0 HG SER A 39 2.646 -11.330 -10.728 1.00 0.00 H new ATOM 578 N ASN A 40 -0.566 -9.190 -13.108 1.00 0.00 N ATOM 579 CA ASN A 40 -1.450 -8.673 -14.147 1.00 0.00 C ATOM 580 C ASN A 40 -2.897 -9.074 -13.879 1.00 0.00 C ATOM 581 O ASN A 40 -3.682 -9.261 -14.809 1.00 0.00 O ATOM 582 CB ASN A 40 -1.007 -9.182 -15.522 1.00 0.00 C ATOM 583 CG ASN A 40 -0.528 -8.062 -16.426 1.00 0.00 C ATOM 584 OD1 ASN A 40 0.079 -7.095 -15.968 1.00 0.00 O ATOM 585 ND2 ASN A 40 -0.801 -8.190 -17.720 1.00 0.00 N ATOM 0 H ASN A 40 -0.073 -8.472 -12.577 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.389 -7.585 -14.136 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.207 -9.911 -15.396 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -1.838 -9.701 -16.000 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -0.504 -7.469 -18.378 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -1.307 -9.009 -18.056 1.00 0.00 H new ATOM 592 N CYS A 41 -3.244 -9.205 -12.602 1.00 0.00 N ATOM 593 CA CYS A 41 -4.596 -9.584 -12.213 1.00 0.00 C ATOM 594 C CYS A 41 -5.391 -8.368 -11.749 1.00 0.00 C ATOM 595 O CYS A 41 -4.897 -7.549 -10.974 1.00 0.00 O ATOM 596 CB CYS A 41 -4.553 -10.633 -11.100 1.00 0.00 C ATOM 597 SG CYS A 41 -6.029 -11.673 -11.009 1.00 0.00 S ATOM 0 H CYS A 41 -2.607 -9.054 -11.820 1.00 0.00 H new ATOM 0 HA CYS A 41 -5.092 -10.008 -13.086 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -3.681 -11.270 -11.249 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -4.418 -10.127 -10.144 1.00 0.00 H new ATOM 0 HG CYS A 41 -6.906 -11.258 -11.874 1.00 0.00 H new ATOM 603 N THR A 42 -6.625 -8.255 -12.229 1.00 0.00 N ATOM 604 CA THR A 42 -7.488 -7.139 -11.864 1.00 0.00 C ATOM 605 C THR A 42 -8.527 -7.568 -10.833 1.00 0.00 C ATOM 606 O THR A 42 -9.241 -8.552 -11.028 1.00 0.00 O ATOM 607 CB THR A 42 -8.186 -6.579 -13.105 1.00 0.00 C ATOM 608 OG1 THR A 42 -7.309 -6.580 -14.217 1.00 0.00 O ATOM 609 CG2 THR A 42 -8.692 -5.165 -12.920 1.00 0.00 C ATOM 0 H THR A 42 -7.050 -8.923 -12.872 1.00 0.00 H new ATOM 0 HA THR A 42 -6.865 -6.361 -11.423 1.00 0.00 H new ATOM 0 HB THR A 42 -9.041 -7.234 -13.276 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.774 -6.220 -15.001 1.00 0.00 H new ATOM 0 HG21 THR A 42 -9.176 -4.829 -13.837 1.00 0.00 H new ATOM 0 HG22 THR A 42 -9.410 -5.140 -12.100 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.855 -4.506 -12.689 1.00 0.00 H new ATOM 617 N VAL A 43 -8.606 -6.825 -9.734 1.00 0.00 N ATOM 618 CA VAL A 43 -9.556 -7.128 -8.671 1.00 0.00 C ATOM 619 C VAL A 43 -10.305 -5.876 -8.229 1.00 0.00 C ATOM 620 O VAL A 43 -9.726 -4.793 -8.144 1.00 0.00 O ATOM 621 CB VAL A 43 -8.853 -7.750 -7.450 1.00 0.00 C ATOM 622 CG1 VAL A 43 -9.876 -8.243 -6.438 1.00 0.00 C ATOM 623 CG2 VAL A 43 -7.933 -8.882 -7.882 1.00 0.00 C ATOM 0 H VAL A 43 -8.022 -6.008 -9.557 1.00 0.00 H new ATOM 0 HA VAL A 43 -10.266 -7.848 -9.078 1.00 0.00 H new ATOM 0 HB VAL A 43 -8.246 -6.980 -6.973 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -9.360 -8.679 -5.582 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -10.490 -7.406 -6.104 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -10.512 -8.997 -6.901 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.445 -9.309 -7.006 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -8.517 -9.653 -8.384 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.177 -8.496 -8.566 1.00 0.00 H new ATOM 633 N ARG A 44 -11.594 -6.032 -7.947 1.00 0.00 N ATOM 634 CA ARG A 44 -12.422 -4.913 -7.513 1.00 0.00 C ATOM 635 C ARG A 44 -13.249 -5.291 -6.287 1.00 0.00 C ATOM 636 O ARG A 44 -14.244 -6.008 -6.395 1.00 0.00 O ATOM 637 CB ARG A 44 -13.346 -4.464 -8.647 1.00 0.00 C ATOM 638 CG ARG A 44 -12.611 -4.137 -9.937 1.00 0.00 C ATOM 639 CD ARG A 44 -13.396 -4.591 -11.156 1.00 0.00 C ATOM 640 NE ARG A 44 -12.850 -4.043 -12.395 1.00 0.00 N ATOM 641 CZ ARG A 44 -13.073 -2.802 -12.819 1.00 0.00 C ATOM 642 NH1 ARG A 44 -13.834 -1.977 -12.110 1.00 0.00 N ATOM 643 NH2 ARG A 44 -12.537 -2.383 -13.957 1.00 0.00 N ATOM 0 H ARG A 44 -12.088 -6.922 -8.011 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.762 -4.088 -7.244 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -14.075 -5.250 -8.843 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -13.904 -3.585 -8.324 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -12.436 -3.063 -9.995 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -11.633 -4.619 -9.932 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -13.388 -5.680 -11.207 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -14.437 -4.284 -11.052 1.00 0.00 H new ATOM 0 HE ARG A 44 -12.263 -4.648 -12.969 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -14.251 -2.294 -11.235 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -14.001 -1.027 -12.440 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -11.953 -3.012 -14.508 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -12.708 -1.431 -14.282 1.00 0.00 H new ATOM 657 N LEU A 45 -12.830 -4.804 -5.124 1.00 0.00 N ATOM 658 CA LEU A 45 -13.533 -5.092 -3.879 1.00 0.00 C ATOM 659 C LEU A 45 -14.597 -4.037 -3.599 1.00 0.00 C ATOM 660 O LEU A 45 -14.309 -2.841 -3.571 1.00 0.00 O ATOM 661 CB LEU A 45 -12.543 -5.155 -2.714 1.00 0.00 C ATOM 662 CG LEU A 45 -11.353 -6.092 -2.925 1.00 0.00 C ATOM 663 CD1 LEU A 45 -10.388 -6.002 -1.753 1.00 0.00 C ATOM 664 CD2 LEU A 45 -11.830 -7.524 -3.115 1.00 0.00 C ATOM 0 H LEU A 45 -12.008 -4.209 -5.017 1.00 0.00 H new ATOM 0 HA LEU A 45 -14.024 -6.059 -3.983 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -12.165 -4.150 -2.523 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -13.079 -5.469 -1.818 1.00 0.00 H new ATOM 0 HG LEU A 45 -10.826 -5.782 -3.828 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -9.548 -6.676 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -10.021 -4.980 -1.662 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -10.903 -6.286 -0.835 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -10.970 -8.177 -3.264 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -12.380 -7.845 -2.230 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -12.482 -7.578 -3.987 1.00 0.00 H new ATOM 676 N TYR A 46 -15.831 -4.489 -3.393 1.00 0.00 N ATOM 677 CA TYR A 46 -16.940 -3.584 -3.115 1.00 0.00 C ATOM 678 C TYR A 46 -17.593 -3.919 -1.778 1.00 0.00 C ATOM 679 O TYR A 46 -18.258 -4.946 -1.640 1.00 0.00 O ATOM 680 CB TYR A 46 -17.979 -3.659 -4.235 1.00 0.00 C ATOM 681 CG TYR A 46 -17.601 -2.868 -5.468 1.00 0.00 C ATOM 682 CD1 TYR A 46 -17.968 -1.535 -5.600 1.00 0.00 C ATOM 683 CD2 TYR A 46 -16.878 -3.455 -6.498 1.00 0.00 C ATOM 684 CE1 TYR A 46 -17.625 -0.809 -6.724 1.00 0.00 C ATOM 685 CE2 TYR A 46 -16.530 -2.735 -7.626 1.00 0.00 C ATOM 686 CZ TYR A 46 -16.906 -1.413 -7.734 1.00 0.00 C ATOM 687 OH TYR A 46 -16.563 -0.694 -8.855 1.00 0.00 O ATOM 0 H TYR A 46 -16.087 -5.476 -3.414 1.00 0.00 H new ATOM 0 HA TYR A 46 -16.544 -2.570 -3.062 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -18.125 -4.703 -4.514 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -18.934 -3.293 -3.858 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -18.531 -1.058 -4.811 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -16.583 -4.491 -6.417 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -17.918 0.227 -6.811 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -15.967 -3.206 -8.418 1.00 0.00 H new ATOM 0 HH TYR A 46 -16.057 -1.267 -9.469 1.00 0.00 H new ATOM 697 N GLY A 47 -17.395 -3.047 -0.795 1.00 0.00 N ATOM 698 CA GLY A 47 -17.970 -3.268 0.519 1.00 0.00 C ATOM 699 C GLY A 47 -17.194 -2.565 1.616 1.00 0.00 C ATOM 700 O GLY A 47 -17.144 -1.335 1.661 1.00 0.00 O ATOM 0 H GLY A 47 -16.847 -2.192 -0.885 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -19.002 -2.916 0.525 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -17.997 -4.338 0.725 1.00 0.00 H new ATOM 704 N ASN A 48 -16.590 -3.347 2.505 1.00 0.00 N ATOM 705 CA ASN A 48 -15.814 -2.792 3.607 1.00 0.00 C ATOM 706 C ASN A 48 -15.148 -3.902 4.417 1.00 0.00 C ATOM 707 O ASN A 48 -15.628 -4.276 5.488 1.00 0.00 O ATOM 708 CB ASN A 48 -16.711 -1.948 4.515 1.00 0.00 C ATOM 709 CG ASN A 48 -16.004 -0.716 5.045 1.00 0.00 C ATOM 710 OD1 ASN A 48 -16.156 0.381 4.506 1.00 0.00 O ATOM 711 ND2 ASN A 48 -15.224 -0.892 6.105 1.00 0.00 N ATOM 0 H ASN A 48 -16.623 -4.366 2.483 1.00 0.00 H new ATOM 0 HA ASN A 48 -15.034 -2.157 3.187 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -17.599 -1.644 3.962 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -17.051 -2.557 5.353 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -14.721 -0.100 6.505 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -15.128 -1.819 6.519 1.00 0.00 H new ATOM 718 N PRO A 49 -14.026 -4.447 3.914 1.00 0.00 N ATOM 719 CA PRO A 49 -13.294 -5.520 4.597 1.00 0.00 C ATOM 720 C PRO A 49 -12.888 -5.133 6.014 1.00 0.00 C ATOM 721 O PRO A 49 -13.281 -4.081 6.518 1.00 0.00 O ATOM 722 CB PRO A 49 -12.051 -5.723 3.723 1.00 0.00 C ATOM 723 CG PRO A 49 -12.434 -5.194 2.384 1.00 0.00 C ATOM 724 CD PRO A 49 -13.385 -4.062 2.644 1.00 0.00 C ATOM 0 HA PRO A 49 -13.903 -6.417 4.708 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -11.192 -5.189 4.128 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -11.774 -6.776 3.668 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.558 -4.849 1.835 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.905 -5.968 1.778 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -12.863 -3.109 2.729 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -14.114 -3.956 1.841 1.00 0.00 H new ATOM 732 N ASN A 50 -12.098 -5.990 6.652 1.00 0.00 N ATOM 733 CA ASN A 50 -11.636 -5.738 8.012 1.00 0.00 C ATOM 734 C ASN A 50 -10.169 -5.322 8.020 1.00 0.00 C ATOM 735 O ASN A 50 -9.792 -4.348 8.671 1.00 0.00 O ATOM 736 CB ASN A 50 -11.829 -6.985 8.878 1.00 0.00 C ATOM 737 CG ASN A 50 -12.212 -6.645 10.305 1.00 0.00 C ATOM 738 OD1 ASN A 50 -13.394 -6.532 10.632 1.00 0.00 O ATOM 739 ND2 ASN A 50 -11.213 -6.480 11.164 1.00 0.00 N ATOM 0 H ASN A 50 -11.764 -6.865 6.249 1.00 0.00 H new ATOM 0 HA ASN A 50 -12.229 -4.922 8.425 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -12.603 -7.614 8.437 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -10.908 -7.568 8.881 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.411 -6.250 12.138 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -10.248 -6.583 10.850 1.00 0.00 H new ATOM 746 N THR A 51 -9.345 -6.068 7.291 1.00 0.00 N ATOM 747 CA THR A 51 -7.918 -5.778 7.212 1.00 0.00 C ATOM 748 C THR A 51 -7.337 -6.266 5.889 1.00 0.00 C ATOM 749 O THR A 51 -7.051 -7.451 5.725 1.00 0.00 O ATOM 750 CB THR A 51 -7.179 -6.433 8.380 1.00 0.00 C ATOM 751 OG1 THR A 51 -8.052 -6.634 9.477 1.00 0.00 O ATOM 752 CG2 THR A 51 -6.000 -5.622 8.873 1.00 0.00 C ATOM 0 H THR A 51 -9.641 -6.878 6.746 1.00 0.00 H new ATOM 0 HA THR A 51 -7.787 -4.697 7.269 1.00 0.00 H new ATOM 0 HB THR A 51 -6.809 -7.382 7.992 1.00 0.00 H new ATOM 0 HG1 THR A 51 -7.561 -7.055 10.213 1.00 0.00 H new ATOM 0 HG21 THR A 51 -5.521 -6.143 9.702 1.00 0.00 H new ATOM 0 HG22 THR A 51 -5.283 -5.493 8.062 1.00 0.00 H new ATOM 0 HG23 THR A 51 -6.346 -4.645 9.210 1.00 0.00 H new ATOM 760 N LEU A 52 -7.166 -5.342 4.948 1.00 0.00 N ATOM 761 CA LEU A 52 -6.620 -5.678 3.638 1.00 0.00 C ATOM 762 C LEU A 52 -5.107 -5.862 3.711 1.00 0.00 C ATOM 763 O LEU A 52 -4.415 -5.124 4.411 1.00 0.00 O ATOM 764 CB LEU A 52 -6.964 -4.586 2.624 1.00 0.00 C ATOM 765 CG LEU A 52 -6.416 -4.816 1.214 1.00 0.00 C ATOM 766 CD1 LEU A 52 -7.125 -5.986 0.550 1.00 0.00 C ATOM 767 CD2 LEU A 52 -6.563 -3.555 0.375 1.00 0.00 C ATOM 0 H LEU A 52 -7.398 -4.356 5.068 1.00 0.00 H new ATOM 0 HA LEU A 52 -7.068 -6.618 3.315 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.049 -4.494 2.565 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.583 -3.634 2.995 1.00 0.00 H new ATOM 0 HG LEU A 52 -5.356 -5.057 1.291 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -6.722 -6.134 -0.452 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.970 -6.889 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.192 -5.775 0.484 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.169 -3.735 -0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -7.617 -3.285 0.306 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -6.009 -2.741 0.842 1.00 0.00 H new ATOM 779 N ARG A 53 -4.602 -6.853 2.983 1.00 0.00 N ATOM 780 CA ARG A 53 -3.171 -7.134 2.965 1.00 0.00 C ATOM 781 C ARG A 53 -2.732 -7.638 1.593 1.00 0.00 C ATOM 782 O ARG A 53 -3.087 -8.744 1.184 1.00 0.00 O ATOM 783 CB ARG A 53 -2.820 -8.167 4.039 1.00 0.00 C ATOM 784 CG ARG A 53 -1.557 -7.830 4.817 1.00 0.00 C ATOM 785 CD ARG A 53 -0.932 -9.072 5.432 1.00 0.00 C ATOM 786 NE ARG A 53 -0.633 -8.887 6.851 1.00 0.00 N ATOM 787 CZ ARG A 53 0.217 -9.650 7.535 1.00 0.00 C ATOM 788 NH1 ARG A 53 0.855 -10.648 6.935 1.00 0.00 N ATOM 789 NH2 ARG A 53 0.431 -9.414 8.821 1.00 0.00 N ATOM 0 H ARG A 53 -5.162 -7.474 2.399 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.640 -6.206 3.177 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.654 -8.253 4.736 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.697 -9.142 3.567 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -0.837 -7.350 4.154 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -1.793 -7.113 5.603 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -1.610 -9.917 5.311 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -0.015 -9.320 4.897 1.00 0.00 H new ATOM 0 HE ARG A 53 -1.103 -8.129 7.346 1.00 0.00 H new ATOM 0 HH11 ARG A 53 0.695 -10.833 5.945 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.505 -11.229 7.464 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.055 -8.648 9.287 1.00 0.00 H new ATOM 0 HH22 ARG A 53 1.082 -9.998 9.345 1.00 0.00 H new ATOM 803 N LEU A 54 -1.957 -6.820 0.888 1.00 0.00 N ATOM 804 CA LEU A 54 -1.468 -7.182 -0.437 1.00 0.00 C ATOM 805 C LEU A 54 0.053 -7.292 -0.444 1.00 0.00 C ATOM 806 O LEU A 54 0.751 -6.409 0.056 1.00 0.00 O ATOM 807 CB LEU A 54 -1.921 -6.148 -1.470 1.00 0.00 C ATOM 808 CG LEU A 54 -1.826 -6.603 -2.927 1.00 0.00 C ATOM 809 CD1 LEU A 54 -3.092 -7.336 -3.342 1.00 0.00 C ATOM 810 CD2 LEU A 54 -1.574 -5.412 -3.840 1.00 0.00 C ATOM 0 H LEU A 54 -1.654 -5.902 1.213 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.886 -8.154 -0.698 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.954 -5.874 -1.258 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.320 -5.247 -1.347 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.986 -7.292 -3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.005 -7.652 -4.382 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.230 -8.211 -2.707 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -3.949 -6.671 -3.235 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.509 -5.753 -4.873 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.394 -4.700 -3.744 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.639 -4.929 -3.558 1.00 0.00 H new ATOM 822 N THR A 55 0.562 -8.379 -1.013 1.00 0.00 N ATOM 823 CA THR A 55 2.001 -8.601 -1.082 1.00 0.00 C ATOM 824 C THR A 55 2.362 -9.473 -2.281 1.00 0.00 C ATOM 825 O THR A 55 1.538 -10.247 -2.767 1.00 0.00 O ATOM 826 CB THR A 55 2.500 -9.256 0.207 1.00 0.00 C ATOM 827 OG1 THR A 55 1.734 -10.408 0.512 1.00 0.00 O ATOM 828 CG2 THR A 55 2.445 -8.337 1.407 1.00 0.00 C ATOM 0 H THR A 55 -0.000 -9.119 -1.433 1.00 0.00 H new ATOM 0 HA THR A 55 2.486 -7.632 -1.201 1.00 0.00 H new ATOM 0 HB THR A 55 3.542 -9.513 0.016 1.00 0.00 H new ATOM 0 HG1 THR A 55 2.069 -10.814 1.339 1.00 0.00 H new ATOM 0 HG21 THR A 55 2.813 -8.865 2.287 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.067 -7.461 1.223 1.00 0.00 H new ATOM 0 HG23 THR A 55 1.415 -8.022 1.577 1.00 0.00 H new ATOM 836 N LYS A 56 3.597 -9.341 -2.752 1.00 0.00 N ATOM 837 CA LYS A 56 4.067 -10.117 -3.894 1.00 0.00 C ATOM 838 C LYS A 56 3.214 -9.838 -5.128 1.00 0.00 C ATOM 839 O LYS A 56 2.944 -10.738 -5.925 1.00 0.00 O ATOM 840 CB LYS A 56 4.039 -11.611 -3.567 1.00 0.00 C ATOM 841 CG LYS A 56 5.275 -12.094 -2.823 1.00 0.00 C ATOM 842 CD LYS A 56 6.046 -13.126 -3.630 1.00 0.00 C ATOM 843 CE LYS A 56 5.612 -14.541 -3.282 1.00 0.00 C ATOM 844 NZ LYS A 56 6.536 -15.181 -2.304 1.00 0.00 N ATOM 0 H LYS A 56 4.291 -8.704 -2.361 1.00 0.00 H new ATOM 0 HA LYS A 56 5.093 -9.818 -4.108 1.00 0.00 H new ATOM 0 HB2 LYS A 56 3.156 -11.826 -2.966 1.00 0.00 H new ATOM 0 HB3 LYS A 56 3.939 -12.176 -4.494 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.923 -11.245 -2.603 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.979 -12.526 -1.867 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.891 -12.948 -4.694 1.00 0.00 H new ATOM 0 HD3 LYS A 56 7.114 -13.014 -3.441 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.604 -14.520 -2.869 1.00 0.00 H new ATOM 0 HE3 LYS A 56 5.572 -15.142 -4.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.205 -16.144 -2.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.493 -15.224 -2.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.555 -14.622 -1.427 1.00 0.00 H new ATOM 858 N ALA A 57 2.793 -8.587 -5.280 1.00 0.00 N ATOM 859 CA ALA A 57 1.972 -8.190 -6.417 1.00 0.00 C ATOM 860 C ALA A 57 2.802 -7.453 -7.463 1.00 0.00 C ATOM 861 O ALA A 57 3.693 -6.674 -7.126 1.00 0.00 O ATOM 862 CB ALA A 57 0.814 -7.321 -5.953 1.00 0.00 C ATOM 0 H ALA A 57 3.007 -7.831 -4.630 1.00 0.00 H new ATOM 0 HA ALA A 57 1.573 -9.093 -6.878 1.00 0.00 H new ATOM 0 HB1 ALA A 57 0.209 -7.032 -6.812 1.00 0.00 H new ATOM 0 HB2 ALA A 57 0.199 -7.880 -5.248 1.00 0.00 H new ATOM 0 HB3 ALA A 57 1.203 -6.427 -5.465 1.00 0.00 H new ATOM 868 N HIS A 58 2.503 -7.705 -8.733 1.00 0.00 N ATOM 869 CA HIS A 58 3.221 -7.065 -9.830 1.00 0.00 C ATOM 870 C HIS A 58 2.282 -6.760 -10.990 1.00 0.00 C ATOM 871 O HIS A 58 1.661 -7.662 -11.553 1.00 0.00 O ATOM 872 CB HIS A 58 4.367 -7.959 -10.307 1.00 0.00 C ATOM 873 CG HIS A 58 5.565 -7.195 -10.779 1.00 0.00 C ATOM 874 ND1 HIS A 58 5.712 -6.372 -11.848 1.00 0.00 N flip ATOM 875 CD2 HIS A 58 6.789 -7.219 -10.147 1.00 0.00 C flip ATOM 876 CE1 HIS A 58 7.018 -5.890 -11.878 1.00 0.00 C flip ATOM 877 NE2 HIS A 58 7.622 -6.427 -10.836 1.00 0.00 N flip ATOM 0 H HIS A 58 1.768 -8.348 -9.028 1.00 0.00 H new ATOM 0 HA HIS A 58 3.632 -6.125 -9.463 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.665 -8.619 -9.493 1.00 0.00 H new ATOM 0 HB3 HIS A 58 4.009 -8.594 -11.117 1.00 0.00 H new ATOM 0 HD1 HIS A 58 4.982 -6.143 -12.522 1.00 0.00 H new ATOM 0 HD2 HIS A 58 7.034 -7.777 -9.255 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.447 -5.216 -12.604 1.00 0.00 H new ATOM 885 N SER A 59 2.180 -5.483 -11.344 1.00 0.00 N ATOM 886 CA SER A 59 1.315 -5.058 -12.438 1.00 0.00 C ATOM 887 C SER A 59 -0.137 -5.436 -12.164 1.00 0.00 C ATOM 888 O SER A 59 -0.912 -5.674 -13.090 1.00 0.00 O ATOM 889 CB SER A 59 1.777 -5.687 -13.754 1.00 0.00 C ATOM 890 OG SER A 59 3.175 -5.527 -13.934 1.00 0.00 O ATOM 0 H SER A 59 2.686 -4.724 -10.888 1.00 0.00 H new ATOM 0 HA SER A 59 1.380 -3.973 -12.518 1.00 0.00 H new ATOM 0 HB2 SER A 59 1.525 -6.748 -13.762 1.00 0.00 H new ATOM 0 HB3 SER A 59 1.245 -5.227 -14.587 1.00 0.00 H new ATOM 0 HG SER A 59 3.445 -5.939 -14.781 1.00 0.00 H new ATOM 896 N CYS A 60 -0.498 -5.487 -10.886 1.00 0.00 N ATOM 897 CA CYS A 60 -1.858 -5.837 -10.491 1.00 0.00 C ATOM 898 C CYS A 60 -2.620 -4.602 -10.016 1.00 0.00 C ATOM 899 O CYS A 60 -2.025 -3.642 -9.528 1.00 0.00 O ATOM 900 CB CYS A 60 -1.835 -6.892 -9.384 1.00 0.00 C ATOM 901 SG CYS A 60 -0.900 -8.382 -9.806 1.00 0.00 S ATOM 0 H CYS A 60 0.131 -5.291 -10.107 1.00 0.00 H new ATOM 0 HA CYS A 60 -2.369 -6.246 -11.362 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -1.407 -6.450 -8.484 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -2.860 -7.175 -9.144 1.00 0.00 H new ATOM 0 HG CYS A 60 0.101 -8.064 -10.573 1.00 0.00 H new ATOM 907 N LYS A 61 -3.941 -4.637 -10.163 1.00 0.00 N ATOM 908 CA LYS A 61 -4.786 -3.522 -9.749 1.00 0.00 C ATOM 909 C LYS A 61 -5.754 -3.953 -8.653 1.00 0.00 C ATOM 910 O LYS A 61 -6.483 -4.932 -8.804 1.00 0.00 O ATOM 911 CB LYS A 61 -5.565 -2.975 -10.947 1.00 0.00 C ATOM 912 CG LYS A 61 -4.766 -2.002 -11.799 1.00 0.00 C ATOM 913 CD LYS A 61 -5.398 -1.811 -13.168 1.00 0.00 C ATOM 914 CE LYS A 61 -4.386 -1.305 -14.183 1.00 0.00 C ATOM 915 NZ LYS A 61 -3.447 -2.377 -14.613 1.00 0.00 N ATOM 0 H LYS A 61 -4.449 -5.425 -10.565 1.00 0.00 H new ATOM 0 HA LYS A 61 -4.142 -2.737 -9.353 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.890 -3.808 -11.570 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -6.465 -2.476 -10.588 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.700 -1.040 -11.290 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.747 -2.371 -11.916 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -5.818 -2.757 -13.511 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -6.224 -1.104 -13.093 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -4.911 -0.911 -15.054 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -3.821 -0.479 -13.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -2.922 -2.062 -15.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -2.778 -2.582 -13.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.984 -3.237 -14.843 1.00 0.00 H new ATOM 929 N LEU A 62 -5.755 -3.214 -7.548 1.00 0.00 N ATOM 930 CA LEU A 62 -6.633 -3.519 -6.425 1.00 0.00 C ATOM 931 C LEU A 62 -7.479 -2.308 -6.049 1.00 0.00 C ATOM 932 O LEU A 62 -6.960 -1.296 -5.580 1.00 0.00 O ATOM 933 CB LEU A 62 -5.810 -3.975 -5.218 1.00 0.00 C ATOM 934 CG LEU A 62 -6.560 -4.858 -4.218 1.00 0.00 C ATOM 935 CD1 LEU A 62 -6.819 -6.234 -4.813 1.00 0.00 C ATOM 936 CD2 LEU A 62 -5.778 -4.974 -2.920 1.00 0.00 C ATOM 0 H LEU A 62 -5.157 -2.400 -7.407 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.301 -4.325 -6.728 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.937 -4.520 -5.578 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.441 -3.093 -4.695 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.521 -4.393 -3.999 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.353 -6.849 -4.089 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.420 -6.132 -5.716 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.869 -6.708 -5.061 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.326 -5.605 -2.220 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -4.803 -5.417 -3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.644 -3.983 -2.486 1.00 0.00 H new ATOM 948 N LEU A 63 -8.787 -2.421 -6.258 1.00 0.00 N ATOM 949 CA LEU A 63 -9.709 -1.335 -5.941 1.00 0.00 C ATOM 950 C LEU A 63 -10.674 -1.750 -4.835 1.00 0.00 C ATOM 951 O LEU A 63 -11.608 -2.517 -5.069 1.00 0.00 O ATOM 952 CB LEU A 63 -10.492 -0.923 -7.189 1.00 0.00 C ATOM 953 CG LEU A 63 -9.651 -0.304 -8.308 1.00 0.00 C ATOM 954 CD1 LEU A 63 -10.197 -0.701 -9.670 1.00 0.00 C ATOM 955 CD2 LEU A 63 -9.611 1.210 -8.167 1.00 0.00 C ATOM 0 H LEU A 63 -9.232 -3.253 -6.645 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.125 -0.484 -5.590 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -11.004 -1.800 -7.584 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -11.262 -0.209 -6.897 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.633 -0.684 -8.225 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -9.586 -0.251 -10.452 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.173 -1.786 -9.770 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -11.225 -0.351 -9.766 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.009 1.634 -8.970 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -10.624 1.608 -8.224 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -9.171 1.474 -7.205 1.00 0.00 H new ATOM 967 N CYS A 64 -10.442 -1.240 -3.631 1.00 0.00 N ATOM 968 CA CYS A 64 -11.290 -1.560 -2.489 1.00 0.00 C ATOM 969 C CYS A 64 -11.696 -0.296 -1.737 1.00 0.00 C ATOM 970 O CYS A 64 -10.988 0.711 -1.768 1.00 0.00 O ATOM 971 CB CYS A 64 -10.567 -2.520 -1.543 1.00 0.00 C ATOM 972 SG CYS A 64 -11.550 -3.027 -0.112 1.00 0.00 S ATOM 0 H CYS A 64 -9.674 -0.603 -3.420 1.00 0.00 H new ATOM 0 HA CYS A 64 -12.193 -2.041 -2.865 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -10.272 -3.409 -2.101 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -9.651 -2.045 -1.191 1.00 0.00 H new ATOM 0 HG CYS A 64 -10.792 -3.066 0.943 1.00 0.00 H new ATOM 978 N GLY A 65 -12.839 -0.358 -1.062 1.00 0.00 N ATOM 979 CA GLY A 65 -13.320 0.785 -0.310 1.00 0.00 C ATOM 980 C GLY A 65 -12.516 1.027 0.955 1.00 0.00 C ATOM 981 O GLY A 65 -11.573 0.289 1.241 1.00 0.00 O ATOM 0 H GLY A 65 -13.441 -1.180 -1.023 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -13.278 1.674 -0.939 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -14.366 0.629 -0.048 1.00 0.00 H new ATOM 985 N PRO A 66 -12.868 2.058 1.740 1.00 0.00 N ATOM 986 CA PRO A 66 -12.163 2.382 2.985 1.00 0.00 C ATOM 987 C PRO A 66 -12.144 1.206 3.956 1.00 0.00 C ATOM 988 O PRO A 66 -13.173 0.839 4.523 1.00 0.00 O ATOM 989 CB PRO A 66 -12.967 3.551 3.572 1.00 0.00 C ATOM 990 CG PRO A 66 -14.270 3.542 2.846 1.00 0.00 C ATOM 991 CD PRO A 66 -13.978 2.988 1.482 1.00 0.00 C ATOM 0 HA PRO A 66 -11.116 2.625 2.805 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.114 3.426 4.645 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -12.445 4.497 3.430 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -15.004 2.928 3.368 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -14.686 4.547 2.778 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.843 2.478 1.059 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -13.695 3.771 0.779 1.00 0.00 H new ATOM 999 N VAL A 67 -10.966 0.619 4.142 1.00 0.00 N ATOM 1000 CA VAL A 67 -10.811 -0.517 5.043 1.00 0.00 C ATOM 1001 C VAL A 67 -11.270 -0.167 6.456 1.00 0.00 C ATOM 1002 O VAL A 67 -11.323 1.004 6.831 1.00 0.00 O ATOM 1003 CB VAL A 67 -9.347 -1.000 5.091 1.00 0.00 C ATOM 1004 CG1 VAL A 67 -8.435 0.097 5.618 1.00 0.00 C ATOM 1005 CG2 VAL A 67 -9.225 -2.259 5.937 1.00 0.00 C ATOM 0 H VAL A 67 -10.105 0.912 3.681 1.00 0.00 H new ATOM 0 HA VAL A 67 -11.437 -1.319 4.652 1.00 0.00 H new ATOM 0 HB VAL A 67 -9.033 -1.241 4.075 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -7.407 -0.265 5.643 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -8.497 0.967 4.964 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.746 0.377 6.625 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -8.185 -2.584 5.958 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.560 -2.049 6.953 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.842 -3.048 5.507 1.00 0.00 H new ATOM 1015 N SER A 68 -11.602 -1.192 7.235 1.00 0.00 N ATOM 1016 CA SER A 68 -12.057 -0.995 8.606 1.00 0.00 C ATOM 1017 C SER A 68 -10.957 -0.375 9.462 1.00 0.00 C ATOM 1018 O SER A 68 -11.160 0.657 10.100 1.00 0.00 O ATOM 1019 CB SER A 68 -12.502 -2.326 9.213 1.00 0.00 C ATOM 1020 OG SER A 68 -12.903 -2.164 10.562 1.00 0.00 O ATOM 0 H SER A 68 -11.564 -2.168 6.940 1.00 0.00 H new ATOM 0 HA SER A 68 -12.905 -0.310 8.586 1.00 0.00 H new ATOM 0 HB2 SER A 68 -13.328 -2.736 8.632 1.00 0.00 H new ATOM 0 HB3 SER A 68 -11.685 -3.046 9.157 1.00 0.00 H new ATOM 0 HG SER A 68 -13.184 -3.029 10.926 1.00 0.00 H new ATOM 1026 N THR A 69 -9.791 -1.013 9.471 1.00 0.00 N ATOM 1027 CA THR A 69 -8.659 -0.524 10.250 1.00 0.00 C ATOM 1028 C THR A 69 -7.617 0.128 9.347 1.00 0.00 C ATOM 1029 O THR A 69 -7.517 1.353 9.284 1.00 0.00 O ATOM 1030 CB THR A 69 -8.024 -1.670 11.041 1.00 0.00 C ATOM 1031 OG1 THR A 69 -8.299 -2.917 10.425 1.00 0.00 O ATOM 1032 CG2 THR A 69 -8.508 -1.750 12.472 1.00 0.00 C ATOM 0 H THR A 69 -9.605 -1.869 8.948 1.00 0.00 H new ATOM 0 HA THR A 69 -9.028 0.228 10.948 1.00 0.00 H new ATOM 0 HB THR A 69 -6.955 -1.459 11.047 1.00 0.00 H new ATOM 0 HG1 THR A 69 -7.884 -3.637 10.944 1.00 0.00 H new ATOM 0 HG21 THR A 69 -8.019 -2.584 12.976 1.00 0.00 H new ATOM 0 HG22 THR A 69 -8.268 -0.822 12.990 1.00 0.00 H new ATOM 0 HG23 THR A 69 -9.587 -1.903 12.483 1.00 0.00 H new ATOM 1040 N SER A 70 -6.842 -0.698 8.651 1.00 0.00 N ATOM 1041 CA SER A 70 -5.807 -0.200 7.753 1.00 0.00 C ATOM 1042 C SER A 70 -5.363 -1.285 6.778 1.00 0.00 C ATOM 1043 O SER A 70 -5.864 -2.409 6.814 1.00 0.00 O ATOM 1044 CB SER A 70 -4.607 0.305 8.555 1.00 0.00 C ATOM 1045 OG SER A 70 -4.512 -0.360 9.804 1.00 0.00 O ATOM 0 H SER A 70 -6.911 -1.715 8.692 1.00 0.00 H new ATOM 0 HA SER A 70 -6.226 0.627 7.180 1.00 0.00 H new ATOM 0 HB2 SER A 70 -3.692 0.147 7.985 1.00 0.00 H new ATOM 0 HB3 SER A 70 -4.700 1.379 8.717 1.00 0.00 H new ATOM 0 HG SER A 70 -3.736 -0.021 10.297 1.00 0.00 H new ATOM 1051 N VAL A 71 -4.418 -0.940 5.909 1.00 0.00 N ATOM 1052 CA VAL A 71 -3.905 -1.884 4.923 1.00 0.00 C ATOM 1053 C VAL A 71 -2.389 -2.013 5.027 1.00 0.00 C ATOM 1054 O VAL A 71 -1.716 -1.129 5.556 1.00 0.00 O ATOM 1055 CB VAL A 71 -4.275 -1.460 3.491 1.00 0.00 C ATOM 1056 CG1 VAL A 71 -3.912 -2.553 2.498 1.00 0.00 C ATOM 1057 CG2 VAL A 71 -5.755 -1.119 3.401 1.00 0.00 C ATOM 0 H VAL A 71 -3.992 -0.014 5.868 1.00 0.00 H new ATOM 0 HA VAL A 71 -4.367 -2.848 5.137 1.00 0.00 H new ATOM 0 HB VAL A 71 -3.703 -0.567 3.238 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.182 -2.234 1.491 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.840 -2.744 2.543 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.454 -3.465 2.747 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.998 -0.821 2.381 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.347 -1.992 3.675 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.981 -0.299 4.082 1.00 0.00 H new ATOM 1067 N PHE A 72 -1.857 -3.120 4.519 1.00 0.00 N ATOM 1068 CA PHE A 72 -0.419 -3.364 4.556 1.00 0.00 C ATOM 1069 C PHE A 72 0.090 -3.826 3.195 1.00 0.00 C ATOM 1070 O PHE A 72 -0.563 -4.616 2.512 1.00 0.00 O ATOM 1071 CB PHE A 72 -0.086 -4.410 5.622 1.00 0.00 C ATOM 1072 CG PHE A 72 -0.708 -4.125 6.958 1.00 0.00 C ATOM 1073 CD1 PHE A 72 -0.683 -2.847 7.492 1.00 0.00 C ATOM 1074 CD2 PHE A 72 -1.320 -5.138 7.681 1.00 0.00 C ATOM 1075 CE1 PHE A 72 -1.255 -2.583 8.722 1.00 0.00 C ATOM 1076 CE2 PHE A 72 -1.894 -4.880 8.911 1.00 0.00 C ATOM 1077 CZ PHE A 72 -1.862 -3.601 9.432 1.00 0.00 C ATOM 0 H PHE A 72 -2.400 -3.862 4.077 1.00 0.00 H new ATOM 0 HA PHE A 72 0.077 -2.427 4.809 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -0.420 -5.388 5.276 1.00 0.00 H new ATOM 0 HB3 PHE A 72 0.996 -4.466 5.739 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -0.211 -2.047 6.940 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -1.348 -6.140 7.278 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -1.228 -1.582 9.128 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -2.367 -5.677 9.465 1.00 0.00 H new ATOM 0 HZ PHE A 72 -2.311 -3.397 10.393 1.00 0.00 H new ATOM 1087 N LEU A 73 1.261 -3.331 2.807 1.00 0.00 N ATOM 1088 CA LEU A 73 1.859 -3.695 1.528 1.00 0.00 C ATOM 1089 C LEU A 73 3.313 -4.120 1.710 1.00 0.00 C ATOM 1090 O LEU A 73 4.035 -3.559 2.533 1.00 0.00 O ATOM 1091 CB LEU A 73 1.777 -2.523 0.550 1.00 0.00 C ATOM 1092 CG LEU A 73 1.930 -2.898 -0.925 1.00 0.00 C ATOM 1093 CD1 LEU A 73 0.601 -3.367 -1.497 1.00 0.00 C ATOM 1094 CD2 LEU A 73 2.469 -1.719 -1.721 1.00 0.00 C ATOM 0 H LEU A 73 1.814 -2.677 3.360 1.00 0.00 H new ATOM 0 HA LEU A 73 1.300 -4.538 1.121 1.00 0.00 H new ATOM 0 HB2 LEU A 73 0.817 -2.024 0.684 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.551 -1.800 0.807 1.00 0.00 H new ATOM 0 HG LEU A 73 2.644 -3.718 -1.000 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.729 -3.629 -2.547 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.255 -4.240 -0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.135 -2.568 -1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.572 -2.003 -2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 73 1.779 -0.879 -1.639 1.00 0.00 H new ATOM 0 HD23 LEU A 73 3.443 -1.429 -1.327 1.00 0.00 H new ATOM 1106 N GLU A 74 3.736 -5.115 0.936 1.00 0.00 N ATOM 1107 CA GLU A 74 5.103 -5.613 1.014 1.00 0.00 C ATOM 1108 C GLU A 74 5.440 -6.476 -0.198 1.00 0.00 C ATOM 1109 O GLU A 74 4.610 -7.256 -0.666 1.00 0.00 O ATOM 1110 CB GLU A 74 5.301 -6.419 2.299 1.00 0.00 C ATOM 1111 CG GLU A 74 6.751 -6.796 2.563 1.00 0.00 C ATOM 1112 CD GLU A 74 7.009 -7.130 4.020 1.00 0.00 C ATOM 1113 OE1 GLU A 74 6.893 -6.219 4.867 1.00 0.00 O ATOM 1114 OE2 GLU A 74 7.327 -8.302 4.313 1.00 0.00 O ATOM 0 H GLU A 74 3.152 -5.591 0.249 1.00 0.00 H new ATOM 0 HA GLU A 74 5.775 -4.755 1.023 1.00 0.00 H new ATOM 0 HB2 GLU A 74 4.925 -5.840 3.143 1.00 0.00 H new ATOM 0 HB3 GLU A 74 4.702 -7.328 2.244 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.019 -7.653 1.944 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.398 -5.972 2.263 1.00 0.00 H new ATOM 1121 N ASP A 75 6.661 -6.330 -0.702 1.00 0.00 N ATOM 1122 CA ASP A 75 7.108 -7.096 -1.860 1.00 0.00 C ATOM 1123 C ASP A 75 6.259 -6.775 -3.086 1.00 0.00 C ATOM 1124 O ASP A 75 5.932 -7.660 -3.877 1.00 0.00 O ATOM 1125 CB ASP A 75 7.049 -8.596 -1.559 1.00 0.00 C ATOM 1126 CG ASP A 75 8.347 -9.120 -0.977 1.00 0.00 C ATOM 1127 OD1 ASP A 75 9.421 -8.637 -1.390 1.00 0.00 O ATOM 1128 OD2 ASP A 75 8.288 -10.016 -0.109 1.00 0.00 O ATOM 0 H ASP A 75 7.359 -5.688 -0.327 1.00 0.00 H new ATOM 0 HA ASP A 75 8.140 -6.817 -2.074 1.00 0.00 H new ATOM 0 HB2 ASP A 75 6.236 -8.792 -0.860 1.00 0.00 H new ATOM 0 HB3 ASP A 75 6.820 -9.139 -2.476 1.00 0.00 H new ATOM 1133 N CYS A 76 5.906 -5.503 -3.238 1.00 0.00 N ATOM 1134 CA CYS A 76 5.096 -5.063 -4.369 1.00 0.00 C ATOM 1135 C CYS A 76 5.909 -4.177 -5.307 1.00 0.00 C ATOM 1136 O CYS A 76 6.594 -3.254 -4.868 1.00 0.00 O ATOM 1137 CB CYS A 76 3.862 -4.306 -3.874 1.00 0.00 C ATOM 1138 SG CYS A 76 2.601 -5.361 -3.123 1.00 0.00 S ATOM 0 H CYS A 76 6.168 -4.758 -2.592 1.00 0.00 H new ATOM 0 HA CYS A 76 4.775 -5.946 -4.921 1.00 0.00 H new ATOM 0 HB2 CYS A 76 4.176 -3.558 -3.146 1.00 0.00 H new ATOM 0 HB3 CYS A 76 3.419 -3.768 -4.712 1.00 0.00 H new ATOM 0 HG CYS A 76 2.942 -5.642 -1.901 1.00 0.00 H new ATOM 1144 N SER A 77 5.829 -4.465 -6.603 1.00 0.00 N ATOM 1145 CA SER A 77 6.557 -3.694 -7.603 1.00 0.00 C ATOM 1146 C SER A 77 5.721 -3.511 -8.866 1.00 0.00 C ATOM 1147 O SER A 77 5.118 -4.461 -9.367 1.00 0.00 O ATOM 1148 CB SER A 77 7.877 -4.385 -7.948 1.00 0.00 C ATOM 1149 OG SER A 77 8.552 -4.810 -6.776 1.00 0.00 O ATOM 0 H SER A 77 5.267 -5.226 -6.984 1.00 0.00 H new ATOM 0 HA SER A 77 6.768 -2.710 -7.183 1.00 0.00 H new ATOM 0 HB2 SER A 77 7.684 -5.243 -8.592 1.00 0.00 H new ATOM 0 HB3 SER A 77 8.513 -3.701 -8.510 1.00 0.00 H new ATOM 0 HG SER A 77 9.392 -5.250 -7.024 1.00 0.00 H new ATOM 1155 N ASP A 78 5.690 -2.284 -9.376 1.00 0.00 N ATOM 1156 CA ASP A 78 4.930 -1.977 -10.582 1.00 0.00 C ATOM 1157 C ASP A 78 3.445 -2.265 -10.378 1.00 0.00 C ATOM 1158 O ASP A 78 2.756 -2.705 -11.298 1.00 0.00 O ATOM 1159 CB ASP A 78 5.460 -2.788 -11.766 1.00 0.00 C ATOM 1160 CG ASP A 78 6.914 -2.482 -12.070 1.00 0.00 C ATOM 1161 OD1 ASP A 78 7.789 -2.928 -11.299 1.00 0.00 O ATOM 1162 OD2 ASP A 78 7.177 -1.798 -13.082 1.00 0.00 O ATOM 0 H ASP A 78 6.182 -1.487 -8.973 1.00 0.00 H new ATOM 0 HA ASP A 78 5.050 -0.915 -10.795 1.00 0.00 H new ATOM 0 HB2 ASP A 78 5.352 -3.851 -11.552 1.00 0.00 H new ATOM 0 HB3 ASP A 78 4.855 -2.577 -12.648 1.00 0.00 H new ATOM 1167 N CYS A 79 2.959 -2.011 -9.168 1.00 0.00 N ATOM 1168 CA CYS A 79 1.556 -2.243 -8.844 1.00 0.00 C ATOM 1169 C CYS A 79 0.814 -0.923 -8.657 1.00 0.00 C ATOM 1170 O CYS A 79 1.418 0.150 -8.696 1.00 0.00 O ATOM 1171 CB CYS A 79 1.435 -3.095 -7.579 1.00 0.00 C ATOM 1172 SG CYS A 79 0.111 -4.326 -7.642 1.00 0.00 S ATOM 0 H CYS A 79 3.515 -1.645 -8.396 1.00 0.00 H new ATOM 0 HA CYS A 79 1.102 -2.779 -9.677 1.00 0.00 H new ATOM 0 HB2 CYS A 79 2.383 -3.605 -7.405 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.265 -2.438 -6.726 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.704 -4.037 -8.613 1.00 0.00 H new ATOM 1178 N VAL A 80 -0.495 -1.009 -8.451 1.00 0.00 N ATOM 1179 CA VAL A 80 -1.317 0.179 -8.256 1.00 0.00 C ATOM 1180 C VAL A 80 -2.421 -0.078 -7.236 1.00 0.00 C ATOM 1181 O VAL A 80 -3.521 -0.502 -7.591 1.00 0.00 O ATOM 1182 CB VAL A 80 -1.955 0.646 -9.578 1.00 0.00 C ATOM 1183 CG1 VAL A 80 -2.611 2.007 -9.404 1.00 0.00 C ATOM 1184 CG2 VAL A 80 -0.916 0.686 -10.689 1.00 0.00 C ATOM 0 H VAL A 80 -1.010 -1.889 -8.415 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.656 0.962 -7.884 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.727 -0.071 -9.859 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.056 2.320 -10.349 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.387 1.942 -8.641 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.861 2.736 -9.097 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.386 1.018 -11.615 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.119 1.379 -10.417 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.497 -0.310 -10.832 1.00 0.00 H new ATOM 1194 N LEU A 81 -2.121 0.181 -5.968 1.00 0.00 N ATOM 1195 CA LEU A 81 -3.088 -0.023 -4.897 1.00 0.00 C ATOM 1196 C LEU A 81 -3.945 1.221 -4.691 1.00 0.00 C ATOM 1197 O LEU A 81 -3.445 2.346 -4.738 1.00 0.00 O ATOM 1198 CB LEU A 81 -2.369 -0.382 -3.595 1.00 0.00 C ATOM 1199 CG LEU A 81 -3.287 -0.639 -2.397 1.00 0.00 C ATOM 1200 CD1 LEU A 81 -4.252 -1.774 -2.699 1.00 0.00 C ATOM 1201 CD2 LEU A 81 -2.467 -0.948 -1.155 1.00 0.00 C ATOM 0 H LEU A 81 -1.215 0.533 -5.657 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.741 -0.847 -5.184 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.763 -1.272 -3.766 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.684 0.427 -3.341 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.869 0.263 -2.208 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.897 -1.943 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.863 -1.512 -3.563 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -3.689 -2.682 -2.915 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.136 -1.128 -0.313 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.859 -1.835 -1.332 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.818 -0.103 -0.928 1.00 0.00 H new ATOM 1213 N ALA A 82 -5.238 1.013 -4.465 1.00 0.00 N ATOM 1214 CA ALA A 82 -6.164 2.119 -4.252 1.00 0.00 C ATOM 1215 C ALA A 82 -7.197 1.770 -3.186 1.00 0.00 C ATOM 1216 O ALA A 82 -8.189 1.095 -3.465 1.00 0.00 O ATOM 1217 CB ALA A 82 -6.853 2.487 -5.556 1.00 0.00 C ATOM 0 H ALA A 82 -5.668 0.089 -4.425 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.593 2.978 -3.901 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -7.542 3.314 -5.383 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -6.105 2.785 -6.291 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.407 1.626 -5.930 1.00 0.00 H new ATOM 1223 N VAL A 83 -6.958 2.234 -1.963 1.00 0.00 N ATOM 1224 CA VAL A 83 -7.870 1.970 -0.856 1.00 0.00 C ATOM 1225 C VAL A 83 -7.566 2.878 0.333 1.00 0.00 C ATOM 1226 O VAL A 83 -6.419 2.996 0.760 1.00 0.00 O ATOM 1227 CB VAL A 83 -7.791 0.498 -0.403 1.00 0.00 C ATOM 1228 CG1 VAL A 83 -6.394 0.165 0.103 1.00 0.00 C ATOM 1229 CG2 VAL A 83 -8.838 0.207 0.661 1.00 0.00 C ATOM 0 H VAL A 83 -6.142 2.793 -1.714 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.878 2.176 -1.217 1.00 0.00 H new ATOM 0 HB VAL A 83 -7.998 -0.137 -1.264 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.360 -0.878 0.418 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.670 0.327 -0.695 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -6.151 0.807 0.949 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -8.765 -0.837 0.967 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -8.668 0.851 1.524 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -9.832 0.398 0.256 1.00 0.00 H new ATOM 1239 N ALA A 84 -8.604 3.517 0.862 1.00 0.00 N ATOM 1240 CA ALA A 84 -8.451 4.414 2.001 1.00 0.00 C ATOM 1241 C ALA A 84 -8.138 3.635 3.274 1.00 0.00 C ATOM 1242 O ALA A 84 -8.638 2.527 3.474 1.00 0.00 O ATOM 1243 CB ALA A 84 -9.707 5.250 2.188 1.00 0.00 C ATOM 0 H ALA A 84 -9.561 3.430 0.520 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.612 5.080 1.797 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.578 5.915 3.042 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.887 5.842 1.291 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.558 4.593 2.365 1.00 0.00 H new ATOM 1249 N CYS A 85 -7.309 4.219 4.132 1.00 0.00 N ATOM 1250 CA CYS A 85 -6.929 3.578 5.386 1.00 0.00 C ATOM 1251 C CYS A 85 -6.255 4.575 6.324 1.00 0.00 C ATOM 1252 O CYS A 85 -5.497 5.440 5.885 1.00 0.00 O ATOM 1253 CB CYS A 85 -5.992 2.398 5.118 1.00 0.00 C ATOM 1254 SG CYS A 85 -4.673 2.755 3.934 1.00 0.00 S ATOM 0 H CYS A 85 -6.887 5.135 3.982 1.00 0.00 H new ATOM 0 HA CYS A 85 -7.836 3.210 5.866 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -5.544 2.083 6.060 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -6.580 1.558 4.748 1.00 0.00 H new ATOM 0 HG CYS A 85 -5.172 2.822 2.736 1.00 0.00 H new ATOM 1260 N GLN A 86 -6.537 4.448 7.616 1.00 0.00 N ATOM 1261 CA GLN A 86 -5.959 5.339 8.619 1.00 0.00 C ATOM 1262 C GLN A 86 -4.435 5.332 8.542 1.00 0.00 C ATOM 1263 O GLN A 86 -3.805 6.386 8.451 1.00 0.00 O ATOM 1264 CB GLN A 86 -6.414 4.925 10.020 1.00 0.00 C ATOM 1265 CG GLN A 86 -7.541 5.784 10.572 1.00 0.00 C ATOM 1266 CD GLN A 86 -7.828 5.501 12.033 1.00 0.00 C ATOM 1267 OE1 GLN A 86 -8.006 6.420 12.832 1.00 0.00 O ATOM 1268 NE2 GLN A 86 -7.877 4.222 12.390 1.00 0.00 N ATOM 0 H GLN A 86 -7.162 3.737 7.995 1.00 0.00 H new ATOM 0 HA GLN A 86 -6.309 6.351 8.415 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -6.740 3.885 9.995 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -5.563 4.976 10.699 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -7.282 6.836 10.454 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.445 5.610 9.988 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -7.723 3.492 11.694 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -8.068 3.970 13.360 1.00 0.00 H new ATOM 1277 N GLN A 87 -3.850 4.140 8.579 1.00 0.00 N ATOM 1278 CA GLN A 87 -2.400 3.997 8.514 1.00 0.00 C ATOM 1279 C GLN A 87 -1.998 3.031 7.403 1.00 0.00 C ATOM 1280 O GLN A 87 -2.662 2.020 7.175 1.00 0.00 O ATOM 1281 CB GLN A 87 -1.856 3.507 9.858 1.00 0.00 C ATOM 1282 CG GLN A 87 -1.126 4.582 10.647 1.00 0.00 C ATOM 1283 CD GLN A 87 0.286 4.175 11.025 1.00 0.00 C ATOM 1284 OE1 GLN A 87 1.251 4.555 10.364 1.00 0.00 O ATOM 1285 NE2 GLN A 87 0.410 3.398 12.095 1.00 0.00 N ATOM 0 H GLN A 87 -4.358 3.258 8.654 1.00 0.00 H new ATOM 0 HA GLN A 87 -1.971 4.974 8.291 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -2.682 3.126 10.458 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -1.177 2.672 9.683 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -1.090 5.498 10.057 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -1.689 4.808 11.553 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -0.419 3.107 12.613 1.00 0.00 H new ATOM 0 HE22 GLN A 87 1.334 3.092 12.399 1.00 0.00 H new ATOM 1294 N LEU A 88 -0.908 3.353 6.713 1.00 0.00 N ATOM 1295 CA LEU A 88 -0.417 2.513 5.626 1.00 0.00 C ATOM 1296 C LEU A 88 1.011 2.053 5.896 1.00 0.00 C ATOM 1297 O LEU A 88 1.878 2.855 6.242 1.00 0.00 O ATOM 1298 CB LEU A 88 -0.477 3.275 4.300 1.00 0.00 C ATOM 1299 CG LEU A 88 0.058 2.509 3.089 1.00 0.00 C ATOM 1300 CD1 LEU A 88 -1.013 1.590 2.524 1.00 0.00 C ATOM 1301 CD2 LEU A 88 0.550 3.476 2.023 1.00 0.00 C ATOM 0 H LEU A 88 -0.349 4.188 6.887 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.057 1.633 5.562 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.512 3.555 4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 88 0.089 4.201 4.404 1.00 0.00 H new ATOM 0 HG LEU A 88 0.900 1.896 3.412 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.615 1.053 1.663 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.319 0.875 3.288 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.875 2.182 2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.927 2.914 1.168 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.274 4.114 1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.349 4.093 2.433 1.00 0.00 H new ATOM 1313 N ARG A 89 1.248 0.755 5.736 1.00 0.00 N ATOM 1314 CA ARG A 89 2.572 0.186 5.964 1.00 0.00 C ATOM 1315 C ARG A 89 3.125 -0.433 4.683 1.00 0.00 C ATOM 1316 O ARG A 89 2.478 -1.272 4.057 1.00 0.00 O ATOM 1317 CB ARG A 89 2.514 -0.866 7.074 1.00 0.00 C ATOM 1318 CG ARG A 89 3.250 -0.456 8.339 1.00 0.00 C ATOM 1319 CD ARG A 89 4.041 -1.615 8.927 1.00 0.00 C ATOM 1320 NE ARG A 89 5.147 -2.018 8.062 1.00 0.00 N ATOM 1321 CZ ARG A 89 5.764 -3.193 8.146 1.00 0.00 C ATOM 1322 NH1 ARG A 89 5.388 -4.085 9.056 1.00 0.00 N ATOM 1323 NH2 ARG A 89 6.761 -3.480 7.319 1.00 0.00 N ATOM 0 H ARG A 89 0.541 0.078 5.450 1.00 0.00 H new ATOM 0 HA ARG A 89 3.239 0.990 6.273 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.471 -1.066 7.319 1.00 0.00 H new ATOM 0 HB3 ARG A 89 2.939 -1.798 6.702 1.00 0.00 H new ATOM 0 HG2 ARG A 89 3.925 0.370 8.116 1.00 0.00 H new ATOM 0 HG3 ARG A 89 2.534 -0.093 9.076 1.00 0.00 H new ATOM 0 HD2 ARG A 89 4.431 -1.329 9.904 1.00 0.00 H new ATOM 0 HD3 ARG A 89 3.376 -2.464 9.085 1.00 0.00 H new ATOM 0 HE ARG A 89 5.465 -1.359 7.351 1.00 0.00 H new ATOM 0 HH11 ARG A 89 4.622 -3.870 9.695 1.00 0.00 H new ATOM 0 HH12 ARG A 89 5.865 -4.985 9.116 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.055 -2.799 6.618 1.00 0.00 H new ATOM 0 HH22 ARG A 89 7.234 -4.381 7.384 1.00 0.00 H new ATOM 1337 N ILE A 90 4.327 -0.013 4.301 1.00 0.00 N ATOM 1338 CA ILE A 90 4.968 -0.525 3.097 1.00 0.00 C ATOM 1339 C ILE A 90 6.372 -1.039 3.399 1.00 0.00 C ATOM 1340 O ILE A 90 7.005 -0.610 4.364 1.00 0.00 O ATOM 1341 CB ILE A 90 5.055 0.556 2.002 1.00 0.00 C ATOM 1342 CG1 ILE A 90 3.699 1.242 1.821 1.00 0.00 C ATOM 1343 CG2 ILE A 90 5.526 -0.055 0.690 1.00 0.00 C ATOM 1344 CD1 ILE A 90 3.779 2.546 1.059 1.00 0.00 C ATOM 0 H ILE A 90 4.876 0.681 4.809 1.00 0.00 H new ATOM 0 HA ILE A 90 4.351 -1.348 2.736 1.00 0.00 H new ATOM 0 HB ILE A 90 5.782 1.307 2.312 1.00 0.00 H new ATOM 0 HG12 ILE A 90 3.025 0.565 1.296 1.00 0.00 H new ATOM 0 HG13 ILE A 90 3.262 1.430 2.802 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.582 0.721 -0.073 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.511 -0.500 0.829 1.00 0.00 H new ATOM 0 HG23 ILE A 90 4.822 -0.825 0.374 1.00 0.00 H new ATOM 0 HD11 ILE A 90 2.782 2.976 0.969 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.427 3.241 1.594 1.00 0.00 H new ATOM 0 HD13 ILE A 90 4.186 2.362 0.065 1.00 0.00 H new ATOM 1356 N HIS A 91 6.852 -1.960 2.570 1.00 0.00 N ATOM 1357 CA HIS A 91 8.180 -2.532 2.752 1.00 0.00 C ATOM 1358 C HIS A 91 8.633 -3.271 1.497 1.00 0.00 C ATOM 1359 O HIS A 91 7.872 -4.041 0.909 1.00 0.00 O ATOM 1360 CB HIS A 91 8.190 -3.483 3.949 1.00 0.00 C ATOM 1361 CG HIS A 91 9.501 -3.526 4.671 1.00 0.00 C ATOM 1362 ND1 HIS A 91 10.715 -3.700 4.046 1.00 0.00 N ATOM 1363 CD2 HIS A 91 9.774 -3.411 5.995 1.00 0.00 C ATOM 1364 CE1 HIS A 91 11.668 -3.687 4.987 1.00 0.00 C ATOM 1365 NE2 HIS A 91 11.149 -3.514 6.189 1.00 0.00 N ATOM 0 H HIS A 91 6.341 -2.326 1.766 1.00 0.00 H new ATOM 0 HA HIS A 91 8.876 -1.714 2.941 1.00 0.00 H new ATOM 0 HB2 HIS A 91 7.410 -3.182 4.648 1.00 0.00 H new ATOM 0 HB3 HIS A 91 7.941 -4.487 3.606 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.041 -3.263 6.775 1.00 0.00 H new ATOM 0 HE1 HIS A 91 12.723 -3.803 4.789 1.00 0.00 H new ATOM 0 HE2 HIS A 91 11.651 -3.466 7.076 1.00 0.00 H new ATOM 1373 N SER A 92 9.877 -3.035 1.092 1.00 0.00 N ATOM 1374 CA SER A 92 10.431 -3.680 -0.093 1.00 0.00 C ATOM 1375 C SER A 92 9.613 -3.335 -1.334 1.00 0.00 C ATOM 1376 O SER A 92 9.507 -4.138 -2.261 1.00 0.00 O ATOM 1377 CB SER A 92 10.473 -5.196 0.100 1.00 0.00 C ATOM 1378 OG SER A 92 11.197 -5.544 1.268 1.00 0.00 O ATOM 0 H SER A 92 10.520 -2.402 1.567 1.00 0.00 H new ATOM 0 HA SER A 92 11.446 -3.311 -0.236 1.00 0.00 H new ATOM 0 HB2 SER A 92 9.457 -5.585 0.169 1.00 0.00 H new ATOM 0 HB3 SER A 92 10.934 -5.663 -0.770 1.00 0.00 H new ATOM 0 HG SER A 92 11.207 -6.519 1.368 1.00 0.00 H new ATOM 1384 N THR A 93 9.040 -2.136 -1.345 1.00 0.00 N ATOM 1385 CA THR A 93 8.233 -1.687 -2.473 1.00 0.00 C ATOM 1386 C THR A 93 8.987 -0.655 -3.305 1.00 0.00 C ATOM 1387 O THR A 93 9.691 0.198 -2.763 1.00 0.00 O ATOM 1388 CB THR A 93 6.912 -1.093 -1.978 1.00 0.00 C ATOM 1389 OG1 THR A 93 6.253 -1.995 -1.107 1.00 0.00 O ATOM 1390 CG2 THR A 93 5.953 -0.753 -3.098 1.00 0.00 C ATOM 0 H THR A 93 9.119 -1.459 -0.586 1.00 0.00 H new ATOM 0 HA THR A 93 8.022 -2.551 -3.103 1.00 0.00 H new ATOM 0 HB THR A 93 7.184 -0.172 -1.462 1.00 0.00 H new ATOM 0 HG1 THR A 93 5.451 -2.348 -1.547 1.00 0.00 H new ATOM 0 HG21 THR A 93 5.037 -0.336 -2.679 1.00 0.00 H new ATOM 0 HG22 THR A 93 6.414 -0.022 -3.762 1.00 0.00 H new ATOM 0 HG23 THR A 93 5.717 -1.656 -3.661 1.00 0.00 H new ATOM 1398 N LYS A 94 8.836 -0.738 -4.622 1.00 0.00 N ATOM 1399 CA LYS A 94 9.504 0.189 -5.528 1.00 0.00 C ATOM 1400 C LYS A 94 8.780 0.259 -6.869 1.00 0.00 C ATOM 1401 O LYS A 94 8.333 -0.758 -7.398 1.00 0.00 O ATOM 1402 CB LYS A 94 10.959 -0.235 -5.744 1.00 0.00 C ATOM 1403 CG LYS A 94 11.126 -1.725 -6.000 1.00 0.00 C ATOM 1404 CD LYS A 94 12.592 -2.134 -5.984 1.00 0.00 C ATOM 1405 CE LYS A 94 13.022 -2.719 -7.320 1.00 0.00 C ATOM 1406 NZ LYS A 94 12.852 -1.746 -8.434 1.00 0.00 N ATOM 0 H LYS A 94 8.257 -1.438 -5.086 1.00 0.00 H new ATOM 0 HA LYS A 94 9.484 1.179 -5.072 1.00 0.00 H new ATOM 0 HB2 LYS A 94 11.369 0.319 -6.589 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.544 0.043 -4.867 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.582 -2.288 -5.242 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.686 -1.981 -6.964 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.210 -1.267 -5.749 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.758 -2.867 -5.194 1.00 0.00 H new ATOM 0 HE2 LYS A 94 14.066 -3.026 -7.262 1.00 0.00 H new ATOM 0 HE3 LYS A 94 12.438 -3.615 -7.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.497 -1.992 -9.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.870 -1.777 -8.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.070 -0.788 -8.094 1.00 0.00 H new ATOM 1420 N ASP A 95 8.668 1.467 -7.412 1.00 0.00 N ATOM 1421 CA ASP A 95 7.998 1.670 -8.692 1.00 0.00 C ATOM 1422 C ASP A 95 6.546 1.205 -8.626 1.00 0.00 C ATOM 1423 O ASP A 95 5.986 0.749 -9.622 1.00 0.00 O ATOM 1424 CB ASP A 95 8.736 0.920 -9.802 1.00 0.00 C ATOM 1425 CG ASP A 95 9.793 1.774 -10.474 1.00 0.00 C ATOM 1426 OD1 ASP A 95 10.333 2.683 -9.807 1.00 0.00 O ATOM 1427 OD2 ASP A 95 10.082 1.536 -11.665 1.00 0.00 O ATOM 0 H ASP A 95 9.032 2.319 -6.986 1.00 0.00 H new ATOM 0 HA ASP A 95 8.009 2.737 -8.915 1.00 0.00 H new ATOM 0 HB2 ASP A 95 9.205 0.029 -9.385 1.00 0.00 H new ATOM 0 HB3 ASP A 95 8.017 0.583 -10.549 1.00 0.00 H new ATOM 1432 N THR A 96 5.945 1.326 -7.448 1.00 0.00 N ATOM 1433 CA THR A 96 4.558 0.918 -7.252 1.00 0.00 C ATOM 1434 C THR A 96 3.681 2.118 -6.911 1.00 0.00 C ATOM 1435 O THR A 96 3.989 2.885 -5.999 1.00 0.00 O ATOM 1436 CB THR A 96 4.464 -0.128 -6.141 1.00 0.00 C ATOM 1437 OG1 THR A 96 5.438 -1.141 -6.323 1.00 0.00 O ATOM 1438 CG2 THR A 96 3.110 -0.800 -6.065 1.00 0.00 C ATOM 0 H THR A 96 6.396 1.703 -6.614 1.00 0.00 H new ATOM 0 HA THR A 96 4.199 0.481 -8.184 1.00 0.00 H new ATOM 0 HB THR A 96 4.632 0.419 -5.213 1.00 0.00 H new ATOM 0 HG1 THR A 96 6.263 -0.889 -5.859 1.00 0.00 H new ATOM 0 HG21 THR A 96 3.111 -1.531 -5.256 1.00 0.00 H new ATOM 0 HG22 THR A 96 2.342 -0.050 -5.876 1.00 0.00 H new ATOM 0 HG23 THR A 96 2.900 -1.304 -7.009 1.00 0.00 H new ATOM 1446 N ARG A 97 2.588 2.275 -7.650 1.00 0.00 N ATOM 1447 CA ARG A 97 1.665 3.382 -7.425 1.00 0.00 C ATOM 1448 C ARG A 97 0.685 3.053 -6.305 1.00 0.00 C ATOM 1449 O ARG A 97 0.318 1.895 -6.107 1.00 0.00 O ATOM 1450 CB ARG A 97 0.901 3.706 -8.710 1.00 0.00 C ATOM 1451 CG ARG A 97 1.799 3.909 -9.919 1.00 0.00 C ATOM 1452 CD ARG A 97 0.991 4.235 -11.164 1.00 0.00 C ATOM 1453 NE ARG A 97 1.733 3.948 -12.389 1.00 0.00 N ATOM 1454 CZ ARG A 97 2.673 4.745 -12.891 1.00 0.00 C ATOM 1455 NH1 ARG A 97 2.989 5.878 -12.277 1.00 0.00 N ATOM 1456 NH2 ARG A 97 3.299 4.409 -14.010 1.00 0.00 N ATOM 0 H ARG A 97 2.319 1.650 -8.410 1.00 0.00 H new ATOM 0 HA ARG A 97 2.248 4.254 -7.128 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.201 2.897 -8.920 1.00 0.00 H new ATOM 0 HB3 ARG A 97 0.309 4.607 -8.553 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.503 4.717 -9.719 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.388 3.008 -10.092 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.066 3.658 -11.157 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.710 5.288 -11.149 1.00 0.00 H new ATOM 0 HE ARG A 97 1.518 3.086 -12.889 1.00 0.00 H new ATOM 0 HH11 ARG A 97 2.511 6.142 -11.416 1.00 0.00 H new ATOM 0 HH12 ARG A 97 3.710 6.485 -12.666 1.00 0.00 H new ATOM 0 HH21 ARG A 97 3.060 3.539 -14.487 1.00 0.00 H new ATOM 0 HH22 ARG A 97 4.019 5.020 -14.395 1.00 0.00 H new ATOM 1470 N ILE A 98 0.263 4.079 -5.574 1.00 0.00 N ATOM 1471 CA ILE A 98 -0.676 3.898 -4.473 1.00 0.00 C ATOM 1472 C ILE A 98 -1.538 5.140 -4.275 1.00 0.00 C ATOM 1473 O ILE A 98 -1.033 6.209 -3.931 1.00 0.00 O ATOM 1474 CB ILE A 98 0.055 3.579 -3.154 1.00 0.00 C ATOM 1475 CG1 ILE A 98 1.131 2.516 -3.383 1.00 0.00 C ATOM 1476 CG2 ILE A 98 -0.938 3.119 -2.097 1.00 0.00 C ATOM 1477 CD1 ILE A 98 1.886 2.138 -2.128 1.00 0.00 C ATOM 0 H ILE A 98 0.556 5.044 -5.724 1.00 0.00 H new ATOM 0 HA ILE A 98 -1.313 3.055 -4.739 1.00 0.00 H new ATOM 0 HB ILE A 98 0.542 4.487 -2.797 1.00 0.00 H new ATOM 0 HG12 ILE A 98 0.665 1.623 -3.799 1.00 0.00 H new ATOM 0 HG13 ILE A 98 1.839 2.882 -4.127 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -0.407 2.897 -1.171 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.669 3.907 -1.917 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -1.450 2.222 -2.445 1.00 0.00 H new ATOM 0 HD11 ILE A 98 2.632 1.380 -2.367 1.00 0.00 H new ATOM 0 HD12 ILE A 98 2.382 3.020 -1.722 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.189 1.741 -1.390 1.00 0.00 H new ATOM 1489 N PHE A 99 -2.840 4.992 -4.495 1.00 0.00 N ATOM 1490 CA PHE A 99 -3.773 6.103 -4.339 1.00 0.00 C ATOM 1491 C PHE A 99 -4.717 5.859 -3.166 1.00 0.00 C ATOM 1492 O PHE A 99 -5.696 5.123 -3.287 1.00 0.00 O ATOM 1493 CB PHE A 99 -4.580 6.302 -5.623 1.00 0.00 C ATOM 1494 CG PHE A 99 -3.741 6.712 -6.801 1.00 0.00 C ATOM 1495 CD1 PHE A 99 -2.876 5.811 -7.398 1.00 0.00 C ATOM 1496 CD2 PHE A 99 -3.821 7.999 -7.309 1.00 0.00 C ATOM 1497 CE1 PHE A 99 -2.103 6.185 -8.481 1.00 0.00 C ATOM 1498 CE2 PHE A 99 -3.050 8.378 -8.392 1.00 0.00 C ATOM 1499 CZ PHE A 99 -2.191 7.471 -8.979 1.00 0.00 C ATOM 0 H PHE A 99 -3.273 4.114 -4.782 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.195 7.005 -4.137 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -5.101 5.375 -5.863 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.343 7.060 -5.449 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.804 4.804 -7.013 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -4.492 8.713 -6.854 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -1.431 5.473 -8.937 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -3.120 9.384 -8.779 1.00 0.00 H new ATOM 0 HZ PHE A 99 -1.589 7.766 -9.826 1.00 0.00 H new ATOM 1509 N LEU A 100 -4.415 6.481 -2.030 1.00 0.00 N ATOM 1510 CA LEU A 100 -5.237 6.329 -0.836 1.00 0.00 C ATOM 1511 C LEU A 100 -5.316 7.638 -0.058 1.00 0.00 C ATOM 1512 O LEU A 100 -4.730 8.645 -0.456 1.00 0.00 O ATOM 1513 CB LEU A 100 -4.675 5.223 0.060 1.00 0.00 C ATOM 1514 CG LEU A 100 -3.334 5.545 0.723 1.00 0.00 C ATOM 1515 CD1 LEU A 100 -3.087 4.620 1.904 1.00 0.00 C ATOM 1516 CD2 LEU A 100 -2.202 5.437 -0.288 1.00 0.00 C ATOM 0 H LEU A 100 -3.608 7.094 -1.912 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.243 6.054 -1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.404 5.002 0.839 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.560 4.317 -0.535 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.369 6.570 1.093 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.129 4.864 2.363 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.883 4.746 2.638 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.072 3.586 1.559 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.255 5.669 0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -2.166 4.423 -0.687 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.373 6.141 -1.102 1.00 0.00 H new ATOM 1528 N GLN A 101 -6.043 7.615 1.055 1.00 0.00 N ATOM 1529 CA GLN A 101 -6.199 8.798 1.892 1.00 0.00 C ATOM 1530 C GLN A 101 -6.018 8.446 3.365 1.00 0.00 C ATOM 1531 O GLN A 101 -6.934 7.933 4.008 1.00 0.00 O ATOM 1532 CB GLN A 101 -7.576 9.428 1.673 1.00 0.00 C ATOM 1533 CG GLN A 101 -7.770 10.738 2.420 1.00 0.00 C ATOM 1534 CD GLN A 101 -9.009 10.733 3.295 1.00 0.00 C ATOM 1535 OE1 GLN A 101 -9.989 10.048 3.001 1.00 0.00 O ATOM 1536 NE2 GLN A 101 -8.971 11.502 4.377 1.00 0.00 N ATOM 0 H GLN A 101 -6.533 6.789 1.398 1.00 0.00 H new ATOM 0 HA GLN A 101 -5.430 9.517 1.609 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.722 9.602 0.607 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -8.344 8.722 1.989 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -6.894 10.932 3.039 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -7.840 11.555 1.701 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -8.138 12.053 4.582 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -9.775 11.541 5.003 1.00 0.00 H new ATOM 1545 N VAL A 102 -4.830 8.721 3.893 1.00 0.00 N ATOM 1546 CA VAL A 102 -4.529 8.431 5.289 1.00 0.00 C ATOM 1547 C VAL A 102 -4.796 9.642 6.176 1.00 0.00 C ATOM 1548 O VAL A 102 -4.446 10.770 5.825 1.00 0.00 O ATOM 1549 CB VAL A 102 -3.065 7.991 5.469 1.00 0.00 C ATOM 1550 CG1 VAL A 102 -2.856 6.587 4.922 1.00 0.00 C ATOM 1551 CG2 VAL A 102 -2.123 8.979 4.796 1.00 0.00 C ATOM 0 H VAL A 102 -4.060 9.144 3.375 1.00 0.00 H new ATOM 0 HA VAL A 102 -5.186 7.615 5.588 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.839 7.977 6.535 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -1.815 6.295 5.059 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -3.502 5.889 5.455 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -3.101 6.570 3.860 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -1.093 8.651 4.934 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -2.348 9.029 3.731 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.252 9.966 5.241 1.00 0.00 H new ATOM 1561 N THR A 103 -5.417 9.402 7.326 1.00 0.00 N ATOM 1562 CA THR A 103 -5.729 10.472 8.265 1.00 0.00 C ATOM 1563 C THR A 103 -4.666 10.566 9.353 1.00 0.00 C ATOM 1564 O THR A 103 -4.360 11.652 9.845 1.00 0.00 O ATOM 1565 CB THR A 103 -7.104 10.239 8.895 1.00 0.00 C ATOM 1566 OG1 THR A 103 -7.098 9.066 9.687 1.00 0.00 O ATOM 1567 CG2 THR A 103 -8.214 10.102 7.877 1.00 0.00 C ATOM 0 H THR A 103 -5.714 8.475 7.630 1.00 0.00 H new ATOM 0 HA THR A 103 -5.744 11.413 7.716 1.00 0.00 H new ATOM 0 HB THR A 103 -7.299 11.124 9.501 1.00 0.00 H new ATOM 0 HG1 THR A 103 -7.985 8.934 10.083 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.161 9.939 8.391 1.00 0.00 H new ATOM 0 HG22 THR A 103 -8.276 11.013 7.282 1.00 0.00 H new ATOM 0 HG23 THR A 103 -8.006 9.255 7.223 1.00 0.00 H new ATOM 1575 N SER A 104 -4.105 9.419 9.725 1.00 0.00 N ATOM 1576 CA SER A 104 -3.074 9.372 10.755 1.00 0.00 C ATOM 1577 C SER A 104 -1.694 9.624 10.154 1.00 0.00 C ATOM 1578 O SER A 104 -1.133 10.709 10.298 1.00 0.00 O ATOM 1579 CB SER A 104 -3.099 8.017 11.469 1.00 0.00 C ATOM 1580 OG SER A 104 -3.290 8.179 12.863 1.00 0.00 O ATOM 0 H SER A 104 -4.347 8.511 9.329 1.00 0.00 H new ATOM 0 HA SER A 104 -3.281 10.159 11.481 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.899 7.401 11.058 1.00 0.00 H new ATOM 0 HB3 SER A 104 -2.163 7.489 11.286 1.00 0.00 H new ATOM 0 HG SER A 104 -3.304 7.300 13.296 1.00 0.00 H new ATOM 1586 N ARG A 105 -1.154 8.613 9.480 1.00 0.00 N ATOM 1587 CA ARG A 105 0.160 8.725 8.857 1.00 0.00 C ATOM 1588 C ARG A 105 0.519 7.448 8.106 1.00 0.00 C ATOM 1589 O ARG A 105 -0.176 6.437 8.210 1.00 0.00 O ATOM 1590 CB ARG A 105 1.226 9.024 9.913 1.00 0.00 C ATOM 1591 CG ARG A 105 1.372 7.928 10.957 1.00 0.00 C ATOM 1592 CD ARG A 105 2.799 7.841 11.476 1.00 0.00 C ATOM 1593 NE ARG A 105 3.097 6.526 12.040 1.00 0.00 N ATOM 1594 CZ ARG A 105 2.730 6.143 13.261 1.00 0.00 C ATOM 1595 NH1 ARG A 105 2.051 6.969 14.048 1.00 0.00 N ATOM 1596 NH2 ARG A 105 3.044 4.931 13.697 1.00 0.00 N ATOM 0 H ARG A 105 -1.606 7.708 9.352 1.00 0.00 H new ATOM 0 HA ARG A 105 0.124 9.547 8.143 1.00 0.00 H new ATOM 0 HB2 ARG A 105 2.185 9.172 9.417 1.00 0.00 H new ATOM 0 HB3 ARG A 105 0.978 9.960 10.413 1.00 0.00 H new ATOM 0 HG2 ARG A 105 0.693 8.122 11.787 1.00 0.00 H new ATOM 0 HG3 ARG A 105 1.082 6.971 10.524 1.00 0.00 H new ATOM 0 HD2 ARG A 105 3.494 8.053 10.663 1.00 0.00 H new ATOM 0 HD3 ARG A 105 2.955 8.606 12.237 1.00 0.00 H new ATOM 0 HE ARG A 105 3.616 5.863 11.465 1.00 0.00 H new ATOM 0 HH11 ARG A 105 1.808 7.903 13.718 1.00 0.00 H new ATOM 0 HH12 ARG A 105 1.773 6.670 14.982 1.00 0.00 H new ATOM 0 HH21 ARG A 105 3.566 4.293 13.097 1.00 0.00 H new ATOM 0 HH22 ARG A 105 2.763 4.637 14.632 1.00 0.00 H new ATOM 1610 N ALA A 106 1.611 7.501 7.349 1.00 0.00 N ATOM 1611 CA ALA A 106 2.066 6.349 6.580 1.00 0.00 C ATOM 1612 C ALA A 106 3.515 6.009 6.912 1.00 0.00 C ATOM 1613 O ALA A 106 4.327 6.896 7.173 1.00 0.00 O ATOM 1614 CB ALA A 106 1.913 6.615 5.090 1.00 0.00 C ATOM 0 H ALA A 106 2.197 8.330 7.252 1.00 0.00 H new ATOM 0 HA ALA A 106 1.446 5.494 6.850 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.257 5.746 4.528 1.00 0.00 H new ATOM 0 HB2 ALA A 106 0.865 6.804 4.860 1.00 0.00 H new ATOM 0 HB3 ALA A 106 2.508 7.485 4.813 1.00 0.00 H new ATOM 1620 N ILE A 107 3.833 4.718 6.902 1.00 0.00 N ATOM 1621 CA ILE A 107 5.184 4.262 7.203 1.00 0.00 C ATOM 1622 C ILE A 107 5.769 3.464 6.043 1.00 0.00 C ATOM 1623 O ILE A 107 5.040 2.816 5.293 1.00 0.00 O ATOM 1624 CB ILE A 107 5.214 3.394 8.475 1.00 0.00 C ATOM 1625 CG1 ILE A 107 4.455 4.086 9.609 1.00 0.00 C ATOM 1626 CG2 ILE A 107 6.649 3.108 8.888 1.00 0.00 C ATOM 1627 CD1 ILE A 107 4.138 3.170 10.771 1.00 0.00 C ATOM 0 H ILE A 107 3.173 3.970 6.689 1.00 0.00 H new ATOM 0 HA ILE A 107 5.788 5.155 7.366 1.00 0.00 H new ATOM 0 HB ILE A 107 4.723 2.445 8.261 1.00 0.00 H new ATOM 0 HG12 ILE A 107 5.046 4.927 9.971 1.00 0.00 H new ATOM 0 HG13 ILE A 107 3.525 4.496 9.216 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.653 2.494 9.788 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.160 2.578 8.085 1.00 0.00 H new ATOM 0 HG23 ILE A 107 7.164 4.048 9.088 1.00 0.00 H new ATOM 0 HD11 ILE A 107 3.600 3.728 11.537 1.00 0.00 H new ATOM 0 HD12 ILE A 107 3.520 2.342 10.423 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.065 2.780 11.190 1.00 0.00 H new ATOM 1639 N VAL A 108 7.089 3.515 5.903 1.00 0.00 N ATOM 1640 CA VAL A 108 7.776 2.796 4.837 1.00 0.00 C ATOM 1641 C VAL A 108 9.166 2.353 5.280 1.00 0.00 C ATOM 1642 O VAL A 108 9.875 3.093 5.962 1.00 0.00 O ATOM 1643 CB VAL A 108 7.905 3.660 3.568 1.00 0.00 C ATOM 1644 CG1 VAL A 108 6.549 3.851 2.909 1.00 0.00 C ATOM 1645 CG2 VAL A 108 8.537 5.003 3.900 1.00 0.00 C ATOM 0 H VAL A 108 7.706 4.048 6.516 1.00 0.00 H new ATOM 0 HA VAL A 108 7.173 1.917 4.609 1.00 0.00 H new ATOM 0 HB VAL A 108 8.554 3.141 2.863 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.662 4.464 2.015 1.00 0.00 H new ATOM 0 HG12 VAL A 108 6.138 2.880 2.634 1.00 0.00 H new ATOM 0 HG13 VAL A 108 5.873 4.347 3.605 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.620 5.600 2.992 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.915 5.529 4.624 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.529 4.844 4.322 1.00 0.00 H new ATOM 1655 N GLU A 109 9.549 1.142 4.890 1.00 0.00 N ATOM 1656 CA GLU A 109 10.855 0.602 5.250 1.00 0.00 C ATOM 1657 C GLU A 109 11.514 -0.076 4.053 1.00 0.00 C ATOM 1658 O GLU A 109 10.906 -0.916 3.390 1.00 0.00 O ATOM 1659 CB GLU A 109 10.717 -0.393 6.403 1.00 0.00 C ATOM 1660 CG GLU A 109 10.728 0.259 7.776 1.00 0.00 C ATOM 1661 CD GLU A 109 10.002 -0.566 8.819 1.00 0.00 C ATOM 1662 OE1 GLU A 109 9.940 -1.804 8.660 1.00 0.00 O ATOM 1663 OE2 GLU A 109 9.495 0.024 9.796 1.00 0.00 O ATOM 0 H GLU A 109 8.974 0.516 4.325 1.00 0.00 H new ATOM 0 HA GLU A 109 11.488 1.431 5.567 1.00 0.00 H new ATOM 0 HB2 GLU A 109 9.788 -0.949 6.282 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.531 -1.116 6.347 1.00 0.00 H new ATOM 0 HG2 GLU A 109 11.760 0.412 8.093 1.00 0.00 H new ATOM 0 HG3 GLU A 109 10.265 1.244 7.710 1.00 0.00 H new ATOM 1670 N ASP A 110 12.762 0.295 3.783 1.00 0.00 N ATOM 1671 CA ASP A 110 13.506 -0.278 2.666 1.00 0.00 C ATOM 1672 C ASP A 110 12.786 -0.024 1.344 1.00 0.00 C ATOM 1673 O ASP A 110 12.849 -0.841 0.426 1.00 0.00 O ATOM 1674 CB ASP A 110 13.703 -1.782 2.875 1.00 0.00 C ATOM 1675 CG ASP A 110 15.142 -2.210 2.665 1.00 0.00 C ATOM 1676 OD1 ASP A 110 15.758 -1.757 1.678 1.00 0.00 O ATOM 1677 OD2 ASP A 110 15.652 -2.998 3.488 1.00 0.00 O ATOM 0 H ASP A 110 13.279 0.989 4.322 1.00 0.00 H new ATOM 0 HA ASP A 110 14.482 0.206 2.625 1.00 0.00 H new ATOM 0 HB2 ASP A 110 13.390 -2.050 3.884 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.060 -2.329 2.186 1.00 0.00 H new ATOM 1682 N CYS A 111 12.103 1.112 1.256 1.00 0.00 N ATOM 1683 CA CYS A 111 11.372 1.473 0.048 1.00 0.00 C ATOM 1684 C CYS A 111 12.162 2.475 -0.787 1.00 0.00 C ATOM 1685 O CYS A 111 13.024 3.187 -0.270 1.00 0.00 O ATOM 1686 CB CYS A 111 10.005 2.056 0.408 1.00 0.00 C ATOM 1687 SG CYS A 111 8.966 0.951 1.392 1.00 0.00 S ATOM 0 H CYS A 111 12.041 1.799 2.008 1.00 0.00 H new ATOM 0 HA CYS A 111 11.228 0.569 -0.543 1.00 0.00 H new ATOM 0 HB2 CYS A 111 10.152 2.985 0.959 1.00 0.00 H new ATOM 0 HB3 CYS A 111 9.477 2.311 -0.511 1.00 0.00 H new ATOM 0 HG CYS A 111 9.718 0.210 2.151 1.00 0.00 H new ATOM 1693 N SER A 112 11.861 2.527 -2.081 1.00 0.00 N ATOM 1694 CA SER A 112 12.543 3.443 -2.989 1.00 0.00 C ATOM 1695 C SER A 112 11.719 3.670 -4.252 1.00 0.00 C ATOM 1696 O SER A 112 11.322 2.719 -4.926 1.00 0.00 O ATOM 1697 CB SER A 112 13.923 2.896 -3.357 1.00 0.00 C ATOM 1698 OG SER A 112 14.813 2.971 -2.256 1.00 0.00 O ATOM 0 H SER A 112 11.150 1.946 -2.524 1.00 0.00 H new ATOM 0 HA SER A 112 12.663 4.399 -2.479 1.00 0.00 H new ATOM 0 HB2 SER A 112 13.831 1.860 -3.684 1.00 0.00 H new ATOM 0 HB3 SER A 112 14.329 3.461 -4.196 1.00 0.00 H new ATOM 0 HG SER A 112 14.351 3.368 -1.488 1.00 0.00 H new ATOM 1704 N GLY A 113 11.467 4.936 -4.568 1.00 0.00 N ATOM 1705 CA GLY A 113 10.692 5.264 -5.751 1.00 0.00 C ATOM 1706 C GLY A 113 9.216 4.968 -5.578 1.00 0.00 C ATOM 1707 O GLY A 113 8.545 4.546 -6.520 1.00 0.00 O ATOM 0 H GLY A 113 11.785 5.740 -4.027 1.00 0.00 H new ATOM 0 HA2 GLY A 113 10.822 6.320 -5.985 1.00 0.00 H new ATOM 0 HA3 GLY A 113 11.075 4.699 -6.601 1.00 0.00 H new ATOM 1711 N ILE A 114 8.707 5.190 -4.369 1.00 0.00 N ATOM 1712 CA ILE A 114 7.300 4.943 -4.076 1.00 0.00 C ATOM 1713 C ILE A 114 6.432 6.113 -4.527 1.00 0.00 C ATOM 1714 O ILE A 114 6.918 7.232 -4.695 1.00 0.00 O ATOM 1715 CB ILE A 114 7.073 4.702 -2.572 1.00 0.00 C ATOM 1716 CG1 ILE A 114 8.072 3.671 -2.043 1.00 0.00 C ATOM 1717 CG2 ILE A 114 5.645 4.244 -2.318 1.00 0.00 C ATOM 1718 CD1 ILE A 114 7.941 2.313 -2.698 1.00 0.00 C ATOM 0 H ILE A 114 9.248 5.540 -3.578 1.00 0.00 H new ATOM 0 HA ILE A 114 7.015 4.047 -4.627 1.00 0.00 H new ATOM 0 HB ILE A 114 7.232 5.640 -2.040 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.084 4.044 -2.198 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.934 3.562 -0.967 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.501 4.078 -1.250 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.950 5.010 -2.663 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.459 3.316 -2.858 1.00 0.00 H new ATOM 0 HD11 ILE A 114 8.680 1.632 -2.275 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.940 1.919 -2.521 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.108 2.409 -3.771 1.00 0.00 H new ATOM 1730 N GLN A 115 5.144 5.847 -4.722 1.00 0.00 N ATOM 1731 CA GLN A 115 4.207 6.878 -5.153 1.00 0.00 C ATOM 1732 C GLN A 115 3.117 7.094 -4.108 1.00 0.00 C ATOM 1733 O GLN A 115 2.526 6.138 -3.607 1.00 0.00 O ATOM 1734 CB GLN A 115 3.576 6.494 -6.493 1.00 0.00 C ATOM 1735 CG GLN A 115 3.341 7.678 -7.417 1.00 0.00 C ATOM 1736 CD GLN A 115 1.869 7.953 -7.651 1.00 0.00 C ATOM 1737 OE1 GLN A 115 1.331 8.957 -7.183 1.00 0.00 O ATOM 1738 NE2 GLN A 115 1.208 7.059 -8.378 1.00 0.00 N ATOM 0 H GLN A 115 4.726 4.926 -4.588 1.00 0.00 H new ATOM 0 HA GLN A 115 4.760 7.810 -5.273 1.00 0.00 H new ATOM 0 HB2 GLN A 115 4.222 5.774 -6.996 1.00 0.00 H new ATOM 0 HB3 GLN A 115 2.625 5.994 -6.307 1.00 0.00 H new ATOM 0 HG2 GLN A 115 3.809 8.565 -6.990 1.00 0.00 H new ATOM 0 HG3 GLN A 115 3.828 7.489 -8.374 1.00 0.00 H new ATOM 0 HE21 GLN A 115 1.694 6.241 -8.746 1.00 0.00 H new ATOM 0 HE22 GLN A 115 0.215 7.190 -8.568 1.00 0.00 H new ATOM 1747 N PHE A 116 2.858 8.357 -3.786 1.00 0.00 N ATOM 1748 CA PHE A 116 1.838 8.699 -2.799 1.00 0.00 C ATOM 1749 C PHE A 116 0.904 9.778 -3.337 1.00 0.00 C ATOM 1750 O PHE A 116 1.240 10.963 -3.329 1.00 0.00 O ATOM 1751 CB PHE A 116 2.494 9.175 -1.502 1.00 0.00 C ATOM 1752 CG PHE A 116 3.100 8.063 -0.694 1.00 0.00 C ATOM 1753 CD1 PHE A 116 2.296 7.191 0.023 1.00 0.00 C ATOM 1754 CD2 PHE A 116 4.475 7.890 -0.652 1.00 0.00 C ATOM 1755 CE1 PHE A 116 2.852 6.168 0.767 1.00 0.00 C ATOM 1756 CE2 PHE A 116 5.036 6.869 0.091 1.00 0.00 C ATOM 1757 CZ PHE A 116 4.223 6.006 0.802 1.00 0.00 C ATOM 0 H PHE A 116 3.339 9.160 -4.193 1.00 0.00 H new ATOM 0 HA PHE A 116 1.250 7.804 -2.593 1.00 0.00 H new ATOM 0 HB2 PHE A 116 3.269 9.903 -1.742 1.00 0.00 H new ATOM 0 HB3 PHE A 116 1.749 9.690 -0.895 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.223 7.312 -0.000 1.00 0.00 H new ATOM 0 HD2 PHE A 116 5.115 8.561 -1.206 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.214 5.495 1.321 1.00 0.00 H new ATOM 0 HE2 PHE A 116 6.109 6.745 0.116 1.00 0.00 H new ATOM 0 HZ PHE A 116 4.659 5.207 1.383 1.00 0.00 H new ATOM 1767 N ALA A 117 -0.268 9.361 -3.804 1.00 0.00 N ATOM 1768 CA ALA A 117 -1.251 10.292 -4.344 1.00 0.00 C ATOM 1769 C ALA A 117 -2.612 10.102 -3.679 1.00 0.00 C ATOM 1770 O ALA A 117 -2.920 9.023 -3.173 1.00 0.00 O ATOM 1771 CB ALA A 117 -1.369 10.116 -5.851 1.00 0.00 C ATOM 0 H ALA A 117 -0.560 8.384 -3.819 1.00 0.00 H new ATOM 0 HA ALA A 117 -0.911 11.306 -4.132 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.106 10.817 -6.243 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -0.402 10.308 -6.317 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -1.683 9.096 -6.075 1.00 0.00 H new ATOM 1777 N PRO A 118 -3.448 11.155 -3.670 1.00 0.00 N ATOM 1778 CA PRO A 118 -4.781 11.099 -3.063 1.00 0.00 C ATOM 1779 C PRO A 118 -5.603 9.923 -3.579 1.00 0.00 C ATOM 1780 O PRO A 118 -5.173 9.197 -4.475 1.00 0.00 O ATOM 1781 CB PRO A 118 -5.421 12.423 -3.484 1.00 0.00 C ATOM 1782 CG PRO A 118 -4.272 13.340 -3.724 1.00 0.00 C ATOM 1783 CD PRO A 118 -3.159 12.480 -4.251 1.00 0.00 C ATOM 0 HA PRO A 118 -4.730 10.960 -1.983 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -6.026 12.302 -4.383 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -6.080 12.809 -2.706 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -4.537 14.118 -4.440 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -3.975 13.842 -2.803 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -3.156 12.449 -5.341 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -2.182 12.851 -3.940 1.00 0.00 H new ATOM 1791 N TYR A 119 -6.788 9.740 -3.006 1.00 0.00 N ATOM 1792 CA TYR A 119 -7.671 8.651 -3.409 1.00 0.00 C ATOM 1793 C TYR A 119 -8.514 9.053 -4.615 1.00 0.00 C ATOM 1794 O TYR A 119 -9.322 9.978 -4.541 1.00 0.00 O ATOM 1795 CB TYR A 119 -8.582 8.250 -2.248 1.00 0.00 C ATOM 1796 CG TYR A 119 -9.389 6.998 -2.515 1.00 0.00 C ATOM 1797 CD1 TYR A 119 -8.773 5.756 -2.594 1.00 0.00 C ATOM 1798 CD2 TYR A 119 -10.766 7.060 -2.688 1.00 0.00 C ATOM 1799 CE1 TYR A 119 -9.505 4.611 -2.838 1.00 0.00 C ATOM 1800 CE2 TYR A 119 -11.506 5.918 -2.932 1.00 0.00 C ATOM 1801 CZ TYR A 119 -10.871 4.697 -3.006 1.00 0.00 C ATOM 1802 OH TYR A 119 -11.604 3.559 -3.250 1.00 0.00 O ATOM 0 H TYR A 119 -7.159 10.331 -2.262 1.00 0.00 H new ATOM 0 HA TYR A 119 -7.052 7.798 -3.688 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -7.974 8.097 -1.356 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.264 9.072 -2.032 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -7.703 5.684 -2.462 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.266 8.015 -2.631 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -9.010 3.653 -2.897 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -12.576 5.982 -3.064 1.00 0.00 H new ATOM 0 HH TYR A 119 -11.804 3.498 -4.207 1.00 0.00 H new ATOM 1812 N THR A 120 -8.317 8.351 -5.727 1.00 0.00 N ATOM 1813 CA THR A 120 -9.058 8.635 -6.950 1.00 0.00 C ATOM 1814 C THR A 120 -10.141 7.586 -7.186 1.00 0.00 C ATOM 1815 O THR A 120 -9.871 6.510 -7.720 1.00 0.00 O ATOM 1816 CB THR A 120 -8.107 8.681 -8.147 1.00 0.00 C ATOM 1817 OG1 THR A 120 -7.529 7.409 -8.378 1.00 0.00 O ATOM 1818 CG2 THR A 120 -6.979 9.676 -7.978 1.00 0.00 C ATOM 0 H THR A 120 -7.651 7.582 -5.806 1.00 0.00 H new ATOM 0 HA THR A 120 -9.538 9.607 -6.838 1.00 0.00 H new ATOM 0 HB THR A 120 -8.721 8.994 -8.991 1.00 0.00 H new ATOM 0 HG1 THR A 120 -8.230 6.724 -8.366 1.00 0.00 H new ATOM 0 HG21 THR A 120 -6.342 9.658 -8.862 1.00 0.00 H new ATOM 0 HG22 THR A 120 -7.392 10.676 -7.849 1.00 0.00 H new ATOM 0 HG23 THR A 120 -6.389 9.412 -7.101 1.00 0.00 H new ATOM 1826 N TRP A 121 -11.367 7.908 -6.786 1.00 0.00 N ATOM 1827 CA TRP A 121 -12.491 6.994 -6.955 1.00 0.00 C ATOM 1828 C TRP A 121 -13.791 7.640 -6.487 1.00 0.00 C ATOM 1829 O TRP A 121 -14.105 7.639 -5.296 1.00 0.00 O ATOM 1830 CB TRP A 121 -12.241 5.697 -6.181 1.00 0.00 C ATOM 1831 CG TRP A 121 -12.471 4.464 -6.999 1.00 0.00 C ATOM 1832 CD1 TRP A 121 -12.193 4.296 -8.326 1.00 0.00 C ATOM 1833 CD2 TRP A 121 -13.027 3.224 -6.545 1.00 0.00 C ATOM 1834 NE1 TRP A 121 -12.542 3.029 -8.724 1.00 0.00 N ATOM 1835 CE2 TRP A 121 -13.056 2.351 -7.650 1.00 0.00 C ATOM 1836 CE3 TRP A 121 -13.503 2.767 -5.313 1.00 0.00 C ATOM 1837 CZ2 TRP A 121 -13.542 1.049 -7.557 1.00 0.00 C ATOM 1838 CZ3 TRP A 121 -13.984 1.474 -5.222 1.00 0.00 C ATOM 1839 CH2 TRP A 121 -14.000 0.628 -6.338 1.00 0.00 C ATOM 0 H TRP A 121 -11.607 8.795 -6.343 1.00 0.00 H new ATOM 0 HA TRP A 121 -12.584 6.762 -8.016 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -11.215 5.694 -5.813 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -12.893 5.672 -5.308 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -11.762 5.050 -8.968 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.436 2.653 -9.666 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -13.495 3.413 -4.447 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -13.557 0.395 -8.416 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -14.354 1.110 -4.275 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -14.382 -0.377 -6.235 1.00 0.00 H new ATOM 1850 N SER A 122 -14.546 8.191 -7.433 1.00 0.00 N ATOM 1851 CA SER A 122 -15.813 8.842 -7.119 1.00 0.00 C ATOM 1852 C SER A 122 -16.975 7.863 -7.257 1.00 0.00 C ATOM 1853 O SER A 122 -16.865 6.845 -7.940 1.00 0.00 O ATOM 1854 CB SER A 122 -16.032 10.048 -8.034 1.00 0.00 C ATOM 1855 OG SER A 122 -15.656 11.253 -7.388 1.00 0.00 O ATOM 0 H SER A 122 -14.302 8.199 -8.423 1.00 0.00 H new ATOM 0 HA SER A 122 -15.772 9.185 -6.085 1.00 0.00 H new ATOM 0 HB2 SER A 122 -15.451 9.925 -8.948 1.00 0.00 H new ATOM 0 HB3 SER A 122 -17.081 10.101 -8.327 1.00 0.00 H new ATOM 0 HG SER A 122 -15.804 12.009 -7.994 1.00 0.00 H new ATOM 1861 N TYR A 123 -18.090 8.181 -6.605 1.00 0.00 N ATOM 1862 CA TYR A 123 -19.274 7.331 -6.653 1.00 0.00 C ATOM 1863 C TYR A 123 -20.408 7.930 -5.823 1.00 0.00 C ATOM 1864 O TYR A 123 -20.163 8.605 -4.822 1.00 0.00 O ATOM 1865 CB TYR A 123 -18.940 5.924 -6.148 1.00 0.00 C ATOM 1866 CG TYR A 123 -19.319 4.824 -7.115 1.00 0.00 C ATOM 1867 CD1 TYR A 123 -19.116 4.971 -8.482 1.00 0.00 C ATOM 1868 CD2 TYR A 123 -19.881 3.638 -6.659 1.00 0.00 C ATOM 1869 CE1 TYR A 123 -19.462 3.967 -9.367 1.00 0.00 C ATOM 1870 CE2 TYR A 123 -20.230 2.629 -7.539 1.00 0.00 C ATOM 1871 CZ TYR A 123 -20.018 2.799 -8.890 1.00 0.00 C ATOM 1872 OH TYR A 123 -20.364 1.798 -9.768 1.00 0.00 O ATOM 0 H TYR A 123 -18.198 9.022 -6.037 1.00 0.00 H new ATOM 0 HA TYR A 123 -19.603 7.266 -7.690 1.00 0.00 H new ATOM 0 HB2 TYR A 123 -17.871 5.865 -5.945 1.00 0.00 H new ATOM 0 HB3 TYR A 123 -19.454 5.756 -5.201 1.00 0.00 H new ATOM 0 HD1 TYR A 123 -18.681 5.885 -8.859 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -20.048 3.502 -5.601 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -19.298 4.097 -10.426 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -20.666 1.713 -7.169 1.00 0.00 H new ATOM 0 HH TYR A 123 -20.742 1.043 -9.271 1.00 0.00 H new ATOM 1882 N PRO A 124 -21.668 7.691 -6.228 1.00 0.00 N ATOM 1883 CA PRO A 124 -22.839 8.212 -5.513 1.00 0.00 C ATOM 1884 C PRO A 124 -22.951 7.649 -4.100 1.00 0.00 C ATOM 1885 O PRO A 124 -23.515 8.287 -3.210 1.00 0.00 O ATOM 1886 CB PRO A 124 -24.023 7.750 -6.369 1.00 0.00 C ATOM 1887 CG PRO A 124 -23.502 6.602 -7.162 1.00 0.00 C ATOM 1888 CD PRO A 124 -22.050 6.898 -7.408 1.00 0.00 C ATOM 0 HA PRO A 124 -22.788 9.294 -5.387 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -24.866 7.449 -5.747 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -24.376 8.551 -7.019 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -23.623 5.665 -6.619 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -24.044 6.498 -8.102 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -21.460 5.985 -7.489 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -21.903 7.455 -8.333 1.00 0.00 H new ATOM 1896 N GLU A 125 -22.411 6.451 -3.899 1.00 0.00 N ATOM 1897 CA GLU A 125 -22.451 5.803 -2.594 1.00 0.00 C ATOM 1898 C GLU A 125 -21.057 5.739 -1.977 1.00 0.00 C ATOM 1899 O GLU A 125 -20.705 4.766 -1.311 1.00 0.00 O ATOM 1900 CB GLU A 125 -23.036 4.394 -2.719 1.00 0.00 C ATOM 1901 CG GLU A 125 -24.192 4.129 -1.768 1.00 0.00 C ATOM 1902 CD GLU A 125 -25.537 4.470 -2.377 1.00 0.00 C ATOM 1903 OE1 GLU A 125 -26.036 3.673 -3.198 1.00 0.00 O ATOM 1904 OE2 GLU A 125 -26.092 5.536 -2.033 1.00 0.00 O ATOM 0 H GLU A 125 -21.940 5.910 -4.624 1.00 0.00 H new ATOM 0 HA GLU A 125 -23.090 6.395 -1.939 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -23.376 4.240 -3.743 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -22.248 3.664 -2.532 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -24.185 3.079 -1.477 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -24.051 4.713 -0.858 1.00 0.00 H new ATOM 1911 N ILE A 126 -20.267 6.783 -2.204 1.00 0.00 N ATOM 1912 CA ILE A 126 -18.911 6.846 -1.671 1.00 0.00 C ATOM 1913 C ILE A 126 -18.908 7.348 -0.230 1.00 0.00 C ATOM 1914 O ILE A 126 -18.098 6.914 0.587 1.00 0.00 O ATOM 1915 CB ILE A 126 -18.011 7.760 -2.530 1.00 0.00 C ATOM 1916 CG1 ILE A 126 -16.561 7.688 -2.046 1.00 0.00 C ATOM 1917 CG2 ILE A 126 -18.516 9.196 -2.495 1.00 0.00 C ATOM 1918 CD1 ILE A 126 -15.796 6.508 -2.604 1.00 0.00 C ATOM 0 H ILE A 126 -20.542 7.597 -2.753 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.513 5.832 -1.697 1.00 0.00 H new ATOM 0 HB ILE A 126 -18.049 7.410 -3.562 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -16.047 8.608 -2.324 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -16.552 7.635 -0.957 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -17.868 9.824 -3.106 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.533 9.234 -2.886 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -18.509 9.559 -1.467 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -14.776 6.520 -2.219 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -16.286 5.582 -2.304 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -15.774 6.571 -3.692 1.00 0.00 H new ATOM 1930 N ASP A 127 -19.820 8.267 0.071 1.00 0.00 N ATOM 1931 CA ASP A 127 -19.924 8.830 1.412 1.00 0.00 C ATOM 1932 C ASP A 127 -20.586 7.844 2.369 1.00 0.00 C ATOM 1933 O ASP A 127 -20.275 7.814 3.559 1.00 0.00 O ATOM 1934 CB ASP A 127 -20.717 10.138 1.378 1.00 0.00 C ATOM 1935 CG ASP A 127 -20.059 11.235 2.193 1.00 0.00 C ATOM 1936 OD1 ASP A 127 -18.816 11.346 2.146 1.00 0.00 O ATOM 1937 OD2 ASP A 127 -20.788 11.982 2.879 1.00 0.00 O ATOM 0 H ASP A 127 -20.497 8.637 -0.596 1.00 0.00 H new ATOM 0 HA ASP A 127 -18.915 9.033 1.772 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -20.821 10.470 0.345 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -21.723 9.960 1.759 1.00 0.00 H new ATOM 1942 N LYS A 128 -21.502 7.038 1.840 1.00 0.00 N ATOM 1943 CA LYS A 128 -22.209 6.050 2.648 1.00 0.00 C ATOM 1944 C LYS A 128 -21.247 4.993 3.179 1.00 0.00 C ATOM 1945 O LYS A 128 -21.307 4.618 4.351 1.00 0.00 O ATOM 1946 CB LYS A 128 -23.315 5.386 1.826 1.00 0.00 C ATOM 1947 CG LYS A 128 -24.428 6.339 1.421 1.00 0.00 C ATOM 1948 CD LYS A 128 -25.801 5.730 1.657 1.00 0.00 C ATOM 1949 CE LYS A 128 -26.305 6.020 3.062 1.00 0.00 C ATOM 1950 NZ LYS A 128 -27.768 6.294 3.083 1.00 0.00 N ATOM 0 H LYS A 128 -21.772 7.050 0.856 1.00 0.00 H new ATOM 0 HA LYS A 128 -22.658 6.565 3.498 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -22.877 4.950 0.928 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -23.742 4.566 2.403 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -24.338 7.266 1.988 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -24.321 6.598 0.368 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -26.507 6.127 0.927 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -25.754 4.652 1.501 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -26.086 5.170 3.709 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -25.769 6.877 3.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -28.071 6.487 4.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -27.975 7.120 2.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -28.281 5.466 2.718 1.00 0.00 H new ATOM 1964 N ASP A 129 -20.361 4.515 2.313 1.00 0.00 N ATOM 1965 CA ASP A 129 -19.388 3.500 2.696 1.00 0.00 C ATOM 1966 C ASP A 129 -18.443 4.030 3.770 1.00 0.00 C ATOM 1967 O ASP A 129 -18.113 3.326 4.724 1.00 0.00 O ATOM 1968 CB ASP A 129 -18.588 3.042 1.474 1.00 0.00 C ATOM 1969 CG ASP A 129 -19.058 1.702 0.944 1.00 0.00 C ATOM 1970 OD1 ASP A 129 -19.515 0.870 1.756 1.00 0.00 O ATOM 1971 OD2 ASP A 129 -18.970 1.484 -0.283 1.00 0.00 O ATOM 0 H ASP A 129 -20.297 4.815 1.340 1.00 0.00 H new ATOM 0 HA ASP A 129 -19.931 2.648 3.105 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -18.672 3.791 0.686 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -17.533 2.975 1.738 1.00 0.00 H new ATOM 1976 N PHE A 130 -18.009 5.277 3.607 1.00 0.00 N ATOM 1977 CA PHE A 130 -17.102 5.903 4.562 1.00 0.00 C ATOM 1978 C PHE A 130 -17.728 5.955 5.953 1.00 0.00 C ATOM 1979 O PHE A 130 -17.028 5.868 6.963 1.00 0.00 O ATOM 1980 CB PHE A 130 -16.737 7.314 4.099 1.00 0.00 C ATOM 1981 CG PHE A 130 -15.397 7.396 3.423 1.00 0.00 C ATOM 1982 CD1 PHE A 130 -15.229 6.922 2.131 1.00 0.00 C ATOM 1983 CD2 PHE A 130 -14.309 7.946 4.079 1.00 0.00 C ATOM 1984 CE1 PHE A 130 -13.998 6.995 1.507 1.00 0.00 C ATOM 1985 CE2 PHE A 130 -13.076 8.023 3.459 1.00 0.00 C ATOM 1986 CZ PHE A 130 -12.920 7.547 2.172 1.00 0.00 C ATOM 0 H PHE A 130 -18.271 5.873 2.822 1.00 0.00 H new ATOM 0 HA PHE A 130 -16.195 5.300 4.615 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -17.504 7.672 3.412 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -16.742 7.983 4.960 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -16.069 6.491 1.607 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -14.425 8.319 5.086 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -13.879 6.621 0.501 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -12.235 8.455 3.981 1.00 0.00 H new ATOM 0 HZ PHE A 130 -11.957 7.606 1.686 1.00 0.00 H new ATOM 1996 N GLU A 131 -19.048 6.097 5.997 1.00 0.00 N ATOM 1997 CA GLU A 131 -19.768 6.160 7.264 1.00 0.00 C ATOM 1998 C GLU A 131 -19.800 4.794 7.941 1.00 0.00 C ATOM 1999 O GLU A 131 -19.528 4.675 9.135 1.00 0.00 O ATOM 2000 CB GLU A 131 -21.194 6.666 7.040 1.00 0.00 C ATOM 2001 CG GLU A 131 -21.701 7.569 8.154 1.00 0.00 C ATOM 2002 CD GLU A 131 -23.075 8.139 7.860 1.00 0.00 C ATOM 2003 OE1 GLU A 131 -23.364 8.415 6.677 1.00 0.00 O ATOM 2004 OE2 GLU A 131 -23.863 8.309 8.814 1.00 0.00 O ATOM 0 H GLU A 131 -19.641 6.171 5.171 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.242 6.856 7.918 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -21.234 7.210 6.096 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -21.863 5.811 6.944 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -21.737 7.005 9.086 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -20.996 8.387 8.303 1.00 0.00 H new ATOM 2011 N SER A 132 -20.136 3.764 7.170 1.00 0.00 N ATOM 2012 CA SER A 132 -20.203 2.407 7.696 1.00 0.00 C ATOM 2013 C SER A 132 -18.849 1.964 8.237 1.00 0.00 C ATOM 2014 O SER A 132 -18.772 1.181 9.184 1.00 0.00 O ATOM 2015 CB SER A 132 -20.672 1.439 6.607 1.00 0.00 C ATOM 2016 OG SER A 132 -22.065 1.561 6.380 1.00 0.00 O ATOM 0 H SER A 132 -20.366 3.844 6.179 1.00 0.00 H new ATOM 0 HA SER A 132 -20.921 2.398 8.516 1.00 0.00 H new ATOM 0 HB2 SER A 132 -20.131 1.638 5.682 1.00 0.00 H new ATOM 0 HB3 SER A 132 -20.437 0.416 6.900 1.00 0.00 H new ATOM 0 HG SER A 132 -22.338 0.933 5.679 1.00 0.00 H new ATOM 2022 N SER A 133 -17.780 2.471 7.631 1.00 0.00 N ATOM 2023 CA SER A 133 -16.427 2.129 8.053 1.00 0.00 C ATOM 2024 C SER A 133 -16.055 2.865 9.336 1.00 0.00 C ATOM 2025 O SER A 133 -15.627 2.252 10.314 1.00 0.00 O ATOM 2026 CB SER A 133 -15.424 2.467 6.949 1.00 0.00 C ATOM 2027 OG SER A 133 -15.698 3.738 6.382 1.00 0.00 O ATOM 0 H SER A 133 -17.825 3.120 6.846 1.00 0.00 H new ATOM 0 HA SER A 133 -16.395 1.057 8.247 1.00 0.00 H new ATOM 0 HB2 SER A 133 -14.413 2.457 7.356 1.00 0.00 H new ATOM 0 HB3 SER A 133 -15.462 1.703 6.172 1.00 0.00 H new ATOM 0 HG SER A 133 -16.186 4.287 7.030 1.00 0.00 H new ATOM 2033 N GLY A 134 -16.223 4.183 9.325 1.00 0.00 N ATOM 2034 CA GLY A 134 -15.901 4.983 10.493 1.00 0.00 C ATOM 2035 C GLY A 134 -14.716 5.899 10.259 1.00 0.00 C ATOM 2036 O GLY A 134 -13.997 6.246 11.196 1.00 0.00 O ATOM 0 H GLY A 134 -16.577 4.712 8.528 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -16.769 5.581 10.771 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -15.686 4.323 11.334 1.00 0.00 H new ATOM 2040 N LEU A 135 -14.510 6.289 9.005 1.00 0.00 N ATOM 2041 CA LEU A 135 -13.404 7.170 8.650 1.00 0.00 C ATOM 2042 C LEU A 135 -13.916 8.542 8.226 1.00 0.00 C ATOM 2043 O LEU A 135 -15.090 8.701 7.890 1.00 0.00 O ATOM 2044 CB LEU A 135 -12.573 6.552 7.523 1.00 0.00 C ATOM 2045 CG LEU A 135 -11.787 5.299 7.911 1.00 0.00 C ATOM 2046 CD1 LEU A 135 -11.220 4.620 6.674 1.00 0.00 C ATOM 2047 CD2 LEU A 135 -10.673 5.650 8.886 1.00 0.00 C ATOM 0 H LEU A 135 -15.095 6.008 8.218 1.00 0.00 H new ATOM 0 HA LEU A 135 -12.774 7.294 9.531 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -13.238 6.304 6.696 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.873 7.302 7.155 1.00 0.00 H new ATOM 0 HG LEU A 135 -12.468 4.604 8.402 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.664 3.730 6.970 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -12.036 4.334 6.010 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.553 5.308 6.154 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -10.124 4.747 9.152 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.994 6.364 8.420 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -11.102 6.091 9.786 1.00 0.00 H new ATOM 2059 N ASP A 136 -13.028 9.532 8.241 1.00 0.00 N ATOM 2060 CA ASP A 136 -13.390 10.891 7.858 1.00 0.00 C ATOM 2061 C ASP A 136 -12.594 11.344 6.640 1.00 0.00 C ATOM 2062 O ASP A 136 -11.492 10.855 6.389 1.00 0.00 O ATOM 2063 CB ASP A 136 -13.152 11.854 9.024 1.00 0.00 C ATOM 2064 CG ASP A 136 -14.237 12.906 9.136 1.00 0.00 C ATOM 2065 OD1 ASP A 136 -15.407 12.586 8.840 1.00 0.00 O ATOM 2066 OD2 ASP A 136 -13.916 14.051 9.518 1.00 0.00 O ATOM 0 H ASP A 136 -12.052 9.417 8.515 1.00 0.00 H new ATOM 0 HA ASP A 136 -14.449 10.898 7.601 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -13.101 11.288 9.954 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -12.187 12.344 8.896 1.00 0.00 H new ATOM 2071 N ARG A 137 -13.159 12.281 5.885 1.00 0.00 N ATOM 2072 CA ARG A 137 -12.501 12.803 4.693 1.00 0.00 C ATOM 2073 C ARG A 137 -12.210 14.292 4.839 1.00 0.00 C ATOM 2074 O ARG A 137 -12.180 15.029 3.853 1.00 0.00 O ATOM 2075 CB ARG A 137 -13.371 12.560 3.458 1.00 0.00 C ATOM 2076 CG ARG A 137 -13.211 11.169 2.865 1.00 0.00 C ATOM 2077 CD ARG A 137 -13.769 11.096 1.453 1.00 0.00 C ATOM 2078 NE ARG A 137 -12.712 11.128 0.444 1.00 0.00 N ATOM 2079 CZ ARG A 137 -12.937 11.256 -0.862 1.00 0.00 C ATOM 2080 NH1 ARG A 137 -14.178 11.363 -1.321 1.00 0.00 N ATOM 2081 NH2 ARG A 137 -11.919 11.275 -1.711 1.00 0.00 N ATOM 0 H ARG A 137 -14.071 12.694 6.078 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.554 12.277 4.572 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -14.417 12.714 3.724 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -13.123 13.301 2.698 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -12.156 10.896 2.855 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -13.722 10.442 3.497 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -14.351 10.181 1.340 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -14.452 11.930 1.289 1.00 0.00 H new ATOM 0 HE ARG A 137 -11.745 11.048 0.759 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -14.965 11.347 -0.672 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -14.345 11.461 -2.323 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -10.964 11.192 -1.364 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -12.091 11.373 -2.712 1.00 0.00 H new ATOM 2095 N SER A 138 -11.995 14.730 6.076 1.00 0.00 N ATOM 2096 CA SER A 138 -11.705 16.133 6.351 1.00 0.00 C ATOM 2097 C SER A 138 -10.360 16.287 7.055 1.00 0.00 C ATOM 2098 O SER A 138 -10.133 17.259 7.774 1.00 0.00 O ATOM 2099 CB SER A 138 -12.814 16.744 7.209 1.00 0.00 C ATOM 2100 OG SER A 138 -12.871 18.151 7.044 1.00 0.00 O ATOM 0 H SER A 138 -12.016 14.134 6.903 1.00 0.00 H new ATOM 0 HA SER A 138 -11.657 16.660 5.398 1.00 0.00 H new ATOM 0 HB2 SER A 138 -13.773 16.304 6.936 1.00 0.00 H new ATOM 0 HB3 SER A 138 -12.640 16.505 8.258 1.00 0.00 H new ATOM 0 HG SER A 138 -11.993 18.539 7.240 1.00 0.00 H new ATOM 2106 N LYS A 139 -9.470 15.322 6.841 1.00 0.00 N ATOM 2107 CA LYS A 139 -8.147 15.353 7.455 1.00 0.00 C ATOM 2108 C LYS A 139 -7.055 15.360 6.390 1.00 0.00 C ATOM 2109 O LYS A 139 -6.334 16.345 6.232 1.00 0.00 O ATOM 2110 CB LYS A 139 -7.963 14.151 8.384 1.00 0.00 C ATOM 2111 CG LYS A 139 -8.918 14.146 9.567 1.00 0.00 C ATOM 2112 CD LYS A 139 -8.237 13.646 10.831 1.00 0.00 C ATOM 2113 CE LYS A 139 -9.230 13.477 11.969 1.00 0.00 C ATOM 2114 NZ LYS A 139 -8.719 12.555 13.020 1.00 0.00 N ATOM 0 H LYS A 139 -9.641 14.510 6.248 1.00 0.00 H new ATOM 0 HA LYS A 139 -8.066 16.269 8.040 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -8.103 13.234 7.811 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -6.938 14.142 8.755 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -9.299 15.154 9.732 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -9.776 13.513 9.340 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -7.748 12.693 10.629 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -7.458 14.348 11.128 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -9.443 14.450 12.412 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -10.171 13.093 11.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -9.426 12.467 13.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -8.539 11.619 12.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -7.834 12.934 13.414 1.00 0.00 H new ATOM 2128 N ASN A 140 -6.940 14.254 5.660 1.00 0.00 N ATOM 2129 CA ASN A 140 -5.938 14.133 4.609 1.00 0.00 C ATOM 2130 C ASN A 140 -4.529 14.268 5.179 1.00 0.00 C ATOM 2131 O ASN A 140 -4.138 15.339 5.642 1.00 0.00 O ATOM 2132 CB ASN A 140 -6.168 15.193 3.530 1.00 0.00 C ATOM 2133 CG ASN A 140 -7.528 15.060 2.872 1.00 0.00 C ATOM 2134 OD1 ASN A 140 -7.713 13.992 2.106 1.00 0.00 O flip ATOM 2135 ND2 ASN A 140 -8.401 15.910 3.049 1.00 0.00 N flip ATOM 0 H ASN A 140 -7.529 13.430 5.778 1.00 0.00 H new ATOM 0 HA ASN A 140 -6.036 13.143 4.163 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -6.077 16.185 3.973 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -5.390 15.110 2.771 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -8.215 16.715 3.646 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -9.310 15.809 2.598 1.00 0.00 H new ATOM 2142 N ASN A 141 -3.773 13.176 5.141 1.00 0.00 N ATOM 2143 CA ASN A 141 -2.408 13.174 5.653 1.00 0.00 C ATOM 2144 C ASN A 141 -1.521 12.242 4.831 1.00 0.00 C ATOM 2145 O ASN A 141 -0.866 11.351 5.372 1.00 0.00 O ATOM 2146 CB ASN A 141 -2.394 12.750 7.124 1.00 0.00 C ATOM 2147 CG ASN A 141 -2.514 13.931 8.066 1.00 0.00 C ATOM 2148 OD1 ASN A 141 -3.612 14.289 8.495 1.00 0.00 O ATOM 2149 ND2 ASN A 141 -1.384 14.545 8.394 1.00 0.00 N ATOM 0 H ASN A 141 -4.082 12.281 4.761 1.00 0.00 H new ATOM 0 HA ASN A 141 -2.012 14.186 5.572 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -3.215 12.057 7.308 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -1.470 12.212 7.336 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -1.404 15.347 9.025 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -0.496 14.215 8.016 1.00 0.00 H new ATOM 2156 N TRP A 142 -1.505 12.456 3.519 1.00 0.00 N ATOM 2157 CA TRP A 142 -0.700 11.636 2.620 1.00 0.00 C ATOM 2158 C TRP A 142 0.602 12.344 2.261 1.00 0.00 C ATOM 2159 O TRP A 142 1.140 12.158 1.169 1.00 0.00 O ATOM 2160 CB TRP A 142 -1.486 11.310 1.349 1.00 0.00 C ATOM 2161 CG TRP A 142 -2.185 12.496 0.759 1.00 0.00 C ATOM 2162 CD1 TRP A 142 -3.429 12.959 1.082 1.00 0.00 C ATOM 2163 CD2 TRP A 142 -1.682 13.371 -0.259 1.00 0.00 C ATOM 2164 NE1 TRP A 142 -3.730 14.068 0.328 1.00 0.00 N ATOM 2165 CE2 TRP A 142 -2.673 14.340 -0.502 1.00 0.00 C ATOM 2166 CE3 TRP A 142 -0.491 13.428 -0.987 1.00 0.00 C ATOM 2167 CZ2 TRP A 142 -2.508 15.354 -1.442 1.00 0.00 C ATOM 2168 CZ3 TRP A 142 -0.328 14.435 -1.920 1.00 0.00 C ATOM 2169 CH2 TRP A 142 -1.332 15.387 -2.140 1.00 0.00 C ATOM 0 H TRP A 142 -2.040 13.190 3.055 1.00 0.00 H new ATOM 0 HA TRP A 142 -0.458 10.706 3.135 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -0.805 10.893 0.607 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -2.223 10.539 1.574 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -4.081 12.518 1.822 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -4.598 14.602 0.378 1.00 0.00 H new ATOM 0 HE3 TRP A 142 0.288 12.698 -0.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 -3.281 16.088 -1.614 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 0.589 14.489 -2.489 1.00 0.00 H new ATOM 0 HH2 TRP A 142 -1.174 16.162 -2.875 1.00 0.00 H new ATOM 2180 N ASN A 143 1.106 13.155 3.185 1.00 0.00 N ATOM 2181 CA ASN A 143 2.345 13.891 2.965 1.00 0.00 C ATOM 2182 C ASN A 143 3.401 13.497 3.994 1.00 0.00 C ATOM 2183 O ASN A 143 4.576 13.337 3.664 1.00 0.00 O ATOM 2184 CB ASN A 143 2.088 15.397 3.029 1.00 0.00 C ATOM 2185 CG ASN A 143 1.919 16.013 1.655 1.00 0.00 C ATOM 2186 OD1 ASN A 143 2.453 15.511 0.666 1.00 0.00 O ATOM 2187 ND2 ASN A 143 1.172 17.110 1.585 1.00 0.00 N ATOM 0 H ASN A 143 0.675 13.319 4.095 1.00 0.00 H new ATOM 0 HA ASN A 143 2.718 13.637 1.973 1.00 0.00 H new ATOM 0 HB2 ASN A 143 1.192 15.585 3.621 1.00 0.00 H new ATOM 0 HB3 ASN A 143 2.918 15.883 3.543 1.00 0.00 H new ATOM 0 HD21 ASN A 143 1.023 17.569 0.686 1.00 0.00 H new ATOM 0 HD22 ASN A 143 0.748 17.493 2.430 1.00 0.00 H new ATOM 2194 N ASP A 144 2.973 13.342 5.243 1.00 0.00 N ATOM 2195 CA ASP A 144 3.882 12.967 6.321 1.00 0.00 C ATOM 2196 C ASP A 144 4.158 11.468 6.301 1.00 0.00 C ATOM 2197 O ASP A 144 3.234 10.656 6.260 1.00 0.00 O ATOM 2198 CB ASP A 144 3.296 13.372 7.674 1.00 0.00 C ATOM 2199 CG ASP A 144 3.583 14.820 8.019 1.00 0.00 C ATOM 2200 OD1 ASP A 144 3.177 15.707 7.239 1.00 0.00 O ATOM 2201 OD2 ASP A 144 4.215 15.067 9.067 1.00 0.00 O ATOM 0 H ASP A 144 2.004 13.470 5.534 1.00 0.00 H new ATOM 0 HA ASP A 144 4.824 13.494 6.169 1.00 0.00 H new ATOM 0 HB2 ASP A 144 2.218 13.211 7.663 1.00 0.00 H new ATOM 0 HB3 ASP A 144 3.706 12.728 8.452 1.00 0.00 H new ATOM 2206 N VAL A 145 5.437 11.106 6.331 1.00 0.00 N ATOM 2207 CA VAL A 145 5.835 9.705 6.317 1.00 0.00 C ATOM 2208 C VAL A 145 7.050 9.469 7.208 1.00 0.00 C ATOM 2209 O VAL A 145 7.602 10.407 7.782 1.00 0.00 O ATOM 2210 CB VAL A 145 6.160 9.226 4.890 1.00 0.00 C ATOM 2211 CG1 VAL A 145 4.892 9.138 4.054 1.00 0.00 C ATOM 2212 CG2 VAL A 145 7.176 10.151 4.236 1.00 0.00 C ATOM 0 H VAL A 145 6.215 11.765 6.365 1.00 0.00 H new ATOM 0 HA VAL A 145 4.989 9.134 6.700 1.00 0.00 H new ATOM 0 HB VAL A 145 6.596 8.229 4.951 1.00 0.00 H new ATOM 0 HG11 VAL A 145 5.142 8.798 3.049 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.201 8.432 4.515 1.00 0.00 H new ATOM 0 HG13 VAL A 145 4.424 10.121 3.999 1.00 0.00 H new ATOM 0 HG21 VAL A 145 7.394 9.798 3.228 1.00 0.00 H new ATOM 0 HG22 VAL A 145 6.769 11.161 4.186 1.00 0.00 H new ATOM 0 HG23 VAL A 145 8.093 10.158 4.824 1.00 0.00 H new ATOM 2222 N ASP A 146 7.461 8.210 7.319 1.00 0.00 N ATOM 2223 CA ASP A 146 8.612 7.851 8.140 1.00 0.00 C ATOM 2224 C ASP A 146 9.641 7.074 7.325 1.00 0.00 C ATOM 2225 O ASP A 146 9.388 5.946 6.902 1.00 0.00 O ATOM 2226 CB ASP A 146 8.165 7.019 9.343 1.00 0.00 C ATOM 2227 CG ASP A 146 9.088 7.183 10.535 1.00 0.00 C ATOM 2228 OD1 ASP A 146 9.123 8.291 11.110 1.00 0.00 O ATOM 2229 OD2 ASP A 146 9.777 6.204 10.892 1.00 0.00 O ATOM 0 H ASP A 146 7.014 7.421 6.851 1.00 0.00 H new ATOM 0 HA ASP A 146 9.076 8.772 8.494 1.00 0.00 H new ATOM 0 HB2 ASP A 146 7.154 7.310 9.627 1.00 0.00 H new ATOM 0 HB3 ASP A 146 8.126 5.967 9.059 1.00 0.00 H new ATOM 2234 N ASP A 147 10.801 7.686 7.108 1.00 0.00 N ATOM 2235 CA ASP A 147 11.868 7.052 6.343 1.00 0.00 C ATOM 2236 C ASP A 147 12.520 5.931 7.146 1.00 0.00 C ATOM 2237 O ASP A 147 12.348 5.843 8.362 1.00 0.00 O ATOM 2238 CB ASP A 147 12.919 8.086 5.941 1.00 0.00 C ATOM 2239 CG ASP A 147 13.522 8.795 7.137 1.00 0.00 C ATOM 2240 OD1 ASP A 147 12.769 9.473 7.868 1.00 0.00 O ATOM 2241 OD2 ASP A 147 14.748 8.673 7.346 1.00 0.00 O ATOM 0 H ASP A 147 11.026 8.620 7.451 1.00 0.00 H new ATOM 0 HA ASP A 147 11.430 6.622 5.442 1.00 0.00 H new ATOM 0 HB2 ASP A 147 13.711 7.594 5.377 1.00 0.00 H new ATOM 0 HB3 ASP A 147 12.465 8.822 5.277 1.00 0.00 H new ATOM 2246 N PHE A 148 13.271 5.077 6.458 1.00 0.00 N ATOM 2247 CA PHE A 148 13.950 3.962 7.107 1.00 0.00 C ATOM 2248 C PHE A 148 15.044 3.392 6.207 1.00 0.00 C ATOM 2249 O PHE A 148 15.276 2.184 6.185 1.00 0.00 O ATOM 2250 CB PHE A 148 12.945 2.866 7.466 1.00 0.00 C ATOM 2251 CG PHE A 148 12.363 3.014 8.843 1.00 0.00 C ATOM 2252 CD1 PHE A 148 13.143 2.795 9.967 1.00 0.00 C ATOM 2253 CD2 PHE A 148 11.035 3.373 9.012 1.00 0.00 C ATOM 2254 CE1 PHE A 148 12.609 2.930 11.234 1.00 0.00 C ATOM 2255 CE2 PHE A 148 10.496 3.510 10.277 1.00 0.00 C ATOM 2256 CZ PHE A 148 11.284 3.289 11.390 1.00 0.00 C ATOM 0 H PHE A 148 13.425 5.136 5.451 1.00 0.00 H new ATOM 0 HA PHE A 148 14.414 4.333 8.021 1.00 0.00 H new ATOM 0 HB2 PHE A 148 12.136 2.873 6.736 1.00 0.00 H new ATOM 0 HB3 PHE A 148 13.435 1.895 7.390 1.00 0.00 H new ATOM 0 HD1 PHE A 148 14.180 2.516 9.851 1.00 0.00 H new ATOM 0 HD2 PHE A 148 10.415 3.548 8.145 1.00 0.00 H new ATOM 0 HE1 PHE A 148 13.227 2.755 12.102 1.00 0.00 H new ATOM 0 HE2 PHE A 148 9.460 3.790 10.395 1.00 0.00 H new ATOM 0 HZ PHE A 148 10.865 3.397 12.380 1.00 0.00 H new ATOM 2266 N ASN A 149 15.712 4.272 5.468 1.00 0.00 N ATOM 2267 CA ASN A 149 16.781 3.858 4.568 1.00 0.00 C ATOM 2268 C ASN A 149 17.694 5.032 4.230 1.00 0.00 C ATOM 2269 O ASN A 149 18.918 4.906 4.253 1.00 0.00 O ATOM 2270 CB ASN A 149 16.196 3.265 3.285 1.00 0.00 C ATOM 2271 CG ASN A 149 17.051 2.149 2.720 1.00 0.00 C ATOM 2272 OD1 ASN A 149 18.185 1.940 3.152 1.00 0.00 O ATOM 2273 ND2 ASN A 149 16.511 1.423 1.747 1.00 0.00 N ATOM 0 H ASN A 149 15.532 5.276 5.475 1.00 0.00 H new ATOM 0 HA ASN A 149 17.373 3.096 5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 149 15.195 2.884 3.488 1.00 0.00 H new ATOM 0 HB3 ASN A 149 16.092 4.053 2.539 1.00 0.00 H new ATOM 0 HD21 ASN A 149 17.040 0.658 1.328 1.00 0.00 H new ATOM 0 HD22 ASN A 149 15.568 1.631 1.419 1.00 0.00 H new ATOM 2280 N TRP A 150 17.088 6.173 3.914 1.00 0.00 N ATOM 2281 CA TRP A 150 17.845 7.371 3.571 1.00 0.00 C ATOM 2282 C TRP A 150 17.621 8.471 4.603 1.00 0.00 C ATOM 2283 O TRP A 150 16.490 8.726 5.018 1.00 0.00 O ATOM 2284 CB TRP A 150 17.446 7.870 2.181 1.00 0.00 C ATOM 2285 CG TRP A 150 18.380 8.904 1.631 1.00 0.00 C ATOM 2286 CD1 TRP A 150 18.067 10.182 1.267 1.00 0.00 C ATOM 2287 CD2 TRP A 150 19.782 8.747 1.379 1.00 0.00 C ATOM 2288 NE1 TRP A 150 19.187 10.829 0.804 1.00 0.00 N ATOM 2289 CE2 TRP A 150 20.253 9.969 0.863 1.00 0.00 C ATOM 2290 CE3 TRP A 150 20.683 7.691 1.540 1.00 0.00 C ATOM 2291 CZ2 TRP A 150 21.585 10.163 0.508 1.00 0.00 C ATOM 2292 CZ3 TRP A 150 22.006 7.885 1.187 1.00 0.00 C ATOM 2293 CH2 TRP A 150 22.446 9.112 0.678 1.00 0.00 C ATOM 0 H TRP A 150 16.075 6.292 3.889 1.00 0.00 H new ATOM 0 HA TRP A 150 18.904 7.113 3.567 1.00 0.00 H new ATOM 0 HB2 TRP A 150 17.409 7.023 1.496 1.00 0.00 H new ATOM 0 HB3 TRP A 150 16.440 8.287 2.227 1.00 0.00 H new ATOM 0 HD1 TRP A 150 17.082 10.621 1.333 1.00 0.00 H new ATOM 0 HE1 TRP A 150 19.220 11.792 0.471 1.00 0.00 H new ATOM 0 HE3 TRP A 150 20.352 6.741 1.933 1.00 0.00 H new ATOM 0 HZ2 TRP A 150 21.927 11.108 0.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 150 22.711 7.076 1.306 1.00 0.00 H new ATOM 0 HH2 TRP A 150 23.486 9.232 0.414 1.00 0.00 H new ATOM 2304 N LEU A 151 18.705 9.120 5.015 1.00 0.00 N ATOM 2305 CA LEU A 151 18.626 10.193 5.999 1.00 0.00 C ATOM 2306 C LEU A 151 18.264 11.518 5.332 1.00 0.00 C ATOM 2307 O LEU A 151 18.413 11.675 4.120 1.00 0.00 O ATOM 2308 CB LEU A 151 19.956 10.329 6.745 1.00 0.00 C ATOM 2309 CG LEU A 151 20.036 9.567 8.068 1.00 0.00 C ATOM 2310 CD1 LEU A 151 21.448 9.620 8.629 1.00 0.00 C ATOM 2311 CD2 LEU A 151 19.040 10.133 9.068 1.00 0.00 C ATOM 0 H LEU A 151 19.649 8.921 4.683 1.00 0.00 H new ATOM 0 HA LEU A 151 17.842 9.941 6.713 1.00 0.00 H new ATOM 0 HB2 LEU A 151 20.758 9.981 6.094 1.00 0.00 H new ATOM 0 HB3 LEU A 151 20.140 11.386 6.940 1.00 0.00 H new ATOM 0 HG LEU A 151 19.781 8.524 7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 151 21.486 9.072 9.571 1.00 0.00 H new ATOM 0 HD12 LEU A 151 22.139 9.168 7.918 1.00 0.00 H new ATOM 0 HD13 LEU A 151 21.732 10.658 8.801 1.00 0.00 H new ATOM 0 HD21 LEU A 151 19.110 9.579 10.004 1.00 0.00 H new ATOM 0 HD22 LEU A 151 19.265 11.184 9.250 1.00 0.00 H new ATOM 0 HD23 LEU A 151 18.030 10.042 8.667 1.00 0.00 H new ATOM 2323 N ALA A 152 17.789 12.466 6.132 1.00 0.00 N ATOM 2324 CA ALA A 152 17.406 13.776 5.619 1.00 0.00 C ATOM 2325 C ALA A 152 18.068 14.893 6.418 1.00 0.00 C ATOM 2326 O ALA A 152 17.752 15.105 7.590 1.00 0.00 O ATOM 2327 CB ALA A 152 15.893 13.931 5.646 1.00 0.00 C ATOM 0 H ALA A 152 17.660 12.352 7.137 1.00 0.00 H new ATOM 0 HA ALA A 152 17.750 13.850 4.587 1.00 0.00 H new ATOM 0 HB1 ALA A 152 15.621 14.914 5.260 1.00 0.00 H new ATOM 0 HB2 ALA A 152 15.437 13.159 5.026 1.00 0.00 H new ATOM 0 HB3 ALA A 152 15.535 13.832 6.671 1.00 0.00 H new ATOM 2333 N ARG A 153 18.988 15.607 5.777 1.00 0.00 N ATOM 2334 CA ARG A 153 19.695 16.703 6.429 1.00 0.00 C ATOM 2335 C ARG A 153 19.693 17.949 5.550 1.00 0.00 C ATOM 2336 O ARG A 153 19.275 19.025 5.980 1.00 0.00 O ATOM 2337 CB ARG A 153 21.133 16.292 6.747 1.00 0.00 C ATOM 2338 CG ARG A 153 21.233 15.061 7.635 1.00 0.00 C ATOM 2339 CD ARG A 153 21.580 15.430 9.069 1.00 0.00 C ATOM 2340 NE ARG A 153 20.606 14.900 10.021 1.00 0.00 N ATOM 2341 CZ ARG A 153 20.842 14.763 11.323 1.00 0.00 C ATOM 2342 NH1 ARG A 153 22.016 15.116 11.834 1.00 0.00 N ATOM 2343 NH2 ARG A 153 19.902 14.273 12.119 1.00 0.00 N ATOM 0 H ARG A 153 19.261 15.446 4.807 1.00 0.00 H new ATOM 0 HA ARG A 153 19.177 16.935 7.359 1.00 0.00 H new ATOM 0 HB2 ARG A 153 21.662 16.100 5.813 1.00 0.00 H new ATOM 0 HB3 ARG A 153 21.640 17.124 7.235 1.00 0.00 H new ATOM 0 HG2 ARG A 153 20.286 14.521 7.617 1.00 0.00 H new ATOM 0 HG3 ARG A 153 21.992 14.387 7.239 1.00 0.00 H new ATOM 0 HD2 ARG A 153 22.571 15.047 9.313 1.00 0.00 H new ATOM 0 HD3 ARG A 153 21.626 16.515 9.163 1.00 0.00 H new ATOM 0 HE ARG A 153 19.692 14.619 9.666 1.00 0.00 H new ATOM 0 HH11 ARG A 153 22.743 15.495 11.227 1.00 0.00 H new ATOM 0 HH12 ARG A 153 22.190 15.008 12.833 1.00 0.00 H new ATOM 0 HH21 ARG A 153 18.998 14.001 11.733 1.00 0.00 H new ATOM 0 HH22 ARG A 153 20.083 14.168 13.117 1.00 0.00 H new ATOM 2357 N ASP A 154 20.161 17.798 4.315 1.00 0.00 N ATOM 2358 CA ASP A 154 20.213 18.911 3.374 1.00 0.00 C ATOM 2359 C ASP A 154 19.577 18.528 2.042 1.00 0.00 C ATOM 2360 O ASP A 154 18.787 19.286 1.479 1.00 0.00 O ATOM 2361 CB ASP A 154 21.662 19.352 3.154 1.00 0.00 C ATOM 2362 CG ASP A 154 21.761 20.611 2.315 1.00 0.00 C ATOM 2363 OD1 ASP A 154 21.073 21.601 2.645 1.00 0.00 O ATOM 2364 OD2 ASP A 154 22.526 20.607 1.328 1.00 0.00 O ATOM 0 H ASP A 154 20.510 16.915 3.942 1.00 0.00 H new ATOM 0 HA ASP A 154 19.648 19.741 3.799 1.00 0.00 H new ATOM 0 HB2 ASP A 154 22.137 19.524 4.120 1.00 0.00 H new ATOM 0 HB3 ASP A 154 22.213 18.549 2.666 1.00 0.00 H new ATOM 2369 N MET A 155 19.928 17.347 1.542 1.00 0.00 N ATOM 2370 CA MET A 155 19.391 16.864 0.275 1.00 0.00 C ATOM 2371 C MET A 155 17.962 16.358 0.448 1.00 0.00 C ATOM 2372 O MET A 155 17.502 16.138 1.568 1.00 0.00 O ATOM 2373 CB MET A 155 20.279 15.750 -0.286 1.00 0.00 C ATOM 2374 CG MET A 155 20.580 15.903 -1.768 1.00 0.00 C ATOM 2375 SD MET A 155 19.517 14.878 -2.802 1.00 0.00 S ATOM 2376 CE MET A 155 18.847 16.106 -3.920 1.00 0.00 C ATOM 0 H MET A 155 20.581 16.708 1.995 1.00 0.00 H new ATOM 0 HA MET A 155 19.378 17.696 -0.429 1.00 0.00 H new ATOM 0 HB2 MET A 155 21.218 15.731 0.267 1.00 0.00 H new ATOM 0 HB3 MET A 155 19.792 14.789 -0.120 1.00 0.00 H new ATOM 0 HG2 MET A 155 20.459 16.948 -2.053 1.00 0.00 H new ATOM 0 HG3 MET A 155 21.622 15.641 -1.952 1.00 0.00 H new ATOM 0 HE1 MET A 155 17.942 15.717 -4.388 1.00 0.00 H new ATOM 0 HE2 MET A 155 18.607 17.012 -3.364 1.00 0.00 H new ATOM 0 HE3 MET A 155 19.583 16.337 -4.690 1.00 0.00 H new ATOM 2386 N ALA A 156 17.266 16.177 -0.669 1.00 0.00 N ATOM 2387 CA ALA A 156 15.889 15.698 -0.642 1.00 0.00 C ATOM 2388 C ALA A 156 15.833 14.199 -0.369 1.00 0.00 C ATOM 2389 O ALA A 156 16.858 13.564 -0.118 1.00 0.00 O ATOM 2390 CB ALA A 156 15.192 16.024 -1.955 1.00 0.00 C ATOM 0 H ALA A 156 17.633 16.355 -1.604 1.00 0.00 H new ATOM 0 HA ALA A 156 15.369 16.207 0.170 1.00 0.00 H new ATOM 0 HB1 ALA A 156 14.165 15.661 -1.922 1.00 0.00 H new ATOM 0 HB2 ALA A 156 15.191 17.103 -2.108 1.00 0.00 H new ATOM 0 HB3 ALA A 156 15.721 15.542 -2.777 1.00 0.00 H new ATOM 2396 N SER A 157 14.629 13.639 -0.421 1.00 0.00 N ATOM 2397 CA SER A 157 14.437 12.213 -0.178 1.00 0.00 C ATOM 2398 C SER A 157 13.784 11.539 -1.384 1.00 0.00 C ATOM 2399 O SER A 157 12.559 11.520 -1.506 1.00 0.00 O ATOM 2400 CB SER A 157 13.574 11.999 1.068 1.00 0.00 C ATOM 2401 OG SER A 157 13.654 10.658 1.520 1.00 0.00 O ATOM 0 H SER A 157 13.771 14.150 -0.629 1.00 0.00 H new ATOM 0 HA SER A 157 15.416 11.762 -0.017 1.00 0.00 H new ATOM 0 HB2 SER A 157 13.900 12.673 1.860 1.00 0.00 H new ATOM 0 HB3 SER A 157 12.537 12.249 0.843 1.00 0.00 H new ATOM 0 HG SER A 157 13.095 10.548 2.318 1.00 0.00 H new ATOM 2407 N PRO A 158 14.597 10.974 -2.295 1.00 0.00 N ATOM 2408 CA PRO A 158 14.090 10.299 -3.494 1.00 0.00 C ATOM 2409 C PRO A 158 13.419 8.963 -3.180 1.00 0.00 C ATOM 2410 O PRO A 158 12.828 8.335 -4.058 1.00 0.00 O ATOM 2411 CB PRO A 158 15.348 10.078 -4.334 1.00 0.00 C ATOM 2412 CG PRO A 158 16.457 10.015 -3.342 1.00 0.00 C ATOM 2413 CD PRO A 158 16.071 10.951 -2.230 1.00 0.00 C ATOM 0 HA PRO A 158 13.321 10.888 -3.993 1.00 0.00 H new ATOM 0 HB2 PRO A 158 15.281 9.157 -4.913 1.00 0.00 H new ATOM 0 HB3 PRO A 158 15.498 10.891 -5.045 1.00 0.00 H new ATOM 0 HG2 PRO A 158 16.590 8.999 -2.969 1.00 0.00 H new ATOM 0 HG3 PRO A 158 17.403 10.315 -3.794 1.00 0.00 H new ATOM 0 HD2 PRO A 158 16.425 10.593 -1.263 1.00 0.00 H new ATOM 0 HD3 PRO A 158 16.495 11.945 -2.376 1.00 0.00 H new ATOM 2421 N ASN A 159 13.513 8.530 -1.924 1.00 0.00 N ATOM 2422 CA ASN A 159 12.914 7.267 -1.502 1.00 0.00 C ATOM 2423 C ASN A 159 11.436 7.205 -1.883 1.00 0.00 C ATOM 2424 O ASN A 159 10.897 6.129 -2.141 1.00 0.00 O ATOM 2425 CB ASN A 159 13.070 7.084 0.008 1.00 0.00 C ATOM 2426 CG ASN A 159 14.510 6.843 0.416 1.00 0.00 C ATOM 2427 OD1 ASN A 159 15.352 7.736 0.318 1.00 0.00 O ATOM 2428 ND2 ASN A 159 14.802 5.632 0.874 1.00 0.00 N ATOM 0 H ASN A 159 13.998 9.035 -1.182 1.00 0.00 H new ATOM 0 HA ASN A 159 13.435 6.460 -2.016 1.00 0.00 H new ATOM 0 HB2 ASN A 159 12.694 7.970 0.519 1.00 0.00 H new ATOM 0 HB3 ASN A 159 12.457 6.244 0.334 1.00 0.00 H new ATOM 0 HD21 ASN A 159 15.756 5.412 1.161 1.00 0.00 H new ATOM 0 HD22 ASN A 159 14.073 4.922 0.939 1.00 0.00 H new ATOM 2435 N TRP A 160 10.789 8.365 -1.915 1.00 0.00 N ATOM 2436 CA TRP A 160 9.375 8.440 -2.264 1.00 0.00 C ATOM 2437 C TRP A 160 9.056 9.760 -2.959 1.00 0.00 C ATOM 2438 O TRP A 160 9.401 10.834 -2.465 1.00 0.00 O ATOM 2439 CB TRP A 160 8.510 8.289 -1.010 1.00 0.00 C ATOM 2440 CG TRP A 160 8.707 9.390 -0.014 1.00 0.00 C ATOM 2441 CD1 TRP A 160 9.765 9.550 0.833 1.00 0.00 C ATOM 2442 CD2 TRP A 160 7.819 10.484 0.241 1.00 0.00 C ATOM 2443 NE1 TRP A 160 9.590 10.678 1.598 1.00 0.00 N ATOM 2444 CE2 TRP A 160 8.403 11.268 1.254 1.00 0.00 C ATOM 2445 CE3 TRP A 160 6.586 10.877 -0.289 1.00 0.00 C ATOM 2446 CZ2 TRP A 160 7.796 12.421 1.745 1.00 0.00 C ATOM 2447 CZ3 TRP A 160 5.985 12.022 0.200 1.00 0.00 C ATOM 2448 CH2 TRP A 160 6.591 12.782 1.208 1.00 0.00 C ATOM 0 H TRP A 160 11.220 9.265 -1.704 1.00 0.00 H new ATOM 0 HA TRP A 160 9.152 7.624 -2.952 1.00 0.00 H new ATOM 0 HB2 TRP A 160 7.461 8.258 -1.303 1.00 0.00 H new ATOM 0 HB3 TRP A 160 8.736 7.335 -0.535 1.00 0.00 H new ATOM 0 HD1 TRP A 160 10.615 8.887 0.893 1.00 0.00 H new ATOM 0 HE1 TRP A 160 10.239 11.020 2.307 1.00 0.00 H new ATOM 0 HE3 TRP A 160 6.112 10.296 -1.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 8.260 13.009 2.522 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 5.033 12.335 -0.202 1.00 0.00 H new ATOM 0 HH2 TRP A 160 6.097 13.672 1.569 1.00 0.00 H new ATOM 2459 N SER A 161 8.395 9.672 -4.110 1.00 0.00 N ATOM 2460 CA SER A 161 8.029 10.859 -4.874 1.00 0.00 C ATOM 2461 C SER A 161 6.529 10.891 -5.143 1.00 0.00 C ATOM 2462 O SER A 161 5.907 9.854 -5.374 1.00 0.00 O ATOM 2463 CB SER A 161 8.797 10.897 -6.196 1.00 0.00 C ATOM 2464 OG SER A 161 10.002 10.157 -6.107 1.00 0.00 O ATOM 0 H SER A 161 8.102 8.791 -4.533 1.00 0.00 H new ATOM 0 HA SER A 161 8.293 11.736 -4.283 1.00 0.00 H new ATOM 0 HB2 SER A 161 8.175 10.490 -6.993 1.00 0.00 H new ATOM 0 HB3 SER A 161 9.020 11.930 -6.461 1.00 0.00 H new ATOM 0 HG SER A 161 10.474 10.195 -6.965 1.00 0.00 H new ATOM 2470 N ILE A 162 5.952 12.088 -5.114 1.00 0.00 N ATOM 2471 CA ILE A 162 4.524 12.255 -5.356 1.00 0.00 C ATOM 2472 C ILE A 162 4.244 12.524 -6.831 1.00 0.00 C ATOM 2473 O ILE A 162 4.963 13.284 -7.480 1.00 0.00 O ATOM 2474 CB ILE A 162 3.943 13.409 -4.517 1.00 0.00 C ATOM 2475 CG1 ILE A 162 4.384 13.280 -3.057 1.00 0.00 C ATOM 2476 CG2 ILE A 162 2.425 13.426 -4.619 1.00 0.00 C ATOM 2477 CD1 ILE A 162 4.004 14.472 -2.205 1.00 0.00 C ATOM 0 H ILE A 162 6.452 12.957 -4.925 1.00 0.00 H new ATOM 0 HA ILE A 162 4.043 11.323 -5.061 1.00 0.00 H new ATOM 0 HB ILE A 162 4.324 14.352 -4.909 1.00 0.00 H new ATOM 0 HG12 ILE A 162 3.940 12.381 -2.629 1.00 0.00 H new ATOM 0 HG13 ILE A 162 5.465 13.148 -3.022 1.00 0.00 H new ATOM 0 HG21 ILE A 162 2.029 14.247 -4.021 1.00 0.00 H new ATOM 0 HG22 ILE A 162 2.132 13.561 -5.660 1.00 0.00 H new ATOM 0 HG23 ILE A 162 2.025 12.482 -4.249 1.00 0.00 H new ATOM 0 HD11 ILE A 162 4.347 14.313 -1.183 1.00 0.00 H new ATOM 0 HD12 ILE A 162 4.470 15.371 -2.609 1.00 0.00 H new ATOM 0 HD13 ILE A 162 2.921 14.592 -2.209 1.00 0.00 H new ATOM 2489 N LEU A 163 3.197 11.896 -7.353 1.00 0.00 N ATOM 2490 CA LEU A 163 2.823 12.068 -8.752 1.00 0.00 C ATOM 2491 C LEU A 163 2.129 13.412 -8.969 1.00 0.00 C ATOM 2492 O LEU A 163 1.256 13.799 -8.191 1.00 0.00 O ATOM 2493 CB LEU A 163 1.904 10.929 -9.198 1.00 0.00 C ATOM 2494 CG LEU A 163 1.519 10.949 -10.679 1.00 0.00 C ATOM 2495 CD1 LEU A 163 2.485 10.102 -11.492 1.00 0.00 C ATOM 2496 CD2 LEU A 163 0.090 10.460 -10.865 1.00 0.00 C ATOM 0 H LEU A 163 2.592 11.263 -6.829 1.00 0.00 H new ATOM 0 HA LEU A 163 3.733 12.048 -9.351 1.00 0.00 H new ATOM 0 HB2 LEU A 163 2.394 9.980 -8.978 1.00 0.00 H new ATOM 0 HB3 LEU A 163 0.993 10.963 -8.601 1.00 0.00 H new ATOM 0 HG LEU A 163 1.579 11.977 -11.037 1.00 0.00 H new ATOM 0 HD11 LEU A 163 2.196 10.128 -12.543 1.00 0.00 H new ATOM 0 HD12 LEU A 163 3.495 10.497 -11.384 1.00 0.00 H new ATOM 0 HD13 LEU A 163 2.457 9.073 -11.133 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -0.167 10.481 -11.924 1.00 0.00 H new ATOM 0 HD22 LEU A 163 0.003 9.440 -10.491 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -0.591 11.108 -10.314 1.00 0.00 H new ATOM 2508 N PRO A 164 2.506 14.146 -10.032 1.00 0.00 N ATOM 2509 CA PRO A 164 1.909 15.451 -10.340 1.00 0.00 C ATOM 2510 C PRO A 164 0.387 15.386 -10.413 1.00 0.00 C ATOM 2511 O PRO A 164 -0.206 14.316 -10.277 1.00 0.00 O ATOM 2512 CB PRO A 164 2.495 15.799 -11.711 1.00 0.00 C ATOM 2513 CG PRO A 164 3.771 15.037 -11.783 1.00 0.00 C ATOM 2514 CD PRO A 164 3.538 13.767 -11.016 1.00 0.00 C ATOM 0 HA PRO A 164 2.128 16.191 -9.570 1.00 0.00 H new ATOM 0 HB2 PRO A 164 1.817 15.513 -12.515 1.00 0.00 H new ATOM 0 HB3 PRO A 164 2.668 16.871 -11.807 1.00 0.00 H new ATOM 0 HG2 PRO A 164 4.041 14.824 -12.817 1.00 0.00 H new ATOM 0 HG3 PRO A 164 4.592 15.609 -11.351 1.00 0.00 H new ATOM 0 HD2 PRO A 164 3.197 12.962 -11.666 1.00 0.00 H new ATOM 0 HD3 PRO A 164 4.449 13.419 -10.529 1.00 0.00 H new ATOM 2522 N GLU A 165 -0.240 16.538 -10.629 1.00 0.00 N ATOM 2523 CA GLU A 165 -1.693 16.611 -10.721 1.00 0.00 C ATOM 2524 C GLU A 165 -2.148 16.626 -12.177 1.00 0.00 C ATOM 2525 O GLU A 165 -3.194 17.185 -12.505 1.00 0.00 O ATOM 2526 CB GLU A 165 -2.208 17.860 -10.002 1.00 0.00 C ATOM 2527 CG GLU A 165 -2.293 17.702 -8.493 1.00 0.00 C ATOM 2528 CD GLU A 165 -0.956 17.906 -7.809 1.00 0.00 C ATOM 2529 OE1 GLU A 165 -0.583 19.075 -7.571 1.00 0.00 O ATOM 2530 OE2 GLU A 165 -0.281 16.899 -7.511 1.00 0.00 O ATOM 0 H GLU A 165 0.236 17.433 -10.743 1.00 0.00 H new ATOM 0 HA GLU A 165 -2.106 15.725 -10.240 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -1.552 18.699 -10.235 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -3.196 18.110 -10.389 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -3.013 18.418 -8.096 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -2.670 16.707 -8.256 1.00 0.00 H new ATOM 2537 N GLU A 166 -1.356 16.008 -13.047 1.00 0.00 N ATOM 2538 CA GLU A 166 -1.678 15.950 -14.468 1.00 0.00 C ATOM 2539 C GLU A 166 -1.921 14.512 -14.916 1.00 0.00 C ATOM 2540 O GLU A 166 -2.769 14.252 -15.768 1.00 0.00 O ATOM 2541 CB GLU A 166 -0.549 16.570 -15.293 1.00 0.00 C ATOM 2542 CG GLU A 166 -0.427 18.075 -15.123 1.00 0.00 C ATOM 2543 CD GLU A 166 1.014 18.532 -14.993 1.00 0.00 C ATOM 2544 OE1 GLU A 166 1.516 18.592 -13.852 1.00 0.00 O ATOM 2545 OE2 GLU A 166 1.637 18.832 -16.033 1.00 0.00 O ATOM 0 H GLU A 166 -0.486 15.540 -12.793 1.00 0.00 H new ATOM 0 HA GLU A 166 -2.593 16.519 -14.630 1.00 0.00 H new ATOM 0 HB2 GLU A 166 0.395 16.103 -15.011 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -0.714 16.344 -16.346 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -0.886 18.572 -15.977 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -0.983 18.383 -14.238 1.00 0.00 H new ATOM 2552 N GLU A 167 -1.169 13.581 -14.336 1.00 0.00 N ATOM 2553 CA GLU A 167 -1.304 12.170 -14.676 1.00 0.00 C ATOM 2554 C GLU A 167 -2.191 11.448 -13.667 1.00 0.00 C ATOM 2555 O GLU A 167 -1.958 10.283 -13.343 1.00 0.00 O ATOM 2556 CB GLU A 167 0.073 11.504 -14.730 1.00 0.00 C ATOM 2557 CG GLU A 167 0.900 11.913 -15.936 1.00 0.00 C ATOM 2558 CD GLU A 167 1.862 10.828 -16.378 1.00 0.00 C ATOM 2559 OE1 GLU A 167 2.933 10.691 -15.750 1.00 0.00 O ATOM 2560 OE2 GLU A 167 1.545 10.115 -17.353 1.00 0.00 O ATOM 0 H GLU A 167 -0.461 13.779 -13.629 1.00 0.00 H new ATOM 0 HA GLU A 167 -1.773 12.102 -15.658 1.00 0.00 H new ATOM 0 HB2 GLU A 167 0.623 11.752 -13.822 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -0.056 10.422 -14.739 1.00 0.00 H new ATOM 0 HG2 GLU A 167 0.233 12.161 -16.762 1.00 0.00 H new ATOM 0 HG3 GLU A 167 1.462 12.816 -15.697 1.00 0.00 H new ATOM 2567 N ARG A 168 -3.210 12.147 -13.175 1.00 0.00 N ATOM 2568 CA ARG A 168 -4.133 11.570 -12.204 1.00 0.00 C ATOM 2569 C ARG A 168 -5.298 10.881 -12.906 1.00 0.00 C ATOM 2570 O ARG A 168 -5.847 9.901 -12.401 1.00 0.00 O ATOM 2571 CB ARG A 168 -4.657 12.655 -11.261 1.00 0.00 C ATOM 2572 CG ARG A 168 -3.568 13.332 -10.447 1.00 0.00 C ATOM 2573 CD ARG A 168 -4.036 13.634 -9.031 1.00 0.00 C ATOM 2574 NE ARG A 168 -5.295 14.374 -9.018 1.00 0.00 N ATOM 2575 CZ ARG A 168 -5.823 14.918 -7.924 1.00 0.00 C ATOM 2576 NH1 ARG A 168 -5.205 14.806 -6.754 1.00 0.00 N ATOM 2577 NH2 ARG A 168 -6.972 15.575 -7.998 1.00 0.00 N ATOM 0 H ARG A 168 -3.417 13.112 -13.433 1.00 0.00 H new ATOM 0 HA ARG A 168 -3.592 10.824 -11.622 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -5.184 13.409 -11.846 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -5.385 12.213 -10.581 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -2.687 12.691 -10.411 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -3.268 14.258 -10.937 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -4.159 12.700 -8.483 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -3.271 14.211 -8.511 1.00 0.00 H new ATOM 0 HE ARG A 168 -5.799 14.480 -9.898 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -4.321 14.301 -6.690 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -5.614 15.225 -5.919 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -7.452 15.664 -8.894 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -7.376 15.992 -7.159 1.00 0.00 H new ATOM 2591 N ASN A 169 -5.671 11.400 -14.071 1.00 0.00 N ATOM 2592 CA ASN A 169 -6.772 10.834 -14.842 1.00 0.00 C ATOM 2593 C ASN A 169 -6.388 9.476 -15.422 1.00 0.00 C ATOM 2594 O ASN A 169 -5.747 9.397 -16.469 1.00 0.00 O ATOM 2595 CB ASN A 169 -7.176 11.787 -15.968 1.00 0.00 C ATOM 2596 CG ASN A 169 -8.574 11.513 -16.485 1.00 0.00 C ATOM 2597 OD1 ASN A 169 -9.564 11.913 -15.872 1.00 0.00 O ATOM 2598 ND2 ASN A 169 -8.663 10.828 -17.619 1.00 0.00 N ATOM 0 H ASN A 169 -5.227 12.211 -14.502 1.00 0.00 H new ATOM 0 HA ASN A 169 -7.620 10.696 -14.171 1.00 0.00 H new ATOM 0 HB2 ASN A 169 -7.120 12.814 -15.608 1.00 0.00 H new ATOM 0 HB3 ASN A 169 -6.464 11.697 -16.789 1.00 0.00 H new ATOM 0 HD21 ASN A 169 -9.578 10.614 -18.015 1.00 0.00 H new ATOM 0 HD22 ASN A 169 -7.816 10.516 -18.094 1.00 0.00 H new ATOM 2605 N ILE A 170 -6.786 8.411 -14.733 1.00 0.00 N ATOM 2606 CA ILE A 170 -6.483 7.057 -15.180 1.00 0.00 C ATOM 2607 C ILE A 170 -7.758 6.233 -15.336 1.00 0.00 C ATOM 2608 O ILE A 170 -8.486 6.009 -14.370 1.00 0.00 O ATOM 2609 CB ILE A 170 -5.537 6.338 -14.198 1.00 0.00 C ATOM 2610 CG1 ILE A 170 -4.317 7.211 -13.897 1.00 0.00 C ATOM 2611 CG2 ILE A 170 -5.106 4.993 -14.764 1.00 0.00 C ATOM 2612 CD1 ILE A 170 -3.923 7.215 -12.435 1.00 0.00 C ATOM 0 H ILE A 170 -7.318 8.460 -13.864 1.00 0.00 H new ATOM 0 HA ILE A 170 -5.989 7.146 -16.148 1.00 0.00 H new ATOM 0 HB ILE A 170 -6.073 6.162 -13.265 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -3.473 6.860 -14.491 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -4.525 8.234 -14.212 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -4.438 4.498 -14.058 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -5.985 4.370 -14.930 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -4.586 5.146 -15.709 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -3.051 7.854 -12.295 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -4.751 7.594 -11.836 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -3.683 6.199 -12.120 1.00 0.00 H new ATOM 2624 N GLN A 171 -8.021 5.786 -16.560 1.00 0.00 N ATOM 2625 CA GLN A 171 -9.208 4.987 -16.843 1.00 0.00 C ATOM 2626 C GLN A 171 -9.057 3.575 -16.287 1.00 0.00 C ATOM 2627 O GLN A 171 -8.329 2.752 -16.842 1.00 0.00 O ATOM 2628 CB GLN A 171 -9.464 4.933 -18.351 1.00 0.00 C ATOM 2629 CG GLN A 171 -10.901 5.245 -18.735 1.00 0.00 C ATOM 2630 CD GLN A 171 -11.157 5.078 -20.220 1.00 0.00 C ATOM 2631 OE1 GLN A 171 -12.132 4.445 -20.626 1.00 0.00 O ATOM 2632 NE2 GLN A 171 -10.280 5.645 -21.040 1.00 0.00 N ATOM 0 H GLN A 171 -7.429 5.963 -17.371 1.00 0.00 H new ATOM 0 HA GLN A 171 -10.060 5.460 -16.355 1.00 0.00 H new ATOM 0 HB2 GLN A 171 -8.802 5.641 -18.849 1.00 0.00 H new ATOM 0 HB3 GLN A 171 -9.205 3.940 -18.720 1.00 0.00 H new ATOM 0 HG2 GLN A 171 -11.572 4.591 -18.179 1.00 0.00 H new ATOM 0 HG3 GLN A 171 -11.138 6.268 -18.442 1.00 0.00 H new ATOM 0 HE21 GLN A 171 -9.486 6.161 -20.660 1.00 0.00 H new ATOM 0 HE22 GLN A 171 -10.400 5.565 -22.050 1.00 0.00 H new ATOM 2641 N TRP A 172 -9.752 3.299 -15.188 1.00 0.00 N ATOM 2642 CA TRP A 172 -9.696 1.986 -14.557 1.00 0.00 C ATOM 2643 C TRP A 172 -10.392 0.938 -15.420 1.00 0.00 C ATOM 2644 O TRP A 172 -9.871 -0.158 -15.625 1.00 0.00 O ATOM 2645 CB TRP A 172 -10.343 2.034 -13.172 1.00 0.00 C ATOM 2646 CG TRP A 172 -9.508 2.743 -12.150 1.00 0.00 C ATOM 2647 CD1 TRP A 172 -9.590 4.059 -11.794 1.00 0.00 C ATOM 2648 CD2 TRP A 172 -8.462 2.176 -11.353 1.00 0.00 C ATOM 2649 NE1 TRP A 172 -8.661 4.345 -10.825 1.00 0.00 N ATOM 2650 CE2 TRP A 172 -7.956 3.206 -10.536 1.00 0.00 C ATOM 2651 CE3 TRP A 172 -7.905 0.899 -11.249 1.00 0.00 C ATOM 2652 CZ2 TRP A 172 -6.921 2.995 -9.629 1.00 0.00 C ATOM 2653 CZ3 TRP A 172 -6.878 0.691 -10.348 1.00 0.00 C ATOM 2654 CH2 TRP A 172 -6.395 1.735 -9.548 1.00 0.00 C ATOM 0 H TRP A 172 -10.361 3.968 -14.716 1.00 0.00 H new ATOM 0 HA TRP A 172 -8.648 1.706 -14.451 1.00 0.00 H new ATOM 0 HB2 TRP A 172 -11.310 2.531 -13.248 1.00 0.00 H new ATOM 0 HB3 TRP A 172 -10.533 1.016 -12.832 1.00 0.00 H new ATOM 0 HD1 TRP A 172 -10.285 4.771 -12.214 1.00 0.00 H new ATOM 0 HE1 TRP A 172 -8.519 5.257 -10.391 1.00 0.00 H new ATOM 0 HE3 TRP A 172 -8.271 0.089 -11.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 172 -6.547 3.798 -9.011 1.00 0.00 H new ATOM 0 HZ3 TRP A 172 -6.441 -0.292 -10.259 1.00 0.00 H new ATOM 0 HH2 TRP A 172 -5.591 1.541 -8.853 1.00 0.00 H new ATOM 2665 N ASP A 173 -11.574 1.282 -15.922 1.00 0.00 N ATOM 2666 CA ASP A 173 -12.342 0.372 -16.763 1.00 0.00 C ATOM 2667 C ASP A 173 -11.582 0.040 -18.042 1.00 0.00 C ATOM 2668 O ASP A 173 -10.886 0.888 -18.601 1.00 0.00 O ATOM 2669 CB ASP A 173 -13.700 0.985 -17.107 1.00 0.00 C ATOM 2670 CG ASP A 173 -14.759 -0.067 -17.373 1.00 0.00 C ATOM 2671 OD1 ASP A 173 -14.598 -0.838 -18.343 1.00 0.00 O ATOM 2672 OD2 ASP A 173 -15.747 -0.121 -16.613 1.00 0.00 O ATOM 0 H ASP A 173 -12.020 2.185 -15.761 1.00 0.00 H new ATOM 0 HA ASP A 173 -12.499 -0.552 -16.206 1.00 0.00 H new ATOM 0 HB2 ASP A 173 -14.025 1.624 -16.286 1.00 0.00 H new ATOM 0 HB3 ASP A 173 -13.596 1.622 -17.985 1.00 0.00 H new ATOM 2677 N SER A 174 -11.720 -1.200 -18.502 1.00 0.00 N ATOM 2678 CA SER A 174 -11.047 -1.644 -19.717 1.00 0.00 C ATOM 2679 C SER A 174 -11.684 -2.920 -20.256 1.00 0.00 C ATOM 2680 O SER A 174 -11.552 -3.991 -19.663 1.00 0.00 O ATOM 2681 CB SER A 174 -9.560 -1.877 -19.445 1.00 0.00 C ATOM 2682 OG SER A 174 -8.802 -0.711 -19.718 1.00 0.00 O ATOM 0 H SER A 174 -12.292 -1.915 -18.051 1.00 0.00 H new ATOM 0 HA SER A 174 -11.153 -0.862 -20.468 1.00 0.00 H new ATOM 0 HB2 SER A 174 -9.419 -2.171 -18.405 1.00 0.00 H new ATOM 0 HB3 SER A 174 -9.199 -2.701 -20.060 1.00 0.00 H new ATOM 0 HG SER A 174 -9.293 0.078 -19.407 1.00 0.00 H new ATOM 2688 N GLY A 175 -12.377 -2.799 -21.384 1.00 0.00 N ATOM 2689 CA GLY A 175 -13.025 -3.951 -21.984 1.00 0.00 C ATOM 2690 C GLY A 175 -14.509 -4.011 -21.665 1.00 0.00 C ATOM 2691 O GLY A 175 -14.887 -4.161 -20.504 1.00 0.00 O ATOM 0 H GLY A 175 -12.501 -1.924 -21.893 1.00 0.00 H new ATOM 0 HA2 GLY A 175 -12.889 -3.919 -23.065 1.00 0.00 H new ATOM 0 HA3 GLY A 175 -12.543 -4.862 -21.629 1.00 0.00 H new ATOM 2695 N PRO A 176 -15.385 -3.896 -22.682 1.00 0.00 N ATOM 2696 CA PRO A 176 -16.836 -3.942 -22.479 1.00 0.00 C ATOM 2697 C PRO A 176 -17.271 -5.157 -21.666 1.00 0.00 C ATOM 2698 O PRO A 176 -16.816 -6.274 -21.908 1.00 0.00 O ATOM 2699 CB PRO A 176 -17.393 -4.025 -23.902 1.00 0.00 C ATOM 2700 CG PRO A 176 -16.348 -3.389 -24.752 1.00 0.00 C ATOM 2701 CD PRO A 176 -15.031 -3.714 -24.103 1.00 0.00 C ATOM 0 HA PRO A 176 -17.194 -3.080 -21.916 1.00 0.00 H new ATOM 0 HB2 PRO A 176 -17.570 -5.059 -24.199 1.00 0.00 H new ATOM 0 HB3 PRO A 176 -18.345 -3.501 -23.986 1.00 0.00 H new ATOM 0 HG2 PRO A 176 -16.386 -3.774 -25.771 1.00 0.00 H new ATOM 0 HG3 PRO A 176 -16.497 -2.311 -24.813 1.00 0.00 H new ATOM 0 HD2 PRO A 176 -14.587 -4.616 -24.525 1.00 0.00 H new ATOM 0 HD3 PRO A 176 -14.308 -2.910 -24.237 1.00 0.00 H new ATOM 2709 N SER A 177 -18.154 -4.930 -20.699 1.00 0.00 N ATOM 2710 CA SER A 177 -18.652 -6.006 -19.850 1.00 0.00 C ATOM 2711 C SER A 177 -19.972 -5.616 -19.194 1.00 0.00 C ATOM 2712 O SER A 177 -20.925 -6.394 -19.185 1.00 0.00 O ATOM 2713 CB SER A 177 -17.618 -6.354 -18.776 1.00 0.00 C ATOM 2714 OG SER A 177 -17.790 -7.683 -18.316 1.00 0.00 O ATOM 0 H SER A 177 -18.539 -4.010 -20.484 1.00 0.00 H new ATOM 0 HA SER A 177 -18.825 -6.881 -20.477 1.00 0.00 H new ATOM 0 HB2 SER A 177 -16.613 -6.233 -19.181 1.00 0.00 H new ATOM 0 HB3 SER A 177 -17.710 -5.661 -17.940 1.00 0.00 H new ATOM 0 HG SER A 177 -17.117 -7.882 -17.632 1.00 0.00 H new ATOM 2720 N SER A 178 -20.019 -4.405 -18.646 1.00 0.00 N ATOM 2721 CA SER A 178 -21.223 -3.911 -17.987 1.00 0.00 C ATOM 2722 C SER A 178 -21.124 -2.412 -17.726 1.00 0.00 C ATOM 2723 O SER A 178 -20.716 -1.985 -16.646 1.00 0.00 O ATOM 2724 CB SER A 178 -21.452 -4.656 -16.670 1.00 0.00 C ATOM 2725 OG SER A 178 -20.409 -4.390 -15.747 1.00 0.00 O ATOM 0 H SER A 178 -19.238 -3.749 -18.645 1.00 0.00 H new ATOM 0 HA SER A 178 -22.069 -4.091 -18.650 1.00 0.00 H new ATOM 0 HB2 SER A 178 -22.408 -4.356 -16.240 1.00 0.00 H new ATOM 0 HB3 SER A 178 -21.510 -5.728 -16.860 1.00 0.00 H new ATOM 0 HG SER A 178 -20.291 -3.421 -15.657 1.00 0.00 H new ATOM 2731 N GLY A 179 -21.500 -1.617 -18.723 1.00 0.00 N ATOM 2732 CA GLY A 179 -21.446 -0.174 -18.581 1.00 0.00 C ATOM 2733 C GLY A 179 -20.916 0.511 -19.825 1.00 0.00 C ATOM 2734 O GLY A 179 -19.859 0.082 -20.336 1.00 0.00 O ATOM 2735 OXT GLY A 179 -21.558 1.477 -20.290 1.00 0.00 O ATOM 0 H GLY A 179 -21.841 -1.946 -19.626 1.00 0.00 H new ATOM 0 HA2 GLY A 179 -22.444 0.204 -18.359 1.00 0.00 H new ATOM 0 HA3 GLY A 179 -20.812 0.081 -17.732 1.00 0.00 H new TER 2739 GLY A 179