USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1127 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 92 GLN : amide:sc= 1.23 K(o=1.9,f=-0.37) USER MOD Set 1.2: A 133 HIS : no HD1:sc= 0.634 K(o=1.9,f=-2) USER MOD Set 2.1: A 66 GLN : amide:sc= 0.167 K(o=0.47,f=-0.044) USER MOD Set 2.2: A 70 GLN : amide:sc= 0.304 K(o=0.47,f=-0.044) USER MOD Set 3.1: A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 17 SER OG : rot 98:sc= 0.496 USER MOD Set 4.1: A 15 GLN : amide:sc= -0.141 X(o=-0.15,f=-0.57) USER MOD Set 4.2: A 62 HIS : no HD1:sc=-0.00985 X(o=-0.15,f=-0.57) USER MOD Single : A 1 SER N :NH3+ 173:sc= 1.43 (180deg=1.36) USER MOD Single : A 1 SER OG : rot -160:sc= 0 USER MOD Single : A 3 GLN : amide:sc=-3.43e-05 K(o=-3.4e-05,f=-0.53) USER MOD Single : A 5 THR OG1 : rot -73:sc= 0.994 USER MOD Single : A 6 THR OG1 : rot 79:sc= 0.156 USER MOD Single : A 9 ASN : amide:sc= 0.967 K(o=0.97,f=-5.2!) USER MOD Single : A 10 THR OG1 : rot -69:sc= 1.29 USER MOD Single : A 14 SER OG : rot 180:sc= 0.271 USER MOD Single : A 19 SER OG : rot 95:sc= 1.31 USER MOD Single : A 20 SER OG : rot 80:sc= 0.567 USER MOD Single : A 22 SER OG : rot -37:sc= 1.21 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc=-0.00794 X(o=-0.0079,f=-0.084) USER MOD Single : A 29 TYR OH : rot 180:sc= 0.0615 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl -161:sc= 0 (180deg=-0.00699) USER MOD Single : A 40 LYS NZ :NH3+ -124:sc= 0.453 (180deg=0) USER MOD Single : A 42 TYR OH : rot -165:sc= -0.116 USER MOD Single : A 43 MET CE :methyl -144:sc= -0.191 (180deg=-1.28) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.356! C(o=-0.36!,f=-10!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 166:sc= 1.26 (180deg=1.15) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl -116:sc= -0.443 (180deg=-0.618) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= -0.068 X(o=-0.068,f=-0.14) USER MOD Single : A 68 LYS NZ :NH3+ -169:sc= 1.28 (180deg=1.22) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.103 X(o=-0.1,f=-0.28) USER MOD Single : A 76 GLN : amide:sc= 0.568 K(o=0.57,f=-2.6!) USER MOD Single : A 78 SER OG : rot 127:sc= 1.18 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.148 K(o=-0.15,f=-1.4) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 75:sc= 1.17 USER MOD Single : A 107 ASN : amide:sc= -0.0571 K(o=-0.057,f=-1.6!) USER MOD Single : A 110 LYS NZ :NH3+ -172:sc= 1.05 (180deg=0.982) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 116 SER OG : rot 180:sc= -0.0692 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= 0.498 K(o=0.5,f=-0.2) USER MOD Single : A 121 ASN : amide:sc= -0.0251 K(o=-0.025,f=-1.7!) USER MOD Single : A 126 SER OG : rot -173:sc= 1.29 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.633 -2.837 0.825 1.00 0.00 N ATOM 2 CA SER A 1 3.326 -2.329 -0.353 1.00 0.00 C ATOM 3 C SER A 1 3.558 -0.827 -0.250 1.00 0.00 C ATOM 4 O SER A 1 3.503 -0.111 -1.250 1.00 0.00 O ATOM 5 CB SER A 1 2.529 -2.643 -1.603 1.00 0.00 C ATOM 6 OG SER A 1 1.270 -2.028 -1.564 1.00 0.00 O ATOM 0 H1 SER A 1 2.383 -3.836 0.677 1.00 0.00 H new ATOM 0 H2 SER A 1 3.254 -2.755 1.655 1.00 0.00 H new ATOM 0 H3 SER A 1 1.767 -2.283 0.984 1.00 0.00 H new ATOM 0 HA SER A 1 4.297 -2.821 -0.411 1.00 0.00 H new ATOM 0 HB2 SER A 1 3.076 -2.304 -2.482 1.00 0.00 H new ATOM 0 HB3 SER A 1 2.408 -3.722 -1.700 1.00 0.00 H new ATOM 0 HG SER A 1 0.667 -2.478 -2.191 1.00 0.00 H new ATOM 14 N GLU A 2 3.818 -0.355 0.964 1.00 0.00 N ATOM 15 CA GLU A 2 4.029 1.068 1.204 1.00 0.00 C ATOM 16 C GLU A 2 5.336 1.543 0.581 1.00 0.00 C ATOM 17 O GLU A 2 5.505 2.730 0.301 1.00 0.00 O ATOM 18 CB GLU A 2 4.033 1.361 2.706 1.00 0.00 C ATOM 19 CG GLU A 2 5.117 0.630 3.486 1.00 0.00 C ATOM 20 CD GLU A 2 4.755 -0.796 3.795 1.00 0.00 C ATOM 21 OE1 GLU A 2 3.995 -1.370 3.052 1.00 0.00 O ATOM 22 OE2 GLU A 2 5.239 -1.312 4.774 1.00 0.00 O ATOM 0 H GLU A 2 3.888 -0.938 1.798 1.00 0.00 H new ATOM 0 HA GLU A 2 3.208 1.610 0.736 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.156 2.434 2.854 1.00 0.00 H new ATOM 0 HB3 GLU A 2 3.061 1.092 3.119 1.00 0.00 H new ATOM 0 HG2 GLU A 2 6.044 0.648 2.913 1.00 0.00 H new ATOM 0 HG3 GLU A 2 5.308 1.161 4.418 1.00 0.00 H new ATOM 29 N GLN A 3 6.257 0.610 0.367 1.00 0.00 N ATOM 30 CA GLN A 3 7.513 0.915 -0.308 1.00 0.00 C ATOM 31 C GLN A 3 7.279 1.294 -1.764 1.00 0.00 C ATOM 32 O GLN A 3 7.859 2.258 -2.266 1.00 0.00 O ATOM 33 CB GLN A 3 8.469 -0.279 -0.226 1.00 0.00 C ATOM 34 CG GLN A 3 9.004 -0.553 1.170 1.00 0.00 C ATOM 35 CD GLN A 3 9.797 -1.844 1.242 1.00 0.00 C ATOM 36 OE1 GLN A 3 9.422 -2.854 0.639 1.00 0.00 O ATOM 37 NE2 GLN A 3 10.900 -1.819 1.981 1.00 0.00 N ATOM 0 H GLN A 3 6.157 -0.364 0.651 1.00 0.00 H new ATOM 0 HA GLN A 3 7.964 1.768 0.199 1.00 0.00 H new ATOM 0 HB2 GLN A 3 7.953 -1.169 -0.586 1.00 0.00 H new ATOM 0 HB3 GLN A 3 9.310 -0.104 -0.897 1.00 0.00 H new ATOM 0 HG2 GLN A 3 9.637 0.277 1.483 1.00 0.00 H new ATOM 0 HG3 GLN A 3 8.172 -0.601 1.872 1.00 0.00 H new ATOM 0 HE21 GLN A 3 11.172 -0.962 2.462 1.00 0.00 H new ATOM 0 HE22 GLN A 3 11.475 -2.657 2.067 1.00 0.00 H new ATOM 46 N PHE A 4 6.426 0.532 -2.439 1.00 0.00 N ATOM 47 CA PHE A 4 6.004 0.868 -3.794 1.00 0.00 C ATOM 48 C PHE A 4 5.182 2.150 -3.812 1.00 0.00 C ATOM 49 O PHE A 4 5.420 3.039 -4.630 1.00 0.00 O ATOM 50 CB PHE A 4 5.187 -0.276 -4.398 1.00 0.00 C ATOM 51 CG PHE A 4 4.637 0.027 -5.763 1.00 0.00 C ATOM 52 CD1 PHE A 4 5.485 0.178 -6.850 1.00 0.00 C ATOM 53 CD2 PHE A 4 3.272 0.164 -5.962 1.00 0.00 C ATOM 54 CE1 PHE A 4 4.979 0.458 -8.106 1.00 0.00 C ATOM 55 CE2 PHE A 4 2.764 0.442 -7.216 1.00 0.00 C ATOM 56 CZ PHE A 4 3.619 0.589 -8.289 1.00 0.00 C ATOM 0 H PHE A 4 6.012 -0.324 -2.069 1.00 0.00 H new ATOM 0 HA PHE A 4 6.902 1.024 -4.392 1.00 0.00 H new ATOM 0 HB2 PHE A 4 5.814 -1.166 -4.458 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.361 -0.513 -3.728 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.552 0.076 -6.714 1.00 0.00 H new ATOM 0 HD2 PHE A 4 2.597 0.052 -5.126 1.00 0.00 H new ATOM 0 HE1 PHE A 4 5.650 0.574 -8.944 1.00 0.00 H new ATOM 0 HE2 PHE A 4 1.698 0.544 -7.357 1.00 0.00 H new ATOM 0 HZ PHE A 4 3.224 0.806 -9.270 1.00 0.00 H new ATOM 66 N THR A 5 4.215 2.240 -2.906 1.00 0.00 N ATOM 67 CA THR A 5 3.328 3.396 -2.844 1.00 0.00 C ATOM 68 C THR A 5 4.118 4.698 -2.872 1.00 0.00 C ATOM 69 O THR A 5 3.797 5.614 -3.629 1.00 0.00 O ATOM 70 CB THR A 5 2.448 3.352 -1.581 1.00 0.00 C ATOM 71 OG1 THR A 5 1.665 2.151 -1.583 1.00 0.00 O ATOM 72 CG2 THR A 5 1.521 4.557 -1.535 1.00 0.00 C ATOM 0 H THR A 5 4.025 1.525 -2.203 1.00 0.00 H new ATOM 0 HA THR A 5 2.685 3.357 -3.723 1.00 0.00 H new ATOM 0 HB THR A 5 3.095 3.371 -0.704 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.953 2.226 -2.252 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.907 4.509 -0.636 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.114 5.472 -1.521 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.877 4.555 -2.415 1.00 0.00 H new ATOM 80 N THR A 6 5.153 4.774 -2.042 1.00 0.00 N ATOM 81 CA THR A 6 6.002 5.958 -1.983 1.00 0.00 C ATOM 82 C THR A 6 6.737 6.174 -3.299 1.00 0.00 C ATOM 83 O THR A 6 6.794 7.292 -3.813 1.00 0.00 O ATOM 84 CB THR A 6 7.021 5.853 -0.833 1.00 0.00 C ATOM 85 OG1 THR A 6 6.326 5.761 0.418 1.00 0.00 O ATOM 86 CG2 THR A 6 7.932 7.070 -0.814 1.00 0.00 C ATOM 0 H THR A 6 5.424 4.029 -1.400 1.00 0.00 H new ATOM 0 HA THR A 6 5.351 6.813 -1.800 1.00 0.00 H new ATOM 0 HB THR A 6 7.628 4.961 -0.986 1.00 0.00 H new ATOM 0 HG1 THR A 6 6.006 4.844 0.548 1.00 0.00 H new ATOM 0 HG21 THR A 6 8.645 6.978 0.005 1.00 0.00 H new ATOM 0 HG22 THR A 6 8.471 7.136 -1.759 1.00 0.00 H new ATOM 0 HG23 THR A 6 7.334 7.970 -0.675 1.00 0.00 H new ATOM 94 N LYS A 7 7.299 5.099 -3.841 1.00 0.00 N ATOM 95 CA LYS A 7 8.077 5.179 -5.072 1.00 0.00 C ATOM 96 C LYS A 7 7.201 5.583 -6.251 1.00 0.00 C ATOM 97 O LYS A 7 7.637 6.320 -7.136 1.00 0.00 O ATOM 98 CB LYS A 7 8.763 3.843 -5.360 1.00 0.00 C ATOM 99 CG LYS A 7 9.720 3.869 -6.544 1.00 0.00 C ATOM 100 CD LYS A 7 10.902 4.789 -6.279 1.00 0.00 C ATOM 101 CE LYS A 7 11.899 4.756 -7.428 1.00 0.00 C ATOM 102 NZ LYS A 7 13.045 5.676 -7.197 1.00 0.00 N ATOM 0 H LYS A 7 7.230 4.161 -3.447 1.00 0.00 H new ATOM 0 HA LYS A 7 8.840 5.946 -4.935 1.00 0.00 H new ATOM 0 HB2 LYS A 7 9.312 3.532 -4.471 1.00 0.00 H new ATOM 0 HB3 LYS A 7 7.998 3.088 -5.543 1.00 0.00 H new ATOM 0 HG2 LYS A 7 10.080 2.860 -6.746 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.190 4.203 -7.436 1.00 0.00 H new ATOM 0 HD2 LYS A 7 10.546 5.809 -6.133 1.00 0.00 H new ATOM 0 HD3 LYS A 7 11.398 4.490 -5.356 1.00 0.00 H new ATOM 0 HE2 LYS A 7 12.270 3.739 -7.557 1.00 0.00 H new ATOM 0 HE3 LYS A 7 11.394 5.031 -8.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 13.700 5.623 -8.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 12.694 6.650 -7.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 13.543 5.399 -6.327 1.00 0.00 H new ATOM 116 N LEU A 8 5.965 5.096 -6.258 1.00 0.00 N ATOM 117 CA LEU A 8 5.001 5.468 -7.287 1.00 0.00 C ATOM 118 C LEU A 8 4.646 6.946 -7.202 1.00 0.00 C ATOM 119 O LEU A 8 4.670 7.659 -8.205 1.00 0.00 O ATOM 120 CB LEU A 8 3.729 4.621 -7.151 1.00 0.00 C ATOM 121 CG LEU A 8 2.606 4.944 -8.146 1.00 0.00 C ATOM 122 CD1 LEU A 8 3.105 4.718 -9.567 1.00 0.00 C ATOM 123 CD2 LEU A 8 1.396 4.072 -7.846 1.00 0.00 C ATOM 0 H LEU A 8 5.607 4.442 -5.562 1.00 0.00 H new ATOM 0 HA LEU A 8 5.459 5.281 -8.258 1.00 0.00 H new ATOM 0 HB2 LEU A 8 4.000 3.571 -7.265 1.00 0.00 H new ATOM 0 HB3 LEU A 8 3.340 4.742 -6.140 1.00 0.00 H new ATOM 0 HG LEU A 8 2.310 5.988 -8.048 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.307 4.947 -10.274 1.00 0.00 H new ATOM 0 HD12 LEU A 8 3.959 5.367 -9.760 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.406 3.677 -9.686 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.598 4.301 -8.552 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.672 3.022 -7.939 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.049 4.267 -6.831 1.00 0.00 H new ATOM 135 N ASN A 9 4.318 7.402 -5.998 1.00 0.00 N ATOM 136 CA ASN A 9 3.959 8.798 -5.778 1.00 0.00 C ATOM 137 C ASN A 9 5.103 9.728 -6.161 1.00 0.00 C ATOM 138 O ASN A 9 4.880 10.834 -6.652 1.00 0.00 O ATOM 139 CB ASN A 9 3.547 9.024 -4.335 1.00 0.00 C ATOM 140 CG ASN A 9 2.187 8.461 -4.028 1.00 0.00 C ATOM 141 OD1 ASN A 9 1.348 8.309 -4.923 1.00 0.00 O ATOM 142 ND2 ASN A 9 1.952 8.150 -2.779 1.00 0.00 N ATOM 0 H ASN A 9 4.293 6.824 -5.158 1.00 0.00 H new ATOM 0 HA ASN A 9 3.109 9.030 -6.420 1.00 0.00 H new ATOM 0 HB2 ASN A 9 4.283 8.566 -3.675 1.00 0.00 H new ATOM 0 HB3 ASN A 9 3.550 10.093 -4.123 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.046 7.765 -2.511 1.00 0.00 H new ATOM 0 HD22 ASN A 9 2.675 8.293 -2.073 1.00 0.00 H new ATOM 149 N THR A 10 6.330 9.272 -5.932 1.00 0.00 N ATOM 150 CA THR A 10 7.513 10.058 -6.262 1.00 0.00 C ATOM 151 C THR A 10 8.290 9.429 -7.411 1.00 0.00 C ATOM 152 O THR A 10 9.517 9.515 -7.464 1.00 0.00 O ATOM 153 CB THR A 10 8.435 10.212 -5.038 1.00 0.00 C ATOM 154 OG1 THR A 10 8.813 8.917 -4.555 1.00 0.00 O ATOM 155 CG2 THR A 10 7.726 10.976 -3.929 1.00 0.00 C ATOM 0 H THR A 10 6.531 8.361 -5.519 1.00 0.00 H new ATOM 0 HA THR A 10 7.168 11.045 -6.571 1.00 0.00 H new ATOM 0 HB THR A 10 9.323 10.768 -5.339 1.00 0.00 H new ATOM 0 HG1 THR A 10 8.031 8.472 -4.166 1.00 0.00 H new ATOM 0 HG21 THR A 10 8.392 11.075 -3.072 1.00 0.00 H new ATOM 0 HG22 THR A 10 7.448 11.966 -4.290 1.00 0.00 H new ATOM 0 HG23 THR A 10 6.829 10.434 -3.630 1.00 0.00 H new ATOM 163 N LEU A 11 7.569 8.796 -8.330 1.00 0.00 N ATOM 164 CA LEU A 11 8.187 8.175 -9.496 1.00 0.00 C ATOM 165 C LEU A 11 8.882 9.212 -10.368 1.00 0.00 C ATOM 166 O LEU A 11 8.260 10.172 -10.824 1.00 0.00 O ATOM 167 CB LEU A 11 7.131 7.429 -10.321 1.00 0.00 C ATOM 168 CG LEU A 11 7.672 6.558 -11.462 1.00 0.00 C ATOM 169 CD1 LEU A 11 8.487 5.409 -10.882 1.00 0.00 C ATOM 170 CD2 LEU A 11 6.512 6.038 -12.298 1.00 0.00 C ATOM 0 H LEU A 11 6.554 8.699 -8.290 1.00 0.00 H new ATOM 0 HA LEU A 11 8.936 7.467 -9.141 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.552 6.796 -9.649 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.442 8.161 -10.742 1.00 0.00 H new ATOM 0 HG LEU A 11 8.322 7.150 -12.106 1.00 0.00 H new ATOM 0 HD11 LEU A 11 8.871 4.790 -11.693 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.320 5.809 -10.304 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.853 4.804 -10.233 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.896 5.419 -13.109 1.00 0.00 H new ATOM 0 HD22 LEU A 11 5.849 5.443 -11.670 1.00 0.00 H new ATOM 0 HD23 LEU A 11 5.958 6.879 -12.715 1.00 0.00 H new ATOM 182 N GLU A 12 10.176 9.013 -10.598 1.00 0.00 N ATOM 183 CA GLU A 12 10.982 9.983 -11.329 1.00 0.00 C ATOM 184 C GLU A 12 11.087 9.613 -12.803 1.00 0.00 C ATOM 185 O GLU A 12 10.874 8.461 -13.180 1.00 0.00 O ATOM 186 CB GLU A 12 12.381 10.083 -10.717 1.00 0.00 C ATOM 187 CG GLU A 12 12.408 10.623 -9.294 1.00 0.00 C ATOM 188 CD GLU A 12 13.801 10.746 -8.742 1.00 0.00 C ATOM 189 OE1 GLU A 12 14.721 10.333 -9.405 1.00 0.00 O ATOM 190 OE2 GLU A 12 13.944 11.253 -7.654 1.00 0.00 O ATOM 0 H GLU A 12 10.689 8.188 -10.288 1.00 0.00 H new ATOM 0 HA GLU A 12 10.488 10.952 -11.253 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.840 9.094 -10.726 1.00 0.00 H new ATOM 0 HB3 GLU A 12 12.995 10.725 -11.348 1.00 0.00 H new ATOM 0 HG2 GLU A 12 11.926 11.601 -9.272 1.00 0.00 H new ATOM 0 HG3 GLU A 12 11.824 9.966 -8.650 1.00 0.00 H new ATOM 197 N ASP A 13 11.417 10.597 -13.633 1.00 0.00 N ATOM 198 CA ASP A 13 11.476 10.395 -15.075 1.00 0.00 C ATOM 199 C ASP A 13 12.772 9.707 -15.483 1.00 0.00 C ATOM 200 O ASP A 13 13.700 10.351 -15.972 1.00 0.00 O ATOM 201 CB ASP A 13 11.347 11.732 -15.810 1.00 0.00 C ATOM 202 CG ASP A 13 11.236 11.570 -17.320 1.00 0.00 C ATOM 203 OD1 ASP A 13 11.333 10.460 -17.788 1.00 0.00 O ATOM 204 OD2 ASP A 13 11.056 12.557 -17.992 1.00 0.00 O ATOM 0 H ASP A 13 11.648 11.543 -13.331 1.00 0.00 H new ATOM 0 HA ASP A 13 10.641 9.751 -15.353 1.00 0.00 H new ATOM 0 HB2 ASP A 13 10.468 12.260 -15.441 1.00 0.00 H new ATOM 0 HB3 ASP A 13 12.213 12.353 -15.579 1.00 0.00 H new ATOM 209 N SER A 14 12.830 8.396 -15.278 1.00 0.00 N ATOM 210 CA SER A 14 13.974 7.602 -15.712 1.00 0.00 C ATOM 211 C SER A 14 13.640 6.116 -15.726 1.00 0.00 C ATOM 212 O SER A 14 12.702 5.675 -15.062 1.00 0.00 O ATOM 213 CB SER A 14 15.160 7.855 -14.802 1.00 0.00 C ATOM 214 OG SER A 14 14.936 7.321 -13.526 1.00 0.00 O ATOM 0 H SER A 14 12.097 7.860 -14.813 1.00 0.00 H new ATOM 0 HA SER A 14 14.227 7.904 -16.728 1.00 0.00 H new ATOM 0 HB2 SER A 14 16.056 7.410 -15.234 1.00 0.00 H new ATOM 0 HB3 SER A 14 15.342 8.927 -14.725 1.00 0.00 H new ATOM 0 HG SER A 14 15.715 7.495 -12.957 1.00 0.00 H new ATOM 220 N GLN A 15 14.413 5.348 -16.486 1.00 0.00 N ATOM 221 CA GLN A 15 14.211 3.907 -16.574 1.00 0.00 C ATOM 222 C GLN A 15 14.645 3.210 -15.291 1.00 0.00 C ATOM 223 O GLN A 15 14.103 2.167 -14.926 1.00 0.00 O ATOM 224 CB GLN A 15 14.978 3.330 -17.768 1.00 0.00 C ATOM 225 CG GLN A 15 14.476 3.808 -19.120 1.00 0.00 C ATOM 226 CD GLN A 15 13.032 3.416 -19.372 1.00 0.00 C ATOM 227 OE1 GLN A 15 12.637 2.268 -19.150 1.00 0.00 O ATOM 228 NE2 GLN A 15 12.234 4.371 -19.838 1.00 0.00 N ATOM 0 H GLN A 15 15.186 5.700 -17.051 1.00 0.00 H new ATOM 0 HA GLN A 15 13.145 3.729 -16.716 1.00 0.00 H new ATOM 0 HB2 GLN A 15 16.031 3.593 -17.670 1.00 0.00 H new ATOM 0 HB3 GLN A 15 14.916 2.242 -17.734 1.00 0.00 H new ATOM 0 HG2 GLN A 15 14.571 4.892 -19.177 1.00 0.00 H new ATOM 0 HG3 GLN A 15 15.105 3.391 -19.906 1.00 0.00 H new ATOM 0 HE21 GLN A 15 12.603 5.307 -20.007 1.00 0.00 H new ATOM 0 HE22 GLN A 15 11.252 4.168 -20.027 1.00 0.00 H new ATOM 237 N GLU A 16 15.626 3.793 -14.610 1.00 0.00 N ATOM 238 CA GLU A 16 16.100 3.257 -13.340 1.00 0.00 C ATOM 239 C GLU A 16 15.055 3.430 -12.245 1.00 0.00 C ATOM 240 O GLU A 16 14.858 2.541 -11.416 1.00 0.00 O ATOM 241 CB GLU A 16 17.405 3.941 -12.926 1.00 0.00 C ATOM 242 CG GLU A 16 18.600 3.599 -13.804 1.00 0.00 C ATOM 243 CD GLU A 16 19.849 4.334 -13.404 1.00 0.00 C ATOM 244 OE1 GLU A 16 19.762 5.208 -12.575 1.00 0.00 O ATOM 245 OE2 GLU A 16 20.892 4.022 -13.928 1.00 0.00 O ATOM 0 H GLU A 16 16.108 4.638 -14.917 1.00 0.00 H new ATOM 0 HA GLU A 16 16.282 2.191 -13.476 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.256 5.021 -12.941 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.635 3.665 -11.897 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.785 2.526 -13.756 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.362 3.835 -14.841 1.00 0.00 H new ATOM 252 N SER A 17 14.388 4.578 -12.247 1.00 0.00 N ATOM 253 CA SER A 17 13.316 4.843 -11.295 1.00 0.00 C ATOM 254 C SER A 17 12.148 3.887 -11.500 1.00 0.00 C ATOM 255 O SER A 17 11.633 3.307 -10.545 1.00 0.00 O ATOM 256 CB SER A 17 12.838 6.276 -11.432 1.00 0.00 C ATOM 257 OG SER A 17 11.785 6.541 -10.546 1.00 0.00 O ATOM 0 H SER A 17 14.571 5.341 -12.898 1.00 0.00 H new ATOM 0 HA SER A 17 13.712 4.688 -10.291 1.00 0.00 H new ATOM 0 HB2 SER A 17 13.664 6.959 -11.235 1.00 0.00 H new ATOM 0 HB3 SER A 17 12.511 6.458 -12.456 1.00 0.00 H new ATOM 0 HG SER A 17 12.135 6.984 -9.745 1.00 0.00 H new ATOM 263 N ILE A 18 11.734 3.727 -12.753 1.00 0.00 N ATOM 264 CA ILE A 18 10.652 2.810 -13.091 1.00 0.00 C ATOM 265 C ILE A 18 11.022 1.372 -12.749 1.00 0.00 C ATOM 266 O ILE A 18 10.214 0.630 -12.190 1.00 0.00 O ATOM 267 CB ILE A 18 10.296 2.908 -14.586 1.00 0.00 C ATOM 268 CG1 ILE A 18 9.646 4.260 -14.892 1.00 0.00 C ATOM 269 CG2 ILE A 18 9.375 1.767 -14.989 1.00 0.00 C ATOM 270 CD1 ILE A 18 9.503 4.548 -16.369 1.00 0.00 C ATOM 0 H ILE A 18 12.132 4.221 -13.552 1.00 0.00 H new ATOM 0 HA ILE A 18 9.784 3.099 -12.498 1.00 0.00 H new ATOM 0 HB ILE A 18 11.214 2.829 -15.168 1.00 0.00 H new ATOM 0 HG12 ILE A 18 8.660 4.292 -14.428 1.00 0.00 H new ATOM 0 HG13 ILE A 18 10.240 5.050 -14.433 1.00 0.00 H new ATOM 0 HG21 ILE A 18 9.133 1.851 -16.048 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.873 0.815 -14.805 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.457 1.816 -14.403 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.035 5.523 -16.506 1.00 0.00 H new ATOM 0 HD12 ILE A 18 10.488 4.550 -16.836 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.883 3.780 -16.831 1.00 0.00 H new ATOM 282 N SER A 19 12.246 0.985 -13.089 1.00 0.00 N ATOM 283 CA SER A 19 12.739 -0.353 -12.783 1.00 0.00 C ATOM 284 C SER A 19 12.692 -0.628 -11.285 1.00 0.00 C ATOM 285 O SER A 19 12.270 -1.701 -10.855 1.00 0.00 O ATOM 286 CB SER A 19 14.158 -0.515 -13.292 1.00 0.00 C ATOM 287 OG SER A 19 14.200 -0.461 -14.691 1.00 0.00 O ATOM 0 H SER A 19 12.916 1.579 -13.577 1.00 0.00 H new ATOM 0 HA SER A 19 12.091 -1.073 -13.283 1.00 0.00 H new ATOM 0 HB2 SER A 19 14.789 0.270 -12.875 1.00 0.00 H new ATOM 0 HB3 SER A 19 14.564 -1.466 -12.949 1.00 0.00 H new ATOM 0 HG SER A 19 14.410 0.452 -14.977 1.00 0.00 H new ATOM 293 N SER A 20 13.128 0.348 -10.496 1.00 0.00 N ATOM 294 CA SER A 20 13.106 0.226 -9.043 1.00 0.00 C ATOM 295 C SER A 20 11.679 0.117 -8.521 1.00 0.00 C ATOM 296 O SER A 20 11.395 -0.678 -7.626 1.00 0.00 O ATOM 297 CB SER A 20 13.797 1.417 -8.409 1.00 0.00 C ATOM 298 OG SER A 20 15.162 1.432 -8.724 1.00 0.00 O ATOM 0 H SER A 20 13.501 1.233 -10.839 1.00 0.00 H new ATOM 0 HA SER A 20 13.639 -0.686 -8.774 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.330 2.339 -8.755 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.670 1.382 -7.327 1.00 0.00 H new ATOM 0 HG SER A 20 15.286 1.800 -9.624 1.00 0.00 H new ATOM 304 N ALA A 21 10.785 0.922 -9.086 1.00 0.00 N ATOM 305 CA ALA A 21 9.377 0.885 -8.711 1.00 0.00 C ATOM 306 C ALA A 21 8.759 -0.472 -9.022 1.00 0.00 C ATOM 307 O ALA A 21 8.026 -1.032 -8.207 1.00 0.00 O ATOM 308 CB ALA A 21 8.611 1.991 -9.422 1.00 0.00 C ATOM 0 H ALA A 21 11.011 1.608 -9.806 1.00 0.00 H new ATOM 0 HA ALA A 21 9.311 1.046 -7.635 1.00 0.00 H new ATOM 0 HB1 ALA A 21 7.561 1.951 -9.132 1.00 0.00 H new ATOM 0 HB2 ALA A 21 9.027 2.959 -9.144 1.00 0.00 H new ATOM 0 HB3 ALA A 21 8.695 1.857 -10.500 1.00 0.00 H new ATOM 314 N SER A 22 9.059 -0.996 -10.206 1.00 0.00 N ATOM 315 CA SER A 22 8.535 -2.290 -10.626 1.00 0.00 C ATOM 316 C SER A 22 9.060 -3.411 -9.738 1.00 0.00 C ATOM 317 O SER A 22 8.366 -4.396 -9.490 1.00 0.00 O ATOM 318 CB SER A 22 8.908 -2.560 -12.070 1.00 0.00 C ATOM 319 OG SER A 22 10.286 -2.777 -12.201 1.00 0.00 O ATOM 0 H SER A 22 9.663 -0.543 -10.892 1.00 0.00 H new ATOM 0 HA SER A 22 7.449 -2.260 -10.533 1.00 0.00 H new ATOM 0 HB2 SER A 22 8.363 -3.431 -12.433 1.00 0.00 H new ATOM 0 HB3 SER A 22 8.609 -1.715 -12.691 1.00 0.00 H new ATOM 0 HG SER A 22 10.770 -2.188 -11.585 1.00 0.00 H new ATOM 325 N LYS A 23 10.291 -3.255 -9.262 1.00 0.00 N ATOM 326 CA LYS A 23 10.871 -4.198 -8.314 1.00 0.00 C ATOM 327 C LYS A 23 10.071 -4.239 -7.018 1.00 0.00 C ATOM 328 O LYS A 23 9.732 -5.312 -6.520 1.00 0.00 O ATOM 329 CB LYS A 23 12.328 -3.836 -8.021 1.00 0.00 C ATOM 330 CG LYS A 23 13.028 -4.779 -7.051 1.00 0.00 C ATOM 331 CD LYS A 23 14.486 -4.389 -6.856 1.00 0.00 C ATOM 332 CE LYS A 23 15.178 -5.312 -5.864 1.00 0.00 C ATOM 333 NZ LYS A 23 16.608 -4.946 -5.669 1.00 0.00 N ATOM 0 H LYS A 23 10.907 -2.483 -9.518 1.00 0.00 H new ATOM 0 HA LYS A 23 10.837 -5.189 -8.767 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.882 -3.823 -8.960 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.364 -2.825 -7.615 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.514 -4.763 -6.090 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.970 -5.800 -7.427 1.00 0.00 H new ATOM 0 HD2 LYS A 23 15.006 -4.426 -7.814 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.545 -3.360 -6.501 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.659 -5.270 -4.906 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.112 -6.341 -6.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.043 -5.599 -4.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 17.110 -5.010 -6.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.671 -3.973 -5.307 1.00 0.00 H new ATOM 347 N TRP A 24 9.771 -3.063 -6.477 1.00 0.00 N ATOM 348 CA TRP A 24 9.034 -2.962 -5.223 1.00 0.00 C ATOM 349 C TRP A 24 7.669 -3.629 -5.332 1.00 0.00 C ATOM 350 O TRP A 24 7.218 -4.298 -4.402 1.00 0.00 O ATOM 351 CB TRP A 24 8.859 -1.496 -4.823 1.00 0.00 C ATOM 352 CG TRP A 24 10.120 -0.856 -4.326 1.00 0.00 C ATOM 353 CD1 TRP A 24 10.684 0.296 -4.783 1.00 0.00 C ATOM 354 CD2 TRP A 24 10.983 -1.333 -3.266 1.00 0.00 C ATOM 355 NE1 TRP A 24 11.835 0.569 -4.086 1.00 0.00 N ATOM 356 CE2 TRP A 24 12.033 -0.417 -3.152 1.00 0.00 C ATOM 357 CE3 TRP A 24 10.950 -2.446 -2.417 1.00 0.00 C ATOM 358 CZ2 TRP A 24 13.048 -0.577 -2.223 1.00 0.00 C ATOM 359 CZ3 TRP A 24 11.968 -2.606 -1.484 1.00 0.00 C ATOM 360 CH2 TRP A 24 12.989 -1.694 -1.389 1.00 0.00 C ATOM 0 H TRP A 24 10.027 -2.165 -6.888 1.00 0.00 H new ATOM 0 HA TRP A 24 9.612 -3.478 -4.456 1.00 0.00 H new ATOM 0 HB2 TRP A 24 8.491 -0.935 -5.682 1.00 0.00 H new ATOM 0 HB3 TRP A 24 8.096 -1.428 -4.047 1.00 0.00 H new ATOM 0 HD1 TRP A 24 10.284 0.907 -5.579 1.00 0.00 H new ATOM 0 HE1 TRP A 24 12.444 1.373 -4.238 1.00 0.00 H new ATOM 0 HE3 TRP A 24 10.149 -3.167 -2.486 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 13.855 0.137 -2.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 11.955 -3.461 -0.824 1.00 0.00 H new ATOM 0 HH2 TRP A 24 13.764 -1.844 -0.652 1.00 0.00 H new ATOM 371 N LEU A 25 7.014 -3.443 -6.473 1.00 0.00 N ATOM 372 CA LEU A 25 5.684 -3.998 -6.693 1.00 0.00 C ATOM 373 C LEU A 25 5.741 -5.508 -6.881 1.00 0.00 C ATOM 374 O LEU A 25 4.936 -6.246 -6.312 1.00 0.00 O ATOM 375 CB LEU A 25 5.034 -3.348 -7.921 1.00 0.00 C ATOM 376 CG LEU A 25 3.614 -3.823 -8.252 1.00 0.00 C ATOM 377 CD1 LEU A 25 2.732 -3.687 -7.018 1.00 0.00 C ATOM 378 CD2 LEU A 25 3.063 -3.006 -9.411 1.00 0.00 C ATOM 0 H LEU A 25 7.384 -2.911 -7.261 1.00 0.00 H new ATOM 0 HA LEU A 25 5.083 -3.784 -5.809 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.010 -2.269 -7.768 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.670 -3.533 -8.787 1.00 0.00 H new ATOM 0 HG LEU A 25 3.631 -4.872 -8.548 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.723 -4.025 -7.253 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.139 -4.296 -6.211 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.702 -2.643 -6.706 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.054 -3.343 -9.647 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.038 -1.952 -9.134 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.702 -3.136 -10.284 1.00 0.00 H new ATOM 390 N LEU A 26 6.698 -5.964 -7.683 1.00 0.00 N ATOM 391 CA LEU A 26 6.862 -7.388 -7.948 1.00 0.00 C ATOM 392 C LEU A 26 7.182 -8.153 -6.670 1.00 0.00 C ATOM 393 O LEU A 26 6.817 -9.320 -6.526 1.00 0.00 O ATOM 394 CB LEU A 26 7.978 -7.610 -8.977 1.00 0.00 C ATOM 395 CG LEU A 26 7.648 -7.193 -10.416 1.00 0.00 C ATOM 396 CD1 LEU A 26 8.909 -7.263 -11.267 1.00 0.00 C ATOM 397 CD2 LEU A 26 6.561 -8.101 -10.972 1.00 0.00 C ATOM 0 H LEU A 26 7.372 -5.366 -8.161 1.00 0.00 H new ATOM 0 HA LEU A 26 5.920 -7.765 -8.347 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.861 -7.060 -8.652 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.243 -8.667 -8.976 1.00 0.00 H new ATOM 0 HG LEU A 26 7.279 -6.167 -10.431 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.675 -6.967 -12.290 1.00 0.00 H new ATOM 0 HD12 LEU A 26 9.662 -6.590 -10.858 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.294 -8.283 -11.264 1.00 0.00 H new ATOM 0 HD21 LEU A 26 6.327 -7.804 -11.994 1.00 0.00 H new ATOM 0 HD22 LEU A 26 6.910 -9.133 -10.965 1.00 0.00 H new ATOM 0 HD23 LEU A 26 5.666 -8.017 -10.356 1.00 0.00 H new ATOM 409 N LEU A 27 7.865 -7.489 -5.744 1.00 0.00 N ATOM 410 CA LEU A 27 8.185 -8.085 -4.453 1.00 0.00 C ATOM 411 C LEU A 27 7.012 -7.972 -3.488 1.00 0.00 C ATOM 412 O LEU A 27 7.045 -8.525 -2.389 1.00 0.00 O ATOM 413 CB LEU A 27 9.420 -7.407 -3.847 1.00 0.00 C ATOM 414 CG LEU A 27 10.734 -7.610 -4.613 1.00 0.00 C ATOM 415 CD1 LEU A 27 11.828 -6.760 -3.981 1.00 0.00 C ATOM 416 CD2 LEU A 27 11.109 -9.084 -4.597 1.00 0.00 C ATOM 0 H LEU A 27 8.208 -6.536 -5.864 1.00 0.00 H new ATOM 0 HA LEU A 27 8.396 -9.142 -4.616 1.00 0.00 H new ATOM 0 HB2 LEU A 27 9.225 -6.337 -3.774 1.00 0.00 H new ATOM 0 HB3 LEU A 27 9.553 -7.777 -2.830 1.00 0.00 H new ATOM 0 HG LEU A 27 10.612 -7.298 -5.650 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.761 -6.905 -4.525 1.00 0.00 H new ATOM 0 HD12 LEU A 27 11.542 -5.709 -4.023 1.00 0.00 H new ATOM 0 HD13 LEU A 27 11.965 -7.057 -2.941 1.00 0.00 H new ATOM 0 HD21 LEU A 27 12.042 -9.228 -5.141 1.00 0.00 H new ATOM 0 HD22 LEU A 27 11.235 -9.416 -3.567 1.00 0.00 H new ATOM 0 HD23 LEU A 27 10.319 -9.666 -5.072 1.00 0.00 H new ATOM 428 N GLN A 28 5.976 -7.253 -3.906 1.00 0.00 N ATOM 429 CA GLN A 28 4.783 -7.079 -3.086 1.00 0.00 C ATOM 430 C GLN A 28 3.528 -7.489 -3.845 1.00 0.00 C ATOM 431 O GLN A 28 2.484 -6.847 -3.731 1.00 0.00 O ATOM 432 CB GLN A 28 4.661 -5.626 -2.620 1.00 0.00 C ATOM 433 CG GLN A 28 5.811 -5.152 -1.748 1.00 0.00 C ATOM 434 CD GLN A 28 5.820 -5.822 -0.387 1.00 0.00 C ATOM 435 OE1 GLN A 28 4.807 -5.841 0.318 1.00 0.00 O ATOM 436 NE2 GLN A 28 6.966 -6.376 -0.008 1.00 0.00 N ATOM 0 H GLN A 28 5.939 -6.781 -4.809 1.00 0.00 H new ATOM 0 HA GLN A 28 4.882 -7.725 -2.214 1.00 0.00 H new ATOM 0 HB2 GLN A 28 4.594 -4.980 -3.495 1.00 0.00 H new ATOM 0 HB3 GLN A 28 3.729 -5.511 -2.067 1.00 0.00 H new ATOM 0 HG2 GLN A 28 6.755 -5.353 -2.255 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.743 -4.072 -1.618 1.00 0.00 H new ATOM 0 HE21 GLN A 28 7.779 -6.337 -0.623 1.00 0.00 H new ATOM 0 HE22 GLN A 28 7.033 -6.841 0.898 1.00 0.00 H new ATOM 445 N TYR A 29 3.636 -8.564 -4.619 1.00 0.00 N ATOM 446 CA TYR A 29 2.531 -9.020 -5.455 1.00 0.00 C ATOM 447 C TYR A 29 1.314 -9.378 -4.612 1.00 0.00 C ATOM 448 O TYR A 29 0.182 -9.346 -5.094 1.00 0.00 O ATOM 449 CB TYR A 29 2.961 -10.219 -6.303 1.00 0.00 C ATOM 450 CG TYR A 29 3.098 -11.504 -5.517 1.00 0.00 C ATOM 451 CD1 TYR A 29 2.030 -12.386 -5.438 1.00 0.00 C ATOM 452 CD2 TYR A 29 4.291 -11.801 -4.876 1.00 0.00 C ATOM 453 CE1 TYR A 29 2.155 -13.560 -4.720 1.00 0.00 C ATOM 454 CE2 TYR A 29 4.417 -12.975 -4.158 1.00 0.00 C ATOM 455 CZ TYR A 29 3.354 -13.852 -4.080 1.00 0.00 C ATOM 456 OH TYR A 29 3.479 -15.021 -3.365 1.00 0.00 O ATOM 0 H TYR A 29 4.478 -9.136 -4.685 1.00 0.00 H new ATOM 0 HA TYR A 29 2.253 -8.201 -6.119 1.00 0.00 H new ATOM 0 HB2 TYR A 29 2.233 -10.368 -7.101 1.00 0.00 H new ATOM 0 HB3 TYR A 29 3.915 -9.992 -6.780 1.00 0.00 H new ATOM 0 HD1 TYR A 29 1.101 -12.155 -5.938 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.122 -11.114 -4.938 1.00 0.00 H new ATOM 0 HE1 TYR A 29 1.325 -14.248 -4.656 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.346 -13.206 -3.658 1.00 0.00 H new ATOM 0 HH TYR A 29 4.379 -15.075 -2.980 1.00 0.00 H new ATOM 466 N ARG A 30 1.554 -9.720 -3.350 1.00 0.00 N ATOM 467 CA ARG A 30 0.485 -10.143 -2.454 1.00 0.00 C ATOM 468 C ARG A 30 -0.413 -8.972 -2.077 1.00 0.00 C ATOM 469 O ARG A 30 -1.542 -9.163 -1.625 1.00 0.00 O ATOM 470 CB ARG A 30 1.060 -10.765 -1.190 1.00 0.00 C ATOM 471 CG ARG A 30 1.783 -12.086 -1.399 1.00 0.00 C ATOM 472 CD ARG A 30 2.347 -12.611 -0.129 1.00 0.00 C ATOM 473 NE ARG A 30 3.089 -13.844 -0.334 1.00 0.00 N ATOM 474 CZ ARG A 30 3.739 -14.516 0.636 1.00 0.00 C ATOM 475 NH1 ARG A 30 3.730 -14.061 1.870 1.00 0.00 N ATOM 476 NH2 ARG A 30 4.387 -15.631 0.347 1.00 0.00 N ATOM 0 H ARG A 30 2.481 -9.712 -2.925 1.00 0.00 H new ATOM 0 HA ARG A 30 -0.111 -10.886 -2.984 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.753 -10.056 -0.736 1.00 0.00 H new ATOM 0 HB3 ARG A 30 0.250 -10.920 -0.477 1.00 0.00 H new ATOM 0 HG2 ARG A 30 1.092 -12.816 -1.820 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.585 -11.951 -2.125 1.00 0.00 H new ATOM 0 HD2 ARG A 30 3.003 -11.862 0.314 1.00 0.00 H new ATOM 0 HD3 ARG A 30 1.539 -12.787 0.581 1.00 0.00 H new ATOM 0 HE ARG A 30 3.120 -14.227 -1.279 1.00 0.00 H new ATOM 0 HH11 ARG A 30 3.231 -13.200 2.092 1.00 0.00 H new ATOM 0 HH12 ARG A 30 4.222 -14.570 2.605 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.395 -15.983 -0.610 1.00 0.00 H new ATOM 0 HH22 ARG A 30 4.879 -16.140 1.081 1.00 0.00 H new ATOM 490 N ASP A 31 0.095 -7.758 -2.265 1.00 0.00 N ATOM 491 CA ASP A 31 -0.677 -6.553 -1.986 1.00 0.00 C ATOM 492 C ASP A 31 -1.236 -5.949 -3.267 1.00 0.00 C ATOM 493 O ASP A 31 -1.746 -4.828 -3.265 1.00 0.00 O ATOM 494 CB ASP A 31 0.188 -5.518 -1.261 1.00 0.00 C ATOM 495 CG ASP A 31 0.587 -5.957 0.141 1.00 0.00 C ATOM 496 OD1 ASP A 31 -0.076 -6.807 0.688 1.00 0.00 O ATOM 497 OD2 ASP A 31 1.550 -5.439 0.652 1.00 0.00 O ATOM 0 H ASP A 31 1.039 -7.583 -2.610 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.512 -6.835 -1.344 1.00 0.00 H new ATOM 0 HB2 ASP A 31 1.088 -5.329 -1.847 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.356 -4.576 -1.200 1.00 0.00 H new ATOM 502 N ALA A 32 -1.138 -6.697 -4.360 1.00 0.00 N ATOM 503 CA ALA A 32 -1.522 -6.190 -5.673 1.00 0.00 C ATOM 504 C ALA A 32 -2.981 -5.753 -5.689 1.00 0.00 C ATOM 505 O ALA A 32 -3.324 -4.722 -6.268 1.00 0.00 O ATOM 506 CB ALA A 32 -1.273 -7.245 -6.741 1.00 0.00 C ATOM 0 H ALA A 32 -0.796 -7.658 -4.363 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.907 -5.317 -5.890 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.564 -6.852 -7.715 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.214 -7.505 -6.756 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -1.862 -8.135 -6.518 1.00 0.00 H new ATOM 512 N PRO A 33 -3.837 -6.544 -5.051 1.00 0.00 N ATOM 513 CA PRO A 33 -5.258 -6.226 -4.968 1.00 0.00 C ATOM 514 C PRO A 33 -5.475 -4.802 -4.472 1.00 0.00 C ATOM 515 O PRO A 33 -6.407 -4.121 -4.901 1.00 0.00 O ATOM 516 CB PRO A 33 -5.785 -7.259 -3.968 1.00 0.00 C ATOM 517 CG PRO A 33 -4.916 -8.451 -4.182 1.00 0.00 C ATOM 518 CD PRO A 33 -3.539 -7.878 -4.388 1.00 0.00 C ATOM 0 HA PRO A 33 -5.767 -6.270 -5.931 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -5.715 -6.894 -2.943 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -6.834 -7.492 -4.152 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -4.943 -9.122 -3.323 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -5.240 -9.029 -5.048 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -3.006 -7.753 -3.446 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.923 -8.517 -5.020 1.00 0.00 H new ATOM 526 N LYS A 34 -4.610 -4.358 -3.567 1.00 0.00 N ATOM 527 CA LYS A 34 -4.691 -3.005 -3.030 1.00 0.00 C ATOM 528 C LYS A 34 -4.011 -2.003 -3.955 1.00 0.00 C ATOM 529 O LYS A 34 -4.451 -0.860 -4.079 1.00 0.00 O ATOM 530 CB LYS A 34 -4.064 -2.943 -1.636 1.00 0.00 C ATOM 531 CG LYS A 34 -4.845 -3.689 -0.562 1.00 0.00 C ATOM 532 CD LYS A 34 -4.159 -3.585 0.792 1.00 0.00 C ATOM 533 CE LYS A 34 -4.943 -4.320 1.869 1.00 0.00 C ATOM 534 NZ LYS A 34 -4.266 -4.256 3.193 1.00 0.00 N ATOM 0 H LYS A 34 -3.844 -4.916 -3.190 1.00 0.00 H new ATOM 0 HA LYS A 34 -5.745 -2.739 -2.956 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -3.055 -3.353 -1.686 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -3.969 -1.898 -1.340 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.854 -3.281 -0.493 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.943 -4.738 -0.843 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -3.153 -4.000 0.725 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -4.053 -2.536 1.069 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -5.940 -3.887 1.950 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.071 -5.362 1.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -4.833 -4.769 3.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -3.324 -4.692 3.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -4.167 -3.263 3.485 1.00 0.00 H new ATOM 548 N VAL A 35 -2.936 -2.439 -4.602 1.00 0.00 N ATOM 549 CA VAL A 35 -2.216 -1.595 -5.548 1.00 0.00 C ATOM 550 C VAL A 35 -3.091 -1.235 -6.742 1.00 0.00 C ATOM 551 O VAL A 35 -2.910 -0.187 -7.362 1.00 0.00 O ATOM 552 CB VAL A 35 -0.945 -2.310 -6.044 1.00 0.00 C ATOM 553 CG1 VAL A 35 -0.317 -1.542 -7.197 1.00 0.00 C ATOM 554 CG2 VAL A 35 0.042 -2.465 -4.897 1.00 0.00 C ATOM 0 H VAL A 35 -2.544 -3.374 -4.488 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.940 -0.678 -5.028 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.215 -3.301 -6.408 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.580 -2.062 -7.535 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.029 -1.475 -8.020 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.051 -0.539 -6.864 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.939 -2.971 -5.254 1.00 0.00 H new ATOM 0 HG22 VAL A 35 0.310 -1.481 -4.512 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.414 -3.054 -4.101 1.00 0.00 H new ATOM 564 N ALA A 36 -4.040 -2.109 -7.059 1.00 0.00 N ATOM 565 CA ALA A 36 -5.026 -1.828 -8.095 1.00 0.00 C ATOM 566 C ALA A 36 -5.628 -0.440 -7.920 1.00 0.00 C ATOM 567 O ALA A 36 -5.721 0.332 -8.875 1.00 0.00 O ATOM 568 CB ALA A 36 -6.120 -2.885 -8.086 1.00 0.00 C ATOM 0 H ALA A 36 -4.147 -3.020 -6.612 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.518 -1.856 -9.059 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.849 -2.661 -8.865 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.680 -3.865 -8.271 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.616 -2.887 -7.115 1.00 0.00 H new ATOM 574 N GLU A 37 -6.037 -0.128 -6.695 1.00 0.00 N ATOM 575 CA GLU A 37 -6.611 1.176 -6.388 1.00 0.00 C ATOM 576 C GLU A 37 -5.539 2.259 -6.371 1.00 0.00 C ATOM 577 O GLU A 37 -5.780 3.390 -6.793 1.00 0.00 O ATOM 578 CB GLU A 37 -7.331 1.138 -5.038 1.00 0.00 C ATOM 579 CG GLU A 37 -8.590 0.282 -5.021 1.00 0.00 C ATOM 580 CD GLU A 37 -9.258 0.249 -3.675 1.00 0.00 C ATOM 581 OE1 GLU A 37 -8.711 0.798 -2.748 1.00 0.00 O ATOM 582 OE2 GLU A 37 -10.317 -0.324 -3.573 1.00 0.00 O ATOM 0 H GLU A 37 -5.981 -0.762 -5.898 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.330 1.416 -7.171 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.641 0.763 -4.282 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -7.595 2.156 -4.752 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.293 0.665 -5.761 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -8.336 -0.735 -5.320 1.00 0.00 H new ATOM 589 N MET A 38 -4.356 1.906 -5.882 1.00 0.00 N ATOM 590 CA MET A 38 -3.237 2.840 -5.832 1.00 0.00 C ATOM 591 C MET A 38 -2.874 3.339 -7.224 1.00 0.00 C ATOM 592 O MET A 38 -2.776 4.544 -7.457 1.00 0.00 O ATOM 593 CB MET A 38 -2.029 2.181 -5.169 1.00 0.00 C ATOM 594 CG MET A 38 -2.224 1.844 -3.698 1.00 0.00 C ATOM 595 SD MET A 38 -0.810 0.975 -2.990 1.00 0.00 S ATOM 596 CE MET A 38 -1.513 0.379 -1.455 1.00 0.00 C ATOM 0 H MET A 38 -4.146 0.978 -5.514 1.00 0.00 H new ATOM 0 HA MET A 38 -3.540 3.701 -5.237 1.00 0.00 H new ATOM 0 HB2 MET A 38 -1.788 1.266 -5.710 1.00 0.00 H new ATOM 0 HB3 MET A 38 -1.170 2.845 -5.266 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.398 2.763 -3.139 1.00 0.00 H new ATOM 0 HG3 MET A 38 -3.117 1.229 -3.586 1.00 0.00 H new ATOM 0 HE1 MET A 38 -0.711 0.125 -0.762 1.00 0.00 H new ATOM 0 HE2 MET A 38 -2.140 1.155 -1.016 1.00 0.00 H new ATOM 0 HE3 MET A 38 -2.117 -0.507 -1.651 1.00 0.00 H new ATOM 606 N TRP A 39 -2.674 2.405 -8.148 1.00 0.00 N ATOM 607 CA TRP A 39 -2.301 2.748 -9.515 1.00 0.00 C ATOM 608 C TRP A 39 -3.414 3.518 -10.214 1.00 0.00 C ATOM 609 O TRP A 39 -3.162 4.516 -10.890 1.00 0.00 O ATOM 610 CB TRP A 39 -1.974 1.483 -10.312 1.00 0.00 C ATOM 611 CG TRP A 39 -1.466 1.761 -11.694 1.00 0.00 C ATOM 612 CD1 TRP A 39 -0.204 2.145 -12.037 1.00 0.00 C ATOM 613 CD2 TRP A 39 -2.210 1.677 -12.934 1.00 0.00 C ATOM 614 NE1 TRP A 39 -0.112 2.306 -13.398 1.00 0.00 N ATOM 615 CE2 TRP A 39 -1.330 2.022 -13.962 1.00 0.00 C ATOM 616 CE3 TRP A 39 -3.533 1.340 -13.247 1.00 0.00 C ATOM 617 CZ2 TRP A 39 -1.726 2.045 -15.290 1.00 0.00 C ATOM 618 CZ3 TRP A 39 -3.930 1.361 -14.579 1.00 0.00 C ATOM 619 CH2 TRP A 39 -3.049 1.704 -15.574 1.00 0.00 C ATOM 0 H TRP A 39 -2.764 1.404 -7.974 1.00 0.00 H new ATOM 0 HA TRP A 39 -1.417 3.384 -9.467 1.00 0.00 H new ATOM 0 HB2 TRP A 39 -1.227 0.904 -9.769 1.00 0.00 H new ATOM 0 HB3 TRP A 39 -2.869 0.865 -10.380 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.606 2.300 -11.340 1.00 0.00 H new ATOM 0 HE1 TRP A 39 0.725 2.590 -13.906 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -4.231 1.069 -12.469 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -1.036 2.317 -16.076 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -4.947 1.103 -14.835 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -3.387 1.710 -16.600 1.00 0.00 H new ATOM 630 N LYS A 40 -4.646 3.050 -10.047 1.00 0.00 N ATOM 631 CA LYS A 40 -5.808 3.735 -10.601 1.00 0.00 C ATOM 632 C LYS A 40 -5.871 5.182 -10.129 1.00 0.00 C ATOM 633 O LYS A 40 -5.994 6.103 -10.936 1.00 0.00 O ATOM 634 CB LYS A 40 -7.094 3.001 -10.220 1.00 0.00 C ATOM 635 CG LYS A 40 -8.369 3.658 -10.733 1.00 0.00 C ATOM 636 CD LYS A 40 -9.594 2.815 -10.410 1.00 0.00 C ATOM 637 CE LYS A 40 -10.868 3.472 -10.919 1.00 0.00 C ATOM 638 NZ LYS A 40 -12.071 2.640 -10.643 1.00 0.00 N ATOM 0 H LYS A 40 -4.866 2.198 -9.532 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.709 3.735 -11.686 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.044 1.982 -10.605 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -7.149 2.929 -9.134 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -8.477 4.646 -10.286 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.298 3.802 -11.811 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.487 1.828 -10.859 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.663 2.669 -9.332 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.986 4.448 -10.448 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.784 3.644 -11.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.574 2.451 -11.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.779 1.739 -10.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.701 3.147 -9.990 1.00 0.00 H new ATOM 652 N GLU A 41 -5.786 5.375 -8.817 1.00 0.00 N ATOM 653 CA GLU A 41 -5.829 6.711 -8.235 1.00 0.00 C ATOM 654 C GLU A 41 -4.700 7.582 -8.771 1.00 0.00 C ATOM 655 O GLU A 41 -4.925 8.716 -9.194 1.00 0.00 O ATOM 656 CB GLU A 41 -5.745 6.632 -6.709 1.00 0.00 C ATOM 657 CG GLU A 41 -5.785 7.981 -6.006 1.00 0.00 C ATOM 658 CD GLU A 41 -5.725 7.862 -4.508 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.584 7.225 -3.947 1.00 0.00 O ATOM 660 OE2 GLU A 41 -4.820 8.410 -3.925 1.00 0.00 O ATOM 0 H GLU A 41 -5.687 4.622 -8.136 1.00 0.00 H new ATOM 0 HA GLU A 41 -6.778 7.167 -8.518 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.570 6.021 -6.343 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.823 6.120 -6.434 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.949 8.590 -6.351 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.698 8.505 -6.288 1.00 0.00 H new ATOM 667 N TYR A 42 -3.485 7.046 -8.749 1.00 0.00 N ATOM 668 CA TYR A 42 -2.319 7.769 -9.242 1.00 0.00 C ATOM 669 C TYR A 42 -2.523 8.227 -10.681 1.00 0.00 C ATOM 670 O TYR A 42 -2.322 9.398 -11.004 1.00 0.00 O ATOM 671 CB TYR A 42 -1.064 6.899 -9.135 1.00 0.00 C ATOM 672 CG TYR A 42 0.170 7.532 -9.738 1.00 0.00 C ATOM 673 CD1 TYR A 42 0.929 8.422 -8.992 1.00 0.00 C ATOM 674 CD2 TYR A 42 0.544 7.223 -11.038 1.00 0.00 C ATOM 675 CE1 TYR A 42 2.056 9.000 -9.542 1.00 0.00 C ATOM 676 CE2 TYR A 42 1.671 7.801 -11.588 1.00 0.00 C ATOM 677 CZ TYR A 42 2.426 8.686 -10.845 1.00 0.00 C ATOM 678 OH TYR A 42 3.549 9.261 -11.394 1.00 0.00 O ATOM 0 H TYR A 42 -3.282 6.112 -8.394 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.187 8.654 -8.620 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.873 6.681 -8.084 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.251 5.946 -9.629 1.00 0.00 H new ATOM 0 HD1 TYR A 42 0.638 8.663 -7.980 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.046 6.530 -11.620 1.00 0.00 H new ATOM 0 HE1 TYR A 42 2.648 9.693 -8.962 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.962 7.561 -12.600 1.00 0.00 H new ATOM 0 HH TYR A 42 3.539 9.135 -12.366 1.00 0.00 H new ATOM 688 N MET A 43 -2.923 7.298 -11.541 1.00 0.00 N ATOM 689 CA MET A 43 -3.103 7.592 -12.958 1.00 0.00 C ATOM 690 C MET A 43 -4.243 8.578 -13.175 1.00 0.00 C ATOM 691 O MET A 43 -4.255 9.322 -14.156 1.00 0.00 O ATOM 692 CB MET A 43 -3.357 6.302 -13.736 1.00 0.00 C ATOM 693 CG MET A 43 -2.149 5.382 -13.843 1.00 0.00 C ATOM 694 SD MET A 43 -0.769 6.146 -14.719 1.00 0.00 S ATOM 695 CE MET A 43 -1.433 6.240 -16.379 1.00 0.00 C ATOM 0 H MET A 43 -3.129 6.333 -11.282 1.00 0.00 H new ATOM 0 HA MET A 43 -2.187 8.053 -13.328 1.00 0.00 H new ATOM 0 HB2 MET A 43 -4.171 5.758 -13.257 1.00 0.00 H new ATOM 0 HB3 MET A 43 -3.693 6.559 -14.741 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.825 5.096 -12.842 1.00 0.00 H new ATOM 0 HG3 MET A 43 -2.439 4.466 -14.358 1.00 0.00 H new ATOM 0 HE1 MET A 43 -0.636 6.062 -17.100 1.00 0.00 H new ATOM 0 HE2 MET A 43 -2.210 5.486 -16.503 1.00 0.00 H new ATOM 0 HE3 MET A 43 -1.859 7.230 -16.545 1.00 0.00 H new ATOM 705 N LEU A 44 -5.202 8.578 -12.255 1.00 0.00 N ATOM 706 CA LEU A 44 -6.355 9.466 -12.350 1.00 0.00 C ATOM 707 C LEU A 44 -6.278 10.581 -11.316 1.00 0.00 C ATOM 708 O LEU A 44 -7.288 11.200 -10.980 1.00 0.00 O ATOM 709 CB LEU A 44 -7.652 8.671 -12.159 1.00 0.00 C ATOM 710 CG LEU A 44 -7.883 7.525 -13.152 1.00 0.00 C ATOM 711 CD1 LEU A 44 -9.189 6.817 -12.816 1.00 0.00 C ATOM 712 CD2 LEU A 44 -7.910 8.078 -14.569 1.00 0.00 C ATOM 0 H LEU A 44 -5.203 7.972 -11.434 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.350 9.917 -13.342 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.659 8.259 -11.150 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.493 9.361 -12.227 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.071 6.801 -13.081 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.353 6.003 -13.522 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.135 6.415 -11.804 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -10.014 7.526 -12.881 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.074 7.263 -15.274 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.717 8.805 -14.660 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -6.958 8.562 -14.789 1.00 0.00 H new ATOM 724 N ARG A 45 -5.074 10.834 -10.814 1.00 0.00 N ATOM 725 CA ARG A 45 -4.861 11.884 -9.825 1.00 0.00 C ATOM 726 C ARG A 45 -4.669 13.240 -10.494 1.00 0.00 C ATOM 727 O ARG A 45 -3.870 13.378 -11.420 1.00 0.00 O ATOM 728 CB ARG A 45 -3.647 11.571 -8.964 1.00 0.00 C ATOM 729 CG ARG A 45 -3.407 12.542 -7.819 1.00 0.00 C ATOM 730 CD ARG A 45 -2.311 12.081 -6.928 1.00 0.00 C ATOM 731 NE ARG A 45 -2.702 10.920 -6.144 1.00 0.00 N ATOM 732 CZ ARG A 45 -1.842 10.016 -5.636 1.00 0.00 C ATOM 733 NH1 ARG A 45 -0.550 10.151 -5.839 1.00 0.00 N ATOM 734 NH2 ARG A 45 -2.297 8.992 -4.935 1.00 0.00 N ATOM 0 H ARG A 45 -4.230 10.325 -11.076 1.00 0.00 H new ATOM 0 HA ARG A 45 -5.750 11.925 -9.195 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.760 10.568 -8.553 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.762 11.557 -9.600 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.160 13.525 -8.221 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -4.323 12.655 -7.240 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -1.434 11.836 -7.528 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -2.023 12.891 -6.258 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.697 10.781 -5.966 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -0.199 10.940 -6.381 1.00 0.00 H new ATOM 0 HH12 ARG A 45 0.101 9.466 -5.454 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -3.299 8.886 -4.779 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -1.646 8.308 -4.550 1.00 0.00 H new ATOM 748 N PRO A 46 -5.407 14.238 -10.020 1.00 0.00 N ATOM 749 CA PRO A 46 -5.418 15.551 -10.654 1.00 0.00 C ATOM 750 C PRO A 46 -4.137 16.318 -10.353 1.00 0.00 C ATOM 751 O PRO A 46 -3.830 17.313 -11.009 1.00 0.00 O ATOM 752 CB PRO A 46 -6.641 16.226 -10.026 1.00 0.00 C ATOM 753 CG PRO A 46 -6.787 15.560 -8.700 1.00 0.00 C ATOM 754 CD PRO A 46 -6.423 14.123 -8.961 1.00 0.00 C ATOM 0 HA PRO A 46 -5.470 15.505 -11.742 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -6.491 17.300 -9.918 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -7.531 16.089 -10.640 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -6.129 16.008 -7.956 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -7.805 15.649 -8.320 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.027 13.637 -8.070 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -7.284 13.539 -9.287 1.00 0.00 H new ATOM 762 N SER A 47 -3.392 15.849 -9.358 1.00 0.00 N ATOM 763 CA SER A 47 -2.117 16.461 -9.001 1.00 0.00 C ATOM 764 C SER A 47 -0.975 15.864 -9.813 1.00 0.00 C ATOM 765 O SER A 47 0.184 16.243 -9.642 1.00 0.00 O ATOM 766 CB SER A 47 -1.847 16.278 -7.520 1.00 0.00 C ATOM 767 OG SER A 47 -2.806 16.948 -6.748 1.00 0.00 O ATOM 0 H SER A 47 -3.649 15.046 -8.784 1.00 0.00 H new ATOM 0 HA SER A 47 -2.178 17.525 -9.228 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.854 15.216 -7.274 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.853 16.655 -7.279 1.00 0.00 H new ATOM 0 HG SER A 47 -2.612 16.814 -5.797 1.00 0.00 H new ATOM 773 N VAL A 48 -1.308 14.929 -10.696 1.00 0.00 N ATOM 774 CA VAL A 48 -0.311 14.287 -11.545 1.00 0.00 C ATOM 775 C VAL A 48 -0.487 14.692 -13.003 1.00 0.00 C ATOM 776 O VAL A 48 -1.601 14.700 -13.525 1.00 0.00 O ATOM 777 CB VAL A 48 -0.414 12.755 -11.424 1.00 0.00 C ATOM 778 CG1 VAL A 48 0.582 12.080 -12.356 1.00 0.00 C ATOM 779 CG2 VAL A 48 -0.176 12.332 -9.983 1.00 0.00 C ATOM 0 H VAL A 48 -2.262 14.598 -10.843 1.00 0.00 H new ATOM 0 HA VAL A 48 0.673 14.615 -11.208 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.416 12.443 -11.717 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.496 10.998 -12.258 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.371 12.369 -13.385 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.594 12.389 -12.093 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.250 11.247 -9.905 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.818 12.651 -9.670 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.925 12.794 -9.340 1.00 0.00 H new ATOM 789 N ASN A 49 0.621 15.028 -13.656 1.00 0.00 N ATOM 790 CA ASN A 49 0.586 15.474 -15.043 1.00 0.00 C ATOM 791 C ASN A 49 0.758 14.304 -16.003 1.00 0.00 C ATOM 792 O ASN A 49 0.992 13.172 -15.581 1.00 0.00 O ATOM 793 CB ASN A 49 1.649 16.529 -15.292 1.00 0.00 C ATOM 794 CG ASN A 49 3.045 15.992 -15.129 1.00 0.00 C ATOM 795 OD1 ASN A 49 3.288 14.794 -15.318 1.00 0.00 O ATOM 796 ND2 ASN A 49 3.966 16.855 -14.783 1.00 0.00 N ATOM 0 H ASN A 49 1.555 15.000 -13.246 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.393 15.917 -15.227 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.532 16.927 -16.300 1.00 0.00 H new ATOM 0 HB3 ASN A 49 1.500 17.360 -14.602 1.00 0.00 H new ATOM 0 HD21 ASN A 49 4.931 16.549 -14.658 1.00 0.00 H new ATOM 0 HD22 ASN A 49 3.719 17.834 -14.638 1.00 0.00 H new ATOM 803 N THR A 50 0.640 14.584 -17.297 1.00 0.00 N ATOM 804 CA THR A 50 0.597 13.533 -18.307 1.00 0.00 C ATOM 805 C THR A 50 1.949 12.846 -18.444 1.00 0.00 C ATOM 806 O THR A 50 2.026 11.672 -18.807 1.00 0.00 O ATOM 807 CB THR A 50 0.161 14.095 -19.673 1.00 0.00 C ATOM 808 OG1 THR A 50 1.067 15.130 -20.078 1.00 0.00 O ATOM 809 CG2 THR A 50 -1.247 14.663 -19.591 1.00 0.00 C ATOM 0 H THR A 50 0.572 15.531 -17.671 1.00 0.00 H new ATOM 0 HA THR A 50 -0.138 12.798 -17.978 1.00 0.00 H new ATOM 0 HB THR A 50 0.173 13.285 -20.403 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.790 15.486 -20.948 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.538 15.056 -20.565 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.940 13.876 -19.295 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.273 15.466 -18.854 1.00 0.00 H new ATOM 817 N ARG A 51 3.015 13.584 -18.153 1.00 0.00 N ATOM 818 CA ARG A 51 4.363 13.031 -18.189 1.00 0.00 C ATOM 819 C ARG A 51 4.551 11.966 -17.116 1.00 0.00 C ATOM 820 O ARG A 51 5.110 10.900 -17.376 1.00 0.00 O ATOM 821 CB ARG A 51 5.398 14.129 -17.995 1.00 0.00 C ATOM 822 CG ARG A 51 6.844 13.669 -18.088 1.00 0.00 C ATOM 823 CD ARG A 51 7.187 13.207 -19.457 1.00 0.00 C ATOM 824 NE ARG A 51 8.592 12.848 -19.572 1.00 0.00 N ATOM 825 CZ ARG A 51 9.183 12.429 -20.708 1.00 0.00 C ATOM 826 NH1 ARG A 51 8.481 12.321 -21.814 1.00 0.00 N ATOM 827 NH2 ARG A 51 10.470 12.126 -20.710 1.00 0.00 N ATOM 0 H ARG A 51 2.971 14.568 -17.889 1.00 0.00 H new ATOM 0 HA ARG A 51 4.501 12.572 -19.168 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.229 14.903 -18.743 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.240 14.589 -17.019 1.00 0.00 H new ATOM 0 HG2 ARG A 51 7.505 14.488 -17.804 1.00 0.00 H new ATOM 0 HG3 ARG A 51 7.015 12.860 -17.378 1.00 0.00 H new ATOM 0 HD2 ARG A 51 6.570 12.346 -19.715 1.00 0.00 H new ATOM 0 HD3 ARG A 51 6.953 13.993 -20.175 1.00 0.00 H new ATOM 0 HE ARG A 51 9.170 12.918 -18.734 1.00 0.00 H new ATOM 0 HH11 ARG A 51 7.488 12.554 -21.813 1.00 0.00 H new ATOM 0 HH12 ARG A 51 8.929 12.004 -22.674 1.00 0.00 H new ATOM 0 HH21 ARG A 51 11.015 12.209 -19.852 1.00 0.00 H new ATOM 0 HH22 ARG A 51 10.918 11.809 -21.570 1.00 0.00 H new ATOM 841 N ARG A 52 4.080 12.260 -15.909 1.00 0.00 N ATOM 842 CA ARG A 52 4.179 11.320 -14.798 1.00 0.00 C ATOM 843 C ARG A 52 3.222 10.149 -14.982 1.00 0.00 C ATOM 844 O ARG A 52 3.508 9.030 -14.555 1.00 0.00 O ATOM 845 CB ARG A 52 3.877 12.016 -13.480 1.00 0.00 C ATOM 846 CG ARG A 52 4.948 12.987 -13.009 1.00 0.00 C ATOM 847 CD ARG A 52 4.543 13.691 -11.765 1.00 0.00 C ATOM 848 NE ARG A 52 5.566 14.617 -11.308 1.00 0.00 N ATOM 849 CZ ARG A 52 5.406 15.498 -10.302 1.00 0.00 C ATOM 850 NH1 ARG A 52 4.261 15.561 -9.659 1.00 0.00 N ATOM 851 NH2 ARG A 52 6.401 16.300 -9.961 1.00 0.00 N ATOM 0 H ARG A 52 3.625 13.143 -15.675 1.00 0.00 H new ATOM 0 HA ARG A 52 5.200 10.939 -14.780 1.00 0.00 H new ATOM 0 HB2 ARG A 52 2.935 12.556 -13.578 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.731 11.258 -12.711 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.878 12.446 -12.835 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.146 13.718 -13.793 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.614 14.234 -11.941 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.341 12.959 -10.983 1.00 0.00 H new ATOM 0 HE ARG A 52 6.469 14.598 -11.783 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.494 14.943 -9.922 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.140 16.228 -8.897 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.289 16.251 -10.460 1.00 0.00 H new ATOM 0 HH22 ARG A 52 6.280 16.967 -9.199 1.00 0.00 H new ATOM 865 N LYS A 53 2.086 10.413 -15.618 1.00 0.00 N ATOM 866 CA LYS A 53 1.150 9.357 -15.985 1.00 0.00 C ATOM 867 C LYS A 53 1.758 8.416 -17.018 1.00 0.00 C ATOM 868 O LYS A 53 1.583 7.200 -16.943 1.00 0.00 O ATOM 869 CB LYS A 53 -0.151 9.956 -16.521 1.00 0.00 C ATOM 870 CG LYS A 53 -1.009 10.641 -15.466 1.00 0.00 C ATOM 871 CD LYS A 53 -2.216 11.323 -16.092 1.00 0.00 C ATOM 872 CE LYS A 53 -3.000 12.120 -15.061 1.00 0.00 C ATOM 873 NZ LYS A 53 -4.103 12.902 -15.683 1.00 0.00 N ATOM 0 H LYS A 53 1.791 11.351 -15.890 1.00 0.00 H new ATOM 0 HA LYS A 53 0.930 8.780 -15.087 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.090 10.678 -17.301 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -0.736 9.164 -16.989 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -1.343 9.907 -14.733 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -0.410 11.377 -14.929 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -1.887 11.985 -16.893 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -2.865 10.573 -16.545 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.413 11.441 -14.315 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.326 12.797 -14.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.752 13.237 -14.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.706 13.718 -16.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.623 12.298 -16.351 1.00 0.00 H new ATOM 887 N LEU A 54 2.473 8.987 -17.982 1.00 0.00 N ATOM 888 CA LEU A 54 3.192 8.196 -18.973 1.00 0.00 C ATOM 889 C LEU A 54 4.210 7.276 -18.311 1.00 0.00 C ATOM 890 O LEU A 54 4.382 6.128 -18.721 1.00 0.00 O ATOM 891 CB LEU A 54 3.900 9.117 -19.974 1.00 0.00 C ATOM 892 CG LEU A 54 4.590 8.415 -21.151 1.00 0.00 C ATOM 893 CD1 LEU A 54 3.551 7.670 -21.978 1.00 0.00 C ATOM 894 CD2 LEU A 54 5.325 9.445 -21.996 1.00 0.00 C ATOM 0 H LEU A 54 2.570 9.996 -18.098 1.00 0.00 H new ATOM 0 HA LEU A 54 2.464 7.579 -19.501 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.169 9.820 -20.372 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.646 9.703 -19.436 1.00 0.00 H new ATOM 0 HG LEU A 54 5.317 7.692 -20.780 1.00 0.00 H new ATOM 0 HD11 LEU A 54 4.041 7.171 -22.814 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.053 6.928 -21.354 1.00 0.00 H new ATOM 0 HD13 LEU A 54 2.814 8.377 -22.359 1.00 0.00 H new ATOM 0 HD21 LEU A 54 5.815 8.947 -22.832 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.614 10.178 -22.377 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.073 9.950 -21.385 1.00 0.00 H new ATOM 906 N LEU A 55 4.882 7.787 -17.286 1.00 0.00 N ATOM 907 CA LEU A 55 5.807 6.981 -16.498 1.00 0.00 C ATOM 908 C LEU A 55 5.088 5.822 -15.820 1.00 0.00 C ATOM 909 O LEU A 55 5.592 4.699 -15.790 1.00 0.00 O ATOM 910 CB LEU A 55 6.499 7.850 -15.440 1.00 0.00 C ATOM 911 CG LEU A 55 7.466 8.912 -15.980 1.00 0.00 C ATOM 912 CD1 LEU A 55 7.909 9.821 -14.842 1.00 0.00 C ATOM 913 CD2 LEU A 55 8.659 8.228 -16.631 1.00 0.00 C ATOM 0 H LEU A 55 4.803 8.757 -16.981 1.00 0.00 H new ATOM 0 HA LEU A 55 6.555 6.572 -17.177 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.732 8.350 -14.849 1.00 0.00 H new ATOM 0 HB3 LEU A 55 7.048 7.196 -14.762 1.00 0.00 H new ATOM 0 HG LEU A 55 6.967 9.522 -16.733 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.596 10.575 -15.225 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.038 10.311 -14.407 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.411 9.228 -14.077 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.346 8.982 -17.015 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.172 7.611 -15.893 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.315 7.600 -17.452 1.00 0.00 H new ATOM 925 N GLY A 56 3.908 6.100 -15.277 1.00 0.00 N ATOM 926 CA GLY A 56 3.103 5.074 -14.625 1.00 0.00 C ATOM 927 C GLY A 56 2.573 4.065 -15.636 1.00 0.00 C ATOM 928 O GLY A 56 2.400 2.888 -15.320 1.00 0.00 O ATOM 0 H GLY A 56 3.487 7.029 -15.276 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.703 4.560 -13.874 1.00 0.00 H new ATOM 0 HA3 GLY A 56 2.269 5.541 -14.101 1.00 0.00 H new ATOM 932 N LEU A 57 2.317 4.533 -16.853 1.00 0.00 N ATOM 933 CA LEU A 57 1.892 3.655 -17.937 1.00 0.00 C ATOM 934 C LEU A 57 2.964 2.622 -18.262 1.00 0.00 C ATOM 935 O LEU A 57 2.686 1.425 -18.327 1.00 0.00 O ATOM 936 CB LEU A 57 1.571 4.479 -19.191 1.00 0.00 C ATOM 937 CG LEU A 57 1.170 3.673 -20.432 1.00 0.00 C ATOM 938 CD1 LEU A 57 -0.127 2.925 -20.156 1.00 0.00 C ATOM 939 CD2 LEU A 57 1.019 4.611 -21.620 1.00 0.00 C ATOM 0 H LEU A 57 2.397 5.516 -17.113 1.00 0.00 H new ATOM 0 HA LEU A 57 0.995 3.129 -17.609 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.762 5.170 -18.952 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.443 5.083 -19.439 1.00 0.00 H new ATOM 0 HG LEU A 57 1.944 2.942 -20.667 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.412 2.352 -21.039 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.016 2.247 -19.314 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.915 3.639 -19.917 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.734 4.038 -22.502 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.249 5.351 -21.404 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.966 5.117 -21.807 1.00 0.00 H new ATOM 951 N TYR A 58 4.189 3.093 -18.466 1.00 0.00 N ATOM 952 CA TYR A 58 5.307 2.210 -18.776 1.00 0.00 C ATOM 953 C TYR A 58 5.687 1.358 -17.571 1.00 0.00 C ATOM 954 O TYR A 58 6.128 0.218 -17.719 1.00 0.00 O ATOM 955 CB TYR A 58 6.514 3.021 -19.254 1.00 0.00 C ATOM 956 CG TYR A 58 6.372 3.552 -20.663 1.00 0.00 C ATOM 957 CD1 TYR A 58 6.480 4.914 -20.905 1.00 0.00 C ATOM 958 CD2 TYR A 58 6.135 2.678 -21.714 1.00 0.00 C ATOM 959 CE1 TYR A 58 6.351 5.399 -22.193 1.00 0.00 C ATOM 960 CE2 TYR A 58 6.006 3.163 -23.001 1.00 0.00 C ATOM 961 CZ TYR A 58 6.113 4.517 -23.241 1.00 0.00 C ATOM 962 OH TYR A 58 5.985 5.001 -24.523 1.00 0.00 O ATOM 0 H TYR A 58 4.433 4.082 -18.422 1.00 0.00 H new ATOM 0 HA TYR A 58 4.993 1.542 -19.578 1.00 0.00 H new ATOM 0 HB2 TYR A 58 6.670 3.858 -18.574 1.00 0.00 H new ATOM 0 HB3 TYR A 58 7.405 2.396 -19.199 1.00 0.00 H new ATOM 0 HD1 TYR A 58 6.665 5.595 -20.087 1.00 0.00 H new ATOM 0 HD2 TYR A 58 6.051 1.618 -21.526 1.00 0.00 H new ATOM 0 HE1 TYR A 58 6.435 6.459 -22.384 1.00 0.00 H new ATOM 0 HE2 TYR A 58 5.821 2.482 -23.819 1.00 0.00 H new ATOM 0 HH TYR A 58 5.823 4.256 -25.139 1.00 0.00 H new ATOM 972 N LEU A 59 5.514 1.919 -16.379 1.00 0.00 N ATOM 973 CA LEU A 59 5.713 1.169 -15.144 1.00 0.00 C ATOM 974 C LEU A 59 4.843 -0.081 -15.112 1.00 0.00 C ATOM 975 O LEU A 59 5.332 -1.183 -14.867 1.00 0.00 O ATOM 976 CB LEU A 59 5.395 2.052 -13.931 1.00 0.00 C ATOM 977 CG LEU A 59 5.448 1.353 -12.567 1.00 0.00 C ATOM 978 CD1 LEU A 59 6.844 0.792 -12.337 1.00 0.00 C ATOM 979 CD2 LEU A 59 5.068 2.342 -11.474 1.00 0.00 C ATOM 0 H LEU A 59 5.236 2.891 -16.242 1.00 0.00 H new ATOM 0 HA LEU A 59 6.758 0.861 -15.104 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.096 2.886 -13.918 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.399 2.475 -14.064 1.00 0.00 H new ATOM 0 HG LEU A 59 4.738 0.526 -12.544 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.881 0.295 -11.367 1.00 0.00 H new ATOM 0 HD12 LEU A 59 7.081 0.074 -13.122 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.570 1.604 -12.357 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.106 1.845 -10.505 1.00 0.00 H new ATOM 0 HD22 LEU A 59 5.767 3.178 -11.481 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.058 2.712 -11.653 1.00 0.00 H new ATOM 991 N MET A 60 3.550 0.098 -15.362 1.00 0.00 N ATOM 992 CA MET A 60 2.633 -1.028 -15.498 1.00 0.00 C ATOM 993 C MET A 60 3.129 -2.019 -16.542 1.00 0.00 C ATOM 994 O MET A 60 3.242 -3.215 -16.272 1.00 0.00 O ATOM 995 CB MET A 60 1.235 -0.529 -15.858 1.00 0.00 C ATOM 996 CG MET A 60 0.230 -1.633 -16.154 1.00 0.00 C ATOM 997 SD MET A 60 -1.341 -0.995 -16.771 1.00 0.00 S ATOM 998 CE MET A 60 -0.890 -0.549 -18.445 1.00 0.00 C ATOM 0 H MET A 60 3.113 1.013 -15.475 1.00 0.00 H new ATOM 0 HA MET A 60 2.588 -1.546 -14.540 1.00 0.00 H new ATOM 0 HB2 MET A 60 0.857 0.079 -15.036 1.00 0.00 H new ATOM 0 HB3 MET A 60 1.308 0.122 -16.729 1.00 0.00 H new ATOM 0 HG2 MET A 60 0.654 -2.317 -16.889 1.00 0.00 H new ATOM 0 HG3 MET A 60 0.052 -2.210 -15.247 1.00 0.00 H new ATOM 0 HE1 MET A 60 -0.989 0.529 -18.573 1.00 0.00 H new ATOM 0 HE2 MET A 60 0.142 -0.844 -18.635 1.00 0.00 H new ATOM 0 HE3 MET A 60 -1.548 -1.060 -19.148 1.00 0.00 H new ATOM 1008 N ASN A 61 3.424 -1.516 -17.736 1.00 0.00 N ATOM 1009 CA ASN A 61 3.828 -2.368 -18.848 1.00 0.00 C ATOM 1010 C ASN A 61 4.947 -3.316 -18.438 1.00 0.00 C ATOM 1011 O ASN A 61 4.925 -4.500 -18.776 1.00 0.00 O ATOM 1012 CB ASN A 61 4.250 -1.527 -20.039 1.00 0.00 C ATOM 1013 CG ASN A 61 4.544 -2.357 -21.257 1.00 0.00 C ATOM 1014 OD1 ASN A 61 3.668 -3.063 -21.769 1.00 0.00 O ATOM 1015 ND2 ASN A 61 5.762 -2.286 -21.732 1.00 0.00 N ATOM 0 H ASN A 61 3.391 -0.521 -17.958 1.00 0.00 H new ATOM 0 HA ASN A 61 2.968 -2.971 -19.137 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.461 -0.812 -20.273 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.136 -0.949 -19.775 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.020 -2.827 -22.557 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.453 -1.690 -21.277 1.00 0.00 H new ATOM 1022 N HIS A 62 5.924 -2.790 -17.708 1.00 0.00 N ATOM 1023 CA HIS A 62 7.070 -3.581 -17.276 1.00 0.00 C ATOM 1024 C HIS A 62 6.657 -4.645 -16.268 1.00 0.00 C ATOM 1025 O HIS A 62 7.127 -5.782 -16.322 1.00 0.00 O ATOM 1026 CB HIS A 62 8.149 -2.682 -16.665 1.00 0.00 C ATOM 1027 CG HIS A 62 8.794 -1.759 -17.652 1.00 0.00 C ATOM 1028 ND1 HIS A 62 9.621 -0.723 -17.271 1.00 0.00 N ATOM 1029 CD2 HIS A 62 8.732 -1.714 -19.003 1.00 0.00 C ATOM 1030 CE1 HIS A 62 10.041 -0.082 -18.348 1.00 0.00 C ATOM 1031 NE2 HIS A 62 9.516 -0.663 -19.411 1.00 0.00 N ATOM 0 H HIS A 62 5.945 -1.817 -17.402 1.00 0.00 H new ATOM 0 HA HIS A 62 7.477 -4.077 -18.157 1.00 0.00 H new ATOM 0 HB2 HIS A 62 7.706 -2.091 -15.864 1.00 0.00 H new ATOM 0 HB3 HIS A 62 8.917 -3.308 -16.211 1.00 0.00 H new ATOM 0 HD2 HIS A 62 8.171 -2.380 -19.641 1.00 0.00 H new ATOM 0 HE1 HIS A 62 10.702 0.772 -18.357 1.00 0.00 H new ATOM 0 HE2 HIS A 62 9.668 -0.378 -20.378 1.00 0.00 H new ATOM 1039 N VAL A 63 5.774 -4.271 -15.348 1.00 0.00 N ATOM 1040 CA VAL A 63 5.342 -5.174 -14.288 1.00 0.00 C ATOM 1041 C VAL A 63 4.490 -6.308 -14.844 1.00 0.00 C ATOM 1042 O VAL A 63 4.694 -7.473 -14.504 1.00 0.00 O ATOM 1043 CB VAL A 63 4.536 -4.403 -13.225 1.00 0.00 C ATOM 1044 CG1 VAL A 63 3.900 -5.368 -12.236 1.00 0.00 C ATOM 1045 CG2 VAL A 63 5.441 -3.413 -12.507 1.00 0.00 C ATOM 0 H VAL A 63 5.343 -3.347 -15.315 1.00 0.00 H new ATOM 0 HA VAL A 63 6.235 -5.600 -13.831 1.00 0.00 H new ATOM 0 HB VAL A 63 3.737 -3.850 -13.719 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.335 -4.807 -11.492 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.230 -6.044 -12.767 1.00 0.00 H new ATOM 0 HG13 VAL A 63 4.679 -5.946 -11.739 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.865 -2.871 -11.757 1.00 0.00 H new ATOM 0 HG22 VAL A 63 6.255 -3.951 -12.021 1.00 0.00 H new ATOM 0 HG23 VAL A 63 5.852 -2.707 -13.228 1.00 0.00 H new ATOM 1055 N VAL A 64 3.535 -5.959 -15.699 1.00 0.00 N ATOM 1056 CA VAL A 64 2.593 -6.935 -16.235 1.00 0.00 C ATOM 1057 C VAL A 64 3.268 -7.855 -17.244 1.00 0.00 C ATOM 1058 O VAL A 64 2.824 -8.982 -17.465 1.00 0.00 O ATOM 1059 CB VAL A 64 1.408 -6.219 -16.909 1.00 0.00 C ATOM 1060 CG1 VAL A 64 0.713 -5.293 -15.922 1.00 0.00 C ATOM 1061 CG2 VAL A 64 1.895 -5.444 -18.124 1.00 0.00 C ATOM 0 H VAL A 64 3.393 -5.007 -16.036 1.00 0.00 H new ATOM 0 HA VAL A 64 2.230 -7.538 -15.402 1.00 0.00 H new ATOM 0 HB VAL A 64 0.685 -6.965 -17.238 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.122 -4.796 -16.416 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.341 -5.874 -15.078 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.421 -4.545 -15.564 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.052 -4.940 -18.596 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.632 -4.704 -17.812 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.351 -6.132 -18.836 1.00 0.00 H new ATOM 1071 N GLN A 65 4.343 -7.368 -17.855 1.00 0.00 N ATOM 1072 CA GLN A 65 5.193 -8.205 -18.693 1.00 0.00 C ATOM 1073 C GLN A 65 5.917 -9.258 -17.864 1.00 0.00 C ATOM 1074 O GLN A 65 6.052 -10.408 -18.285 1.00 0.00 O ATOM 1075 CB GLN A 65 6.209 -7.347 -19.451 1.00 0.00 C ATOM 1076 CG GLN A 65 7.074 -8.125 -20.428 1.00 0.00 C ATOM 1077 CD GLN A 65 6.262 -8.759 -21.542 1.00 0.00 C ATOM 1078 OE1 GLN A 65 5.499 -8.082 -22.235 1.00 0.00 O ATOM 1079 NE2 GLN A 65 6.423 -10.066 -21.719 1.00 0.00 N ATOM 0 H GLN A 65 4.646 -6.397 -17.785 1.00 0.00 H new ATOM 0 HA GLN A 65 4.552 -8.716 -19.412 1.00 0.00 H new ATOM 0 HB2 GLN A 65 5.676 -6.568 -19.996 1.00 0.00 H new ATOM 0 HB3 GLN A 65 6.855 -6.846 -18.730 1.00 0.00 H new ATOM 0 HG2 GLN A 65 7.819 -7.457 -20.860 1.00 0.00 H new ATOM 0 HG3 GLN A 65 7.616 -8.902 -19.890 1.00 0.00 H new ATOM 0 HE21 GLN A 65 7.066 -10.586 -21.122 1.00 0.00 H new ATOM 0 HE22 GLN A 65 5.904 -10.549 -22.452 1.00 0.00 H new ATOM 1088 N GLN A 66 6.382 -8.860 -16.685 1.00 0.00 N ATOM 1089 CA GLN A 66 6.972 -9.798 -15.738 1.00 0.00 C ATOM 1090 C GLN A 66 5.917 -10.726 -15.151 1.00 0.00 C ATOM 1091 O GLN A 66 6.188 -11.894 -14.875 1.00 0.00 O ATOM 1092 CB GLN A 66 7.689 -9.044 -14.614 1.00 0.00 C ATOM 1093 CG GLN A 66 8.989 -8.383 -15.038 1.00 0.00 C ATOM 1094 CD GLN A 66 10.029 -9.390 -15.491 1.00 0.00 C ATOM 1095 OE1 GLN A 66 10.193 -10.451 -14.882 1.00 0.00 O ATOM 1096 NE2 GLN A 66 10.740 -9.063 -16.564 1.00 0.00 N ATOM 0 H GLN A 66 6.362 -7.893 -16.362 1.00 0.00 H new ATOM 0 HA GLN A 66 7.698 -10.405 -16.279 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.019 -8.281 -14.218 1.00 0.00 H new ATOM 0 HB3 GLN A 66 7.896 -9.739 -13.800 1.00 0.00 H new ATOM 0 HG2 GLN A 66 8.789 -7.682 -15.848 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.387 -7.803 -14.205 1.00 0.00 H new ATOM 0 HE21 GLN A 66 10.571 -8.175 -17.037 1.00 0.00 H new ATOM 0 HE22 GLN A 66 11.455 -9.700 -16.915 1.00 0.00 H new ATOM 1105 N ALA A 67 4.712 -10.198 -14.962 1.00 0.00 N ATOM 1106 CA ALA A 67 3.588 -11.003 -14.498 1.00 0.00 C ATOM 1107 C ALA A 67 3.225 -12.079 -15.513 1.00 0.00 C ATOM 1108 O ALA A 67 2.816 -13.181 -15.145 1.00 0.00 O ATOM 1109 CB ALA A 67 2.384 -10.117 -14.213 1.00 0.00 C ATOM 0 H ALA A 67 4.489 -9.216 -15.123 1.00 0.00 H new ATOM 0 HA ALA A 67 3.888 -11.498 -13.575 1.00 0.00 H new ATOM 0 HB1 ALA A 67 1.553 -10.732 -13.868 1.00 0.00 H new ATOM 0 HB2 ALA A 67 2.642 -9.390 -13.443 1.00 0.00 H new ATOM 0 HB3 ALA A 67 2.094 -9.594 -15.124 1.00 0.00 H new ATOM 1115 N LYS A 68 3.376 -11.754 -16.793 1.00 0.00 N ATOM 1116 CA LYS A 68 3.143 -12.718 -17.861 1.00 0.00 C ATOM 1117 C LYS A 68 4.193 -13.822 -17.845 1.00 0.00 C ATOM 1118 O LYS A 68 3.865 -15.005 -17.941 1.00 0.00 O ATOM 1119 CB LYS A 68 3.137 -12.019 -19.221 1.00 0.00 C ATOM 1120 CG LYS A 68 2.895 -12.948 -20.404 1.00 0.00 C ATOM 1121 CD LYS A 68 1.480 -13.506 -20.389 1.00 0.00 C ATOM 1122 CE LYS A 68 1.235 -14.427 -21.575 1.00 0.00 C ATOM 1123 NZ LYS A 68 -0.164 -14.933 -21.607 1.00 0.00 N ATOM 0 H LYS A 68 3.659 -10.829 -17.116 1.00 0.00 H new ATOM 0 HA LYS A 68 2.167 -13.173 -17.692 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.367 -11.248 -19.216 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.093 -11.514 -19.361 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.065 -12.407 -21.335 1.00 0.00 H new ATOM 0 HG3 LYS A 68 3.612 -13.769 -20.377 1.00 0.00 H new ATOM 0 HD2 LYS A 68 1.312 -14.053 -19.461 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.763 -12.685 -20.409 1.00 0.00 H new ATOM 0 HE2 LYS A 68 1.448 -13.892 -22.500 1.00 0.00 H new ATOM 0 HE3 LYS A 68 1.925 -15.270 -21.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.242 -15.694 -22.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -0.422 -15.301 -20.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.808 -14.158 -21.863 1.00 0.00 H new ATOM 1137 N GLY A 69 5.456 -13.429 -17.721 1.00 0.00 N ATOM 1138 CA GLY A 69 6.557 -14.384 -17.705 1.00 0.00 C ATOM 1139 C GLY A 69 6.545 -15.217 -16.429 1.00 0.00 C ATOM 1140 O GLY A 69 6.781 -16.425 -16.463 1.00 0.00 O ATOM 0 H GLY A 69 5.743 -12.454 -17.630 1.00 0.00 H new ATOM 0 HA2 GLY A 69 6.485 -15.041 -18.572 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.505 -13.852 -17.786 1.00 0.00 H new ATOM 1144 N GLN A 70 6.267 -14.565 -15.305 1.00 0.00 N ATOM 1145 CA GLN A 70 6.274 -15.234 -14.010 1.00 0.00 C ATOM 1146 C GLN A 70 4.912 -15.840 -13.696 1.00 0.00 C ATOM 1147 O GLN A 70 4.757 -16.567 -12.715 1.00 0.00 O ATOM 1148 CB GLN A 70 6.679 -14.256 -12.904 1.00 0.00 C ATOM 1149 CG GLN A 70 8.096 -13.725 -13.031 1.00 0.00 C ATOM 1150 CD GLN A 70 8.446 -12.740 -11.931 1.00 0.00 C ATOM 1151 OE1 GLN A 70 8.120 -12.954 -10.760 1.00 0.00 O ATOM 1152 NE2 GLN A 70 9.113 -11.653 -12.302 1.00 0.00 N ATOM 0 H GLN A 70 6.034 -13.573 -15.265 1.00 0.00 H new ATOM 0 HA GLN A 70 7.005 -16.041 -14.056 1.00 0.00 H new ATOM 0 HB2 GLN A 70 5.986 -13.415 -12.907 1.00 0.00 H new ATOM 0 HB3 GLN A 70 6.574 -14.752 -11.939 1.00 0.00 H new ATOM 0 HG2 GLN A 70 8.797 -14.559 -13.005 1.00 0.00 H new ATOM 0 HG3 GLN A 70 8.214 -13.240 -14.000 1.00 0.00 H new ATOM 0 HE21 GLN A 70 9.362 -11.517 -13.282 1.00 0.00 H new ATOM 0 HE22 GLN A 70 9.376 -10.954 -11.607 1.00 0.00 H new ATOM 1161 N LYS A 71 3.927 -15.536 -14.534 1.00 0.00 N ATOM 1162 CA LYS A 71 2.586 -16.084 -14.372 1.00 0.00 C ATOM 1163 C LYS A 71 1.973 -15.658 -13.044 1.00 0.00 C ATOM 1164 O LYS A 71 1.607 -16.497 -12.221 1.00 0.00 O ATOM 1165 CB LYS A 71 2.616 -17.610 -14.472 1.00 0.00 C ATOM 1166 CG LYS A 71 3.146 -18.144 -15.796 1.00 0.00 C ATOM 1167 CD LYS A 71 3.097 -19.664 -15.838 1.00 0.00 C ATOM 1168 CE LYS A 71 3.666 -20.200 -17.144 1.00 0.00 C ATOM 1169 NZ LYS A 71 3.652 -21.688 -17.187 1.00 0.00 N ATOM 0 H LYS A 71 4.033 -14.912 -15.334 1.00 0.00 H new ATOM 0 HA LYS A 71 1.965 -15.689 -15.176 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.232 -18.003 -13.663 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.607 -17.992 -14.318 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.557 -17.736 -16.617 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.172 -17.807 -15.942 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.661 -20.071 -14.999 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.067 -20.000 -15.723 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.087 -19.807 -17.980 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.688 -19.843 -17.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.047 -22.013 -18.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.225 -22.063 -16.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.674 -22.029 -17.094 1.00 0.00 H new ATOM 1183 N ILE A 72 1.865 -14.349 -12.841 1.00 0.00 N ATOM 1184 CA ILE A 72 1.278 -13.809 -11.621 1.00 0.00 C ATOM 1185 C ILE A 72 -0.117 -13.253 -11.880 1.00 0.00 C ATOM 1186 O ILE A 72 -0.268 -12.148 -12.402 1.00 0.00 O ATOM 1187 CB ILE A 72 2.169 -12.704 -11.024 1.00 0.00 C ATOM 1188 CG1 ILE A 72 3.575 -13.243 -10.749 1.00 0.00 C ATOM 1189 CG2 ILE A 72 1.549 -12.152 -9.750 1.00 0.00 C ATOM 1190 CD1 ILE A 72 4.575 -12.175 -10.369 1.00 0.00 C ATOM 0 H ILE A 72 2.177 -13.642 -13.507 1.00 0.00 H new ATOM 0 HA ILE A 72 1.202 -14.629 -10.907 1.00 0.00 H new ATOM 0 HB ILE A 72 2.247 -11.892 -11.747 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.521 -13.979 -9.947 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.934 -13.764 -11.636 1.00 0.00 H new ATOM 0 HG21 ILE A 72 2.191 -11.372 -9.341 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.568 -11.733 -9.975 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.443 -12.954 -9.020 1.00 0.00 H new ATOM 0 HD11 ILE A 72 5.547 -12.634 -10.190 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.659 -11.451 -11.179 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.240 -11.669 -9.463 1.00 0.00 H new ATOM 1202 N ILE A 73 -1.134 -14.025 -11.514 1.00 0.00 N ATOM 1203 CA ILE A 73 -2.516 -13.653 -11.789 1.00 0.00 C ATOM 1204 C ILE A 73 -2.953 -12.478 -10.923 1.00 0.00 C ATOM 1205 O ILE A 73 -3.961 -11.829 -11.204 1.00 0.00 O ATOM 1206 CB ILE A 73 -3.463 -14.844 -11.555 1.00 0.00 C ATOM 1207 CG1 ILE A 73 -3.457 -15.248 -10.078 1.00 0.00 C ATOM 1208 CG2 ILE A 73 -3.065 -16.021 -12.433 1.00 0.00 C ATOM 1209 CD1 ILE A 73 -4.504 -16.280 -9.723 1.00 0.00 C ATOM 0 H ILE A 73 -1.027 -14.914 -11.025 1.00 0.00 H new ATOM 0 HA ILE A 73 -2.569 -13.356 -12.836 1.00 0.00 H new ATOM 0 HB ILE A 73 -4.474 -14.541 -11.825 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.473 -15.640 -9.822 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -3.615 -14.359 -9.467 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -3.745 -16.854 -12.255 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.118 -15.727 -13.481 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -2.047 -16.326 -12.193 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.438 -16.515 -8.661 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.495 -15.884 -9.946 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.335 -17.185 -10.306 1.00 0.00 H new ATOM 1221 N GLN A 74 -2.190 -12.210 -9.869 1.00 0.00 N ATOM 1222 CA GLN A 74 -2.486 -11.101 -8.971 1.00 0.00 C ATOM 1223 C GLN A 74 -2.388 -9.764 -9.696 1.00 0.00 C ATOM 1224 O GLN A 74 -3.113 -8.821 -9.379 1.00 0.00 O ATOM 1225 CB GLN A 74 -1.536 -11.115 -7.771 1.00 0.00 C ATOM 1226 CG GLN A 74 -1.707 -12.315 -6.856 1.00 0.00 C ATOM 1227 CD GLN A 74 -3.104 -12.404 -6.273 1.00 0.00 C ATOM 1228 OE1 GLN A 74 -3.692 -11.394 -5.875 1.00 0.00 O ATOM 1229 NE2 GLN A 74 -3.646 -13.616 -6.218 1.00 0.00 N ATOM 0 H GLN A 74 -1.361 -12.747 -9.616 1.00 0.00 H new ATOM 0 HA GLN A 74 -3.509 -11.224 -8.616 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -0.509 -11.093 -8.135 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -1.688 -10.205 -7.191 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -1.490 -13.227 -7.413 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -0.981 -12.256 -6.045 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -3.124 -14.424 -6.558 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -4.584 -13.738 -5.836 1.00 0.00 H new ATOM 1238 N PHE A 75 -1.488 -9.690 -10.670 1.00 0.00 N ATOM 1239 CA PHE A 75 -1.279 -8.462 -11.427 1.00 0.00 C ATOM 1240 C PHE A 75 -2.203 -8.396 -12.636 1.00 0.00 C ATOM 1241 O PHE A 75 -2.603 -7.313 -13.066 1.00 0.00 O ATOM 1242 CB PHE A 75 0.177 -8.358 -11.887 1.00 0.00 C ATOM 1243 CG PHE A 75 1.149 -8.105 -10.769 1.00 0.00 C ATOM 1244 CD1 PHE A 75 2.280 -8.893 -10.623 1.00 0.00 C ATOM 1245 CD2 PHE A 75 0.933 -7.079 -9.862 1.00 0.00 C ATOM 1246 CE1 PHE A 75 3.175 -8.661 -9.595 1.00 0.00 C ATOM 1247 CE2 PHE A 75 1.825 -6.844 -8.834 1.00 0.00 C ATOM 1248 CZ PHE A 75 2.948 -7.637 -8.701 1.00 0.00 C ATOM 0 H PHE A 75 -0.891 -10.467 -10.954 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.510 -7.625 -10.768 1.00 0.00 H new ATOM 0 HB2 PHE A 75 0.455 -9.281 -12.395 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.261 -7.554 -12.618 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.464 -9.697 -11.320 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.056 -6.456 -9.960 1.00 0.00 H new ATOM 0 HE1 PHE A 75 4.052 -9.282 -9.493 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.645 -6.041 -8.135 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.647 -7.455 -7.898 1.00 0.00 H new ATOM 1258 N GLN A 76 -2.541 -9.560 -13.181 1.00 0.00 N ATOM 1259 CA GLN A 76 -3.523 -9.647 -14.255 1.00 0.00 C ATOM 1260 C GLN A 76 -4.888 -9.150 -13.795 1.00 0.00 C ATOM 1261 O GLN A 76 -5.624 -8.530 -14.563 1.00 0.00 O ATOM 1262 CB GLN A 76 -3.635 -11.086 -14.763 1.00 0.00 C ATOM 1263 CG GLN A 76 -2.426 -11.565 -15.550 1.00 0.00 C ATOM 1264 CD GLN A 76 -2.588 -12.987 -16.052 1.00 0.00 C ATOM 1265 OE1 GLN A 76 -2.932 -13.894 -15.289 1.00 0.00 O ATOM 1266 NE2 GLN A 76 -2.340 -13.190 -17.341 1.00 0.00 N ATOM 0 H GLN A 76 -2.148 -10.457 -12.896 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.182 -9.008 -15.070 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.786 -11.749 -13.911 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -4.521 -11.169 -15.393 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.261 -10.900 -16.398 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -1.539 -11.504 -14.920 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -2.058 -12.410 -17.935 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -2.432 -14.126 -17.737 1.00 0.00 H new ATOM 1275 N ASP A 77 -5.220 -9.426 -12.538 1.00 0.00 N ATOM 1276 CA ASP A 77 -6.437 -8.898 -11.934 1.00 0.00 C ATOM 1277 C ASP A 77 -6.248 -7.455 -11.484 1.00 0.00 C ATOM 1278 O ASP A 77 -7.035 -6.577 -11.838 1.00 0.00 O ATOM 1279 CB ASP A 77 -6.861 -9.759 -10.742 1.00 0.00 C ATOM 1280 CG ASP A 77 -7.394 -11.124 -11.156 1.00 0.00 C ATOM 1281 OD1 ASP A 77 -7.674 -11.303 -12.318 1.00 0.00 O ATOM 1282 OD2 ASP A 77 -7.516 -11.975 -10.307 1.00 0.00 O ATOM 0 H ASP A 77 -4.662 -10.013 -11.918 1.00 0.00 H new ATOM 0 HA ASP A 77 -7.220 -8.924 -12.692 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.008 -9.894 -10.077 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.628 -9.232 -10.174 1.00 0.00 H new ATOM 1287 N SER A 78 -5.200 -7.217 -10.703 1.00 0.00 N ATOM 1288 CA SER A 78 -4.956 -5.898 -10.129 1.00 0.00 C ATOM 1289 C SER A 78 -5.026 -4.813 -11.195 1.00 0.00 C ATOM 1290 O SER A 78 -5.755 -3.831 -11.049 1.00 0.00 O ATOM 1291 CB SER A 78 -3.601 -5.867 -9.451 1.00 0.00 C ATOM 1292 OG SER A 78 -3.322 -4.591 -8.945 1.00 0.00 O ATOM 0 H SER A 78 -4.505 -7.920 -10.453 1.00 0.00 H new ATOM 0 HA SER A 78 -5.734 -5.703 -9.391 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.579 -6.596 -8.641 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.828 -6.157 -10.162 1.00 0.00 H new ATOM 0 HG SER A 78 -3.084 -4.660 -7.997 1.00 0.00 H new ATOM 1298 N PHE A 79 -4.265 -4.995 -12.269 1.00 0.00 N ATOM 1299 CA PHE A 79 -4.198 -4.005 -13.337 1.00 0.00 C ATOM 1300 C PHE A 79 -5.359 -4.164 -14.310 1.00 0.00 C ATOM 1301 O PHE A 79 -5.949 -3.180 -14.754 1.00 0.00 O ATOM 1302 CB PHE A 79 -2.873 -4.123 -14.093 1.00 0.00 C ATOM 1303 CG PHE A 79 -1.693 -3.586 -13.335 1.00 0.00 C ATOM 1304 CD1 PHE A 79 -0.733 -4.444 -12.818 1.00 0.00 C ATOM 1305 CD2 PHE A 79 -1.539 -2.222 -13.136 1.00 0.00 C ATOM 1306 CE1 PHE A 79 0.353 -3.950 -12.120 1.00 0.00 C ATOM 1307 CE2 PHE A 79 -0.454 -1.726 -12.440 1.00 0.00 C ATOM 1308 CZ PHE A 79 0.493 -2.592 -11.931 1.00 0.00 C ATOM 0 H PHE A 79 -3.685 -5.820 -12.423 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.264 -3.019 -12.878 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -2.693 -5.171 -14.331 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.957 -3.591 -15.040 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.835 -5.509 -12.963 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.277 -1.539 -13.530 1.00 0.00 H new ATOM 0 HE1 PHE A 79 1.093 -4.629 -11.722 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.347 -0.661 -12.294 1.00 0.00 H new ATOM 0 HZ PHE A 79 1.342 -2.206 -11.386 1.00 0.00 H new ATOM 1318 N GLY A 80 -5.682 -5.411 -14.638 1.00 0.00 N ATOM 1319 CA GLY A 80 -6.676 -5.699 -15.665 1.00 0.00 C ATOM 1320 C GLY A 80 -8.022 -5.075 -15.321 1.00 0.00 C ATOM 1321 O GLY A 80 -8.724 -4.569 -16.196 1.00 0.00 O ATOM 0 H GLY A 80 -5.269 -6.238 -14.207 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.331 -5.318 -16.626 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.789 -6.778 -15.772 1.00 0.00 H new ATOM 1325 N LYS A 81 -8.376 -5.114 -14.041 1.00 0.00 N ATOM 1326 CA LYS A 81 -9.691 -4.666 -13.596 1.00 0.00 C ATOM 1327 C LYS A 81 -9.828 -3.154 -13.717 1.00 0.00 C ATOM 1328 O LYS A 81 -10.935 -2.629 -13.830 1.00 0.00 O ATOM 1329 CB LYS A 81 -9.945 -5.104 -12.153 1.00 0.00 C ATOM 1330 CG LYS A 81 -10.184 -6.598 -11.981 1.00 0.00 C ATOM 1331 CD LYS A 81 -10.423 -6.955 -10.522 1.00 0.00 C ATOM 1332 CE LYS A 81 -10.688 -8.444 -10.351 1.00 0.00 C ATOM 1333 NZ LYS A 81 -10.928 -8.807 -8.928 1.00 0.00 N ATOM 0 H LYS A 81 -7.770 -5.451 -13.293 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.437 -5.128 -14.243 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.091 -4.813 -11.542 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -10.810 -4.564 -11.769 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.044 -6.902 -12.578 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.324 -7.152 -12.357 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -9.555 -6.668 -9.929 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.272 -6.387 -10.141 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.553 -8.729 -10.949 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -9.837 -9.010 -10.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -11.104 -9.829 -8.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.092 -8.559 -8.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -11.755 -8.287 -8.572 1.00 0.00 H new ATOM 1347 N VAL A 82 -8.696 -2.459 -13.693 1.00 0.00 N ATOM 1348 CA VAL A 82 -8.693 -1.001 -13.666 1.00 0.00 C ATOM 1349 C VAL A 82 -8.133 -0.427 -14.962 1.00 0.00 C ATOM 1350 O VAL A 82 -8.343 0.744 -15.275 1.00 0.00 O ATOM 1351 CB VAL A 82 -7.856 -0.490 -12.479 1.00 0.00 C ATOM 1352 CG1 VAL A 82 -8.447 -0.975 -11.163 1.00 0.00 C ATOM 1353 CG2 VAL A 82 -6.414 -0.952 -12.625 1.00 0.00 C ATOM 0 H VAL A 82 -7.768 -2.882 -13.692 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.726 -0.670 -13.555 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.874 0.600 -12.476 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.843 -0.605 -10.335 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.467 -0.603 -11.063 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.455 -2.065 -11.147 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -5.828 -0.587 -11.782 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -6.381 -2.041 -12.645 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -5.998 -0.559 -13.553 1.00 0.00 H new ATOM 1363 N ALA A 83 -7.420 -1.260 -15.712 1.00 0.00 N ATOM 1364 CA ALA A 83 -6.773 -0.820 -16.942 1.00 0.00 C ATOM 1365 C ALA A 83 -7.799 -0.365 -17.972 1.00 0.00 C ATOM 1366 O ALA A 83 -7.608 0.645 -18.649 1.00 0.00 O ATOM 1367 CB ALA A 83 -5.907 -1.933 -17.514 1.00 0.00 C ATOM 0 H ALA A 83 -7.275 -2.245 -15.489 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.137 0.032 -16.700 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.431 -1.588 -18.432 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.141 -2.207 -16.789 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -6.528 -2.802 -17.731 1.00 0.00 H new ATOM 1373 N ALA A 84 -8.888 -1.117 -18.086 1.00 0.00 N ATOM 1374 CA ALA A 84 -9.918 -0.828 -19.077 1.00 0.00 C ATOM 1375 C ALA A 84 -10.486 0.573 -18.889 1.00 0.00 C ATOM 1376 O ALA A 84 -10.793 1.264 -19.861 1.00 0.00 O ATOM 1377 CB ALA A 84 -11.031 -1.864 -19.002 1.00 0.00 C ATOM 0 H ALA A 84 -9.080 -1.932 -17.504 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.458 -0.875 -20.064 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.792 -1.635 -19.748 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.620 -2.855 -19.196 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.479 -1.845 -18.009 1.00 0.00 H new ATOM 1383 N GLU A 85 -10.622 0.987 -17.634 1.00 0.00 N ATOM 1384 CA GLU A 85 -11.143 2.312 -17.317 1.00 0.00 C ATOM 1385 C GLU A 85 -10.050 3.370 -17.410 1.00 0.00 C ATOM 1386 O GLU A 85 -10.199 4.370 -18.111 1.00 0.00 O ATOM 1387 CB GLU A 85 -11.759 2.322 -15.917 1.00 0.00 C ATOM 1388 CG GLU A 85 -12.366 3.656 -15.506 1.00 0.00 C ATOM 1389 CD GLU A 85 -13.003 3.615 -14.145 1.00 0.00 C ATOM 1390 OE1 GLU A 85 -12.962 2.581 -13.522 1.00 0.00 O ATOM 1391 OE2 GLU A 85 -13.530 4.618 -13.727 1.00 0.00 O ATOM 0 H GLU A 85 -10.379 0.424 -16.819 1.00 0.00 H new ATOM 0 HA GLU A 85 -11.915 2.551 -18.049 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.532 1.555 -15.868 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -10.991 2.048 -15.194 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.589 4.421 -15.515 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.113 3.952 -16.242 1.00 0.00 H new ATOM 1398 N VAL A 86 -8.952 3.142 -16.697 1.00 0.00 N ATOM 1399 CA VAL A 86 -7.899 4.143 -16.573 1.00 0.00 C ATOM 1400 C VAL A 86 -7.321 4.507 -17.934 1.00 0.00 C ATOM 1401 O VAL A 86 -7.184 5.684 -18.267 1.00 0.00 O ATOM 1402 CB VAL A 86 -6.771 3.621 -15.663 1.00 0.00 C ATOM 1403 CG1 VAL A 86 -5.561 4.541 -15.733 1.00 0.00 C ATOM 1404 CG2 VAL A 86 -7.274 3.500 -14.232 1.00 0.00 C ATOM 0 H VAL A 86 -8.768 2.273 -16.196 1.00 0.00 H new ATOM 0 HA VAL A 86 -8.342 5.036 -16.132 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.465 2.634 -16.010 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.774 4.157 -15.084 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.196 4.585 -16.759 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.845 5.541 -15.406 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.471 3.130 -13.594 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.599 4.478 -13.877 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -8.113 2.805 -14.199 1.00 0.00 H new ATOM 1414 N LEU A 87 -6.984 3.489 -18.720 1.00 0.00 N ATOM 1415 CA LEU A 87 -6.294 3.696 -19.988 1.00 0.00 C ATOM 1416 C LEU A 87 -7.150 4.503 -20.955 1.00 0.00 C ATOM 1417 O LEU A 87 -6.633 5.290 -21.748 1.00 0.00 O ATOM 1418 CB LEU A 87 -5.932 2.346 -20.620 1.00 0.00 C ATOM 1419 CG LEU A 87 -4.917 1.498 -19.842 1.00 0.00 C ATOM 1420 CD1 LEU A 87 -4.708 0.171 -20.559 1.00 0.00 C ATOM 1421 CD2 LEU A 87 -3.608 2.263 -19.714 1.00 0.00 C ATOM 0 H LEU A 87 -7.178 2.512 -18.501 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.382 4.258 -19.785 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.846 1.765 -20.741 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.536 2.528 -21.619 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.294 1.292 -18.840 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.987 -0.431 -20.006 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.656 -0.363 -20.620 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.331 0.356 -21.565 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.887 1.661 -19.161 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.214 2.479 -20.707 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.783 3.198 -19.182 1.00 0.00 H new ATOM 1433 N GLY A 88 -8.462 4.303 -20.885 1.00 0.00 N ATOM 1434 CA GLY A 88 -9.397 5.062 -21.706 1.00 0.00 C ATOM 1435 C GLY A 88 -9.454 6.521 -21.271 1.00 0.00 C ATOM 1436 O GLY A 88 -9.469 7.427 -22.104 1.00 0.00 O ATOM 0 H GLY A 88 -8.902 3.621 -20.267 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -9.097 5.003 -22.752 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.390 4.619 -21.634 1.00 0.00 H new ATOM 1440 N ARG A 89 -9.487 6.741 -19.961 1.00 0.00 N ATOM 1441 CA ARG A 89 -9.571 8.089 -19.413 1.00 0.00 C ATOM 1442 C ARG A 89 -8.337 8.908 -19.771 1.00 0.00 C ATOM 1443 O ARG A 89 -8.444 10.065 -20.176 1.00 0.00 O ATOM 1444 CB ARG A 89 -9.723 8.043 -17.899 1.00 0.00 C ATOM 1445 CG ARG A 89 -11.081 7.570 -17.407 1.00 0.00 C ATOM 1446 CD ARG A 89 -11.196 7.672 -15.930 1.00 0.00 C ATOM 1447 NE ARG A 89 -12.458 7.137 -15.446 1.00 0.00 N ATOM 1448 CZ ARG A 89 -13.633 7.796 -15.481 1.00 0.00 C ATOM 1449 NH1 ARG A 89 -13.689 9.011 -15.980 1.00 0.00 N ATOM 1450 NH2 ARG A 89 -14.728 7.221 -15.015 1.00 0.00 N ATOM 0 H ARG A 89 -9.457 6.002 -19.259 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.448 8.566 -19.851 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -8.956 7.385 -17.491 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.534 9.039 -17.499 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -11.865 8.165 -17.875 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -11.239 6.536 -17.714 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -10.371 7.134 -15.464 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -11.105 8.716 -15.630 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.454 6.196 -15.052 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -12.844 9.454 -16.340 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -14.578 9.511 -16.007 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -14.684 6.278 -14.629 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -15.617 7.720 -15.042 1.00 0.00 H new ATOM 1464 N ILE A 90 -7.165 8.300 -19.620 1.00 0.00 N ATOM 1465 CA ILE A 90 -5.906 8.990 -19.870 1.00 0.00 C ATOM 1466 C ILE A 90 -5.655 9.156 -21.364 1.00 0.00 C ATOM 1467 O ILE A 90 -4.887 10.022 -21.782 1.00 0.00 O ATOM 1468 CB ILE A 90 -4.728 8.232 -19.232 1.00 0.00 C ATOM 1469 CG1 ILE A 90 -4.539 6.872 -19.909 1.00 0.00 C ATOM 1470 CG2 ILE A 90 -4.953 8.059 -17.738 1.00 0.00 C ATOM 1471 CD1 ILE A 90 -3.317 6.118 -19.435 1.00 0.00 C ATOM 0 H ILE A 90 -7.062 7.329 -19.325 1.00 0.00 H new ATOM 0 HA ILE A 90 -5.982 9.978 -19.416 1.00 0.00 H new ATOM 0 HB ILE A 90 -3.820 8.818 -19.376 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.424 6.261 -19.729 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.468 7.020 -20.987 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.111 7.521 -17.303 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.040 9.038 -17.267 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.870 7.493 -17.571 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.251 5.165 -19.960 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.423 6.708 -19.640 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.394 5.937 -18.363 1.00 0.00 H new ATOM 1483 N ASN A 91 -6.308 8.320 -22.164 1.00 0.00 N ATOM 1484 CA ASN A 91 -6.265 8.458 -23.615 1.00 0.00 C ATOM 1485 C ASN A 91 -6.763 9.829 -24.053 1.00 0.00 C ATOM 1486 O ASN A 91 -6.154 10.479 -24.903 1.00 0.00 O ATOM 1487 CB ASN A 91 -7.073 7.358 -24.280 1.00 0.00 C ATOM 1488 CG ASN A 91 -6.937 7.366 -25.777 1.00 0.00 C ATOM 1489 OD1 ASN A 91 -5.823 7.416 -26.311 1.00 0.00 O ATOM 1490 ND2 ASN A 91 -8.049 7.318 -26.465 1.00 0.00 N ATOM 0 H ASN A 91 -6.874 7.539 -21.832 1.00 0.00 H new ATOM 0 HA ASN A 91 -5.226 8.363 -23.930 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -6.750 6.391 -23.895 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -8.124 7.472 -24.014 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.018 7.321 -27.485 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -8.946 7.278 -25.982 1.00 0.00 H new ATOM 1497 N GLN A 92 -7.874 10.264 -23.468 1.00 0.00 N ATOM 1498 CA GLN A 92 -8.410 11.594 -23.734 1.00 0.00 C ATOM 1499 C GLN A 92 -7.512 12.677 -23.149 1.00 0.00 C ATOM 1500 O GLN A 92 -7.299 13.720 -23.766 1.00 0.00 O ATOM 1501 CB GLN A 92 -9.825 11.725 -23.165 1.00 0.00 C ATOM 1502 CG GLN A 92 -10.867 10.892 -23.892 1.00 0.00 C ATOM 1503 CD GLN A 92 -12.271 11.142 -23.375 1.00 0.00 C ATOM 1504 OE1 GLN A 92 -12.466 11.484 -22.206 1.00 0.00 O ATOM 1505 NE2 GLN A 92 -13.260 10.974 -24.246 1.00 0.00 N ATOM 0 H GLN A 92 -8.421 9.714 -22.806 1.00 0.00 H new ATOM 0 HA GLN A 92 -8.447 11.727 -24.815 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -9.811 11.433 -22.115 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.124 12.773 -23.201 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.830 11.118 -24.958 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.625 9.835 -23.781 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.053 10.690 -25.204 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.226 11.129 -23.957 1.00 0.00 H new ATOM 1514 N GLU A 93 -6.987 12.422 -21.955 1.00 0.00 N ATOM 1515 CA GLU A 93 -6.157 13.397 -21.259 1.00 0.00 C ATOM 1516 C GLU A 93 -4.820 13.586 -21.965 1.00 0.00 C ATOM 1517 O GLU A 93 -4.276 14.690 -21.999 1.00 0.00 O ATOM 1518 CB GLU A 93 -5.922 12.962 -19.811 1.00 0.00 C ATOM 1519 CG GLU A 93 -7.168 12.989 -18.936 1.00 0.00 C ATOM 1520 CD GLU A 93 -6.924 12.451 -17.554 1.00 0.00 C ATOM 1521 OE1 GLU A 93 -5.946 11.767 -17.367 1.00 0.00 O ATOM 1522 OE2 GLU A 93 -7.717 12.723 -16.684 1.00 0.00 O ATOM 0 H GLU A 93 -7.122 11.547 -21.449 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.687 14.349 -21.265 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.514 11.951 -19.810 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.167 13.611 -19.367 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.532 14.014 -18.862 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -7.954 12.405 -19.414 1.00 0.00 H new ATOM 1529 N PHE A 94 -4.296 12.503 -22.529 1.00 0.00 N ATOM 1530 CA PHE A 94 -2.986 12.529 -23.167 1.00 0.00 C ATOM 1531 C PHE A 94 -3.021 13.325 -24.465 1.00 0.00 C ATOM 1532 O PHE A 94 -4.000 13.274 -25.209 1.00 0.00 O ATOM 1533 CB PHE A 94 -2.500 11.106 -23.448 1.00 0.00 C ATOM 1534 CG PHE A 94 -1.945 10.406 -22.240 1.00 0.00 C ATOM 1535 CD1 PHE A 94 -1.815 11.073 -21.032 1.00 0.00 C ATOM 1536 CD2 PHE A 94 -1.550 9.078 -22.311 1.00 0.00 C ATOM 1537 CE1 PHE A 94 -1.304 10.430 -19.920 1.00 0.00 C ATOM 1538 CE2 PHE A 94 -1.041 8.432 -21.201 1.00 0.00 C ATOM 1539 CZ PHE A 94 -0.917 9.109 -20.005 1.00 0.00 C ATOM 0 H PHE A 94 -4.760 11.595 -22.557 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.293 13.017 -22.481 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -3.329 10.521 -23.847 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -1.733 11.140 -24.221 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -2.117 12.107 -20.959 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.641 8.543 -23.245 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -1.208 10.962 -18.985 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.740 7.397 -21.269 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.518 8.605 -19.137 1.00 0.00 H new ATOM 1549 N PRO A 95 -1.946 14.060 -24.732 1.00 0.00 N ATOM 1550 CA PRO A 95 -1.777 14.731 -26.015 1.00 0.00 C ATOM 1551 C PRO A 95 -1.501 13.729 -27.129 1.00 0.00 C ATOM 1552 O PRO A 95 -1.322 12.538 -26.874 1.00 0.00 O ATOM 1553 CB PRO A 95 -0.573 15.646 -25.769 1.00 0.00 C ATOM 1554 CG PRO A 95 0.247 14.910 -24.765 1.00 0.00 C ATOM 1555 CD PRO A 95 -0.764 14.269 -23.853 1.00 0.00 C ATOM 0 HA PRO A 95 -2.665 15.274 -26.338 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -0.013 15.823 -26.687 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -0.884 16.620 -25.392 1.00 0.00 H new ATOM 0 HG2 PRO A 95 0.882 14.163 -25.241 1.00 0.00 H new ATOM 0 HG3 PRO A 95 0.905 15.585 -24.217 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -0.396 13.327 -23.446 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.003 14.911 -23.005 1.00 0.00 H new ATOM 1563 N ARG A 96 -1.469 14.218 -28.363 1.00 0.00 N ATOM 1564 CA ARG A 96 -1.312 13.353 -29.526 1.00 0.00 C ATOM 1565 C ARG A 96 -0.155 12.381 -29.337 1.00 0.00 C ATOM 1566 O ARG A 96 -0.304 11.176 -29.542 1.00 0.00 O ATOM 1567 CB ARG A 96 -1.076 14.180 -30.781 1.00 0.00 C ATOM 1568 CG ARG A 96 -0.850 13.371 -32.048 1.00 0.00 C ATOM 1569 CD ARG A 96 -0.123 14.155 -33.079 1.00 0.00 C ATOM 1570 NE ARG A 96 1.229 14.483 -32.656 1.00 0.00 N ATOM 1571 CZ ARG A 96 1.999 15.432 -33.224 1.00 0.00 C ATOM 1572 NH1 ARG A 96 1.537 16.137 -34.233 1.00 0.00 N ATOM 1573 NH2 ARG A 96 3.218 15.656 -32.765 1.00 0.00 N ATOM 0 H ARG A 96 -1.550 15.210 -28.584 1.00 0.00 H new ATOM 0 HA ARG A 96 -2.235 12.783 -29.637 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -1.934 14.835 -30.934 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -0.210 14.822 -30.618 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -0.283 12.471 -31.809 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -1.810 13.046 -32.448 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -0.085 13.586 -34.008 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -0.671 15.074 -33.290 1.00 0.00 H new ATOM 0 HE ARG A 96 1.622 13.958 -31.875 1.00 0.00 H new ATOM 0 HH11 ARG A 96 0.596 15.966 -34.586 1.00 0.00 H new ATOM 0 HH12 ARG A 96 2.120 16.855 -34.663 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.576 15.111 -31.981 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.801 16.374 -33.195 1.00 0.00 H new ATOM 1587 N ASP A 97 0.999 12.911 -28.946 1.00 0.00 N ATOM 1588 CA ASP A 97 2.219 12.117 -28.866 1.00 0.00 C ATOM 1589 C ASP A 97 2.065 10.969 -27.877 1.00 0.00 C ATOM 1590 O ASP A 97 2.488 9.845 -28.145 1.00 0.00 O ATOM 1591 CB ASP A 97 3.404 12.995 -28.458 1.00 0.00 C ATOM 1592 CG ASP A 97 3.821 13.972 -29.548 1.00 0.00 C ATOM 1593 OD1 ASP A 97 3.373 13.818 -30.660 1.00 0.00 O ATOM 1594 OD2 ASP A 97 4.584 14.863 -29.260 1.00 0.00 O ATOM 0 H ASP A 97 1.115 13.889 -28.679 1.00 0.00 H new ATOM 0 HA ASP A 97 2.407 11.698 -29.855 1.00 0.00 H new ATOM 0 HB2 ASP A 97 3.144 13.552 -27.558 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.251 12.358 -28.205 1.00 0.00 H new ATOM 1599 N LEU A 98 1.457 11.259 -26.732 1.00 0.00 N ATOM 1600 CA LEU A 98 1.295 10.265 -25.677 1.00 0.00 C ATOM 1601 C LEU A 98 0.154 9.307 -25.993 1.00 0.00 C ATOM 1602 O LEU A 98 0.145 8.164 -25.535 1.00 0.00 O ATOM 1603 CB LEU A 98 1.034 10.957 -24.333 1.00 0.00 C ATOM 1604 CG LEU A 98 2.279 11.282 -23.499 1.00 0.00 C ATOM 1605 CD1 LEU A 98 3.127 12.313 -24.231 1.00 0.00 C ATOM 1606 CD2 LEU A 98 1.854 11.795 -22.131 1.00 0.00 C ATOM 0 H LEU A 98 1.068 12.175 -26.510 1.00 0.00 H new ATOM 0 HA LEU A 98 2.219 9.690 -25.614 1.00 0.00 H new ATOM 0 HB2 LEU A 98 0.494 11.885 -24.522 1.00 0.00 H new ATOM 0 HB3 LEU A 98 0.378 10.321 -23.739 1.00 0.00 H new ATOM 0 HG LEU A 98 2.878 10.382 -23.358 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.012 12.544 -23.638 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.432 11.913 -25.198 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.545 13.222 -24.382 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.739 12.026 -21.538 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.252 12.696 -22.251 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.266 11.031 -21.623 1.00 0.00 H new ATOM 1618 N LYS A 99 -0.809 9.780 -26.777 1.00 0.00 N ATOM 1619 CA LYS A 99 -1.883 8.926 -27.272 1.00 0.00 C ATOM 1620 C LYS A 99 -1.344 7.843 -28.197 1.00 0.00 C ATOM 1621 O LYS A 99 -1.809 6.704 -28.172 1.00 0.00 O ATOM 1622 CB LYS A 99 -2.939 9.761 -27.997 1.00 0.00 C ATOM 1623 CG LYS A 99 -3.831 10.584 -27.078 1.00 0.00 C ATOM 1624 CD LYS A 99 -4.687 11.562 -27.868 1.00 0.00 C ATOM 1625 CE LYS A 99 -5.749 10.836 -28.682 1.00 0.00 C ATOM 1626 NZ LYS A 99 -6.641 11.784 -29.404 1.00 0.00 N ATOM 0 H LYS A 99 -0.868 10.751 -27.084 1.00 0.00 H new ATOM 0 HA LYS A 99 -2.345 8.440 -26.413 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -2.438 10.433 -28.694 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.566 9.096 -28.591 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.474 9.919 -26.501 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.215 11.131 -26.364 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.166 12.263 -27.185 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.053 12.148 -28.534 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.266 10.174 -29.400 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.346 10.208 -28.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.350 11.250 -29.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.122 12.399 -28.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.075 12.366 -30.054 1.00 0.00 H new ATOM 1640 N LYS A 100 -0.360 8.206 -29.014 1.00 0.00 N ATOM 1641 CA LYS A 100 0.320 7.240 -29.869 1.00 0.00 C ATOM 1642 C LYS A 100 1.115 6.237 -29.043 1.00 0.00 C ATOM 1643 O LYS A 100 1.084 5.036 -29.310 1.00 0.00 O ATOM 1644 CB LYS A 100 1.243 7.957 -30.857 1.00 0.00 C ATOM 1645 CG LYS A 100 0.516 8.733 -31.946 1.00 0.00 C ATOM 1646 CD LYS A 100 1.498 9.412 -32.890 1.00 0.00 C ATOM 1647 CE LYS A 100 0.774 10.157 -34.002 1.00 0.00 C ATOM 1648 NZ LYS A 100 1.723 10.812 -34.942 1.00 0.00 N ATOM 0 H LYS A 100 -0.016 9.162 -29.102 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.441 6.694 -30.427 1.00 0.00 H new ATOM 0 HB2 LYS A 100 1.884 8.644 -30.304 1.00 0.00 H new ATOM 0 HB3 LYS A 100 1.895 7.221 -31.326 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.126 8.057 -32.510 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -0.132 9.482 -31.491 1.00 0.00 H new ATOM 0 HD2 LYS A 100 2.122 10.108 -32.329 1.00 0.00 H new ATOM 0 HD3 LYS A 100 2.164 8.666 -33.323 1.00 0.00 H new ATOM 0 HE2 LYS A 100 0.141 9.461 -34.552 1.00 0.00 H new ATOM 0 HE3 LYS A 100 0.117 10.910 -33.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 1.190 11.308 -35.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 2.311 11.495 -34.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 2.333 10.091 -35.378 1.00 0.00 H new ATOM 1662 N LYS A 101 1.827 6.737 -28.038 1.00 0.00 N ATOM 1663 CA LYS A 101 2.588 5.880 -27.138 1.00 0.00 C ATOM 1664 C LYS A 101 1.669 4.952 -26.353 1.00 0.00 C ATOM 1665 O LYS A 101 1.960 3.767 -26.190 1.00 0.00 O ATOM 1666 CB LYS A 101 3.428 6.724 -26.178 1.00 0.00 C ATOM 1667 CG LYS A 101 4.594 7.451 -26.835 1.00 0.00 C ATOM 1668 CD LYS A 101 5.362 8.290 -25.825 1.00 0.00 C ATOM 1669 CE LYS A 101 6.524 9.021 -26.481 1.00 0.00 C ATOM 1670 NZ LYS A 101 7.285 9.846 -25.504 1.00 0.00 N ATOM 0 H LYS A 101 1.892 7.733 -27.827 1.00 0.00 H new ATOM 0 HA LYS A 101 3.254 5.266 -27.745 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.781 7.459 -25.699 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.816 6.078 -25.390 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.266 6.725 -27.294 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.222 8.091 -27.635 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.689 9.013 -25.363 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.737 7.649 -25.027 1.00 0.00 H new ATOM 0 HE2 LYS A 101 7.194 8.296 -26.943 1.00 0.00 H new ATOM 0 HE3 LYS A 101 6.146 9.660 -27.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.068 10.327 -25.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.652 10.555 -25.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.668 9.233 -24.756 1.00 0.00 H new ATOM 1684 N LEU A 102 0.559 5.499 -25.867 1.00 0.00 N ATOM 1685 CA LEU A 102 -0.446 4.703 -25.174 1.00 0.00 C ATOM 1686 C LEU A 102 -0.999 3.606 -26.076 1.00 0.00 C ATOM 1687 O LEU A 102 -1.094 2.447 -25.673 1.00 0.00 O ATOM 1688 CB LEU A 102 -1.592 5.601 -24.690 1.00 0.00 C ATOM 1689 CG LEU A 102 -2.785 4.874 -24.057 1.00 0.00 C ATOM 1690 CD1 LEU A 102 -2.312 4.080 -22.846 1.00 0.00 C ATOM 1691 CD2 LEU A 102 -3.848 5.889 -23.663 1.00 0.00 C ATOM 0 H LEU A 102 0.333 6.491 -25.941 1.00 0.00 H new ATOM 0 HA LEU A 102 0.034 4.233 -24.316 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.193 6.307 -23.962 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -1.953 6.185 -25.536 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.221 4.180 -24.775 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.160 3.563 -22.396 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.566 3.349 -23.159 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.871 4.759 -22.116 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.696 5.372 -23.213 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.430 6.594 -22.944 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.181 6.429 -24.549 1.00 0.00 H new ATOM 1703 N SER A 103 -1.361 3.979 -27.299 1.00 0.00 N ATOM 1704 CA SER A 103 -1.875 3.022 -28.271 1.00 0.00 C ATOM 1705 C SER A 103 -0.907 1.862 -28.466 1.00 0.00 C ATOM 1706 O SER A 103 -1.319 0.706 -28.559 1.00 0.00 O ATOM 1707 CB SER A 103 -2.127 3.710 -29.598 1.00 0.00 C ATOM 1708 OG SER A 103 -3.144 4.668 -29.482 1.00 0.00 O ATOM 0 H SER A 103 -1.308 4.939 -27.641 1.00 0.00 H new ATOM 0 HA SER A 103 -2.814 2.623 -27.886 1.00 0.00 H new ATOM 0 HB2 SER A 103 -1.210 4.188 -29.944 1.00 0.00 H new ATOM 0 HB3 SER A 103 -2.404 2.970 -30.349 1.00 0.00 H new ATOM 0 HG SER A 103 -2.796 5.460 -29.022 1.00 0.00 H new ATOM 1714 N ARG A 104 0.382 2.178 -28.528 1.00 0.00 N ATOM 1715 CA ARG A 104 1.413 1.160 -28.695 1.00 0.00 C ATOM 1716 C ARG A 104 1.443 0.207 -27.507 1.00 0.00 C ATOM 1717 O ARG A 104 1.544 -1.008 -27.676 1.00 0.00 O ATOM 1718 CB ARG A 104 2.781 1.806 -28.858 1.00 0.00 C ATOM 1719 CG ARG A 104 3.003 2.504 -30.190 1.00 0.00 C ATOM 1720 CD ARG A 104 4.321 3.189 -30.237 1.00 0.00 C ATOM 1721 NE ARG A 104 4.543 3.850 -31.514 1.00 0.00 N ATOM 1722 CZ ARG A 104 5.603 4.632 -31.796 1.00 0.00 C ATOM 1723 NH1 ARG A 104 6.527 4.841 -30.885 1.00 0.00 N ATOM 1724 NH2 ARG A 104 5.714 5.188 -32.990 1.00 0.00 N ATOM 0 H ARG A 104 0.738 3.132 -28.465 1.00 0.00 H new ATOM 0 HA ARG A 104 1.171 0.593 -29.594 1.00 0.00 H new ATOM 0 HB2 ARG A 104 2.923 2.531 -28.056 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.546 1.040 -28.734 1.00 0.00 H new ATOM 0 HG2 ARG A 104 2.943 1.775 -30.998 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.208 3.231 -30.357 1.00 0.00 H new ATOM 0 HD2 ARG A 104 4.378 3.923 -29.433 1.00 0.00 H new ATOM 0 HD3 ARG A 104 5.114 2.462 -30.061 1.00 0.00 H new ATOM 0 HE ARG A 104 3.847 3.712 -32.247 1.00 0.00 H new ATOM 0 HH11 ARG A 104 6.442 4.411 -29.964 1.00 0.00 H new ATOM 0 HH12 ARG A 104 7.329 5.433 -31.099 1.00 0.00 H new ATOM 0 HH21 ARG A 104 4.997 5.025 -33.697 1.00 0.00 H new ATOM 0 HH22 ARG A 104 6.516 5.780 -33.204 1.00 0.00 H new ATOM 1738 N VAL A 105 1.355 0.765 -26.304 1.00 0.00 N ATOM 1739 CA VAL A 105 1.340 -0.036 -25.086 1.00 0.00 C ATOM 1740 C VAL A 105 0.158 -0.996 -25.073 1.00 0.00 C ATOM 1741 O VAL A 105 0.305 -2.174 -24.745 1.00 0.00 O ATOM 1742 CB VAL A 105 1.270 0.876 -23.847 1.00 0.00 C ATOM 1743 CG1 VAL A 105 1.003 0.054 -22.595 1.00 0.00 C ATOM 1744 CG2 VAL A 105 2.565 1.662 -23.710 1.00 0.00 C ATOM 0 H VAL A 105 1.293 1.771 -26.147 1.00 0.00 H new ATOM 0 HA VAL A 105 2.262 -0.617 -25.061 1.00 0.00 H new ATOM 0 HB VAL A 105 0.446 1.579 -23.971 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.957 0.714 -21.729 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.055 -0.473 -22.701 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.806 -0.670 -22.457 1.00 0.00 H new ATOM 0 HG21 VAL A 105 2.509 2.305 -22.832 1.00 0.00 H new ATOM 0 HG22 VAL A 105 3.400 0.971 -23.601 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.715 2.274 -24.599 1.00 0.00 H new ATOM 1754 N VAL A 106 -1.016 -0.487 -25.433 1.00 0.00 N ATOM 1755 CA VAL A 106 -2.219 -1.308 -25.498 1.00 0.00 C ATOM 1756 C VAL A 106 -2.071 -2.422 -26.526 1.00 0.00 C ATOM 1757 O VAL A 106 -2.473 -3.560 -26.285 1.00 0.00 O ATOM 1758 CB VAL A 106 -3.439 -0.439 -25.858 1.00 0.00 C ATOM 1759 CG1 VAL A 106 -4.648 -1.315 -26.152 1.00 0.00 C ATOM 1760 CG2 VAL A 106 -3.738 0.530 -24.724 1.00 0.00 C ATOM 0 H VAL A 106 -1.159 0.491 -25.684 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.367 -1.758 -24.516 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.211 0.136 -26.756 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -5.501 -0.685 -26.404 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.424 -1.975 -26.990 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -4.886 -1.913 -25.273 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -4.602 1.141 -24.986 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -3.952 -0.030 -23.814 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.874 1.174 -24.559 1.00 0.00 H new ATOM 1770 N ASN A 107 -1.492 -2.087 -27.674 1.00 0.00 N ATOM 1771 CA ASN A 107 -1.233 -3.072 -28.717 1.00 0.00 C ATOM 1772 C ASN A 107 -0.293 -4.164 -28.223 1.00 0.00 C ATOM 1773 O ASN A 107 -0.475 -5.341 -28.533 1.00 0.00 O ATOM 1774 CB ASN A 107 -0.668 -2.402 -29.957 1.00 0.00 C ATOM 1775 CG ASN A 107 -1.706 -1.623 -30.716 1.00 0.00 C ATOM 1776 OD1 ASN A 107 -2.910 -1.864 -30.571 1.00 0.00 O ATOM 1777 ND2 ASN A 107 -1.263 -0.694 -31.524 1.00 0.00 N ATOM 0 H ASN A 107 -1.193 -1.140 -27.906 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.182 -3.540 -28.978 1.00 0.00 H new ATOM 0 HB2 ASN A 107 0.143 -1.734 -29.667 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.238 -3.160 -30.611 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -1.921 -0.134 -32.066 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -0.260 -0.530 -31.612 1.00 0.00 H new ATOM 1784 N ILE A 108 0.713 -3.766 -27.451 1.00 0.00 N ATOM 1785 CA ILE A 108 1.638 -4.718 -26.847 1.00 0.00 C ATOM 1786 C ILE A 108 0.915 -5.657 -25.891 1.00 0.00 C ATOM 1787 O ILE A 108 1.136 -6.868 -25.910 1.00 0.00 O ATOM 1788 CB ILE A 108 2.766 -3.987 -26.096 1.00 0.00 C ATOM 1789 CG1 ILE A 108 3.689 -3.270 -27.085 1.00 0.00 C ATOM 1790 CG2 ILE A 108 3.554 -4.964 -25.238 1.00 0.00 C ATOM 1791 CD1 ILE A 108 4.631 -2.283 -26.434 1.00 0.00 C ATOM 0 H ILE A 108 0.908 -2.790 -27.229 1.00 0.00 H new ATOM 0 HA ILE A 108 2.072 -5.307 -27.655 1.00 0.00 H new ATOM 0 HB ILE A 108 2.319 -3.240 -25.440 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.274 -4.014 -27.626 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.080 -2.746 -27.821 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.347 -4.431 -24.714 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.888 -5.429 -24.511 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.992 -5.734 -25.873 1.00 0.00 H new ATOM 0 HD11 ILE A 108 5.253 -1.815 -27.198 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.054 -1.517 -25.916 1.00 0.00 H new ATOM 0 HD13 ILE A 108 5.267 -2.804 -25.718 1.00 0.00 H new ATOM 1803 N LEU A 109 0.051 -5.092 -25.054 1.00 0.00 N ATOM 1804 CA LEU A 109 -0.721 -5.881 -24.102 1.00 0.00 C ATOM 1805 C LEU A 109 -1.582 -6.916 -24.814 1.00 0.00 C ATOM 1806 O LEU A 109 -1.739 -8.040 -24.337 1.00 0.00 O ATOM 1807 CB LEU A 109 -1.610 -4.964 -23.252 1.00 0.00 C ATOM 1808 CG LEU A 109 -0.870 -4.011 -22.305 1.00 0.00 C ATOM 1809 CD1 LEU A 109 -1.868 -3.059 -21.660 1.00 0.00 C ATOM 1810 CD2 LEU A 109 -0.124 -4.817 -21.253 1.00 0.00 C ATOM 0 H LEU A 109 -0.132 -4.089 -25.016 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.018 -6.406 -23.455 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -2.233 -4.370 -23.921 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.281 -5.586 -22.660 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.144 -3.421 -22.864 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.342 -2.382 -20.987 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -2.373 -2.481 -22.434 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -2.605 -3.631 -21.096 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.402 -4.139 -20.580 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -0.834 -5.416 -20.683 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.596 -5.474 -21.741 1.00 0.00 H new ATOM 1822 N LYS A 110 -2.138 -6.531 -25.957 1.00 0.00 N ATOM 1823 CA LYS A 110 -2.948 -7.439 -26.760 1.00 0.00 C ATOM 1824 C LYS A 110 -2.087 -8.511 -27.415 1.00 0.00 C ATOM 1825 O LYS A 110 -2.355 -9.705 -27.280 1.00 0.00 O ATOM 1826 CB LYS A 110 -3.725 -6.664 -27.825 1.00 0.00 C ATOM 1827 CG LYS A 110 -4.622 -7.528 -28.702 1.00 0.00 C ATOM 1828 CD LYS A 110 -5.487 -6.675 -29.617 1.00 0.00 C ATOM 1829 CE LYS A 110 -6.436 -7.533 -30.442 1.00 0.00 C ATOM 1830 NZ LYS A 110 -7.324 -6.708 -31.305 1.00 0.00 N ATOM 0 H LYS A 110 -2.042 -5.594 -26.349 1.00 0.00 H new ATOM 0 HA LYS A 110 -3.657 -7.931 -26.094 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -4.337 -5.908 -27.333 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -3.016 -6.135 -28.462 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -4.009 -8.201 -29.301 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -5.258 -8.151 -28.073 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -6.061 -5.965 -29.021 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -4.851 -6.091 -30.282 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.859 -8.217 -31.064 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -7.044 -8.145 -29.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -8.043 -7.317 -31.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -7.793 -5.982 -30.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -6.758 -6.248 -32.046 1.00 0.00 H new ATOM 1844 N GLU A 111 -1.051 -8.078 -28.127 1.00 0.00 N ATOM 1845 CA GLU A 111 -0.236 -8.987 -28.924 1.00 0.00 C ATOM 1846 C GLU A 111 0.494 -9.990 -28.041 1.00 0.00 C ATOM 1847 O GLU A 111 0.688 -11.144 -28.424 1.00 0.00 O ATOM 1848 CB GLU A 111 0.775 -8.200 -29.762 1.00 0.00 C ATOM 1849 CG GLU A 111 0.160 -7.403 -30.903 1.00 0.00 C ATOM 1850 CD GLU A 111 1.172 -6.590 -31.661 1.00 0.00 C ATOM 1851 OE1 GLU A 111 2.311 -6.571 -31.260 1.00 0.00 O ATOM 1852 OE2 GLU A 111 0.806 -5.987 -32.642 1.00 0.00 O ATOM 0 H GLU A 111 -0.756 -7.102 -28.168 1.00 0.00 H new ATOM 0 HA GLU A 111 -0.903 -9.537 -29.589 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.317 -7.517 -29.108 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.507 -8.895 -30.173 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -0.337 -8.087 -31.590 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -0.607 -6.739 -30.504 1.00 0.00 H new ATOM 1859 N ARG A 112 0.898 -9.544 -26.856 1.00 0.00 N ATOM 1860 CA ARG A 112 1.654 -10.387 -25.937 1.00 0.00 C ATOM 1861 C ARG A 112 0.726 -11.172 -25.019 1.00 0.00 C ATOM 1862 O ARG A 112 1.180 -11.926 -24.158 1.00 0.00 O ATOM 1863 CB ARG A 112 2.602 -9.546 -25.096 1.00 0.00 C ATOM 1864 CG ARG A 112 3.680 -8.817 -25.883 1.00 0.00 C ATOM 1865 CD ARG A 112 4.645 -9.763 -26.498 1.00 0.00 C ATOM 1866 NE ARG A 112 5.708 -9.068 -27.207 1.00 0.00 N ATOM 1867 CZ ARG A 112 6.638 -9.672 -27.973 1.00 0.00 C ATOM 1868 NH1 ARG A 112 6.623 -10.978 -28.118 1.00 0.00 N ATOM 1869 NH2 ARG A 112 7.565 -8.950 -28.578 1.00 0.00 N ATOM 0 H ARG A 112 0.714 -8.602 -26.509 1.00 0.00 H new ATOM 0 HA ARG A 112 2.230 -11.091 -26.538 1.00 0.00 H new ATOM 0 HB2 ARG A 112 2.018 -8.812 -24.541 1.00 0.00 H new ATOM 0 HB3 ARG A 112 3.083 -10.192 -24.361 1.00 0.00 H new ATOM 0 HG2 ARG A 112 3.216 -8.213 -26.662 1.00 0.00 H new ATOM 0 HG3 ARG A 112 4.212 -8.132 -25.223 1.00 0.00 H new ATOM 0 HD2 ARG A 112 5.078 -10.395 -25.723 1.00 0.00 H new ATOM 0 HD3 ARG A 112 4.118 -10.422 -27.188 1.00 0.00 H new ATOM 0 HE ARG A 112 5.753 -8.053 -27.118 1.00 0.00 H new ATOM 0 HH11 ARG A 112 5.907 -11.535 -27.651 1.00 0.00 H new ATOM 0 HH12 ARG A 112 7.327 -11.435 -28.698 1.00 0.00 H new ATOM 0 HH21 ARG A 112 7.576 -7.936 -28.465 1.00 0.00 H new ATOM 0 HH22 ARG A 112 8.269 -9.406 -29.158 1.00 0.00 H new ATOM 1883 N ASN A 113 -0.577 -10.990 -25.207 1.00 0.00 N ATOM 1884 CA ASN A 113 -1.573 -11.705 -24.418 1.00 0.00 C ATOM 1885 C ASN A 113 -1.313 -11.542 -22.926 1.00 0.00 C ATOM 1886 O ASN A 113 -1.332 -12.516 -22.172 1.00 0.00 O ATOM 1887 CB ASN A 113 -1.601 -13.174 -24.798 1.00 0.00 C ATOM 1888 CG ASN A 113 -2.048 -13.395 -26.216 1.00 0.00 C ATOM 1889 OD1 ASN A 113 -3.021 -12.788 -26.675 1.00 0.00 O ATOM 1890 ND2 ASN A 113 -1.355 -14.254 -26.919 1.00 0.00 N ATOM 0 H ASN A 113 -0.968 -10.352 -25.900 1.00 0.00 H new ATOM 0 HA ASN A 113 -2.549 -11.272 -24.638 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -0.606 -13.599 -24.664 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -2.270 -13.708 -24.123 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -1.611 -14.445 -27.888 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.558 -14.732 -26.498 1.00 0.00 H new ATOM 1897 N ILE A 114 -1.069 -10.306 -22.504 1.00 0.00 N ATOM 1898 CA ILE A 114 -0.726 -10.023 -21.115 1.00 0.00 C ATOM 1899 C ILE A 114 -1.921 -10.247 -20.197 1.00 0.00 C ATOM 1900 O ILE A 114 -1.794 -10.859 -19.136 1.00 0.00 O ATOM 1901 CB ILE A 114 -0.221 -8.578 -20.957 1.00 0.00 C ATOM 1902 CG1 ILE A 114 1.078 -8.378 -21.743 1.00 0.00 C ATOM 1903 CG2 ILE A 114 -0.015 -8.244 -19.488 1.00 0.00 C ATOM 1904 CD1 ILE A 114 2.202 -9.291 -21.307 1.00 0.00 C ATOM 0 H ILE A 114 -1.102 -9.483 -23.105 1.00 0.00 H new ATOM 0 HA ILE A 114 0.070 -10.711 -20.831 1.00 0.00 H new ATOM 0 HB ILE A 114 -0.975 -7.901 -21.360 1.00 0.00 H new ATOM 0 HG12 ILE A 114 0.880 -8.542 -22.802 1.00 0.00 H new ATOM 0 HG13 ILE A 114 1.401 -7.343 -21.635 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.342 -7.218 -19.395 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -0.960 -8.349 -18.955 1.00 0.00 H new ATOM 0 HG23 ILE A 114 0.721 -8.925 -19.060 1.00 0.00 H new ATOM 0 HD11 ILE A 114 3.088 -9.090 -21.909 1.00 0.00 H new ATOM 0 HD12 ILE A 114 2.429 -9.112 -20.256 1.00 0.00 H new ATOM 0 HD13 ILE A 114 1.900 -10.330 -21.441 1.00 0.00 H new ATOM 1916 N PHE A 115 -3.081 -9.749 -20.610 1.00 0.00 N ATOM 1917 CA PHE A 115 -4.310 -9.937 -19.850 1.00 0.00 C ATOM 1918 C PHE A 115 -5.243 -10.920 -20.545 1.00 0.00 C ATOM 1919 O PHE A 115 -4.985 -11.345 -21.671 1.00 0.00 O ATOM 1920 CB PHE A 115 -5.026 -8.600 -19.652 1.00 0.00 C ATOM 1921 CG PHE A 115 -4.231 -7.597 -18.865 1.00 0.00 C ATOM 1922 CD1 PHE A 115 -3.600 -6.538 -19.501 1.00 0.00 C ATOM 1923 CD2 PHE A 115 -4.111 -7.711 -17.489 1.00 0.00 C ATOM 1924 CE1 PHE A 115 -2.868 -5.615 -18.778 1.00 0.00 C ATOM 1925 CE2 PHE A 115 -3.381 -6.789 -16.764 1.00 0.00 C ATOM 1926 CZ PHE A 115 -2.759 -5.740 -17.410 1.00 0.00 C ATOM 0 H PHE A 115 -3.196 -9.211 -21.469 1.00 0.00 H new ATOM 0 HA PHE A 115 -4.038 -10.347 -18.877 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -5.262 -8.177 -20.628 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -5.974 -8.778 -19.144 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -3.682 -6.434 -20.573 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -4.594 -8.530 -16.977 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -2.381 -4.795 -19.286 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -3.297 -6.889 -15.692 1.00 0.00 H new ATOM 0 HZ PHE A 115 -2.188 -5.019 -16.845 1.00 0.00 H new ATOM 1936 N SER A 116 -6.329 -11.278 -19.868 1.00 0.00 N ATOM 1937 CA SER A 116 -7.336 -12.161 -20.446 1.00 0.00 C ATOM 1938 C SER A 116 -8.033 -11.502 -21.629 1.00 0.00 C ATOM 1939 O SER A 116 -8.006 -10.280 -21.776 1.00 0.00 O ATOM 1940 CB SER A 116 -8.359 -12.544 -19.394 1.00 0.00 C ATOM 1941 OG SER A 116 -9.153 -11.445 -19.042 1.00 0.00 O ATOM 0 H SER A 116 -6.535 -10.970 -18.918 1.00 0.00 H new ATOM 0 HA SER A 116 -6.831 -13.058 -20.804 1.00 0.00 H new ATOM 0 HB2 SER A 116 -8.991 -13.348 -19.772 1.00 0.00 H new ATOM 0 HB3 SER A 116 -7.850 -12.928 -18.510 1.00 0.00 H new ATOM 0 HG SER A 116 -9.806 -11.717 -18.364 1.00 0.00 H new ATOM 1947 N LYS A 117 -8.657 -12.318 -22.471 1.00 0.00 N ATOM 1948 CA LYS A 117 -9.343 -11.818 -23.656 1.00 0.00 C ATOM 1949 C LYS A 117 -10.416 -10.803 -23.283 1.00 0.00 C ATOM 1950 O LYS A 117 -10.624 -9.817 -23.991 1.00 0.00 O ATOM 1951 CB LYS A 117 -9.964 -12.973 -24.443 1.00 0.00 C ATOM 1952 CG LYS A 117 -8.953 -13.871 -25.145 1.00 0.00 C ATOM 1953 CD LYS A 117 -9.644 -15.005 -25.888 1.00 0.00 C ATOM 1954 CE LYS A 117 -8.634 -15.909 -26.581 1.00 0.00 C ATOM 1955 NZ LYS A 117 -9.293 -17.044 -27.281 1.00 0.00 N ATOM 0 H LYS A 117 -8.702 -13.330 -22.354 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.604 -11.319 -24.283 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.561 -13.581 -23.763 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -10.647 -12.564 -25.188 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -8.363 -13.280 -25.846 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -8.259 -14.283 -24.413 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.240 -15.591 -25.188 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.333 -14.593 -26.626 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -8.057 -15.326 -27.299 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -7.929 -16.296 -25.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -8.571 -17.635 -27.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -9.823 -17.616 -26.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -9.947 -16.675 -28.001 1.00 0.00 H new ATOM 1969 N GLN A 118 -11.095 -11.049 -22.168 1.00 0.00 N ATOM 1970 CA GLN A 118 -12.088 -10.113 -21.653 1.00 0.00 C ATOM 1971 C GLN A 118 -11.471 -8.746 -21.390 1.00 0.00 C ATOM 1972 O GLN A 118 -11.971 -7.726 -21.865 1.00 0.00 O ATOM 1973 CB GLN A 118 -12.722 -10.657 -20.370 1.00 0.00 C ATOM 1974 CG GLN A 118 -13.772 -9.745 -19.760 1.00 0.00 C ATOM 1975 CD GLN A 118 -15.017 -9.640 -20.620 1.00 0.00 C ATOM 1976 OE1 GLN A 118 -15.548 -10.648 -21.093 1.00 0.00 O ATOM 1977 NE2 GLN A 118 -15.491 -8.416 -20.827 1.00 0.00 N ATOM 0 H GLN A 118 -10.976 -11.890 -21.603 1.00 0.00 H new ATOM 0 HA GLN A 118 -12.863 -9.999 -22.411 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -13.177 -11.624 -20.585 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -11.936 -10.831 -19.635 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -14.046 -10.119 -18.774 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -13.347 -8.751 -19.617 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -15.020 -7.610 -20.416 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -16.326 -8.282 -21.397 1.00 0.00 H new ATOM 1986 N VAL A 119 -10.381 -8.730 -20.629 1.00 0.00 N ATOM 1987 CA VAL A 119 -9.740 -7.482 -20.235 1.00 0.00 C ATOM 1988 C VAL A 119 -9.172 -6.749 -21.444 1.00 0.00 C ATOM 1989 O VAL A 119 -9.369 -5.544 -21.601 1.00 0.00 O ATOM 1990 CB VAL A 119 -8.608 -7.758 -19.228 1.00 0.00 C ATOM 1991 CG1 VAL A 119 -7.797 -6.495 -18.979 1.00 0.00 C ATOM 1992 CG2 VAL A 119 -9.191 -8.289 -17.927 1.00 0.00 C ATOM 0 H VAL A 119 -9.923 -9.569 -20.273 1.00 0.00 H new ATOM 0 HA VAL A 119 -10.498 -6.852 -19.770 1.00 0.00 H new ATOM 0 HB VAL A 119 -7.940 -8.512 -19.645 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -7.001 -6.708 -18.265 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -7.360 -6.152 -19.917 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -8.447 -5.718 -18.576 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -8.385 -8.482 -17.219 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -9.874 -7.551 -17.506 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -9.732 -9.215 -18.122 1.00 0.00 H new ATOM 2002 N VAL A 120 -8.466 -7.484 -22.297 1.00 0.00 N ATOM 2003 CA VAL A 120 -7.823 -6.895 -23.466 1.00 0.00 C ATOM 2004 C VAL A 120 -8.846 -6.241 -24.386 1.00 0.00 C ATOM 2005 O VAL A 120 -8.646 -5.120 -24.854 1.00 0.00 O ATOM 2006 CB VAL A 120 -7.047 -7.971 -24.248 1.00 0.00 C ATOM 2007 CG1 VAL A 120 -6.590 -7.426 -25.593 1.00 0.00 C ATOM 2008 CG2 VAL A 120 -5.860 -8.452 -23.429 1.00 0.00 C ATOM 0 H VAL A 120 -8.325 -8.490 -22.200 1.00 0.00 H new ATOM 0 HA VAL A 120 -7.131 -6.130 -23.113 1.00 0.00 H new ATOM 0 HB VAL A 120 -7.707 -8.818 -24.434 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -6.043 -8.200 -26.132 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -7.459 -7.122 -26.177 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -5.940 -6.565 -25.435 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -5.316 -9.213 -23.989 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.197 -7.612 -23.221 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -6.214 -8.877 -22.490 1.00 0.00 H new ATOM 2018 N ASN A 121 -9.942 -6.947 -24.641 1.00 0.00 N ATOM 2019 CA ASN A 121 -11.004 -6.430 -25.496 1.00 0.00 C ATOM 2020 C ASN A 121 -11.639 -5.184 -24.893 1.00 0.00 C ATOM 2021 O ASN A 121 -11.952 -4.229 -25.604 1.00 0.00 O ATOM 2022 CB ASN A 121 -12.054 -7.497 -25.745 1.00 0.00 C ATOM 2023 CG ASN A 121 -11.579 -8.565 -26.691 1.00 0.00 C ATOM 2024 OD1 ASN A 121 -10.611 -8.368 -27.434 1.00 0.00 O ATOM 2025 ND2 ASN A 121 -12.243 -9.693 -26.679 1.00 0.00 N ATOM 0 H ASN A 121 -10.118 -7.880 -24.267 1.00 0.00 H new ATOM 0 HA ASN A 121 -10.560 -6.150 -26.451 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -12.333 -7.955 -24.796 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -12.952 -7.031 -26.150 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -11.967 -10.454 -27.300 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -13.036 -9.811 -26.049 1.00 0.00 H new ATOM 2032 N ASP A 122 -11.827 -5.199 -23.578 1.00 0.00 N ATOM 2033 CA ASP A 122 -12.408 -4.061 -22.874 1.00 0.00 C ATOM 2034 C ASP A 122 -11.505 -2.838 -22.965 1.00 0.00 C ATOM 2035 O ASP A 122 -11.980 -1.716 -23.144 1.00 0.00 O ATOM 2036 CB ASP A 122 -12.658 -4.410 -21.405 1.00 0.00 C ATOM 2037 CG ASP A 122 -13.826 -5.369 -21.214 1.00 0.00 C ATOM 2038 OD1 ASP A 122 -14.591 -5.533 -22.135 1.00 0.00 O ATOM 2039 OD2 ASP A 122 -13.941 -5.929 -20.150 1.00 0.00 O ATOM 0 H ASP A 122 -11.585 -5.987 -22.977 1.00 0.00 H new ATOM 0 HA ASP A 122 -13.358 -3.826 -23.353 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -11.756 -4.855 -20.984 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -12.852 -3.494 -20.847 1.00 0.00 H new ATOM 2044 N ILE A 123 -10.201 -3.061 -22.841 1.00 0.00 N ATOM 2045 CA ILE A 123 -9.226 -1.982 -22.949 1.00 0.00 C ATOM 2046 C ILE A 123 -9.257 -1.348 -24.333 1.00 0.00 C ATOM 2047 O ILE A 123 -9.373 -0.130 -24.466 1.00 0.00 O ATOM 2048 CB ILE A 123 -7.805 -2.494 -22.649 1.00 0.00 C ATOM 2049 CG1 ILE A 123 -7.673 -2.869 -21.171 1.00 0.00 C ATOM 2050 CG2 ILE A 123 -6.771 -1.446 -23.031 1.00 0.00 C ATOM 2051 CD1 ILE A 123 -6.419 -3.650 -20.849 1.00 0.00 C ATOM 0 H ILE A 123 -9.795 -3.980 -22.665 1.00 0.00 H new ATOM 0 HA ILE A 123 -9.495 -1.226 -22.211 1.00 0.00 H new ATOM 0 HB ILE A 123 -7.625 -3.387 -23.247 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.686 -1.958 -20.572 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -8.542 -3.457 -20.876 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -5.772 -1.824 -22.813 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -6.851 -1.227 -24.096 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -6.948 -0.535 -22.459 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.396 -3.879 -19.784 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.412 -4.579 -21.420 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.543 -3.056 -21.111 1.00 0.00 H new ATOM 2063 N GLU A 124 -9.152 -2.182 -25.363 1.00 0.00 N ATOM 2064 CA GLU A 124 -9.127 -1.700 -26.739 1.00 0.00 C ATOM 2065 C GLU A 124 -10.385 -0.908 -27.069 1.00 0.00 C ATOM 2066 O GLU A 124 -10.314 0.170 -27.658 1.00 0.00 O ATOM 2067 CB GLU A 124 -8.980 -2.873 -27.711 1.00 0.00 C ATOM 2068 CG GLU A 124 -8.867 -2.466 -29.174 1.00 0.00 C ATOM 2069 CD GLU A 124 -8.649 -3.637 -30.091 1.00 0.00 C ATOM 2070 OE1 GLU A 124 -8.531 -4.735 -29.604 1.00 0.00 O ATOM 2071 OE2 GLU A 124 -8.599 -3.432 -31.281 1.00 0.00 O ATOM 0 H GLU A 124 -9.083 -3.195 -25.270 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.268 -1.037 -26.845 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -8.095 -3.448 -27.437 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.838 -3.535 -27.596 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -9.775 -1.942 -29.471 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -8.042 -1.763 -29.288 1.00 0.00 H new ATOM 2078 N ARG A 125 -11.536 -1.449 -26.685 1.00 0.00 N ATOM 2079 CA ARG A 125 -12.818 -0.832 -27.007 1.00 0.00 C ATOM 2080 C ARG A 125 -13.062 0.406 -26.154 1.00 0.00 C ATOM 2081 O ARG A 125 -13.779 1.320 -26.561 1.00 0.00 O ATOM 2082 CB ARG A 125 -13.955 -1.821 -26.798 1.00 0.00 C ATOM 2083 CG ARG A 125 -13.965 -2.997 -27.761 1.00 0.00 C ATOM 2084 CD ARG A 125 -15.129 -3.890 -27.526 1.00 0.00 C ATOM 2085 NE ARG A 125 -15.097 -4.484 -26.199 1.00 0.00 N ATOM 2086 CZ ARG A 125 -16.063 -5.274 -25.691 1.00 0.00 C ATOM 2087 NH1 ARG A 125 -17.128 -5.554 -26.409 1.00 0.00 N ATOM 2088 NH2 ARG A 125 -15.940 -5.766 -24.471 1.00 0.00 N ATOM 0 H ARG A 125 -11.608 -2.314 -26.150 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.785 -0.535 -28.055 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -13.901 -2.205 -25.779 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -14.902 -1.288 -26.888 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -13.991 -2.628 -28.786 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -13.042 -3.566 -27.650 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -16.052 -3.323 -27.648 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -15.138 -4.680 -28.277 1.00 0.00 H new ATOM 0 HE ARG A 125 -14.286 -4.289 -25.612 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -17.223 -5.173 -27.350 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -17.859 -6.152 -26.025 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -15.114 -5.548 -23.914 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -16.671 -6.364 -24.086 1.00 0.00 H new ATOM 2102 N SER A 126 -12.462 0.430 -24.969 1.00 0.00 N ATOM 2103 CA SER A 126 -12.545 1.591 -24.091 1.00 0.00 C ATOM 2104 C SER A 126 -11.898 2.813 -24.732 1.00 0.00 C ATOM 2105 O SER A 126 -12.459 3.908 -24.708 1.00 0.00 O ATOM 2106 CB SER A 126 -11.875 1.292 -22.764 1.00 0.00 C ATOM 2107 OG SER A 126 -11.917 2.407 -21.917 1.00 0.00 O ATOM 0 H SER A 126 -11.912 -0.343 -24.594 1.00 0.00 H new ATOM 0 HA SER A 126 -13.599 1.810 -23.922 1.00 0.00 H new ATOM 0 HB2 SER A 126 -12.371 0.448 -22.284 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.839 0.999 -22.934 1.00 0.00 H new ATOM 0 HG SER A 126 -11.386 2.228 -21.113 1.00 0.00 H new ATOM 2113 N LEU A 127 -10.716 2.618 -25.305 1.00 0.00 N ATOM 2114 CA LEU A 127 -9.988 3.705 -25.949 1.00 0.00 C ATOM 2115 C LEU A 127 -10.642 4.100 -27.267 1.00 0.00 C ATOM 2116 O LEU A 127 -10.650 5.274 -27.640 1.00 0.00 O ATOM 2117 CB LEU A 127 -8.531 3.294 -26.197 1.00 0.00 C ATOM 2118 CG LEU A 127 -7.563 3.543 -25.033 1.00 0.00 C ATOM 2119 CD1 LEU A 127 -7.831 2.534 -23.925 1.00 0.00 C ATOM 2120 CD2 LEU A 127 -6.130 3.438 -25.534 1.00 0.00 C ATOM 0 H LEU A 127 -10.241 1.716 -25.337 1.00 0.00 H new ATOM 0 HA LEU A 127 -10.012 4.566 -25.281 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -8.509 2.232 -26.443 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -8.165 3.832 -27.072 1.00 0.00 H new ATOM 0 HG LEU A 127 -7.714 4.544 -24.630 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -7.143 2.711 -23.098 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -8.857 2.643 -23.574 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -7.685 1.524 -24.309 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -5.442 3.615 -24.707 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.959 2.442 -25.942 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -5.961 4.182 -26.312 1.00 0.00 H new ATOM 2132 N ALA A 128 -11.189 3.114 -27.970 1.00 0.00 N ATOM 2133 CA ALA A 128 -11.969 3.373 -29.174 1.00 0.00 C ATOM 2134 C ALA A 128 -13.188 4.233 -28.867 1.00 0.00 C ATOM 2135 O ALA A 128 -13.486 5.184 -29.589 1.00 0.00 O ATOM 2136 CB ALA A 128 -12.395 2.063 -29.821 1.00 0.00 C ATOM 0 H ALA A 128 -11.106 2.127 -27.726 1.00 0.00 H new ATOM 0 HA ALA A 128 -11.337 3.922 -29.872 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -12.977 2.273 -30.719 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -11.511 1.485 -30.088 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -13.003 1.492 -29.120 1.00 0.00 H new ATOM 2142 N ALA A 129 -13.890 3.893 -27.792 1.00 0.00 N ATOM 2143 CA ALA A 129 -15.023 4.688 -27.334 1.00 0.00 C ATOM 2144 C ALA A 129 -14.577 6.071 -26.878 1.00 0.00 C ATOM 2145 O ALA A 129 -15.277 7.061 -27.093 1.00 0.00 O ATOM 2146 CB ALA A 129 -15.753 3.970 -26.208 1.00 0.00 C ATOM 0 H ALA A 129 -13.694 3.071 -27.221 1.00 0.00 H new ATOM 0 HA ALA A 129 -15.707 4.814 -28.174 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -16.596 4.576 -25.877 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -16.117 3.007 -26.566 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -15.070 3.812 -25.374 1.00 0.00 H new ATOM 2152 N ALA A 130 -13.409 6.133 -26.248 1.00 0.00 N ATOM 2153 CA ALA A 130 -12.845 7.401 -25.803 1.00 0.00 C ATOM 2154 C ALA A 130 -12.555 8.320 -26.983 1.00 0.00 C ATOM 2155 O ALA A 130 -12.726 9.536 -26.893 1.00 0.00 O ATOM 2156 CB ALA A 130 -11.578 7.163 -24.994 1.00 0.00 C ATOM 0 H ALA A 130 -12.834 5.318 -26.034 1.00 0.00 H new ATOM 0 HA ALA A 130 -13.582 7.892 -25.167 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -11.169 8.120 -24.669 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -11.813 6.553 -24.121 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -10.844 6.645 -25.611 1.00 0.00 H new ATOM 2162 N LEU A 131 -12.115 7.731 -28.090 1.00 0.00 N ATOM 2163 CA LEU A 131 -11.879 8.484 -29.316 1.00 0.00 C ATOM 2164 C LEU A 131 -13.186 9.002 -29.904 1.00 0.00 C ATOM 2165 O LEU A 131 -13.244 10.116 -30.424 1.00 0.00 O ATOM 2166 CB LEU A 131 -11.161 7.605 -30.348 1.00 0.00 C ATOM 2167 CG LEU A 131 -9.703 7.255 -30.022 1.00 0.00 C ATOM 2168 CD1 LEU A 131 -9.196 6.216 -31.014 1.00 0.00 C ATOM 2169 CD2 LEU A 131 -8.854 8.516 -30.071 1.00 0.00 C ATOM 0 H LEU A 131 -11.915 6.734 -28.163 1.00 0.00 H new ATOM 0 HA LEU A 131 -11.250 9.339 -29.068 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -11.722 6.677 -30.461 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -11.187 8.113 -31.312 1.00 0.00 H new ATOM 0 HG LEU A 131 -9.637 6.835 -29.018 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -8.160 5.967 -30.783 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -9.809 5.317 -30.945 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -9.255 6.619 -32.025 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -7.818 8.267 -29.839 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -8.908 8.952 -31.068 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -9.226 9.234 -29.340 1.00 0.00 H new ATOM 2181 N GLU A 132 -14.232 8.188 -29.818 1.00 0.00 N ATOM 2182 CA GLU A 132 -15.554 8.587 -30.284 1.00 0.00 C ATOM 2183 C GLU A 132 -16.167 9.638 -29.368 1.00 0.00 C ATOM 2184 O GLU A 132 -16.859 10.548 -29.826 1.00 0.00 O ATOM 2185 CB GLU A 132 -16.479 7.371 -30.372 1.00 0.00 C ATOM 2186 CG GLU A 132 -16.107 6.376 -31.463 1.00 0.00 C ATOM 2187 CD GLU A 132 -17.000 5.167 -31.481 1.00 0.00 C ATOM 2188 OE1 GLU A 132 -17.808 5.036 -30.593 1.00 0.00 O ATOM 2189 OE2 GLU A 132 -16.874 4.374 -32.384 1.00 0.00 O ATOM 0 H GLU A 132 -14.189 7.246 -29.429 1.00 0.00 H new ATOM 0 HA GLU A 132 -15.439 9.022 -31.277 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -16.475 6.856 -29.411 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -17.498 7.717 -30.544 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -16.156 6.872 -32.432 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -15.075 6.057 -31.320 1.00 0.00 H new ATOM 2196 N HIS A 133 -15.910 9.507 -28.071 1.00 0.00 N ATOM 2197 CA HIS A 133 -16.446 10.440 -27.086 1.00 0.00 C ATOM 2198 C HIS A 133 -15.729 11.782 -27.152 1.00 0.00 C ATOM 2199 O HIS A 133 -16.027 12.580 -27.997 1.00 0.00 O ATOM 2200 CB HIS A 133 -16.329 9.860 -25.673 1.00 0.00 C ATOM 2201 CG HIS A 133 -16.883 10.755 -24.608 1.00 0.00 C ATOM 2202 ND1 HIS A 133 -16.159 11.792 -24.057 1.00 0.00 N ATOM 2203 CD2 HIS A 133 -18.088 10.769 -23.993 1.00 0.00 C ATOM 2204 CE1 HIS A 133 -16.897 12.405 -23.148 1.00 0.00 C ATOM 2205 NE2 HIS A 133 -18.071 11.803 -23.090 1.00 0.00 N ATOM 0 H HIS A 133 -15.334 8.763 -27.677 1.00 0.00 H new ATOM 0 HA HIS A 133 -17.499 10.598 -27.321 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -16.850 8.903 -25.638 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -15.279 9.660 -25.458 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -18.910 10.093 -24.178 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -16.592 13.254 -22.554 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -18.841 12.064 -22.474 1.00 0.00 H new TER 2213 HIS A 133