USER MOD reduce.3.24.130724 H: found=0, std=0, add=947, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 947 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 20 ASN : amide:sc= -0.0294 X(o=-1.5,f=-1.4) USER MOD Set 1.2: A 111 SER OG : rot -140:sc= -1.46! USER MOD Single : A 1 MET CE :methyl -116:sc= -0.126 (180deg=-0.615) USER MOD Single : A 1 MET N :NH3+ 147:sc= 0.0776 (180deg=0) USER MOD Single : A 6 SER OG : rot -130:sc= -0.245 USER MOD Single : A 8 SER OG : rot -117:sc= 1.29 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0.852 (180deg=0.852) USER MOD Single : A 14 LYS NZ :NH3+ -156:sc= 1.22 (180deg=1.14) USER MOD Single : A 19 SER OG : rot 86:sc= 0.962 USER MOD Single : A 21 LYS NZ :NH3+ 153:sc= 1.22 (180deg=1.01) USER MOD Single : A 22 ASN :FLIP amide:sc= 0.616 F(o=-0.033,f=0.62) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.168 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 33 SER OG : rot -83:sc= 1.05 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0.584 (180deg=0.584) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 HIS : no HD1:sc= -0.0744 X(o=-0.074,f=-0.088) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= 0.599 K(o=0.6,f=-0.22) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 75:sc= -0.119 USER MOD Single : A 74 MET CE :methyl -107:sc= -0.573 (180deg=-2.52!) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0.067) USER MOD Single : A 88 LYS NZ :NH3+ 165:sc= -0.059 (180deg=-0.296) USER MOD Single : A 92 ASN : amide:sc= -3.55! C(o=-3.6!,f=-5.6!) USER MOD Single : A 93 LYS NZ :NH3+ -177:sc= 1.25 (180deg=1.2) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.365 X(o=-0.36,f=0) USER MOD Single : A 110 SER OG : rot 91:sc= 1.28 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.0046) USER MOD Single : A 115 HIS : no HD1:sc= -0.373 X(o=-0.37,f=-0.54) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=-0.0073) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.763 -11.196 -10.242 1.00 0.00 N ATOM 2 CA MET A 1 0.515 -11.351 -8.822 1.00 0.00 C ATOM 3 C MET A 1 -0.643 -10.452 -8.437 1.00 0.00 C ATOM 4 O MET A 1 -0.801 -9.359 -9.001 1.00 0.00 O ATOM 5 CB MET A 1 1.778 -11.006 -8.024 1.00 0.00 C ATOM 6 CG MET A 1 1.660 -11.229 -6.525 1.00 0.00 C ATOM 7 SD MET A 1 3.185 -10.844 -5.654 1.00 0.00 S ATOM 8 CE MET A 1 2.723 -11.278 -3.983 1.00 0.00 C ATOM 0 H1 MET A 1 1.780 -11.306 -10.431 1.00 0.00 H new ATOM 0 H2 MET A 1 0.233 -11.920 -10.768 1.00 0.00 H new ATOM 0 H3 MET A 1 0.454 -10.251 -10.547 1.00 0.00 H new ATOM 0 HA MET A 1 0.257 -12.385 -8.593 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.606 -11.605 -8.403 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.031 -9.961 -8.204 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.853 -10.611 -6.131 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.388 -12.267 -6.335 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.740 -10.386 -3.357 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.719 -11.703 -3.982 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.427 -12.011 -3.589 1.00 0.00 H new ATOM 20 N PHE A 2 -1.469 -10.911 -7.528 1.00 0.00 N ATOM 21 CA PHE A 2 -2.613 -10.151 -7.091 1.00 0.00 C ATOM 22 C PHE A 2 -2.226 -9.230 -5.940 1.00 0.00 C ATOM 23 O PHE A 2 -1.249 -9.491 -5.222 1.00 0.00 O ATOM 24 CB PHE A 2 -3.762 -11.083 -6.654 1.00 0.00 C ATOM 25 CG PHE A 2 -4.291 -12.001 -7.735 1.00 0.00 C ATOM 26 CD1 PHE A 2 -5.085 -11.509 -8.755 1.00 0.00 C ATOM 27 CD2 PHE A 2 -3.991 -13.354 -7.728 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.571 -12.344 -9.743 1.00 0.00 C ATOM 29 CE2 PHE A 2 -4.474 -14.193 -8.711 1.00 0.00 C ATOM 30 CZ PHE A 2 -5.264 -13.688 -9.721 1.00 0.00 C ATOM 0 H PHE A 2 -1.367 -11.818 -7.073 1.00 0.00 H new ATOM 0 HA PHE A 2 -2.959 -9.549 -7.931 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -3.417 -11.692 -5.819 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.585 -10.471 -6.284 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.329 -10.457 -8.780 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -3.370 -13.757 -6.942 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -6.191 -11.944 -10.532 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -4.233 -15.246 -8.689 1.00 0.00 H new ATOM 0 HZ PHE A 2 -5.641 -14.343 -10.493 1.00 0.00 H new ATOM 40 N ALA A 3 -2.958 -8.162 -5.790 1.00 0.00 N ATOM 41 CA ALA A 3 -2.760 -7.228 -4.707 1.00 0.00 C ATOM 42 C ALA A 3 -4.096 -6.940 -4.063 1.00 0.00 C ATOM 43 O ALA A 3 -4.949 -6.291 -4.655 1.00 0.00 O ATOM 44 CB ALA A 3 -2.109 -5.944 -5.201 1.00 0.00 C ATOM 0 H ALA A 3 -3.718 -7.909 -6.421 1.00 0.00 H new ATOM 0 HA ALA A 3 -2.086 -7.667 -3.971 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -1.972 -5.260 -4.364 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -1.140 -6.174 -5.643 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.748 -5.477 -5.950 1.00 0.00 H new ATOM 50 N VAL A 4 -4.278 -7.434 -2.883 1.00 0.00 N ATOM 51 CA VAL A 4 -5.528 -7.301 -2.184 1.00 0.00 C ATOM 52 C VAL A 4 -5.458 -6.076 -1.297 1.00 0.00 C ATOM 53 O VAL A 4 -4.451 -5.845 -0.629 1.00 0.00 O ATOM 54 CB VAL A 4 -5.834 -8.556 -1.326 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.229 -8.478 -0.710 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.686 -9.823 -2.154 1.00 0.00 C ATOM 0 H VAL A 4 -3.563 -7.946 -2.367 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.331 -7.197 -2.914 1.00 0.00 H new ATOM 0 HB VAL A 4 -5.109 -8.588 -0.513 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.414 -9.372 -0.114 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.296 -7.597 -0.072 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -7.974 -8.410 -1.503 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.905 -10.691 -1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.381 -9.793 -2.993 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.666 -9.895 -2.530 1.00 0.00 H new ATOM 66 N ILE A 5 -6.482 -5.288 -1.321 1.00 0.00 N ATOM 67 CA ILE A 5 -6.522 -4.083 -0.544 1.00 0.00 C ATOM 68 C ILE A 5 -7.435 -4.281 0.671 1.00 0.00 C ATOM 69 O ILE A 5 -8.527 -4.851 0.549 1.00 0.00 O ATOM 70 CB ILE A 5 -7.073 -2.922 -1.399 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.328 -2.857 -2.746 1.00 0.00 C ATOM 72 CG2 ILE A 5 -6.907 -1.607 -0.643 1.00 0.00 C ATOM 73 CD1 ILE A 5 -6.932 -1.892 -3.741 1.00 0.00 C ATOM 0 H ILE A 5 -7.319 -5.458 -1.879 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.511 -3.846 -0.213 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.132 -3.091 -1.594 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.292 -2.571 -2.562 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.311 -3.853 -3.187 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.296 -0.788 -1.248 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.456 -1.656 0.298 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.850 -1.436 -0.438 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.349 -1.906 -4.662 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -7.959 -2.187 -3.957 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.925 -0.886 -3.322 1.00 0.00 H new ATOM 85 N SER A 6 -6.978 -3.858 1.821 1.00 0.00 N ATOM 86 CA SER A 6 -7.781 -3.885 3.017 1.00 0.00 C ATOM 87 C SER A 6 -8.569 -2.563 3.124 1.00 0.00 C ATOM 88 O SER A 6 -8.080 -1.515 2.673 1.00 0.00 O ATOM 89 CB SER A 6 -6.878 -4.072 4.238 1.00 0.00 C ATOM 90 OG SER A 6 -6.116 -5.266 4.133 1.00 0.00 O ATOM 0 H SER A 6 -6.038 -3.485 1.955 1.00 0.00 H new ATOM 0 HA SER A 6 -8.484 -4.717 2.976 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.209 -3.217 4.333 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.486 -4.103 5.142 1.00 0.00 H new ATOM 0 HG SER A 6 -6.202 -5.783 4.961 1.00 0.00 H new ATOM 96 N PRO A 7 -9.804 -2.590 3.687 1.00 0.00 N ATOM 97 CA PRO A 7 -10.653 -1.391 3.852 1.00 0.00 C ATOM 98 C PRO A 7 -9.957 -0.212 4.567 1.00 0.00 C ATOM 99 O PRO A 7 -10.289 0.959 4.319 1.00 0.00 O ATOM 100 CB PRO A 7 -11.856 -1.900 4.645 1.00 0.00 C ATOM 101 CG PRO A 7 -11.922 -3.344 4.303 1.00 0.00 C ATOM 102 CD PRO A 7 -10.494 -3.798 4.177 1.00 0.00 C ATOM 0 HA PRO A 7 -10.918 -0.967 2.883 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.722 -1.749 5.716 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.771 -1.380 4.362 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.445 -3.906 5.077 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.466 -3.501 3.372 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -10.091 -4.133 5.133 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.395 -4.630 3.480 1.00 0.00 H new ATOM 110 N SER A 8 -8.995 -0.503 5.426 1.00 0.00 N ATOM 111 CA SER A 8 -8.205 0.532 6.086 1.00 0.00 C ATOM 112 C SER A 8 -7.405 1.392 5.075 1.00 0.00 C ATOM 113 O SER A 8 -7.056 2.545 5.358 1.00 0.00 O ATOM 114 CB SER A 8 -7.262 -0.098 7.118 1.00 0.00 C ATOM 115 OG SER A 8 -6.484 -1.149 6.541 1.00 0.00 O ATOM 0 H SER A 8 -8.738 -1.455 5.687 1.00 0.00 H new ATOM 0 HA SER A 8 -8.901 1.199 6.595 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.599 0.667 7.522 1.00 0.00 H new ATOM 0 HB3 SER A 8 -7.843 -0.490 7.953 1.00 0.00 H new ATOM 0 HG SER A 8 -6.700 -1.997 6.983 1.00 0.00 H new ATOM 121 N ALA A 9 -7.151 0.838 3.891 1.00 0.00 N ATOM 122 CA ALA A 9 -6.370 1.508 2.863 1.00 0.00 C ATOM 123 C ALA A 9 -7.273 2.185 1.825 1.00 0.00 C ATOM 124 O ALA A 9 -6.814 2.617 0.764 1.00 0.00 O ATOM 125 CB ALA A 9 -5.442 0.502 2.193 1.00 0.00 C ATOM 0 H ALA A 9 -7.483 -0.088 3.621 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.775 2.290 3.335 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.857 1.004 1.423 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.771 0.074 2.938 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.034 -0.293 1.739 1.00 0.00 H new ATOM 131 N PHE A 10 -8.544 2.301 2.141 1.00 0.00 N ATOM 132 CA PHE A 10 -9.508 2.916 1.238 1.00 0.00 C ATOM 133 C PHE A 10 -9.329 4.408 1.075 1.00 0.00 C ATOM 134 O PHE A 10 -8.677 5.073 1.877 1.00 0.00 O ATOM 135 CB PHE A 10 -10.940 2.597 1.633 1.00 0.00 C ATOM 136 CG PHE A 10 -11.441 1.291 1.110 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.590 0.220 0.914 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.772 1.140 0.809 1.00 0.00 C ATOM 139 CE1 PHE A 10 -11.063 -0.970 0.429 1.00 0.00 C ATOM 140 CE2 PHE A 10 -13.248 -0.047 0.328 1.00 0.00 C ATOM 141 CZ PHE A 10 -12.398 -1.100 0.136 1.00 0.00 C ATOM 0 H PHE A 10 -8.942 1.976 3.022 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.303 2.469 0.265 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -11.013 2.593 2.721 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.591 3.394 1.273 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.540 0.323 1.146 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.450 1.968 0.954 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.390 -1.801 0.278 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -14.298 -0.153 0.099 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.777 -2.036 -0.247 1.00 0.00 H new ATOM 151 N GLY A 11 -9.892 4.914 -0.001 1.00 0.00 N ATOM 152 CA GLY A 11 -9.832 6.325 -0.324 1.00 0.00 C ATOM 153 C GLY A 11 -8.592 6.664 -1.111 1.00 0.00 C ATOM 154 O GLY A 11 -8.618 7.476 -2.023 1.00 0.00 O ATOM 0 H GLY A 11 -10.408 4.355 -0.681 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.715 6.605 -0.898 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.851 6.910 0.595 1.00 0.00 H new ATOM 158 N LYS A 12 -7.520 5.978 -0.814 1.00 0.00 N ATOM 159 CA LYS A 12 -6.263 6.202 -1.480 1.00 0.00 C ATOM 160 C LYS A 12 -6.014 5.119 -2.521 1.00 0.00 C ATOM 161 O LYS A 12 -4.916 4.984 -3.069 1.00 0.00 O ATOM 162 CB LYS A 12 -5.151 6.266 -0.454 1.00 0.00 C ATOM 163 CG LYS A 12 -5.339 7.392 0.557 1.00 0.00 C ATOM 164 CD LYS A 12 -4.175 7.494 1.520 1.00 0.00 C ATOM 165 CE LYS A 12 -2.886 7.941 0.832 1.00 0.00 C ATOM 166 NZ LYS A 12 -3.039 9.252 0.164 1.00 0.00 N ATOM 0 H LYS A 12 -7.493 5.247 -0.103 1.00 0.00 H new ATOM 0 HA LYS A 12 -6.292 7.155 -2.008 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -5.097 5.315 0.075 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -4.198 6.400 -0.966 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -5.455 8.338 0.028 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -6.259 7.225 1.117 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.424 8.200 2.313 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.014 6.526 1.994 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.084 8.001 1.568 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.589 7.192 0.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -2.142 9.517 -0.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.786 9.189 -0.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -3.297 9.972 0.868 1.00 0.00 H new ATOM 180 N LEU A 13 -7.081 4.384 -2.815 1.00 0.00 N ATOM 181 CA LEU A 13 -7.102 3.304 -3.814 1.00 0.00 C ATOM 182 C LEU A 13 -6.664 3.852 -5.168 1.00 0.00 C ATOM 183 O LEU A 13 -5.885 3.248 -5.894 1.00 0.00 O ATOM 184 CB LEU A 13 -8.545 2.785 -3.957 1.00 0.00 C ATOM 185 CG LEU A 13 -9.252 2.346 -2.672 1.00 0.00 C ATOM 186 CD1 LEU A 13 -10.691 1.952 -2.963 1.00 0.00 C ATOM 187 CD2 LEU A 13 -8.520 1.194 -2.030 1.00 0.00 C ATOM 0 H LEU A 13 -7.982 4.521 -2.357 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.431 2.506 -3.496 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.143 3.568 -4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.535 1.940 -4.645 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.253 3.188 -1.980 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.178 1.643 -2.038 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -11.223 2.804 -3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.705 1.126 -3.674 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -9.038 0.897 -1.118 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.490 0.352 -2.721 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -7.503 1.500 -1.786 1.00 0.00 H new ATOM 199 N LYS A 14 -7.147 5.038 -5.445 1.00 0.00 N ATOM 200 CA LYS A 14 -6.932 5.747 -6.697 1.00 0.00 C ATOM 201 C LYS A 14 -5.466 6.124 -6.876 1.00 0.00 C ATOM 202 O LYS A 14 -4.974 6.248 -8.004 1.00 0.00 O ATOM 203 CB LYS A 14 -7.791 6.998 -6.654 1.00 0.00 C ATOM 204 CG LYS A 14 -9.255 6.683 -6.404 1.00 0.00 C ATOM 205 CD LYS A 14 -10.037 7.897 -5.956 1.00 0.00 C ATOM 206 CE LYS A 14 -10.109 8.980 -6.999 1.00 0.00 C ATOM 207 NZ LYS A 14 -10.959 10.084 -6.534 1.00 0.00 N ATOM 0 H LYS A 14 -7.723 5.561 -4.785 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.203 5.110 -7.539 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -7.425 7.661 -5.870 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.693 7.536 -7.597 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.699 6.284 -7.316 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.332 5.904 -5.645 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.049 7.591 -5.691 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.579 8.302 -5.053 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.107 9.351 -7.217 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -10.507 8.573 -7.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -11.331 10.605 -7.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -11.751 9.702 -5.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.398 10.728 -5.941 1.00 0.00 H new ATOM 221 N GLU A 15 -4.777 6.266 -5.770 1.00 0.00 N ATOM 222 CA GLU A 15 -3.398 6.671 -5.778 1.00 0.00 C ATOM 223 C GLU A 15 -2.490 5.480 -6.014 1.00 0.00 C ATOM 224 O GLU A 15 -1.635 5.524 -6.895 1.00 0.00 O ATOM 225 CB GLU A 15 -3.067 7.397 -4.484 1.00 0.00 C ATOM 226 CG GLU A 15 -3.870 8.675 -4.326 1.00 0.00 C ATOM 227 CD GLU A 15 -3.701 9.324 -2.989 1.00 0.00 C ATOM 228 OE1 GLU A 15 -2.794 10.157 -2.815 1.00 0.00 O ATOM 229 OE2 GLU A 15 -4.478 9.019 -2.074 1.00 0.00 O ATOM 0 H GLU A 15 -5.160 6.103 -4.839 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.230 7.364 -6.602 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.264 6.738 -3.638 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.003 7.633 -4.463 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.574 9.379 -5.103 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -4.926 8.453 -4.483 1.00 0.00 H new ATOM 236 N ILE A 16 -2.700 4.401 -5.266 1.00 0.00 N ATOM 237 CA ILE A 16 -1.885 3.187 -5.424 1.00 0.00 C ATOM 238 C ILE A 16 -2.065 2.572 -6.812 1.00 0.00 C ATOM 239 O ILE A 16 -1.085 2.273 -7.515 1.00 0.00 O ATOM 240 CB ILE A 16 -2.160 2.119 -4.312 1.00 0.00 C ATOM 241 CG1 ILE A 16 -3.664 1.798 -4.181 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.595 2.580 -2.991 1.00 0.00 C ATOM 243 CD1 ILE A 16 -4.002 0.760 -3.128 1.00 0.00 C ATOM 0 H ILE A 16 -3.421 4.336 -4.547 1.00 0.00 H new ATOM 0 HA ILE A 16 -0.848 3.504 -5.313 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.658 1.198 -4.608 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.199 2.719 -3.949 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.033 1.450 -5.146 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.794 1.828 -2.228 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.519 2.725 -3.086 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.064 3.521 -2.703 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.080 0.600 -3.108 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.500 -0.178 -3.367 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.669 1.111 -2.151 1.00 0.00 H new ATOM 255 N LEU A 17 -3.307 2.464 -7.221 1.00 0.00 N ATOM 256 CA LEU A 17 -3.671 1.875 -8.483 1.00 0.00 C ATOM 257 C LEU A 17 -3.204 2.749 -9.646 1.00 0.00 C ATOM 258 O LEU A 17 -2.631 2.250 -10.614 1.00 0.00 O ATOM 259 CB LEU A 17 -5.187 1.685 -8.499 1.00 0.00 C ATOM 260 CG LEU A 17 -5.833 1.087 -9.742 1.00 0.00 C ATOM 261 CD1 LEU A 17 -5.270 -0.285 -10.056 1.00 0.00 C ATOM 262 CD2 LEU A 17 -7.320 0.997 -9.519 1.00 0.00 C ATOM 0 H LEU A 17 -4.105 2.789 -6.675 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.182 0.908 -8.602 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.450 1.052 -7.652 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.645 2.659 -8.324 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.617 1.731 -10.594 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.754 -0.681 -10.949 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.197 -0.207 -10.229 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.454 -0.955 -9.216 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -7.795 0.570 -10.402 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -7.521 0.362 -8.656 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.722 1.994 -9.337 1.00 0.00 H new ATOM 274 N GLY A 18 -3.398 4.052 -9.511 1.00 0.00 N ATOM 275 CA GLY A 18 -3.038 4.978 -10.559 1.00 0.00 C ATOM 276 C GLY A 18 -1.539 5.147 -10.718 1.00 0.00 C ATOM 277 O GLY A 18 -1.048 5.327 -11.824 1.00 0.00 O ATOM 0 H GLY A 18 -3.804 4.487 -8.682 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.460 4.631 -11.502 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.486 5.949 -10.347 1.00 0.00 H new ATOM 281 N SER A 19 -0.813 5.060 -9.640 1.00 0.00 N ATOM 282 CA SER A 19 0.615 5.261 -9.697 1.00 0.00 C ATOM 283 C SER A 19 1.369 4.003 -10.103 1.00 0.00 C ATOM 284 O SER A 19 2.238 4.052 -10.980 1.00 0.00 O ATOM 285 CB SER A 19 1.131 5.753 -8.353 1.00 0.00 C ATOM 286 OG SER A 19 0.471 6.951 -7.974 1.00 0.00 O ATOM 0 H SER A 19 -1.181 4.852 -8.712 1.00 0.00 H new ATOM 0 HA SER A 19 0.796 6.013 -10.465 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.972 4.987 -7.594 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.206 5.926 -8.411 1.00 0.00 H new ATOM 0 HG SER A 19 -0.369 6.732 -7.519 1.00 0.00 H new ATOM 292 N ASN A 20 1.011 2.887 -9.516 1.00 0.00 N ATOM 293 CA ASN A 20 1.810 1.690 -9.676 1.00 0.00 C ATOM 294 C ASN A 20 1.309 0.761 -10.754 1.00 0.00 C ATOM 295 O ASN A 20 2.047 0.447 -11.689 1.00 0.00 O ATOM 296 CB ASN A 20 1.885 0.918 -8.349 1.00 0.00 C ATOM 297 CG ASN A 20 2.842 -0.277 -8.387 1.00 0.00 C ATOM 298 OD1 ASN A 20 3.863 -0.260 -9.080 1.00 0.00 O ATOM 299 ND2 ASN A 20 2.523 -1.312 -7.649 1.00 0.00 N ATOM 0 H ASN A 20 0.183 2.779 -8.930 1.00 0.00 H new ATOM 0 HA ASN A 20 2.798 2.035 -9.983 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.200 1.600 -7.559 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.887 0.566 -8.087 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.126 -2.135 -7.636 1.00 0.00 H new ATOM 0 HD22 ASN A 20 1.672 -1.295 -7.087 1.00 0.00 H new ATOM 306 N LYS A 21 0.032 0.394 -10.663 1.00 0.00 N ATOM 307 CA LYS A 21 -0.504 -0.742 -11.405 1.00 0.00 C ATOM 308 C LYS A 21 0.302 -1.981 -10.987 1.00 0.00 C ATOM 309 O LYS A 21 0.263 -2.353 -9.820 1.00 0.00 O ATOM 310 CB LYS A 21 -0.516 -0.586 -12.955 1.00 0.00 C ATOM 311 CG LYS A 21 -1.450 0.472 -13.544 1.00 0.00 C ATOM 312 CD LYS A 21 -0.884 1.875 -13.475 1.00 0.00 C ATOM 313 CE LYS A 21 -1.815 2.855 -14.168 1.00 0.00 C ATOM 314 NZ LYS A 21 -1.258 4.217 -14.232 1.00 0.00 N ATOM 0 H LYS A 21 -0.654 0.872 -10.078 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.560 -0.828 -11.149 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.499 -0.358 -13.279 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.781 -1.550 -13.389 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.660 0.223 -14.584 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -2.401 0.444 -13.012 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.746 2.168 -12.434 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.099 1.901 -13.946 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.020 2.503 -15.179 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.768 2.881 -13.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.654 4.716 -15.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.502 4.733 -13.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -0.223 4.165 -14.325 1.00 0.00 H new ATOM 328 N ASN A 22 1.062 -2.561 -11.925 1.00 0.00 N ATOM 329 CA ASN A 22 2.024 -3.694 -11.716 1.00 0.00 C ATOM 330 C ASN A 22 1.443 -4.996 -11.074 1.00 0.00 C ATOM 331 O ASN A 22 2.029 -6.075 -11.203 1.00 0.00 O ATOM 332 CB ASN A 22 3.276 -3.165 -10.959 1.00 0.00 C ATOM 333 CG ASN A 22 4.318 -4.218 -10.592 1.00 0.00 C ATOM 334 OD1 ASN A 22 5.227 -4.494 -11.483 1.00 0.00 O flip ATOM 335 ND2 ASN A 22 4.303 -4.766 -9.495 1.00 0.00 N flip ATOM 0 H ASN A 22 1.035 -2.254 -12.897 1.00 0.00 H new ATOM 0 HA ASN A 22 2.297 -4.039 -12.713 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.756 -2.404 -11.574 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.945 -2.673 -10.044 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.579 -4.530 -8.817 1.00 0.00 H new ATOM 0 HD22 ASN A 22 5.015 -5.458 -9.261 1.00 0.00 H new ATOM 342 N TYR A 23 0.286 -4.921 -10.495 1.00 0.00 N ATOM 343 CA TYR A 23 -0.361 -6.052 -9.890 1.00 0.00 C ATOM 344 C TYR A 23 -1.789 -6.108 -10.348 1.00 0.00 C ATOM 345 O TYR A 23 -2.308 -5.137 -10.924 1.00 0.00 O ATOM 346 CB TYR A 23 -0.365 -5.940 -8.356 1.00 0.00 C ATOM 347 CG TYR A 23 0.982 -6.004 -7.676 1.00 0.00 C ATOM 348 CD1 TYR A 23 1.588 -7.223 -7.432 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.628 -4.851 -7.251 1.00 0.00 C ATOM 350 CE1 TYR A 23 2.803 -7.299 -6.784 1.00 0.00 C ATOM 351 CE2 TYR A 23 2.846 -4.916 -6.607 1.00 0.00 C ATOM 352 CZ TYR A 23 3.429 -6.144 -6.373 1.00 0.00 C ATOM 353 OH TYR A 23 4.644 -6.214 -5.721 1.00 0.00 O ATOM 0 H TYR A 23 -0.250 -4.056 -10.426 1.00 0.00 H new ATOM 0 HA TYR A 23 0.187 -6.947 -10.185 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.841 -4.998 -8.083 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -0.988 -6.740 -7.956 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.101 -8.131 -7.755 1.00 0.00 H new ATOM 0 HD2 TYR A 23 1.170 -3.889 -7.427 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.261 -8.260 -6.600 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.340 -4.010 -6.288 1.00 0.00 H new ATOM 0 HH TYR A 23 4.949 -5.309 -5.500 1.00 0.00 H new ATOM 363 N LYS A 24 -2.422 -7.216 -10.112 1.00 0.00 N ATOM 364 CA LYS A 24 -3.824 -7.341 -10.371 1.00 0.00 C ATOM 365 C LYS A 24 -4.514 -7.126 -9.038 1.00 0.00 C ATOM 366 O LYS A 24 -4.444 -7.970 -8.152 1.00 0.00 O ATOM 367 CB LYS A 24 -4.162 -8.724 -10.959 1.00 0.00 C ATOM 368 CG LYS A 24 -5.613 -8.917 -11.448 1.00 0.00 C ATOM 369 CD LYS A 24 -5.871 -8.384 -12.880 1.00 0.00 C ATOM 370 CE LYS A 24 -5.745 -6.869 -13.021 1.00 0.00 C ATOM 371 NZ LYS A 24 -6.009 -6.430 -14.403 1.00 0.00 N ATOM 0 H LYS A 24 -1.984 -8.057 -9.736 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.157 -6.612 -11.110 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.490 -8.915 -11.795 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.952 -9.480 -10.202 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.858 -9.979 -11.417 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.289 -8.413 -10.757 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.168 -8.860 -13.564 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.872 -8.684 -13.191 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.445 -6.380 -12.343 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.744 -6.557 -12.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.915 -5.396 -14.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.325 -6.878 -15.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.974 -6.706 -14.677 1.00 0.00 H new ATOM 385 N PHE A 25 -5.110 -5.985 -8.882 1.00 0.00 N ATOM 386 CA PHE A 25 -5.696 -5.602 -7.617 1.00 0.00 C ATOM 387 C PHE A 25 -6.998 -6.329 -7.359 1.00 0.00 C ATOM 388 O PHE A 25 -7.803 -6.538 -8.271 1.00 0.00 O ATOM 389 CB PHE A 25 -5.876 -4.092 -7.538 1.00 0.00 C ATOM 390 CG PHE A 25 -4.581 -3.315 -7.494 1.00 0.00 C ATOM 391 CD1 PHE A 25 -3.831 -3.117 -8.640 1.00 0.00 C ATOM 392 CD2 PHE A 25 -4.117 -2.785 -6.303 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.652 -2.407 -8.599 1.00 0.00 C ATOM 394 CE2 PHE A 25 -2.935 -2.072 -6.260 1.00 0.00 C ATOM 395 CZ PHE A 25 -2.200 -1.885 -7.409 1.00 0.00 C ATOM 0 H PHE A 25 -5.209 -5.288 -9.620 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.004 -5.899 -6.829 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.456 -3.761 -8.399 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.460 -3.853 -6.649 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -4.175 -3.525 -9.579 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.686 -2.931 -5.397 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -2.080 -2.259 -9.503 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.587 -1.661 -5.324 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.273 -1.331 -7.376 1.00 0.00 H new ATOM 405 N VAL A 26 -7.179 -6.730 -6.129 1.00 0.00 N ATOM 406 CA VAL A 26 -8.321 -7.496 -5.705 1.00 0.00 C ATOM 407 C VAL A 26 -8.919 -6.862 -4.452 1.00 0.00 C ATOM 408 O VAL A 26 -8.190 -6.385 -3.571 1.00 0.00 O ATOM 409 CB VAL A 26 -7.915 -8.970 -5.380 1.00 0.00 C ATOM 410 CG1 VAL A 26 -9.115 -9.804 -4.978 1.00 0.00 C ATOM 411 CG2 VAL A 26 -7.195 -9.622 -6.546 1.00 0.00 C ATOM 0 H VAL A 26 -6.521 -6.528 -5.376 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.051 -7.501 -6.515 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.229 -8.926 -4.534 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.794 -10.822 -4.760 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.578 -9.372 -4.091 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.838 -9.819 -5.794 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.929 -10.646 -6.283 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.848 -9.630 -7.418 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.290 -9.059 -6.776 1.00 0.00 H new ATOM 421 N ILE A 27 -10.218 -6.837 -4.387 1.00 0.00 N ATOM 422 CA ILE A 27 -10.914 -6.314 -3.252 1.00 0.00 C ATOM 423 C ILE A 27 -11.974 -7.340 -2.797 1.00 0.00 C ATOM 424 O ILE A 27 -12.392 -8.204 -3.578 1.00 0.00 O ATOM 425 CB ILE A 27 -11.552 -4.925 -3.578 1.00 0.00 C ATOM 426 CG1 ILE A 27 -12.137 -4.259 -2.327 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.613 -5.052 -4.661 1.00 0.00 C ATOM 428 CD1 ILE A 27 -11.122 -4.055 -1.226 1.00 0.00 C ATOM 0 H ILE A 27 -10.828 -7.183 -5.128 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.211 -6.151 -2.435 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.753 -4.284 -3.951 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.562 -3.294 -2.603 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.956 -4.871 -1.948 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.041 -4.071 -4.868 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.160 -5.450 -5.569 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.400 -5.726 -4.322 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.603 -3.580 -0.371 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.715 -5.020 -0.923 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.315 -3.418 -1.589 1.00 0.00 H new ATOM 440 N THR A 28 -12.368 -7.262 -1.555 1.00 0.00 N ATOM 441 CA THR A 28 -13.309 -8.176 -0.977 1.00 0.00 C ATOM 442 C THR A 28 -14.750 -7.666 -1.105 1.00 0.00 C ATOM 443 O THR A 28 -14.990 -6.497 -1.449 1.00 0.00 O ATOM 444 CB THR A 28 -12.975 -8.362 0.514 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.838 -7.070 1.136 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.687 -9.128 0.688 1.00 0.00 C ATOM 0 H THR A 28 -12.037 -6.548 -0.907 1.00 0.00 H new ATOM 0 HA THR A 28 -13.236 -9.122 -1.514 1.00 0.00 H new ATOM 0 HB THR A 28 -13.784 -8.925 0.980 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.627 -7.185 2.086 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.474 -9.245 1.751 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.783 -10.111 0.226 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.872 -8.582 0.213 1.00 0.00 H new ATOM 454 N THR A 29 -15.688 -8.539 -0.806 1.00 0.00 N ATOM 455 CA THR A 29 -17.103 -8.235 -0.769 1.00 0.00 C ATOM 456 C THR A 29 -17.397 -7.231 0.343 1.00 0.00 C ATOM 457 O THR A 29 -18.168 -6.266 0.174 1.00 0.00 O ATOM 458 CB THR A 29 -17.822 -9.538 -0.485 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.956 -10.316 0.388 1.00 0.00 O ATOM 460 CG2 THR A 29 -18.078 -10.292 -1.769 1.00 0.00 C ATOM 0 H THR A 29 -15.480 -9.511 -0.575 1.00 0.00 H new ATOM 0 HA THR A 29 -17.432 -7.798 -1.712 1.00 0.00 H new ATOM 0 HB THR A 29 -18.788 -9.352 -0.016 1.00 0.00 H new ATOM 0 HG1 THR A 29 -17.387 -11.171 0.599 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.595 -11.225 -1.546 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.695 -9.684 -2.431 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.129 -10.511 -2.258 1.00 0.00 H new ATOM 468 N LEU A 30 -16.751 -7.451 1.472 1.00 0.00 N ATOM 469 CA LEU A 30 -16.873 -6.578 2.614 1.00 0.00 C ATOM 470 C LEU A 30 -16.224 -5.229 2.289 1.00 0.00 C ATOM 471 O LEU A 30 -16.666 -4.186 2.760 1.00 0.00 O ATOM 472 CB LEU A 30 -16.212 -7.219 3.845 1.00 0.00 C ATOM 473 CG LEU A 30 -16.699 -8.636 4.224 1.00 0.00 C ATOM 474 CD1 LEU A 30 -15.988 -9.140 5.464 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.205 -8.671 4.435 1.00 0.00 C ATOM 0 H LEU A 30 -16.126 -8.244 1.619 1.00 0.00 H new ATOM 0 HA LEU A 30 -17.927 -6.419 2.842 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.137 -7.262 3.673 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.372 -6.562 4.700 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.458 -9.294 3.389 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -16.349 -10.139 5.710 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -14.915 -9.177 5.278 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.189 -8.467 6.297 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -18.512 -9.683 4.700 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -18.476 -7.987 5.240 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -18.708 -8.368 3.517 1.00 0.00 H new ATOM 487 N GLY A 31 -15.197 -5.273 1.448 1.00 0.00 N ATOM 488 CA GLY A 31 -14.512 -4.086 1.017 1.00 0.00 C ATOM 489 C GLY A 31 -15.358 -3.235 0.089 1.00 0.00 C ATOM 490 O GLY A 31 -15.543 -2.050 0.340 1.00 0.00 O ATOM 0 H GLY A 31 -14.825 -6.137 1.053 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.229 -3.496 1.889 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.590 -4.366 0.508 1.00 0.00 H new ATOM 494 N VAL A 32 -15.903 -3.836 -0.970 1.00 0.00 N ATOM 495 CA VAL A 32 -16.723 -3.077 -1.926 1.00 0.00 C ATOM 496 C VAL A 32 -17.922 -2.418 -1.253 1.00 0.00 C ATOM 497 O VAL A 32 -18.237 -1.266 -1.529 1.00 0.00 O ATOM 498 CB VAL A 32 -17.188 -3.901 -3.177 1.00 0.00 C ATOM 499 CG1 VAL A 32 -16.006 -4.352 -3.993 1.00 0.00 C ATOM 500 CG2 VAL A 32 -18.050 -5.098 -2.799 1.00 0.00 C ATOM 0 H VAL A 32 -15.797 -4.827 -1.188 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.055 -2.302 -2.300 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.803 -3.232 -3.778 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.355 -4.921 -4.855 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.447 -3.481 -4.335 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.360 -4.980 -3.380 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.345 -5.634 -3.701 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.482 -5.765 -2.150 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -18.941 -4.753 -2.274 1.00 0.00 H new ATOM 510 N SER A 33 -18.533 -3.115 -0.319 1.00 0.00 N ATOM 511 CA SER A 33 -19.684 -2.593 0.360 1.00 0.00 C ATOM 512 C SER A 33 -19.287 -1.527 1.397 1.00 0.00 C ATOM 513 O SER A 33 -20.093 -0.665 1.766 1.00 0.00 O ATOM 514 CB SER A 33 -20.487 -3.737 0.969 1.00 0.00 C ATOM 515 OG SER A 33 -19.677 -4.555 1.806 1.00 0.00 O ATOM 0 H SER A 33 -18.246 -4.046 -0.017 1.00 0.00 H new ATOM 0 HA SER A 33 -20.325 -2.086 -0.361 1.00 0.00 H new ATOM 0 HB2 SER A 33 -21.317 -3.332 1.548 1.00 0.00 H new ATOM 0 HB3 SER A 33 -20.919 -4.344 0.173 1.00 0.00 H new ATOM 0 HG SER A 33 -19.190 -5.205 1.257 1.00 0.00 H new ATOM 521 N PHE A 34 -18.036 -1.573 1.843 1.00 0.00 N ATOM 522 CA PHE A 34 -17.499 -0.580 2.766 1.00 0.00 C ATOM 523 C PHE A 34 -17.378 0.744 2.022 1.00 0.00 C ATOM 524 O PHE A 34 -17.726 1.811 2.540 1.00 0.00 O ATOM 525 CB PHE A 34 -16.126 -1.041 3.300 1.00 0.00 C ATOM 526 CG PHE A 34 -15.483 -0.127 4.311 1.00 0.00 C ATOM 527 CD1 PHE A 34 -15.845 -0.187 5.645 1.00 0.00 C ATOM 528 CD2 PHE A 34 -14.508 0.779 3.924 1.00 0.00 C ATOM 529 CE1 PHE A 34 -15.247 0.641 6.575 1.00 0.00 C ATOM 530 CE2 PHE A 34 -13.906 1.608 4.848 1.00 0.00 C ATOM 531 CZ PHE A 34 -14.276 1.539 6.177 1.00 0.00 C ATOM 0 H PHE A 34 -17.368 -2.297 1.576 1.00 0.00 H new ATOM 0 HA PHE A 34 -18.162 -0.458 3.622 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -16.243 -2.027 3.750 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.447 -1.155 2.455 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -16.603 -0.888 5.962 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -14.216 0.837 2.886 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -15.539 0.586 7.613 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -13.147 2.309 4.533 1.00 0.00 H new ATOM 0 HZ PHE A 34 -13.807 2.186 6.904 1.00 0.00 H new ATOM 541 N ALA A 35 -16.933 0.654 0.780 1.00 0.00 N ATOM 542 CA ALA A 35 -16.809 1.817 -0.065 1.00 0.00 C ATOM 543 C ALA A 35 -18.180 2.390 -0.375 1.00 0.00 C ATOM 544 O ALA A 35 -18.370 3.603 -0.313 1.00 0.00 O ATOM 545 CB ALA A 35 -16.081 1.480 -1.345 1.00 0.00 C ATOM 0 H ALA A 35 -16.651 -0.221 0.338 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.226 2.566 0.471 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.001 2.374 -1.964 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -15.083 1.111 -1.109 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.633 0.712 -1.886 1.00 0.00 H new ATOM 551 N ILE A 36 -19.130 1.507 -0.678 1.00 0.00 N ATOM 552 CA ILE A 36 -20.509 1.897 -0.991 1.00 0.00 C ATOM 553 C ILE A 36 -21.140 2.689 0.158 1.00 0.00 C ATOM 554 O ILE A 36 -21.624 3.804 -0.041 1.00 0.00 O ATOM 555 CB ILE A 36 -21.411 0.658 -1.298 1.00 0.00 C ATOM 556 CG1 ILE A 36 -20.906 -0.130 -2.521 1.00 0.00 C ATOM 557 CG2 ILE A 36 -22.871 1.062 -1.485 1.00 0.00 C ATOM 558 CD1 ILE A 36 -20.844 0.662 -3.813 1.00 0.00 C ATOM 0 H ILE A 36 -18.968 0.501 -0.714 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.452 2.525 -1.880 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.349 0.001 -0.431 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -19.910 -0.515 -2.300 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.555 -0.992 -2.672 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.469 0.176 -1.697 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -23.236 1.537 -0.575 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -22.951 1.762 -2.317 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.477 0.022 -4.615 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.840 1.025 -4.066 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.170 1.510 -3.688 1.00 0.00 H new ATOM 570 N LYS A 37 -21.085 2.132 1.363 1.00 0.00 N ATOM 571 CA LYS A 37 -21.734 2.750 2.522 1.00 0.00 C ATOM 572 C LYS A 37 -21.121 4.093 2.919 1.00 0.00 C ATOM 573 O LYS A 37 -21.790 4.915 3.533 1.00 0.00 O ATOM 574 CB LYS A 37 -21.781 1.807 3.739 1.00 0.00 C ATOM 575 CG LYS A 37 -20.418 1.320 4.216 1.00 0.00 C ATOM 576 CD LYS A 37 -20.500 0.525 5.517 1.00 0.00 C ATOM 577 CE LYS A 37 -21.405 -0.696 5.418 1.00 0.00 C ATOM 578 NZ LYS A 37 -20.970 -1.651 4.384 1.00 0.00 N ATOM 0 H LYS A 37 -20.601 1.258 1.566 1.00 0.00 H new ATOM 0 HA LYS A 37 -22.756 2.945 2.197 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -22.277 2.321 4.562 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -22.394 0.942 3.488 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.968 0.698 3.442 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -19.760 2.177 4.359 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.498 0.204 5.803 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.865 1.176 6.311 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -21.432 -1.201 6.384 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -22.422 -0.371 5.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.623 -2.460 4.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -20.970 -1.182 3.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -20.010 -1.986 4.603 1.00 0.00 H new ATOM 592 N SER A 38 -19.872 4.321 2.591 1.00 0.00 N ATOM 593 CA SER A 38 -19.262 5.569 2.968 1.00 0.00 C ATOM 594 C SER A 38 -19.217 6.576 1.800 1.00 0.00 C ATOM 595 O SER A 38 -19.287 7.795 2.013 1.00 0.00 O ATOM 596 CB SER A 38 -17.871 5.341 3.581 1.00 0.00 C ATOM 597 OG SER A 38 -17.326 6.555 4.078 1.00 0.00 O ATOM 0 H SER A 38 -19.272 3.676 2.077 1.00 0.00 H new ATOM 0 HA SER A 38 -19.893 6.018 3.735 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.941 4.613 4.389 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.203 4.920 2.829 1.00 0.00 H new ATOM 0 HG SER A 38 -16.442 6.383 4.464 1.00 0.00 H new ATOM 603 N GLY A 39 -19.161 6.087 0.579 1.00 0.00 N ATOM 604 CA GLY A 39 -19.068 6.984 -0.557 1.00 0.00 C ATOM 605 C GLY A 39 -17.640 7.108 -1.030 1.00 0.00 C ATOM 606 O GLY A 39 -17.152 8.205 -1.328 1.00 0.00 O ATOM 0 H GLY A 39 -19.178 5.094 0.348 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.694 6.614 -1.369 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.451 7.967 -0.282 1.00 0.00 H new ATOM 610 N ILE A 40 -16.961 5.989 -1.056 1.00 0.00 N ATOM 611 CA ILE A 40 -15.574 5.925 -1.468 1.00 0.00 C ATOM 612 C ILE A 40 -15.533 5.425 -2.913 1.00 0.00 C ATOM 613 O ILE A 40 -16.407 4.642 -3.316 1.00 0.00 O ATOM 614 CB ILE A 40 -14.789 4.942 -0.546 1.00 0.00 C ATOM 615 CG1 ILE A 40 -14.978 5.346 0.927 1.00 0.00 C ATOM 616 CG2 ILE A 40 -13.304 4.913 -0.908 1.00 0.00 C ATOM 617 CD1 ILE A 40 -14.364 4.387 1.927 1.00 0.00 C ATOM 0 H ILE A 40 -17.355 5.087 -0.790 1.00 0.00 H new ATOM 0 HA ILE A 40 -15.113 6.910 -1.393 1.00 0.00 H new ATOM 0 HB ILE A 40 -15.186 3.938 -0.694 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.544 6.335 1.078 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -16.045 5.431 1.133 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -12.782 4.219 -0.249 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -13.188 4.588 -1.942 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -12.882 5.911 -0.792 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -14.546 4.750 2.938 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -14.814 3.401 1.809 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -13.290 4.319 1.753 1.00 0.00 H new ATOM 629 N ASP A 41 -14.555 5.887 -3.688 1.00 0.00 N ATOM 630 CA ASP A 41 -14.414 5.490 -5.097 1.00 0.00 C ATOM 631 C ASP A 41 -14.071 4.035 -5.227 1.00 0.00 C ATOM 632 O ASP A 41 -12.912 3.640 -5.067 1.00 0.00 O ATOM 633 CB ASP A 41 -13.346 6.298 -5.854 1.00 0.00 C ATOM 634 CG ASP A 41 -13.728 7.726 -6.157 1.00 0.00 C ATOM 635 OD1 ASP A 41 -14.564 7.937 -7.054 1.00 0.00 O ATOM 636 OD2 ASP A 41 -13.140 8.664 -5.545 1.00 0.00 O ATOM 0 H ASP A 41 -13.841 6.541 -3.366 1.00 0.00 H new ATOM 0 HA ASP A 41 -15.387 5.695 -5.543 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -12.428 6.299 -5.267 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -13.123 5.790 -6.792 1.00 0.00 H new ATOM 641 N ILE A 42 -15.061 3.238 -5.474 1.00 0.00 N ATOM 642 CA ILE A 42 -14.839 1.837 -5.677 1.00 0.00 C ATOM 643 C ILE A 42 -15.040 1.495 -7.148 1.00 0.00 C ATOM 644 O ILE A 42 -14.317 0.684 -7.706 1.00 0.00 O ATOM 645 CB ILE A 42 -15.751 0.953 -4.756 1.00 0.00 C ATOM 646 CG1 ILE A 42 -15.415 -0.542 -4.883 1.00 0.00 C ATOM 647 CG2 ILE A 42 -17.239 1.197 -5.008 1.00 0.00 C ATOM 648 CD1 ILE A 42 -14.010 -0.900 -4.427 1.00 0.00 C ATOM 0 H ILE A 42 -16.035 3.532 -5.541 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.810 1.612 -5.396 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.538 1.259 -3.732 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -16.133 -1.116 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.537 -0.844 -5.923 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.829 0.562 -4.347 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.474 2.243 -4.812 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.476 0.960 -6.045 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.850 -1.971 -4.548 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.282 -0.355 -5.028 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.888 -0.631 -3.378 1.00 0.00 H new ATOM 660 N ASP A 43 -15.977 2.189 -7.785 1.00 0.00 N ATOM 661 CA ASP A 43 -16.340 1.942 -9.185 1.00 0.00 C ATOM 662 C ASP A 43 -15.170 2.194 -10.093 1.00 0.00 C ATOM 663 O ASP A 43 -14.830 1.355 -10.927 1.00 0.00 O ATOM 664 CB ASP A 43 -17.521 2.817 -9.614 1.00 0.00 C ATOM 665 CG ASP A 43 -18.778 2.526 -8.842 1.00 0.00 C ATOM 666 OD1 ASP A 43 -18.915 3.029 -7.716 1.00 0.00 O ATOM 667 OD2 ASP A 43 -19.651 1.790 -9.349 1.00 0.00 O ATOM 0 H ASP A 43 -16.510 2.941 -7.348 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.634 0.895 -9.265 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -17.255 3.866 -9.483 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -17.711 2.666 -10.677 1.00 0.00 H new ATOM 672 N SER A 44 -14.526 3.335 -9.900 1.00 0.00 N ATOM 673 CA SER A 44 -13.371 3.704 -10.679 1.00 0.00 C ATOM 674 C SER A 44 -12.242 2.695 -10.445 1.00 0.00 C ATOM 675 O SER A 44 -11.545 2.322 -11.371 1.00 0.00 O ATOM 676 CB SER A 44 -12.920 5.142 -10.332 1.00 0.00 C ATOM 677 OG SER A 44 -11.850 5.587 -11.170 1.00 0.00 O ATOM 0 H SER A 44 -14.795 4.025 -9.198 1.00 0.00 H new ATOM 0 HA SER A 44 -13.633 3.686 -11.737 1.00 0.00 H new ATOM 0 HB2 SER A 44 -13.766 5.821 -10.434 1.00 0.00 H new ATOM 0 HB3 SER A 44 -12.604 5.181 -9.290 1.00 0.00 H new ATOM 0 HG SER A 44 -11.596 6.500 -10.919 1.00 0.00 H new ATOM 683 N ALA A 45 -12.109 2.214 -9.212 1.00 0.00 N ATOM 684 CA ALA A 45 -11.082 1.241 -8.883 1.00 0.00 C ATOM 685 C ALA A 45 -11.343 -0.068 -9.625 1.00 0.00 C ATOM 686 O ALA A 45 -10.455 -0.598 -10.307 1.00 0.00 O ATOM 687 CB ALA A 45 -11.022 1.006 -7.379 1.00 0.00 C ATOM 0 H ALA A 45 -12.701 2.485 -8.427 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.116 1.634 -9.200 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.246 0.274 -7.156 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.792 1.944 -6.873 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -11.985 0.632 -7.030 1.00 0.00 H new ATOM 693 N LEU A 46 -12.576 -0.548 -9.534 1.00 0.00 N ATOM 694 CA LEU A 46 -12.994 -1.780 -10.200 1.00 0.00 C ATOM 695 C LEU A 46 -12.758 -1.668 -11.704 1.00 0.00 C ATOM 696 O LEU A 46 -12.187 -2.567 -12.332 1.00 0.00 O ATOM 697 CB LEU A 46 -14.480 -2.066 -9.925 1.00 0.00 C ATOM 698 CG LEU A 46 -14.893 -2.214 -8.451 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.386 -2.447 -8.335 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.126 -3.335 -7.768 1.00 0.00 C ATOM 0 H LEU A 46 -13.316 -0.096 -8.997 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.401 -2.604 -9.804 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -15.069 -1.261 -10.364 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -14.753 -2.982 -10.449 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.644 -1.282 -7.944 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.658 -2.549 -7.284 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -16.921 -1.602 -8.768 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -16.655 -3.358 -8.869 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.443 -3.412 -6.728 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.327 -4.277 -8.279 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.058 -3.121 -7.807 1.00 0.00 H new ATOM 712 N ASP A 47 -13.157 -0.542 -12.253 1.00 0.00 N ATOM 713 CA ASP A 47 -13.001 -0.237 -13.677 1.00 0.00 C ATOM 714 C ASP A 47 -11.528 -0.208 -14.098 1.00 0.00 C ATOM 715 O ASP A 47 -11.156 -0.749 -15.152 1.00 0.00 O ATOM 716 CB ASP A 47 -13.668 1.099 -13.995 1.00 0.00 C ATOM 717 CG ASP A 47 -13.462 1.548 -15.419 1.00 0.00 C ATOM 718 OD1 ASP A 47 -14.163 1.034 -16.335 1.00 0.00 O ATOM 719 OD2 ASP A 47 -12.644 2.453 -15.645 1.00 0.00 O ATOM 0 H ASP A 47 -13.607 0.205 -11.724 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.485 -1.032 -14.244 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -14.737 1.019 -13.798 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.277 1.861 -13.321 1.00 0.00 H new ATOM 724 N ARG A 48 -10.685 0.378 -13.261 1.00 0.00 N ATOM 725 CA ARG A 48 -9.256 0.483 -13.549 1.00 0.00 C ATOM 726 C ARG A 48 -8.518 -0.850 -13.383 1.00 0.00 C ATOM 727 O ARG A 48 -7.335 -0.946 -13.705 1.00 0.00 O ATOM 728 CB ARG A 48 -8.588 1.535 -12.693 1.00 0.00 C ATOM 729 CG ARG A 48 -9.011 2.965 -12.947 1.00 0.00 C ATOM 730 CD ARG A 48 -8.265 3.860 -11.993 1.00 0.00 C ATOM 731 NE ARG A 48 -8.677 5.266 -12.033 1.00 0.00 N ATOM 732 CZ ARG A 48 -7.820 6.296 -11.928 1.00 0.00 C ATOM 733 NH1 ARG A 48 -6.509 6.089 -12.082 1.00 0.00 N ATOM 734 NH2 ARG A 48 -8.269 7.534 -11.724 1.00 0.00 N ATOM 0 H ARG A 48 -10.965 0.791 -12.371 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.191 0.778 -14.596 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.782 1.300 -11.646 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.510 1.464 -12.841 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.795 3.246 -13.978 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.086 3.073 -12.805 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.401 3.483 -10.979 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.200 3.800 -12.216 1.00 0.00 H new ATOM 0 HE ARG A 48 -9.669 5.474 -12.147 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.160 5.151 -12.279 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -5.857 6.869 -12.003 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -9.271 7.707 -11.646 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -7.610 8.309 -11.646 1.00 0.00 H new ATOM 748 N GLY A 49 -9.187 -1.860 -12.860 1.00 0.00 N ATOM 749 CA GLY A 49 -8.554 -3.161 -12.782 1.00 0.00 C ATOM 750 C GLY A 49 -8.522 -3.779 -11.401 1.00 0.00 C ATOM 751 O GLY A 49 -7.657 -4.615 -11.120 1.00 0.00 O ATOM 0 H GLY A 49 -10.138 -1.810 -12.494 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.075 -3.842 -13.455 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.531 -3.072 -13.147 1.00 0.00 H new ATOM 755 N VAL A 50 -9.422 -3.369 -10.533 1.00 0.00 N ATOM 756 CA VAL A 50 -9.550 -4.012 -9.237 1.00 0.00 C ATOM 757 C VAL A 50 -10.703 -5.011 -9.321 1.00 0.00 C ATOM 758 O VAL A 50 -11.826 -4.637 -9.647 1.00 0.00 O ATOM 759 CB VAL A 50 -9.808 -2.992 -8.081 1.00 0.00 C ATOM 760 CG1 VAL A 50 -9.935 -3.705 -6.747 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.688 -1.970 -8.005 1.00 0.00 C ATOM 0 H VAL A 50 -10.072 -2.600 -10.696 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.610 -4.511 -9.002 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.745 -2.478 -8.298 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.114 -2.973 -5.959 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.768 -4.406 -6.787 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.014 -4.248 -6.535 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.888 -1.270 -7.194 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.742 -2.480 -7.820 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.628 -1.425 -8.947 1.00 0.00 H new ATOM 771 N ILE A 51 -10.423 -6.266 -9.100 1.00 0.00 N ATOM 772 CA ILE A 51 -11.447 -7.293 -9.183 1.00 0.00 C ATOM 773 C ILE A 51 -11.958 -7.664 -7.803 1.00 0.00 C ATOM 774 O ILE A 51 -11.268 -7.480 -6.809 1.00 0.00 O ATOM 775 CB ILE A 51 -10.965 -8.566 -9.931 1.00 0.00 C ATOM 776 CG1 ILE A 51 -9.729 -9.179 -9.244 1.00 0.00 C ATOM 777 CG2 ILE A 51 -10.676 -8.241 -11.392 1.00 0.00 C ATOM 778 CD1 ILE A 51 -9.242 -10.473 -9.872 1.00 0.00 C ATOM 0 H ILE A 51 -9.494 -6.612 -8.860 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.262 -6.864 -9.766 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.762 -9.309 -9.895 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.918 -8.451 -9.265 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -9.965 -9.364 -8.196 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.339 -9.142 -11.905 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.583 -7.870 -11.869 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.899 -7.479 -11.448 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.370 -10.836 -9.328 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -10.034 -11.220 -9.827 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.971 -10.293 -10.912 1.00 0.00 H new ATOM 790 N VAL A 52 -13.156 -8.174 -7.747 1.00 0.00 N ATOM 791 CA VAL A 52 -13.771 -8.548 -6.492 1.00 0.00 C ATOM 792 C VAL A 52 -13.601 -10.049 -6.261 1.00 0.00 C ATOM 793 O VAL A 52 -13.759 -10.851 -7.189 1.00 0.00 O ATOM 794 CB VAL A 52 -15.294 -8.195 -6.474 1.00 0.00 C ATOM 795 CG1 VAL A 52 -15.925 -8.495 -5.114 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.520 -6.740 -6.855 1.00 0.00 C ATOM 0 H VAL A 52 -13.739 -8.345 -8.567 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.278 -7.987 -5.698 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.782 -8.827 -7.216 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -16.984 -8.237 -5.139 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -15.815 -9.556 -4.888 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.427 -7.906 -4.344 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.587 -6.520 -6.835 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -15.003 -6.094 -6.146 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.132 -6.562 -7.858 1.00 0.00 H new ATOM 806 N ARG A 53 -13.234 -10.409 -5.060 1.00 0.00 N ATOM 807 CA ARG A 53 -13.122 -11.789 -4.651 1.00 0.00 C ATOM 808 C ARG A 53 -14.034 -11.983 -3.457 1.00 0.00 C ATOM 809 O ARG A 53 -13.935 -11.249 -2.469 1.00 0.00 O ATOM 810 CB ARG A 53 -11.665 -12.070 -4.248 1.00 0.00 C ATOM 811 CG ARG A 53 -11.322 -13.463 -3.674 1.00 0.00 C ATOM 812 CD ARG A 53 -11.317 -14.602 -4.693 1.00 0.00 C ATOM 813 NE ARG A 53 -12.646 -15.128 -4.995 1.00 0.00 N ATOM 814 CZ ARG A 53 -13.058 -16.375 -4.669 1.00 0.00 C ATOM 815 NH1 ARG A 53 -12.286 -17.184 -3.936 1.00 0.00 N ATOM 816 NH2 ARG A 53 -14.258 -16.795 -5.050 1.00 0.00 N ATOM 0 H ARG A 53 -13.000 -9.743 -4.324 1.00 0.00 H new ATOM 0 HA ARG A 53 -13.404 -12.467 -5.457 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.040 -11.908 -5.126 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.374 -11.324 -3.508 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -10.340 -13.413 -3.204 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.040 -13.702 -2.889 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -10.858 -14.249 -5.616 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.693 -15.412 -4.316 1.00 0.00 H new ATOM 0 HE ARG A 53 -13.303 -14.518 -5.481 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -11.373 -16.864 -3.614 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -12.611 -18.121 -3.698 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -14.867 -16.178 -5.587 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -14.571 -17.735 -4.806 1.00 0.00 H new ATOM 830 N ALA A 54 -14.916 -12.930 -3.552 1.00 0.00 N ATOM 831 CA ALA A 54 -15.804 -13.244 -2.478 1.00 0.00 C ATOM 832 C ALA A 54 -15.326 -14.508 -1.834 1.00 0.00 C ATOM 833 O ALA A 54 -15.379 -15.575 -2.451 1.00 0.00 O ATOM 834 CB ALA A 54 -17.214 -13.424 -3.004 1.00 0.00 C ATOM 0 H ALA A 54 -15.040 -13.510 -4.382 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.816 -12.434 -1.749 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.883 -13.663 -2.177 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -17.544 -12.502 -3.483 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -17.230 -14.236 -3.731 1.00 0.00 H new ATOM 840 N PHE A 55 -14.857 -14.397 -0.628 1.00 0.00 N ATOM 841 CA PHE A 55 -14.319 -15.528 0.067 1.00 0.00 C ATOM 842 C PHE A 55 -15.467 -16.378 0.607 1.00 0.00 C ATOM 843 O PHE A 55 -16.483 -15.837 1.089 1.00 0.00 O ATOM 844 CB PHE A 55 -13.428 -15.051 1.207 1.00 0.00 C ATOM 845 CG PHE A 55 -12.323 -15.996 1.536 1.00 0.00 C ATOM 846 CD1 PHE A 55 -12.576 -17.275 1.968 1.00 0.00 C ATOM 847 CD2 PHE A 55 -11.023 -15.603 1.379 1.00 0.00 C ATOM 848 CE1 PHE A 55 -11.553 -18.136 2.236 1.00 0.00 C ATOM 849 CE2 PHE A 55 -9.996 -16.456 1.643 1.00 0.00 C ATOM 850 CZ PHE A 55 -10.253 -17.726 2.072 1.00 0.00 C ATOM 0 H PHE A 55 -14.836 -13.525 -0.100 1.00 0.00 H new ATOM 0 HA PHE A 55 -13.719 -16.131 -0.615 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -13.001 -14.084 0.943 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -14.040 -14.897 2.096 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -13.597 -17.603 2.097 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -10.808 -14.600 1.040 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -11.765 -19.139 2.577 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -8.975 -16.127 1.513 1.00 0.00 H new ATOM 0 HZ PHE A 55 -9.439 -18.404 2.281 1.00 0.00 H new ATOM 860 N SER A 56 -15.328 -17.676 0.507 1.00 0.00 N ATOM 861 CA SER A 56 -16.345 -18.566 0.957 1.00 0.00 C ATOM 862 C SER A 56 -16.251 -18.817 2.477 1.00 0.00 C ATOM 863 O SER A 56 -17.200 -18.520 3.191 1.00 0.00 O ATOM 864 CB SER A 56 -16.272 -19.867 0.161 1.00 0.00 C ATOM 865 OG SER A 56 -16.353 -19.598 -1.242 1.00 0.00 O ATOM 0 H SER A 56 -14.507 -18.135 0.112 1.00 0.00 H new ATOM 0 HA SER A 56 -17.317 -18.105 0.783 1.00 0.00 H new ATOM 0 HB2 SER A 56 -15.340 -20.386 0.385 1.00 0.00 H new ATOM 0 HB3 SER A 56 -17.085 -20.529 0.458 1.00 0.00 H new ATOM 0 HG SER A 56 -16.303 -20.441 -1.740 1.00 0.00 H new ATOM 871 N HIS A 57 -15.091 -19.311 2.989 1.00 0.00 N ATOM 872 CA HIS A 57 -14.955 -19.578 4.450 1.00 0.00 C ATOM 873 C HIS A 57 -13.534 -19.985 4.895 1.00 0.00 C ATOM 874 O HIS A 57 -13.093 -21.113 4.661 1.00 0.00 O ATOM 875 CB HIS A 57 -15.995 -20.633 4.966 1.00 0.00 C ATOM 876 CG HIS A 57 -15.951 -21.994 4.300 1.00 0.00 C ATOM 877 ND1 HIS A 57 -15.579 -23.147 4.951 1.00 0.00 N ATOM 878 CD2 HIS A 57 -16.268 -22.373 3.045 1.00 0.00 C ATOM 879 CE1 HIS A 57 -15.671 -24.163 4.129 1.00 0.00 C ATOM 880 NE2 HIS A 57 -16.089 -23.719 2.965 1.00 0.00 N ATOM 0 H HIS A 57 -14.262 -19.527 2.435 1.00 0.00 H new ATOM 0 HA HIS A 57 -15.167 -18.614 4.912 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -15.842 -20.770 6.037 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -16.995 -20.220 4.837 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -16.603 -21.725 2.248 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -15.442 -25.191 4.368 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -16.253 -24.291 2.136 1.00 0.00 H new ATOM 889 N LYS A 58 -12.809 -19.056 5.464 1.00 0.00 N ATOM 890 CA LYS A 58 -11.535 -19.355 6.103 1.00 0.00 C ATOM 891 C LYS A 58 -11.519 -18.601 7.426 1.00 0.00 C ATOM 892 O LYS A 58 -11.624 -17.364 7.419 1.00 0.00 O ATOM 893 CB LYS A 58 -10.351 -18.902 5.235 1.00 0.00 C ATOM 894 CG LYS A 58 -9.094 -19.788 5.294 1.00 0.00 C ATOM 895 CD LYS A 58 -8.413 -19.826 6.659 1.00 0.00 C ATOM 896 CE LYS A 58 -7.213 -20.765 6.623 1.00 0.00 C ATOM 897 NZ LYS A 58 -6.521 -20.875 7.922 1.00 0.00 N ATOM 0 H LYS A 58 -13.076 -18.072 5.502 1.00 0.00 H new ATOM 0 HA LYS A 58 -11.434 -20.430 6.249 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -10.685 -18.848 4.199 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -10.073 -17.891 5.533 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -9.367 -20.804 5.009 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -8.378 -19.431 4.554 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -8.091 -18.823 6.941 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -9.121 -20.158 7.418 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -7.544 -21.755 6.310 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.507 -20.413 5.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.716 -21.527 7.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.177 -19.938 8.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.182 -21.238 8.638 1.00 0.00 H new ATOM 911 N PRO A 59 -11.455 -19.296 8.564 1.00 0.00 N ATOM 912 CA PRO A 59 -11.393 -18.634 9.866 1.00 0.00 C ATOM 913 C PRO A 59 -10.076 -17.846 10.017 1.00 0.00 C ATOM 914 O PRO A 59 -8.983 -18.406 9.852 1.00 0.00 O ATOM 915 CB PRO A 59 -11.442 -19.800 10.866 1.00 0.00 C ATOM 916 CG PRO A 59 -11.006 -20.995 10.093 1.00 0.00 C ATOM 917 CD PRO A 59 -11.461 -20.766 8.685 1.00 0.00 C ATOM 0 HA PRO A 59 -12.196 -17.912 10.012 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -10.783 -19.618 11.715 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -12.447 -19.934 11.265 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -9.924 -21.115 10.138 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -11.445 -21.905 10.502 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -10.790 -21.232 7.964 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -12.454 -21.180 8.510 1.00 0.00 H new ATOM 925 N PRO A 60 -10.154 -16.546 10.303 1.00 0.00 N ATOM 926 CA PRO A 60 -8.977 -15.714 10.453 1.00 0.00 C ATOM 927 C PRO A 60 -8.464 -15.667 11.896 1.00 0.00 C ATOM 928 O PRO A 60 -9.135 -16.132 12.832 1.00 0.00 O ATOM 929 CB PRO A 60 -9.492 -14.340 10.031 1.00 0.00 C ATOM 930 CG PRO A 60 -10.931 -14.327 10.454 1.00 0.00 C ATOM 931 CD PRO A 60 -11.399 -15.768 10.467 1.00 0.00 C ATOM 0 HA PRO A 60 -8.133 -16.083 9.871 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -8.930 -13.541 10.514 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.394 -14.193 8.955 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -11.039 -13.877 11.441 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -11.531 -13.732 9.765 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -11.905 -16.016 11.400 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -12.104 -15.967 9.660 1.00 0.00 H new ATOM 939 N LYS A 61 -7.276 -15.131 12.070 1.00 0.00 N ATOM 940 CA LYS A 61 -6.740 -14.929 13.386 1.00 0.00 C ATOM 941 C LYS A 61 -6.637 -13.450 13.609 1.00 0.00 C ATOM 942 O LYS A 61 -5.775 -12.794 13.024 1.00 0.00 O ATOM 943 CB LYS A 61 -5.351 -15.544 13.515 1.00 0.00 C ATOM 944 CG LYS A 61 -5.280 -17.032 13.262 1.00 0.00 C ATOM 945 CD LYS A 61 -3.873 -17.521 13.501 1.00 0.00 C ATOM 946 CE LYS A 61 -3.757 -19.013 13.332 1.00 0.00 C ATOM 947 NZ LYS A 61 -2.413 -19.486 13.705 1.00 0.00 N ATOM 0 H LYS A 61 -6.666 -14.828 11.311 1.00 0.00 H new ATOM 0 HA LYS A 61 -7.391 -15.404 14.120 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -4.682 -15.041 12.817 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -4.974 -15.344 14.518 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -5.974 -17.556 13.919 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -5.583 -17.252 12.238 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.194 -17.024 12.808 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.559 -17.245 14.508 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -4.505 -19.511 13.948 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -3.966 -19.282 12.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -2.361 -20.517 13.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -1.703 -19.027 13.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -2.225 -19.249 14.700 1.00 0.00 H new ATOM 961 N VAL A 62 -7.496 -12.938 14.448 1.00 0.00 N ATOM 962 CA VAL A 62 -7.591 -11.516 14.751 1.00 0.00 C ATOM 963 C VAL A 62 -8.270 -11.345 16.085 1.00 0.00 C ATOM 964 O VAL A 62 -8.961 -12.265 16.556 1.00 0.00 O ATOM 965 CB VAL A 62 -8.409 -10.698 13.681 1.00 0.00 C ATOM 966 CG1 VAL A 62 -7.628 -10.482 12.390 1.00 0.00 C ATOM 967 CG2 VAL A 62 -9.740 -11.386 13.378 1.00 0.00 C ATOM 0 H VAL A 62 -8.172 -13.505 14.959 1.00 0.00 H new ATOM 0 HA VAL A 62 -6.572 -11.129 14.753 1.00 0.00 H new ATOM 0 HB VAL A 62 -8.600 -9.717 14.115 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -8.237 -9.913 11.687 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.713 -9.930 12.606 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -7.375 -11.448 11.952 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -10.289 -10.805 12.637 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -9.552 -12.386 12.988 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -10.329 -11.458 14.292 1.00 0.00 H new ATOM 977 N GLY A 63 -8.085 -10.201 16.676 1.00 0.00 N ATOM 978 CA GLY A 63 -8.726 -9.890 17.919 1.00 0.00 C ATOM 979 C GLY A 63 -9.273 -8.491 17.899 1.00 0.00 C ATOM 980 O GLY A 63 -10.475 -8.279 18.028 1.00 0.00 O ATOM 0 H GLY A 63 -7.487 -9.459 16.311 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -9.533 -10.599 18.105 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -8.014 -9.996 18.738 1.00 0.00 H new ATOM 984 N ASN A 64 -8.393 -7.539 17.690 1.00 0.00 N ATOM 985 CA ASN A 64 -8.755 -6.119 17.646 1.00 0.00 C ATOM 986 C ASN A 64 -9.035 -5.666 16.219 1.00 0.00 C ATOM 987 O ASN A 64 -9.372 -4.507 15.978 1.00 0.00 O ATOM 988 CB ASN A 64 -7.645 -5.243 18.275 1.00 0.00 C ATOM 989 CG ASN A 64 -6.278 -5.488 17.661 1.00 0.00 C ATOM 990 OD1 ASN A 64 -5.539 -6.344 18.130 1.00 0.00 O ATOM 991 ND2 ASN A 64 -5.919 -4.749 16.646 1.00 0.00 N ATOM 0 H ASN A 64 -7.399 -7.716 17.544 1.00 0.00 H new ATOM 0 HA ASN A 64 -9.667 -5.996 18.231 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -7.908 -4.192 18.156 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -7.597 -5.440 19.346 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -5.000 -4.877 16.222 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -6.557 -4.044 16.278 1.00 0.00 H new ATOM 998 N LEU A 65 -8.894 -6.556 15.280 1.00 0.00 N ATOM 999 CA LEU A 65 -9.152 -6.224 13.901 1.00 0.00 C ATOM 1000 C LEU A 65 -10.531 -6.694 13.474 1.00 0.00 C ATOM 1001 O LEU A 65 -10.937 -7.820 13.797 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.089 -6.806 12.981 1.00 0.00 C ATOM 1003 CG LEU A 65 -6.684 -6.244 13.141 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -5.736 -6.953 12.207 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.672 -4.742 12.884 1.00 0.00 C ATOM 0 H LEU A 65 -8.601 -7.520 15.440 1.00 0.00 H new ATOM 0 HA LEU A 65 -9.116 -5.138 13.818 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.048 -7.883 13.143 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.405 -6.650 11.950 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.355 -6.412 14.166 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.733 -6.545 12.328 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -5.725 -8.018 12.439 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.064 -6.810 11.178 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.658 -4.360 13.004 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.017 -4.544 11.869 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.333 -4.246 13.595 1.00 0.00 H new ATOM 1017 N PRO A 66 -11.293 -5.829 12.783 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.608 -6.183 12.254 1.00 0.00 C ATOM 1019 C PRO A 66 -12.507 -7.252 11.164 1.00 0.00 C ATOM 1020 O PRO A 66 -11.453 -7.412 10.506 1.00 0.00 O ATOM 1021 CB PRO A 66 -13.125 -4.877 11.646 1.00 0.00 C ATOM 1022 CG PRO A 66 -12.291 -3.808 12.251 1.00 0.00 C ATOM 1023 CD PRO A 66 -10.953 -4.422 12.489 1.00 0.00 C ATOM 0 HA PRO A 66 -13.258 -6.593 13.027 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.030 -4.883 10.560 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -14.181 -4.728 11.872 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -12.214 -2.948 11.585 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -12.729 -3.451 13.183 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -10.306 -4.335 11.616 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -10.432 -3.948 13.321 1.00 0.00 H new ATOM 1031 N GLN A 67 -13.596 -7.954 10.941 1.00 0.00 N ATOM 1032 CA GLN A 67 -13.622 -9.033 9.982 1.00 0.00 C ATOM 1033 C GLN A 67 -13.425 -8.530 8.546 1.00 0.00 C ATOM 1034 O GLN A 67 -12.899 -9.257 7.716 1.00 0.00 O ATOM 1035 CB GLN A 67 -14.892 -9.871 10.105 1.00 0.00 C ATOM 1036 CG GLN A 67 -14.848 -11.170 9.311 1.00 0.00 C ATOM 1037 CD GLN A 67 -16.097 -11.990 9.477 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -16.197 -12.811 10.384 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -17.042 -11.809 8.598 1.00 0.00 N ATOM 0 H GLN A 67 -14.484 -7.793 11.417 1.00 0.00 H new ATOM 0 HA GLN A 67 -12.778 -9.681 10.217 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.063 -10.104 11.156 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -15.742 -9.278 9.768 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -14.705 -10.942 8.255 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -13.987 -11.757 9.629 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -16.924 -11.117 7.858 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -17.899 -12.359 8.650 1.00 0.00 H new ATOM 1048 N TYR A 68 -13.815 -7.285 8.252 1.00 0.00 N ATOM 1049 CA TYR A 68 -13.578 -6.752 6.906 1.00 0.00 C ATOM 1050 C TYR A 68 -12.084 -6.675 6.552 1.00 0.00 C ATOM 1051 O TYR A 68 -11.692 -6.988 5.419 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.369 -5.449 6.578 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.337 -4.331 7.611 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.182 -3.610 7.886 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.494 -3.983 8.291 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -13.186 -2.585 8.816 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.509 -2.968 9.215 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.357 -2.272 9.478 1.00 0.00 C ATOM 1059 OH TYR A 68 -14.373 -1.262 10.418 1.00 0.00 O ATOM 0 H TYR A 68 -14.279 -6.648 8.900 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.007 -7.492 6.230 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.987 -5.050 5.638 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.411 -5.721 6.408 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.267 -3.853 7.366 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.406 -4.524 8.089 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.280 -2.034 9.022 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.424 -2.719 9.732 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.277 -1.172 10.787 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.253 -6.334 7.536 1.00 0.00 N ATOM 1070 CA GLU A 69 -9.802 -6.327 7.340 1.00 0.00 C ATOM 1071 C GLU A 69 -9.318 -7.769 7.238 1.00 0.00 C ATOM 1072 O GLU A 69 -8.466 -8.111 6.420 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.084 -5.657 8.521 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.439 -4.198 8.768 1.00 0.00 C ATOM 1075 CD GLU A 69 -9.141 -3.306 7.583 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -7.975 -3.228 7.149 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -10.053 -2.657 7.097 1.00 0.00 O ATOM 0 H GLU A 69 -11.556 -6.061 8.471 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.578 -5.768 6.432 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.305 -6.224 9.425 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.009 -5.727 8.356 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.499 -4.125 9.013 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -8.886 -3.837 9.635 1.00 0.00 H new ATOM 1084 N SER A 70 -9.921 -8.611 8.054 1.00 0.00 N ATOM 1085 CA SER A 70 -9.574 -10.012 8.150 1.00 0.00 C ATOM 1086 C SER A 70 -9.832 -10.751 6.833 1.00 0.00 C ATOM 1087 O SER A 70 -9.025 -11.569 6.416 1.00 0.00 O ATOM 1088 CB SER A 70 -10.373 -10.650 9.275 1.00 0.00 C ATOM 1089 OG SER A 70 -10.205 -9.922 10.483 1.00 0.00 O ATOM 0 H SER A 70 -10.678 -8.334 8.679 1.00 0.00 H new ATOM 0 HA SER A 70 -8.508 -10.088 8.362 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.429 -10.680 9.006 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.050 -11.681 9.418 1.00 0.00 H new ATOM 0 HG SER A 70 -10.718 -9.089 10.437 1.00 0.00 H new ATOM 1095 N GLU A 71 -10.945 -10.440 6.183 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.316 -11.065 4.924 1.00 0.00 C ATOM 1097 C GLU A 71 -10.311 -10.667 3.848 1.00 0.00 C ATOM 1098 O GLU A 71 -9.969 -11.463 2.984 1.00 0.00 O ATOM 1099 CB GLU A 71 -12.711 -10.611 4.517 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.351 -11.462 3.441 1.00 0.00 C ATOM 1101 CD GLU A 71 -13.824 -12.807 3.962 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -13.045 -13.537 4.620 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -15.013 -13.137 3.766 1.00 0.00 O ATOM 0 H GLU A 71 -11.616 -9.747 6.515 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.314 -12.149 5.041 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.353 -10.615 5.398 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.658 -9.581 4.166 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -14.197 -10.924 3.014 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.635 -11.621 2.635 1.00 0.00 H new ATOM 1110 N ALA A 72 -9.822 -9.429 3.927 1.00 0.00 N ATOM 1111 CA ALA A 72 -8.811 -8.953 2.996 1.00 0.00 C ATOM 1112 C ALA A 72 -7.532 -9.759 3.188 1.00 0.00 C ATOM 1113 O ALA A 72 -6.922 -10.219 2.219 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.557 -7.471 3.190 1.00 0.00 C ATOM 0 H ALA A 72 -10.111 -8.744 4.625 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.167 -9.092 1.975 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.797 -7.136 2.483 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.481 -6.918 3.019 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.210 -7.291 4.208 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.166 -9.967 4.454 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.015 -10.798 4.808 1.00 0.00 C ATOM 1122 C ILE A 73 -6.229 -12.225 4.284 1.00 0.00 C ATOM 1123 O ILE A 73 -5.338 -12.814 3.688 1.00 0.00 O ATOM 1124 CB ILE A 73 -5.785 -10.859 6.353 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.564 -9.455 6.938 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.597 -11.766 6.685 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.367 -9.436 8.448 1.00 0.00 C ATOM 0 H ILE A 73 -7.654 -9.568 5.256 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.135 -10.346 4.350 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.683 -11.278 6.807 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.691 -9.008 6.463 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.420 -8.829 6.686 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.453 -11.796 7.765 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.794 -12.773 6.317 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.697 -11.376 6.209 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.217 -8.409 8.783 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.249 -9.852 8.935 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.493 -10.033 8.708 1.00 0.00 H new ATOM 1139 N MET A 74 -7.432 -12.752 4.492 1.00 0.00 N ATOM 1140 CA MET A 74 -7.786 -14.097 4.049 1.00 0.00 C ATOM 1141 C MET A 74 -7.697 -14.231 2.547 1.00 0.00 C ATOM 1142 O MET A 74 -7.143 -15.199 2.056 1.00 0.00 O ATOM 1143 CB MET A 74 -9.170 -14.522 4.542 1.00 0.00 C ATOM 1144 CG MET A 74 -9.343 -14.674 6.063 1.00 0.00 C ATOM 1145 SD MET A 74 -8.330 -15.987 6.834 1.00 0.00 S ATOM 1146 CE MET A 74 -6.737 -15.185 7.074 1.00 0.00 C ATOM 0 H MET A 74 -8.187 -12.261 4.971 1.00 0.00 H new ATOM 0 HA MET A 74 -7.054 -14.770 4.496 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.897 -13.791 4.188 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.421 -15.474 4.074 1.00 0.00 H new ATOM 0 HG2 MET A 74 -9.099 -13.723 6.537 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.393 -14.876 6.275 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.020 -15.577 6.353 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.845 -14.110 6.930 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.379 -15.381 8.085 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.223 -13.260 1.816 1.00 0.00 N ATOM 1157 CA VAL A 75 -8.145 -13.277 0.359 1.00 0.00 C ATOM 1158 C VAL A 75 -6.684 -13.240 -0.107 1.00 0.00 C ATOM 1159 O VAL A 75 -6.287 -13.984 -1.016 1.00 0.00 O ATOM 1160 CB VAL A 75 -8.992 -12.135 -0.296 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -8.669 -11.987 -1.773 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.481 -12.427 -0.137 1.00 0.00 C ATOM 0 H VAL A 75 -8.708 -12.451 2.204 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.584 -14.215 0.020 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.741 -11.204 0.212 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.273 -11.186 -2.199 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.612 -11.747 -1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.889 -12.922 -2.289 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -11.060 -11.626 -0.596 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.720 -13.373 -0.623 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.728 -12.491 0.923 1.00 0.00 H new ATOM 1172 N ALA A 76 -5.878 -12.438 0.558 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.462 -12.353 0.247 1.00 0.00 C ATOM 1174 C ALA A 76 -3.749 -13.660 0.600 1.00 0.00 C ATOM 1175 O ALA A 76 -2.786 -14.042 -0.044 1.00 0.00 O ATOM 1176 CB ALA A 76 -3.828 -11.181 0.970 1.00 0.00 C ATOM 0 H ALA A 76 -6.179 -11.832 1.321 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.356 -12.191 -0.826 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.767 -11.133 0.725 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.314 -10.256 0.660 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.946 -11.310 2.046 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.258 -14.342 1.600 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.713 -15.613 2.051 1.00 0.00 C ATOM 1184 C PHE A 77 -4.189 -16.758 1.131 1.00 0.00 C ATOM 1185 O PHE A 77 -3.517 -17.780 0.980 1.00 0.00 O ATOM 1186 CB PHE A 77 -4.138 -15.847 3.515 1.00 0.00 C ATOM 1187 CG PHE A 77 -3.554 -17.062 4.175 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.214 -17.100 4.519 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.350 -18.149 4.474 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -1.679 -18.206 5.146 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -3.821 -19.256 5.097 1.00 0.00 C ATOM 1192 CZ PHE A 77 -2.482 -19.286 5.434 1.00 0.00 C ATOM 0 H PHE A 77 -5.071 -14.031 2.132 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.624 -15.591 2.002 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.861 -14.970 4.099 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.225 -15.923 3.551 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.580 -16.255 4.294 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.399 -18.131 4.216 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.632 -18.224 5.410 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.453 -20.102 5.323 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.066 -20.155 5.922 1.00 0.00 H new ATOM 1202 N GLU A 78 -5.350 -16.573 0.525 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.896 -17.534 -0.420 1.00 0.00 C ATOM 1204 C GLU A 78 -5.155 -17.440 -1.750 1.00 0.00 C ATOM 1205 O GLU A 78 -4.695 -18.445 -2.294 1.00 0.00 O ATOM 1206 CB GLU A 78 -7.409 -17.294 -0.646 1.00 0.00 C ATOM 1207 CG GLU A 78 -8.032 -18.237 -1.668 1.00 0.00 C ATOM 1208 CD GLU A 78 -9.503 -17.988 -1.946 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -9.823 -17.150 -2.819 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -10.358 -18.688 -1.358 1.00 0.00 O ATOM 0 H GLU A 78 -5.940 -15.754 0.674 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.764 -18.532 -0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.932 -17.405 0.304 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.560 -16.266 -0.974 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -7.480 -18.153 -2.604 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.911 -19.262 -1.318 1.00 0.00 H new ATOM 1217 N LEU A 79 -5.010 -16.229 -2.242 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.402 -15.984 -3.543 1.00 0.00 C ATOM 1219 C LEU A 79 -2.893 -15.947 -3.454 1.00 0.00 C ATOM 1220 O LEU A 79 -2.210 -15.977 -4.486 1.00 0.00 O ATOM 1221 CB LEU A 79 -4.890 -14.644 -4.105 1.00 0.00 C ATOM 1222 CG LEU A 79 -6.391 -14.505 -4.349 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.726 -13.089 -4.782 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -6.852 -15.491 -5.404 1.00 0.00 C ATOM 0 H LEU A 79 -5.308 -15.383 -1.756 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.696 -16.803 -4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.583 -13.856 -3.418 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.374 -14.463 -5.048 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.911 -14.722 -3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.799 -13.005 -4.952 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.427 -12.389 -4.002 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.193 -12.855 -5.703 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.924 -15.377 -5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.323 -15.299 -6.337 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.641 -16.507 -5.070 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.386 -15.870 -2.225 1.00 0.00 N ATOM 1237 CA ASN A 80 -0.953 -15.692 -1.942 1.00 0.00 C ATOM 1238 C ASN A 80 -0.530 -14.422 -2.645 1.00 0.00 C ATOM 1239 O ASN A 80 0.226 -14.421 -3.629 1.00 0.00 O ATOM 1240 CB ASN A 80 -0.094 -16.903 -2.372 1.00 0.00 C ATOM 1241 CG ASN A 80 1.360 -16.800 -1.906 1.00 0.00 C ATOM 1242 OD1 ASN A 80 2.221 -16.244 -2.594 1.00 0.00 O ATOM 1243 ND2 ASN A 80 1.656 -17.369 -0.767 1.00 0.00 N ATOM 0 H ASN A 80 -2.961 -15.930 -1.384 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.794 -15.618 -0.866 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.535 -17.815 -1.970 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -0.116 -16.990 -3.458 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.618 -17.360 -0.427 1.00 0.00 H new ATOM 0 HD22 ASN A 80 0.925 -17.822 -0.218 1.00 0.00 H new ATOM 1250 N ALA A 81 -1.124 -13.364 -2.198 1.00 0.00 N ATOM 1251 CA ALA A 81 -1.032 -12.100 -2.850 1.00 0.00 C ATOM 1252 C ALA A 81 -0.339 -11.064 -1.997 1.00 0.00 C ATOM 1253 O ALA A 81 0.085 -11.337 -0.874 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.433 -11.637 -3.207 1.00 0.00 C ATOM 0 H ALA A 81 -1.697 -13.354 -1.354 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.428 -12.219 -3.749 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.380 -10.670 -3.707 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.898 -12.365 -3.872 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.028 -11.543 -2.298 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.231 -9.888 -2.549 1.00 0.00 N ATOM 1261 CA LEU A 82 0.367 -8.766 -1.906 1.00 0.00 C ATOM 1262 C LEU A 82 -0.778 -8.070 -1.181 1.00 0.00 C ATOM 1263 O LEU A 82 -1.829 -7.870 -1.775 1.00 0.00 O ATOM 1264 CB LEU A 82 0.967 -7.863 -3.025 1.00 0.00 C ATOM 1265 CG LEU A 82 1.995 -6.772 -2.653 1.00 0.00 C ATOM 1266 CD1 LEU A 82 1.416 -5.701 -1.753 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.235 -7.393 -2.037 1.00 0.00 C ATOM 0 H LEU A 82 -0.570 -9.684 -3.489 1.00 0.00 H new ATOM 0 HA LEU A 82 1.162 -9.018 -1.204 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.438 -8.519 -3.757 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.135 -7.370 -3.528 1.00 0.00 H new ATOM 0 HG LEU A 82 2.277 -6.274 -3.580 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.185 -4.962 -1.526 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.582 -5.213 -2.258 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.064 -6.155 -0.827 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.947 -6.608 -1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.959 -7.939 -1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.691 -8.079 -2.751 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.615 -7.751 0.075 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.691 -7.094 0.793 1.00 0.00 C ATOM 1281 C LEU A 83 -1.349 -5.640 1.036 1.00 0.00 C ATOM 1282 O LEU A 83 -0.248 -5.317 1.488 1.00 0.00 O ATOM 1283 CB LEU A 83 -2.002 -7.801 2.119 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.202 -7.247 2.910 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.505 -7.472 2.164 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.273 -7.860 4.288 1.00 0.00 C ATOM 0 H LEU A 83 0.230 -7.927 0.619 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.586 -7.149 0.173 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.183 -8.856 1.913 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.117 -7.748 2.753 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.054 -6.173 3.018 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.333 -7.070 2.748 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.463 -6.967 1.199 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.656 -8.540 2.009 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.129 -7.451 4.824 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.382 -8.941 4.200 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.359 -7.631 4.836 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.264 -4.775 0.706 1.00 0.00 N ATOM 1299 CA ILE A 84 -2.093 -3.360 0.902 1.00 0.00 C ATOM 1300 C ILE A 84 -3.049 -2.918 1.994 1.00 0.00 C ATOM 1301 O ILE A 84 -4.274 -3.011 1.831 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.403 -2.576 -0.399 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.593 -3.161 -1.570 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -2.078 -1.089 -0.209 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -1.902 -2.535 -2.908 1.00 0.00 C ATOM 0 H ILE A 84 -3.159 -5.032 0.289 1.00 0.00 H new ATOM 0 HA ILE A 84 -1.059 -3.157 1.181 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.464 -2.671 -0.628 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.531 -3.037 -1.360 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.784 -4.233 -1.630 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.299 -0.548 -1.129 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.682 -0.686 0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.021 -0.976 0.033 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.290 -3.003 -3.679 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.956 -2.681 -3.143 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.684 -1.468 -2.870 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.512 -2.459 3.092 1.00 0.00 N ATOM 1318 CA ALA A 85 -3.317 -2.062 4.218 1.00 0.00 C ATOM 1319 C ALA A 85 -2.717 -0.853 4.880 1.00 0.00 C ATOM 1320 O ALA A 85 -1.506 -0.696 4.899 1.00 0.00 O ATOM 1321 CB ALA A 85 -3.408 -3.202 5.220 1.00 0.00 C ATOM 0 H ALA A 85 -1.508 -2.349 3.232 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.318 -1.815 3.864 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -4.019 -2.893 6.068 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.863 -4.070 4.743 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.408 -3.461 5.568 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.551 0.009 5.405 1.00 0.00 N ATOM 1328 CA GLU A 86 -3.058 1.164 6.116 1.00 0.00 C ATOM 1329 C GLU A 86 -2.976 0.912 7.587 1.00 0.00 C ATOM 1330 O GLU A 86 -2.127 1.496 8.276 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.855 2.421 5.832 1.00 0.00 C ATOM 1332 CG GLU A 86 -3.380 3.177 4.618 1.00 0.00 C ATOM 1333 CD GLU A 86 -1.947 3.640 4.778 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -1.707 4.666 5.453 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -1.032 2.985 4.260 1.00 0.00 O ATOM 0 H GLU A 86 -4.567 -0.065 5.355 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.050 1.337 5.739 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.903 2.153 5.696 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.804 3.077 6.701 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.462 2.541 3.737 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.025 4.039 4.449 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.833 0.049 8.082 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.801 -0.269 9.483 1.00 0.00 C ATOM 1344 C ASP A 87 -2.611 -1.153 9.734 1.00 0.00 C ATOM 1345 O ASP A 87 -2.469 -2.220 9.125 1.00 0.00 O ATOM 1346 CB ASP A 87 -5.072 -0.950 9.951 1.00 0.00 C ATOM 1347 CG ASP A 87 -5.093 -1.098 11.452 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -4.352 -1.935 12.004 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -5.824 -0.339 12.118 1.00 0.00 O ATOM 0 H ASP A 87 -4.549 -0.437 7.542 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.722 0.658 10.050 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.937 -0.371 9.628 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.154 -1.932 9.485 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.761 -0.720 10.617 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.505 -1.378 10.842 1.00 0.00 C ATOM 1356 C LYS A 88 -0.623 -2.697 11.578 1.00 0.00 C ATOM 1357 O LYS A 88 0.291 -3.525 11.497 1.00 0.00 O ATOM 1358 CB LYS A 88 0.492 -0.418 11.477 1.00 0.00 C ATOM 1359 CG LYS A 88 0.789 0.764 10.565 1.00 0.00 C ATOM 1360 CD LYS A 88 1.671 1.802 11.220 1.00 0.00 C ATOM 1361 CE LYS A 88 1.955 2.951 10.261 1.00 0.00 C ATOM 1362 NZ LYS A 88 0.713 3.626 9.799 1.00 0.00 N ATOM 0 H LYS A 88 -1.917 0.100 11.203 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.115 -1.664 9.865 1.00 0.00 H new ATOM 0 HB2 LYS A 88 0.096 -0.056 12.426 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.418 -0.948 11.700 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.272 0.404 9.657 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -0.149 1.229 10.264 1.00 0.00 H new ATOM 0 HD2 LYS A 88 1.186 2.183 12.119 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.609 1.344 11.534 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.600 3.680 10.753 1.00 0.00 H new ATOM 0 HE3 LYS A 88 2.502 2.573 9.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.955 4.539 9.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 0.232 3.026 9.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.082 3.786 10.610 1.00 0.00 H new ATOM 1376 N ASP A 89 -1.751 -2.941 12.240 1.00 0.00 N ATOM 1377 CA ASP A 89 -1.917 -4.212 12.931 1.00 0.00 C ATOM 1378 C ASP A 89 -2.331 -5.250 11.923 1.00 0.00 C ATOM 1379 O ASP A 89 -1.920 -6.401 11.991 1.00 0.00 O ATOM 1380 CB ASP A 89 -2.884 -4.138 14.119 1.00 0.00 C ATOM 1381 CG ASP A 89 -2.855 -5.402 14.979 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -1.784 -5.719 15.558 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -3.908 -6.048 15.171 1.00 0.00 O ATOM 0 H ASP A 89 -2.539 -2.298 12.311 1.00 0.00 H new ATOM 0 HA ASP A 89 -0.962 -4.491 13.377 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.630 -3.277 14.737 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -3.897 -3.977 13.749 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.093 -4.803 10.924 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.469 -5.644 9.783 1.00 0.00 C ATOM 1390 C VAL A 90 -2.198 -6.093 9.064 1.00 0.00 C ATOM 1391 O VAL A 90 -2.052 -7.267 8.692 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.381 -4.871 8.777 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -4.740 -5.735 7.574 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.643 -4.398 9.456 1.00 0.00 C ATOM 0 H VAL A 90 -3.466 -3.854 10.881 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.028 -6.502 10.156 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.817 -4.007 8.425 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.375 -5.167 6.894 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -3.829 -6.033 7.055 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.273 -6.624 7.911 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.264 -3.862 8.738 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.193 -5.257 9.841 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.385 -3.733 10.280 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.261 -5.152 8.930 1.00 0.00 N ATOM 1405 CA ILE A 91 0.011 -5.397 8.293 1.00 0.00 C ATOM 1406 C ILE A 91 0.781 -6.502 9.020 1.00 0.00 C ATOM 1407 O ILE A 91 1.211 -7.478 8.392 1.00 0.00 O ATOM 1408 CB ILE A 91 0.852 -4.091 8.212 1.00 0.00 C ATOM 1409 CG1 ILE A 91 0.126 -3.061 7.333 1.00 0.00 C ATOM 1410 CG2 ILE A 91 2.261 -4.361 7.680 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.813 -1.720 7.256 1.00 0.00 C ATOM 0 H ILE A 91 -1.376 -4.196 9.267 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.181 -5.736 7.275 1.00 0.00 H new ATOM 0 HB ILE A 91 0.959 -3.690 9.220 1.00 0.00 H new ATOM 0 HG12 ILE A 91 0.028 -3.465 6.325 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.883 -2.918 7.719 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.819 -3.426 7.637 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.773 -5.059 8.343 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.196 -4.791 6.680 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.236 -1.052 6.617 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.887 -1.291 8.255 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.813 -1.847 6.840 1.00 0.00 H new ATOM 1423 N ASN A 92 0.909 -6.387 10.341 1.00 0.00 N ATOM 1424 CA ASN A 92 1.641 -7.400 11.092 1.00 0.00 C ATOM 1425 C ASN A 92 0.932 -8.732 11.130 1.00 0.00 C ATOM 1426 O ASN A 92 1.580 -9.760 10.956 1.00 0.00 O ATOM 1427 CB ASN A 92 2.095 -6.962 12.499 1.00 0.00 C ATOM 1428 CG ASN A 92 0.995 -6.513 13.441 1.00 0.00 C ATOM 1429 OD1 ASN A 92 0.710 -5.338 13.524 1.00 0.00 O ATOM 1430 ND2 ASN A 92 0.401 -7.418 14.178 1.00 0.00 N ATOM 0 H ASN A 92 0.526 -5.624 10.899 1.00 0.00 H new ATOM 0 HA ASN A 92 2.559 -7.531 10.519 1.00 0.00 H new ATOM 0 HB2 ASN A 92 2.627 -7.793 12.963 1.00 0.00 H new ATOM 0 HB3 ASN A 92 2.810 -6.146 12.391 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -0.321 -7.141 14.843 1.00 0.00 H new ATOM 0 HD22 ASN A 92 0.661 -8.400 14.087 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.391 -8.721 11.314 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.171 -9.967 11.359 1.00 0.00 C ATOM 1439 C LYS A 93 -1.029 -10.759 10.075 1.00 0.00 C ATOM 1440 O LYS A 93 -0.822 -11.980 10.098 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.667 -9.710 11.641 1.00 0.00 C ATOM 1442 CG LYS A 93 -2.981 -9.128 13.021 1.00 0.00 C ATOM 1443 CD LYS A 93 -2.381 -9.959 14.140 1.00 0.00 C ATOM 1444 CE LYS A 93 -2.858 -11.403 14.110 1.00 0.00 C ATOM 1445 NZ LYS A 93 -2.095 -12.234 15.047 1.00 0.00 N ATOM 0 H LYS A 93 -0.944 -7.872 11.434 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.762 -10.550 12.184 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.051 -9.029 10.882 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.208 -10.650 11.529 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.597 -8.109 13.080 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.061 -9.070 13.152 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.294 -9.937 14.063 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.642 -9.513 15.100 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.917 -11.444 14.363 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.756 -11.801 13.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.408 -13.223 14.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -1.082 -12.172 14.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.254 -11.897 16.018 1.00 0.00 H new ATOM 1459 N ALA A 94 -1.107 -10.061 8.962 1.00 0.00 N ATOM 1460 CA ALA A 94 -0.996 -10.681 7.665 1.00 0.00 C ATOM 1461 C ALA A 94 0.376 -11.303 7.468 1.00 0.00 C ATOM 1462 O ALA A 94 0.487 -12.443 7.008 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.286 -9.682 6.578 1.00 0.00 C ATOM 0 H ALA A 94 -1.249 -9.051 8.934 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.735 -11.480 7.610 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.198 -10.166 5.606 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.298 -9.295 6.700 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.573 -8.860 6.640 1.00 0.00 H new ATOM 1469 N LYS A 95 1.424 -10.591 7.861 1.00 0.00 N ATOM 1470 CA LYS A 95 2.761 -11.118 7.683 1.00 0.00 C ATOM 1471 C LYS A 95 3.119 -12.221 8.667 1.00 0.00 C ATOM 1472 O LYS A 95 4.049 -12.995 8.411 1.00 0.00 O ATOM 1473 CB LYS A 95 3.849 -10.046 7.495 1.00 0.00 C ATOM 1474 CG LYS A 95 3.969 -9.000 8.582 1.00 0.00 C ATOM 1475 CD LYS A 95 5.017 -7.940 8.218 1.00 0.00 C ATOM 1476 CE LYS A 95 4.634 -7.150 6.961 1.00 0.00 C ATOM 1477 NZ LYS A 95 5.668 -6.165 6.566 1.00 0.00 N ATOM 0 H LYS A 95 1.373 -9.669 8.295 1.00 0.00 H new ATOM 0 HA LYS A 95 2.732 -11.619 6.715 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.811 -10.550 7.401 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.663 -9.535 6.550 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.002 -8.521 8.738 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.243 -9.478 9.522 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.139 -7.251 9.054 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.981 -8.424 8.060 1.00 0.00 H new ATOM 0 HE2 LYS A 95 4.467 -7.844 6.138 1.00 0.00 H new ATOM 0 HE3 LYS A 95 3.692 -6.631 7.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 5.358 -5.660 5.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 5.811 -5.483 7.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 6.562 -6.659 6.370 1.00 0.00 H new ATOM 1491 N GLU A 96 2.371 -12.314 9.778 1.00 0.00 N ATOM 1492 CA GLU A 96 2.505 -13.458 10.697 1.00 0.00 C ATOM 1493 C GLU A 96 2.006 -14.715 9.988 1.00 0.00 C ATOM 1494 O GLU A 96 2.470 -15.821 10.242 1.00 0.00 O ATOM 1495 CB GLU A 96 1.705 -13.267 12.001 1.00 0.00 C ATOM 1496 CG GLU A 96 2.192 -12.147 12.899 1.00 0.00 C ATOM 1497 CD GLU A 96 1.441 -12.080 14.214 1.00 0.00 C ATOM 1498 OE1 GLU A 96 0.407 -11.399 14.297 1.00 0.00 O ATOM 1499 OE2 GLU A 96 1.890 -12.695 15.206 1.00 0.00 O ATOM 0 H GLU A 96 1.676 -11.622 10.060 1.00 0.00 H new ATOM 0 HA GLU A 96 3.557 -13.545 10.969 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.663 -13.078 11.744 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.731 -14.200 12.564 1.00 0.00 H new ATOM 0 HG2 GLU A 96 3.255 -12.284 13.099 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.086 -11.196 12.376 1.00 0.00 H new ATOM 1506 N LEU A 97 1.055 -14.521 9.081 1.00 0.00 N ATOM 1507 CA LEU A 97 0.501 -15.611 8.290 1.00 0.00 C ATOM 1508 C LEU A 97 1.349 -15.850 7.040 1.00 0.00 C ATOM 1509 O LEU A 97 1.142 -16.810 6.303 1.00 0.00 O ATOM 1510 CB LEU A 97 -0.953 -15.316 7.911 1.00 0.00 C ATOM 1511 CG LEU A 97 -1.928 -15.133 9.083 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.307 -14.775 8.570 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -1.994 -16.395 9.939 1.00 0.00 C ATOM 0 H LEU A 97 0.649 -13.608 8.875 1.00 0.00 H new ATOM 0 HA LEU A 97 0.518 -16.519 8.893 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.973 -14.412 7.302 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.317 -16.130 7.284 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.561 -14.317 9.706 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -3.987 -14.649 9.412 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.254 -13.845 8.003 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.674 -15.573 7.924 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.691 -16.240 10.762 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.334 -17.231 9.328 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.004 -16.616 10.338 1.00 0.00 H new ATOM 1525 N GLY A 98 2.301 -14.969 6.814 1.00 0.00 N ATOM 1526 CA GLY A 98 3.212 -15.116 5.700 1.00 0.00 C ATOM 1527 C GLY A 98 2.904 -14.184 4.551 1.00 0.00 C ATOM 1528 O GLY A 98 3.689 -14.071 3.612 1.00 0.00 O ATOM 0 H GLY A 98 2.464 -14.142 7.389 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.230 -14.933 6.045 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.177 -16.145 5.344 1.00 0.00 H new ATOM 1532 N VAL A 99 1.799 -13.488 4.641 1.00 0.00 N ATOM 1533 CA VAL A 99 1.360 -12.594 3.585 1.00 0.00 C ATOM 1534 C VAL A 99 2.133 -11.282 3.659 1.00 0.00 C ATOM 1535 O VAL A 99 2.200 -10.655 4.718 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.155 -12.299 3.710 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.632 -11.369 2.606 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -0.959 -13.588 3.705 1.00 0.00 C ATOM 0 H VAL A 99 1.174 -13.521 5.446 1.00 0.00 H new ATOM 0 HA VAL A 99 1.549 -13.080 2.628 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.314 -11.796 4.664 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.700 -11.183 2.723 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.090 -10.425 2.666 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.449 -11.832 1.636 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.020 -13.355 3.794 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.782 -14.124 2.772 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.653 -14.211 4.545 1.00 0.00 H new ATOM 1548 N ASN A 100 2.730 -10.875 2.558 1.00 0.00 N ATOM 1549 CA ASN A 100 3.467 -9.624 2.538 1.00 0.00 C ATOM 1550 C ASN A 100 2.508 -8.455 2.481 1.00 0.00 C ATOM 1551 O ASN A 100 1.999 -8.093 1.409 1.00 0.00 O ATOM 1552 CB ASN A 100 4.461 -9.543 1.370 1.00 0.00 C ATOM 1553 CG ASN A 100 5.363 -8.305 1.451 1.00 0.00 C ATOM 1554 OD1 ASN A 100 6.439 -8.347 2.049 1.00 0.00 O ATOM 1555 ND2 ASN A 100 4.942 -7.208 0.870 1.00 0.00 N ATOM 0 H ASN A 100 2.722 -11.384 1.674 1.00 0.00 H new ATOM 0 HA ASN A 100 4.048 -9.581 3.460 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.080 -10.440 1.361 1.00 0.00 H new ATOM 0 HB3 ASN A 100 3.911 -9.527 0.429 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.510 -6.361 0.906 1.00 0.00 H new ATOM 0 HD22 ASN A 100 4.047 -7.201 0.381 1.00 0.00 H new ATOM 1562 N ALA A 101 2.214 -7.921 3.624 1.00 0.00 N ATOM 1563 CA ALA A 101 1.360 -6.777 3.733 1.00 0.00 C ATOM 1564 C ALA A 101 2.202 -5.545 3.893 1.00 0.00 C ATOM 1565 O ALA A 101 3.148 -5.538 4.687 1.00 0.00 O ATOM 1566 CB ALA A 101 0.423 -6.928 4.910 1.00 0.00 C ATOM 0 H ALA A 101 2.562 -8.269 4.517 1.00 0.00 H new ATOM 0 HA ALA A 101 0.758 -6.690 2.828 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.219 -6.050 4.979 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.192 -7.818 4.774 1.00 0.00 H new ATOM 0 HB3 ALA A 101 1.004 -7.025 5.827 1.00 0.00 H new ATOM 1572 N ILE A 102 1.893 -4.537 3.136 1.00 0.00 N ATOM 1573 CA ILE A 102 2.600 -3.284 3.184 1.00 0.00 C ATOM 1574 C ILE A 102 1.617 -2.119 3.180 1.00 0.00 C ATOM 1575 O ILE A 102 0.473 -2.276 2.727 1.00 0.00 O ATOM 1576 CB ILE A 102 3.672 -3.142 2.023 1.00 0.00 C ATOM 1577 CG1 ILE A 102 3.123 -3.514 0.623 1.00 0.00 C ATOM 1578 CG2 ILE A 102 4.928 -3.934 2.322 1.00 0.00 C ATOM 1579 CD1 ILE A 102 2.164 -2.517 0.012 1.00 0.00 C ATOM 0 H ILE A 102 1.133 -4.557 2.456 1.00 0.00 H new ATOM 0 HA ILE A 102 3.160 -3.264 4.119 1.00 0.00 H new ATOM 0 HB ILE A 102 3.922 -2.081 1.991 1.00 0.00 H new ATOM 0 HG12 ILE A 102 3.966 -3.643 -0.056 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.620 -4.478 0.694 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.638 -3.812 1.504 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.375 -3.572 3.248 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.676 -4.989 2.429 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.841 -2.875 -0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.296 -2.402 0.661 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.663 -1.554 -0.100 1.00 0.00 H new ATOM 1591 N PRO A 103 2.007 -0.969 3.734 1.00 0.00 N ATOM 1592 CA PRO A 103 1.177 0.220 3.700 1.00 0.00 C ATOM 1593 C PRO A 103 1.204 0.888 2.323 1.00 0.00 C ATOM 1594 O PRO A 103 2.087 0.599 1.483 1.00 0.00 O ATOM 1595 CB PRO A 103 1.801 1.127 4.754 1.00 0.00 C ATOM 1596 CG PRO A 103 3.222 0.717 4.818 1.00 0.00 C ATOM 1597 CD PRO A 103 3.262 -0.746 4.478 1.00 0.00 C ATOM 0 HA PRO A 103 0.128 -0.002 3.894 1.00 0.00 H new ATOM 0 HB2 PRO A 103 1.705 2.177 4.478 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.311 1.005 5.720 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.824 1.294 4.116 1.00 0.00 H new ATOM 0 HG3 PRO A 103 3.632 0.895 5.812 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.135 -0.992 3.873 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.311 -1.364 5.375 1.00 0.00 H new ATOM 1605 N ILE A 104 0.287 1.806 2.119 1.00 0.00 N ATOM 1606 CA ILE A 104 0.099 2.501 0.851 1.00 0.00 C ATOM 1607 C ILE A 104 1.363 3.182 0.327 1.00 0.00 C ATOM 1608 O ILE A 104 1.706 3.039 -0.857 1.00 0.00 O ATOM 1609 CB ILE A 104 -1.077 3.504 0.952 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -2.398 2.733 0.996 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -1.062 4.559 -0.160 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.609 3.608 1.090 1.00 0.00 C ATOM 0 H ILE A 104 -0.368 2.102 2.843 1.00 0.00 H new ATOM 0 HA ILE A 104 -0.145 1.735 0.115 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.962 4.067 1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.477 2.115 0.101 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.384 2.056 1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.910 5.232 -0.035 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.135 5.130 -0.107 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.130 4.066 -1.130 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.505 2.988 1.117 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.555 4.207 1.999 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.650 4.267 0.223 1.00 0.00 H new ATOM 1624 N GLU A 105 2.076 3.865 1.191 1.00 0.00 N ATOM 1625 CA GLU A 105 3.247 4.595 0.771 1.00 0.00 C ATOM 1626 C GLU A 105 4.364 3.645 0.358 1.00 0.00 C ATOM 1627 O GLU A 105 5.123 3.935 -0.557 1.00 0.00 O ATOM 1628 CB GLU A 105 3.699 5.587 1.838 1.00 0.00 C ATOM 1629 CG GLU A 105 4.879 6.438 1.416 1.00 0.00 C ATOM 1630 CD GLU A 105 5.196 7.513 2.401 1.00 0.00 C ATOM 1631 OE1 GLU A 105 4.617 8.627 2.288 1.00 0.00 O ATOM 1632 OE2 GLU A 105 6.043 7.297 3.281 1.00 0.00 O ATOM 0 H GLU A 105 1.866 3.930 2.187 1.00 0.00 H new ATOM 0 HA GLU A 105 2.981 5.181 -0.109 1.00 0.00 H new ATOM 0 HB2 GLU A 105 2.864 6.240 2.092 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.962 5.039 2.743 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.754 5.800 1.286 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.668 6.890 0.447 1.00 0.00 H new ATOM 1639 N GLU A 106 4.414 2.478 0.971 1.00 0.00 N ATOM 1640 CA GLU A 106 5.414 1.507 0.600 1.00 0.00 C ATOM 1641 C GLU A 106 5.093 0.874 -0.730 1.00 0.00 C ATOM 1642 O GLU A 106 5.991 0.430 -1.440 1.00 0.00 O ATOM 1643 CB GLU A 106 5.649 0.463 1.678 1.00 0.00 C ATOM 1644 CG GLU A 106 6.308 1.034 2.914 1.00 0.00 C ATOM 1645 CD GLU A 106 7.554 1.813 2.576 1.00 0.00 C ATOM 1646 OE1 GLU A 106 8.489 1.236 1.978 1.00 0.00 O ATOM 1647 OE2 GLU A 106 7.622 3.007 2.916 1.00 0.00 O ATOM 0 H GLU A 106 3.782 2.186 1.717 1.00 0.00 H new ATOM 0 HA GLU A 106 6.353 2.050 0.494 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.696 0.013 1.955 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.273 -0.335 1.275 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.604 1.683 3.434 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.560 0.224 3.598 1.00 0.00 H new ATOM 1654 N LEU A 107 3.821 0.855 -1.078 1.00 0.00 N ATOM 1655 CA LEU A 107 3.394 0.385 -2.382 1.00 0.00 C ATOM 1656 C LEU A 107 3.846 1.419 -3.411 1.00 0.00 C ATOM 1657 O LEU A 107 4.414 1.077 -4.445 1.00 0.00 O ATOM 1658 CB LEU A 107 1.848 0.171 -2.395 1.00 0.00 C ATOM 1659 CG LEU A 107 1.179 -0.487 -3.642 1.00 0.00 C ATOM 1660 CD1 LEU A 107 1.151 0.436 -4.849 1.00 0.00 C ATOM 1661 CD2 LEU A 107 1.859 -1.807 -3.995 1.00 0.00 C ATOM 0 H LEU A 107 3.061 1.162 -0.471 1.00 0.00 H new ATOM 0 HA LEU A 107 3.841 -0.579 -2.624 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.594 -0.438 -1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.381 1.145 -2.248 1.00 0.00 H new ATOM 0 HG LEU A 107 0.143 -0.686 -3.368 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.675 -0.074 -5.686 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.588 1.337 -4.605 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.170 0.708 -5.123 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.373 -2.245 -4.867 1.00 0.00 H new ATOM 0 HD22 LEU A 107 2.911 -1.626 -4.217 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.779 -2.494 -3.153 1.00 0.00 H new ATOM 1673 N LEU A 108 3.630 2.687 -3.088 1.00 0.00 N ATOM 1674 CA LEU A 108 4.038 3.795 -3.949 1.00 0.00 C ATOM 1675 C LEU A 108 5.561 3.825 -4.101 1.00 0.00 C ATOM 1676 O LEU A 108 6.081 4.077 -5.185 1.00 0.00 O ATOM 1677 CB LEU A 108 3.538 5.131 -3.387 1.00 0.00 C ATOM 1678 CG LEU A 108 2.017 5.281 -3.235 1.00 0.00 C ATOM 1679 CD1 LEU A 108 1.680 6.617 -2.601 1.00 0.00 C ATOM 1680 CD2 LEU A 108 1.316 5.148 -4.581 1.00 0.00 C ATOM 0 H LEU A 108 3.169 2.978 -2.226 1.00 0.00 H new ATOM 0 HA LEU A 108 3.591 3.643 -4.931 1.00 0.00 H new ATOM 0 HB2 LEU A 108 3.996 5.283 -2.410 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.897 5.930 -4.035 1.00 0.00 H new ATOM 0 HG LEU A 108 1.663 4.480 -2.586 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.599 6.709 -2.500 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.143 6.680 -1.616 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.055 7.424 -3.231 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.240 5.258 -4.444 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.677 5.923 -5.257 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.529 4.167 -5.007 1.00 0.00 H new ATOM 1692 N ALA A 109 6.260 3.540 -3.013 1.00 0.00 N ATOM 1693 CA ALA A 109 7.716 3.478 -3.003 1.00 0.00 C ATOM 1694 C ALA A 109 8.227 2.282 -3.808 1.00 0.00 C ATOM 1695 O ALA A 109 9.357 2.278 -4.275 1.00 0.00 O ATOM 1696 CB ALA A 109 8.238 3.421 -1.574 1.00 0.00 C ATOM 0 H ALA A 109 5.833 3.344 -2.108 1.00 0.00 H new ATOM 0 HA ALA A 109 8.092 4.385 -3.476 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.327 3.375 -1.586 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.918 4.312 -1.034 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.843 2.535 -1.077 1.00 0.00 H new ATOM 1702 N SER A 110 7.391 1.277 -3.978 1.00 0.00 N ATOM 1703 CA SER A 110 7.760 0.118 -4.764 1.00 0.00 C ATOM 1704 C SER A 110 7.488 0.383 -6.237 1.00 0.00 C ATOM 1705 O SER A 110 7.903 -0.382 -7.113 1.00 0.00 O ATOM 1706 CB SER A 110 6.995 -1.115 -4.295 1.00 0.00 C ATOM 1707 OG SER A 110 7.237 -1.363 -2.918 1.00 0.00 O ATOM 0 H SER A 110 6.452 1.240 -3.582 1.00 0.00 H new ATOM 0 HA SER A 110 8.825 -0.071 -4.630 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.927 -0.972 -4.461 1.00 0.00 H new ATOM 0 HB3 SER A 110 7.296 -1.981 -4.884 1.00 0.00 H new ATOM 0 HG SER A 110 6.566 -0.894 -2.378 1.00 0.00 H new ATOM 1713 N SER A 111 6.801 1.467 -6.511 1.00 0.00 N ATOM 1714 CA SER A 111 6.515 1.816 -7.843 1.00 0.00 C ATOM 1715 C SER A 111 7.643 2.686 -8.358 1.00 0.00 C ATOM 1716 O SER A 111 7.706 3.899 -8.101 1.00 0.00 O ATOM 1717 CB SER A 111 5.164 2.515 -7.963 1.00 0.00 C ATOM 1718 OG SER A 111 4.770 2.605 -9.318 1.00 0.00 O ATOM 0 H SER A 111 6.437 2.113 -5.810 1.00 0.00 H new ATOM 0 HA SER A 111 6.443 0.914 -8.451 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.413 1.966 -7.396 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.225 3.513 -7.529 1.00 0.00 H new ATOM 0 HG SER A 111 4.357 3.479 -9.481 1.00 0.00 H new ATOM 1724 N LEU A 112 8.574 2.044 -8.990 1.00 0.00 N ATOM 1725 CA LEU A 112 9.711 2.688 -9.556 1.00 0.00 C ATOM 1726 C LEU A 112 9.815 2.373 -11.030 1.00 0.00 C ATOM 1727 O LEU A 112 10.787 2.728 -11.681 1.00 0.00 O ATOM 1728 CB LEU A 112 11.000 2.321 -8.770 1.00 0.00 C ATOM 1729 CG LEU A 112 11.287 0.822 -8.470 1.00 0.00 C ATOM 1730 CD1 LEU A 112 11.612 0.015 -9.723 1.00 0.00 C ATOM 1731 CD2 LEU A 112 12.410 0.696 -7.454 1.00 0.00 C ATOM 0 H LEU A 112 8.562 1.034 -9.129 1.00 0.00 H new ATOM 0 HA LEU A 112 9.591 3.768 -9.469 1.00 0.00 H new ATOM 0 HB2 LEU A 112 11.850 2.716 -9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.968 2.849 -7.817 1.00 0.00 H new ATOM 0 HG LEU A 112 10.370 0.402 -8.057 1.00 0.00 H new ATOM 0 HD11 LEU A 112 11.803 -1.022 -9.448 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.769 0.059 -10.413 1.00 0.00 H new ATOM 0 HD13 LEU A 112 12.497 0.431 -10.205 1.00 0.00 H new ATOM 0 HD21 LEU A 112 12.602 -0.358 -7.252 1.00 0.00 H new ATOM 0 HD22 LEU A 112 13.313 1.160 -7.851 1.00 0.00 H new ATOM 0 HD23 LEU A 112 12.122 1.196 -6.529 1.00 0.00 H new ATOM 1743 N GLU A 113 8.787 1.732 -11.558 1.00 0.00 N ATOM 1744 CA GLU A 113 8.737 1.359 -12.961 1.00 0.00 C ATOM 1745 C GLU A 113 8.845 2.605 -13.854 1.00 0.00 C ATOM 1746 O GLU A 113 9.475 2.582 -14.903 1.00 0.00 O ATOM 1747 CB GLU A 113 7.449 0.563 -13.254 1.00 0.00 C ATOM 1748 CG GLU A 113 7.322 0.076 -14.688 1.00 0.00 C ATOM 1749 CD GLU A 113 6.099 -0.780 -14.922 1.00 0.00 C ATOM 1750 OE1 GLU A 113 4.985 -0.225 -15.135 1.00 0.00 O ATOM 1751 OE2 GLU A 113 6.223 -2.025 -14.927 1.00 0.00 O ATOM 0 H GLU A 113 7.962 1.455 -11.025 1.00 0.00 H new ATOM 0 HA GLU A 113 9.588 0.717 -13.188 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.409 -0.298 -12.586 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.588 1.189 -13.019 1.00 0.00 H new ATOM 0 HG2 GLU A 113 7.287 0.937 -15.355 1.00 0.00 H new ATOM 0 HG3 GLU A 113 8.212 -0.495 -14.951 1.00 0.00 H new ATOM 1758 N HIS A 114 8.290 3.703 -13.395 1.00 0.00 N ATOM 1759 CA HIS A 114 8.325 4.951 -14.148 1.00 0.00 C ATOM 1760 C HIS A 114 9.394 5.893 -13.615 1.00 0.00 C ATOM 1761 O HIS A 114 9.322 7.100 -13.840 1.00 0.00 O ATOM 1762 CB HIS A 114 6.957 5.656 -14.144 1.00 0.00 C ATOM 1763 CG HIS A 114 5.881 4.928 -14.893 1.00 0.00 C ATOM 1764 ND1 HIS A 114 5.432 5.313 -16.130 1.00 0.00 N ATOM 1765 CD2 HIS A 114 5.160 3.840 -14.568 1.00 0.00 C ATOM 1766 CE1 HIS A 114 4.489 4.501 -16.532 1.00 0.00 C ATOM 1767 NE2 HIS A 114 4.302 3.595 -15.606 1.00 0.00 N ATOM 0 H HIS A 114 7.805 3.765 -12.500 1.00 0.00 H new ATOM 0 HA HIS A 114 8.574 4.689 -15.176 1.00 0.00 H new ATOM 0 HB2 HIS A 114 6.635 5.792 -13.111 1.00 0.00 H new ATOM 0 HB3 HIS A 114 7.073 6.650 -14.575 1.00 0.00 H new ATOM 0 HD2 HIS A 114 5.243 3.266 -13.657 1.00 0.00 H new ATOM 0 HE1 HIS A 114 3.955 4.567 -17.469 1.00 0.00 H new ATOM 0 HE2 HIS A 114 3.627 2.831 -15.651 1.00 0.00 H new ATOM 1776 N HIS A 115 10.437 5.338 -12.956 1.00 0.00 N ATOM 1777 CA HIS A 115 11.536 6.186 -12.412 1.00 0.00 C ATOM 1778 C HIS A 115 12.344 6.866 -13.517 1.00 0.00 C ATOM 1779 O HIS A 115 13.182 7.712 -13.255 1.00 0.00 O ATOM 1780 CB HIS A 115 12.479 5.456 -11.390 1.00 0.00 C ATOM 1781 CG HIS A 115 13.307 4.278 -11.893 1.00 0.00 C ATOM 1782 ND1 HIS A 115 13.842 3.333 -11.040 1.00 0.00 N ATOM 1783 CD2 HIS A 115 13.696 3.902 -13.142 1.00 0.00 C ATOM 1784 CE1 HIS A 115 14.515 2.441 -11.739 1.00 0.00 C ATOM 1785 NE2 HIS A 115 14.439 2.767 -13.012 1.00 0.00 N ATOM 0 H HIS A 115 10.546 4.338 -12.788 1.00 0.00 H new ATOM 0 HA HIS A 115 11.022 6.958 -11.839 1.00 0.00 H new ATOM 0 HB2 HIS A 115 13.166 6.197 -10.982 1.00 0.00 H new ATOM 0 HB3 HIS A 115 11.864 5.102 -10.562 1.00 0.00 H new ATOM 0 HD2 HIS A 115 13.459 4.409 -14.066 1.00 0.00 H new ATOM 0 HE1 HIS A 115 15.040 1.588 -11.336 1.00 0.00 H new ATOM 0 HE2 HIS A 115 14.869 2.251 -13.780 1.00 0.00 H new ATOM 1794 N HIS A 116 12.098 6.470 -14.737 1.00 0.00 N ATOM 1795 CA HIS A 116 12.721 7.083 -15.864 1.00 0.00 C ATOM 1796 C HIS A 116 11.620 7.747 -16.669 1.00 0.00 C ATOM 1797 O HIS A 116 11.158 7.218 -17.681 1.00 0.00 O ATOM 1798 CB HIS A 116 13.469 6.048 -16.708 1.00 0.00 C ATOM 1799 CG HIS A 116 14.440 6.635 -17.683 1.00 0.00 C ATOM 1800 ND1 HIS A 116 15.759 6.844 -17.374 1.00 0.00 N ATOM 1801 CD2 HIS A 116 14.287 7.051 -18.958 1.00 0.00 C ATOM 1802 CE1 HIS A 116 16.376 7.359 -18.408 1.00 0.00 C ATOM 1803 NE2 HIS A 116 15.507 7.495 -19.384 1.00 0.00 N ATOM 0 H HIS A 116 11.458 5.711 -14.971 1.00 0.00 H new ATOM 0 HA HIS A 116 13.461 7.817 -15.544 1.00 0.00 H new ATOM 0 HB2 HIS A 116 14.005 5.372 -16.042 1.00 0.00 H new ATOM 0 HB3 HIS A 116 12.742 5.447 -17.254 1.00 0.00 H new ATOM 0 HD2 HIS A 116 13.373 7.036 -19.533 1.00 0.00 H new ATOM 0 HE1 HIS A 116 17.421 7.626 -18.451 1.00 0.00 H new ATOM 0 HE2 HIS A 116 15.710 7.871 -20.310 1.00 0.00 H new ATOM 1812 N HIS A 117 11.140 8.851 -16.156 1.00 0.00 N ATOM 1813 CA HIS A 117 10.031 9.565 -16.760 1.00 0.00 C ATOM 1814 C HIS A 117 10.555 10.434 -17.900 1.00 0.00 C ATOM 1815 O HIS A 117 10.820 11.626 -17.725 1.00 0.00 O ATOM 1816 CB HIS A 117 9.312 10.405 -15.680 1.00 0.00 C ATOM 1817 CG HIS A 117 7.994 11.037 -16.060 1.00 0.00 C ATOM 1818 ND1 HIS A 117 6.814 10.716 -15.427 1.00 0.00 N ATOM 1819 CD2 HIS A 117 7.686 12.023 -16.929 1.00 0.00 C ATOM 1820 CE1 HIS A 117 5.848 11.471 -15.886 1.00 0.00 C ATOM 1821 NE2 HIS A 117 6.347 12.274 -16.798 1.00 0.00 N ATOM 0 H HIS A 117 11.503 9.285 -15.307 1.00 0.00 H new ATOM 0 HA HIS A 117 9.306 8.865 -17.175 1.00 0.00 H new ATOM 0 HB2 HIS A 117 9.143 9.767 -14.813 1.00 0.00 H new ATOM 0 HB3 HIS A 117 9.989 11.199 -15.364 1.00 0.00 H new ATOM 0 HD2 HIS A 117 8.369 12.521 -17.602 1.00 0.00 H new ATOM 0 HE1 HIS A 117 4.816 11.439 -15.569 1.00 0.00 H new ATOM 0 HE2 HIS A 117 5.821 12.972 -17.324 1.00 0.00 H new ATOM 1830 N HIS A 118 10.782 9.807 -19.026 1.00 0.00 N ATOM 1831 CA HIS A 118 11.291 10.460 -20.211 1.00 0.00 C ATOM 1832 C HIS A 118 10.996 9.550 -21.381 1.00 0.00 C ATOM 1833 O HIS A 118 10.892 8.329 -21.207 1.00 0.00 O ATOM 1834 CB HIS A 118 12.821 10.670 -20.087 1.00 0.00 C ATOM 1835 CG HIS A 118 13.447 11.513 -21.171 1.00 0.00 C ATOM 1836 ND1 HIS A 118 14.003 10.992 -22.320 1.00 0.00 N ATOM 1837 CD2 HIS A 118 13.616 12.851 -21.257 1.00 0.00 C ATOM 1838 CE1 HIS A 118 14.484 11.967 -23.056 1.00 0.00 C ATOM 1839 NE2 HIS A 118 14.261 13.104 -22.435 1.00 0.00 N ATOM 0 H HIS A 118 10.616 8.808 -19.150 1.00 0.00 H new ATOM 0 HA HIS A 118 10.823 11.436 -20.344 1.00 0.00 H new ATOM 0 HB2 HIS A 118 13.030 11.133 -19.123 1.00 0.00 H new ATOM 0 HB3 HIS A 118 13.306 9.694 -20.083 1.00 0.00 H new ATOM 0 HD2 HIS A 118 13.300 13.584 -20.530 1.00 0.00 H new ATOM 0 HE1 HIS A 118 14.979 11.854 -24.009 1.00 0.00 H new ATOM 0 HE2 HIS A 118 14.527 14.027 -22.778 1.00 0.00 H new ATOM 1848 N HIS A 119 10.832 10.113 -22.530 1.00 0.00 N ATOM 1849 CA HIS A 119 10.602 9.345 -23.716 1.00 0.00 C ATOM 1850 C HIS A 119 11.579 9.805 -24.780 1.00 0.00 C ATOM 1851 O HIS A 119 12.688 9.267 -24.834 1.00 0.00 O ATOM 1852 CB HIS A 119 9.142 9.493 -24.179 1.00 0.00 C ATOM 1853 CG HIS A 119 8.801 8.702 -25.409 1.00 0.00 C ATOM 1854 ND1 HIS A 119 8.558 9.285 -26.626 1.00 0.00 N ATOM 1855 CD2 HIS A 119 8.653 7.371 -25.597 1.00 0.00 C ATOM 1856 CE1 HIS A 119 8.279 8.357 -27.512 1.00 0.00 C ATOM 1857 NE2 HIS A 119 8.330 7.186 -26.914 1.00 0.00 N ATOM 1858 OXT HIS A 119 11.262 10.737 -25.525 1.00 0.00 O ATOM 0 H HIS A 119 10.853 11.122 -22.678 1.00 0.00 H new ATOM 0 HA HIS A 119 10.765 8.285 -23.519 1.00 0.00 H new ATOM 0 HB2 HIS A 119 8.483 9.184 -23.368 1.00 0.00 H new ATOM 0 HB3 HIS A 119 8.939 10.547 -24.371 1.00 0.00 H new ATOM 0 HD2 HIS A 119 8.768 6.600 -24.849 1.00 0.00 H new ATOM 0 HE1 HIS A 119 8.047 8.526 -28.553 1.00 0.00 H new ATOM 0 HE2 HIS A 119 8.157 6.285 -27.360 1.00 0.00 H new TER 1867 HIS A 119