USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 903 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 76 SER OG : rot -120:sc= -5.55! USER MOD Set 1.2: A 78 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 50 ASN : amide:sc= -0.74 K(o=-0.75,f=-0.0069) USER MOD Set 2.2: A 51 ASN : amide:sc=-0.00689 K(o=-0.75,f=-2.6!) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0961 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot -76:sc= -0.488! USER MOD Single : A 9 ASN : amide:sc= -0.924 K(o=-0.92,f=-4.6!) USER MOD Single : A 13 THR OG1 : rot -61:sc= 0.807 USER MOD Single : A 17 THR OG1 : rot -36:sc= 0.656 USER MOD Single : A 18 GLN : amide:sc= -0.221 X(o=-0.22,f=0) USER MOD Single : A 27 ASN : amide:sc= -0.302 K(o=-0.3,f=-2.5!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= -1.6 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= -2.3! USER MOD Single : A 41 GLN : amide:sc= -7.77! C(o=-7.8!,f=-4.9!) USER MOD Single : A 43 GLN : amide:sc= -0.283 K(o=-0.28,f=-3.2!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -79:sc= -0.0382 USER MOD Single : A 58 SER OG : rot 100:sc= -0.346 USER MOD Single : A 66 HIS : no HE2:sc= -1.76 K(o=-1.8,f=-6!) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -16:sc= -0.0503 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 87:sc= -0.503! USER MOD Single : A 88 THR OG1 : rot -13:sc= 0.939 USER MOD Single : A 90 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0397) USER MOD Single : A 91 THR OG1 : rot -160:sc= 0.215 USER MOD Single : A 92 SER OG : rot 180:sc= -0.0325 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 111:sc= 0.634 USER MOD Single : A 100 TYR OH : rot 180:sc= -0.344 USER MOD Single : A 101 ASN : amide:sc= -1.78! C(o=-1.8!,f=-6.4!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc=-0.000904 USER MOD Single : A 111 ASN : amide:sc= -0.188 X(o=-0.19,f=-0.59) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 14 N TRP A 2 7.879 3.154 -2.267 1.00 0.00 N ATOM 15 CA TRP A 2 8.738 4.270 -1.784 1.00 0.00 C ATOM 16 C TRP A 2 9.401 4.957 -2.982 1.00 0.00 C ATOM 17 O TRP A 2 9.270 4.519 -4.106 1.00 0.00 O ATOM 18 CB TRP A 2 9.793 3.706 -0.833 1.00 0.00 C ATOM 19 CG TRP A 2 9.158 2.649 0.015 1.00 0.00 C ATOM 20 CD1 TRP A 2 9.347 1.315 -0.125 1.00 0.00 C ATOM 21 CD2 TRP A 2 8.221 2.814 1.117 1.00 0.00 C ATOM 22 NE1 TRP A 2 8.600 0.655 0.834 1.00 0.00 N ATOM 23 CE2 TRP A 2 7.887 1.535 1.622 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.640 3.940 1.725 1.00 0.00 C ATOM 25 CZ2 TRP A 2 7.006 1.379 2.691 1.00 0.00 C ATOM 26 CZ3 TRP A 2 6.751 3.787 2.803 1.00 0.00 C ATOM 27 CH2 TRP A 2 6.437 2.509 3.286 1.00 0.00 C ATOM 0 HA TRP A 2 8.137 5.007 -1.251 1.00 0.00 H new ATOM 0 HB2 TRP A 2 10.626 3.287 -1.398 1.00 0.00 H new ATOM 0 HB3 TRP A 2 10.200 4.500 -0.206 1.00 0.00 H new ATOM 0 HD1 TRP A 2 9.978 0.844 -0.864 1.00 0.00 H new ATOM 0 HE1 TRP A 2 8.579 -0.359 0.945 1.00 0.00 H new ATOM 0 HE3 TRP A 2 7.878 4.929 1.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 6.765 0.392 3.057 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 6.308 4.659 3.262 1.00 0.00 H new ATOM 0 HH2 TRP A 2 5.756 2.397 4.117 1.00 0.00 H new ATOM 38 N GLN A 3 10.088 6.045 -2.757 1.00 0.00 N ATOM 39 CA GLN A 3 10.727 6.775 -3.894 1.00 0.00 C ATOM 40 C GLN A 3 11.813 5.919 -4.559 1.00 0.00 C ATOM 41 O GLN A 3 11.564 5.233 -5.530 1.00 0.00 O ATOM 42 CB GLN A 3 11.343 8.078 -3.381 1.00 0.00 C ATOM 43 CG GLN A 3 10.545 9.266 -3.925 1.00 0.00 C ATOM 44 CD GLN A 3 11.508 10.370 -4.369 1.00 0.00 C ATOM 45 OE1 GLN A 3 11.995 10.357 -5.482 1.00 0.00 O ATOM 46 NE2 GLN A 3 11.805 11.332 -3.538 1.00 0.00 N ATOM 0 H GLN A 3 10.235 6.460 -1.837 1.00 0.00 H new ATOM 0 HA GLN A 3 9.961 6.993 -4.638 1.00 0.00 H new ATOM 0 HB2 GLN A 3 11.338 8.091 -2.291 1.00 0.00 H new ATOM 0 HB3 GLN A 3 12.384 8.150 -3.696 1.00 0.00 H new ATOM 0 HG2 GLN A 3 9.927 8.948 -4.765 1.00 0.00 H new ATOM 0 HG3 GLN A 3 9.869 9.645 -3.158 1.00 0.00 H new ATOM 0 HE21 GLN A 3 11.396 11.343 -2.604 1.00 0.00 H new ATOM 0 HE22 GLN A 3 12.446 12.073 -3.823 1.00 0.00 H new ATOM 55 N THR A 4 13.022 5.975 -4.066 1.00 0.00 N ATOM 56 CA THR A 4 14.127 5.185 -4.693 1.00 0.00 C ATOM 57 C THR A 4 13.812 3.688 -4.639 1.00 0.00 C ATOM 58 O THR A 4 13.981 2.974 -5.607 1.00 0.00 O ATOM 59 CB THR A 4 15.444 5.453 -3.953 1.00 0.00 C ATOM 60 OG1 THR A 4 15.261 6.502 -3.012 1.00 0.00 O ATOM 61 CG2 THR A 4 16.523 5.853 -4.960 1.00 0.00 C ATOM 0 H THR A 4 13.294 6.533 -3.257 1.00 0.00 H new ATOM 0 HA THR A 4 14.223 5.491 -5.735 1.00 0.00 H new ATOM 0 HB THR A 4 15.753 4.549 -3.428 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.104 6.669 -2.540 1.00 0.00 H new ATOM 0 HG21 THR A 4 17.459 6.043 -4.434 1.00 0.00 H new ATOM 0 HG22 THR A 4 16.668 5.046 -5.678 1.00 0.00 H new ATOM 0 HG23 THR A 4 16.213 6.755 -5.487 1.00 0.00 H new ATOM 69 N TYR A 5 13.365 3.199 -3.518 1.00 0.00 N ATOM 70 CA TYR A 5 13.056 1.745 -3.420 1.00 0.00 C ATOM 71 C TYR A 5 12.155 1.335 -4.588 1.00 0.00 C ATOM 72 O TYR A 5 12.093 0.178 -4.957 1.00 0.00 O ATOM 73 CB TYR A 5 12.354 1.462 -2.092 1.00 0.00 C ATOM 74 CG TYR A 5 13.093 2.162 -0.969 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.427 2.556 -1.142 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.446 2.417 0.247 1.00 0.00 C ATOM 77 CE1 TYR A 5 15.109 3.203 -0.104 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.127 3.063 1.284 1.00 0.00 C ATOM 79 CZ TYR A 5 14.458 3.456 1.109 1.00 0.00 C ATOM 80 OH TYR A 5 15.130 4.092 2.133 1.00 0.00 O ATOM 0 H TYR A 5 13.200 3.739 -2.669 1.00 0.00 H new ATOM 0 HA TYR A 5 13.981 1.169 -3.464 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.321 1.809 -2.133 1.00 0.00 H new ATOM 0 HB3 TYR A 5 12.323 0.388 -1.907 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.930 2.360 -2.078 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.419 2.114 0.384 1.00 0.00 H new ATOM 0 HE1 TYR A 5 16.137 3.507 -0.239 1.00 0.00 H new ATOM 0 HE2 TYR A 5 12.625 3.258 2.220 1.00 0.00 H new ATOM 0 HH TYR A 5 14.533 4.191 2.904 1.00 0.00 H new ATOM 90 N VAL A 6 11.466 2.272 -5.181 1.00 0.00 N ATOM 91 CA VAL A 6 10.584 1.925 -6.331 1.00 0.00 C ATOM 92 C VAL A 6 11.455 1.747 -7.583 1.00 0.00 C ATOM 93 O VAL A 6 11.239 0.862 -8.386 1.00 0.00 O ATOM 94 CB VAL A 6 9.546 3.053 -6.540 1.00 0.00 C ATOM 95 CG1 VAL A 6 9.392 3.403 -8.027 1.00 0.00 C ATOM 96 CG2 VAL A 6 8.186 2.597 -6.000 1.00 0.00 C ATOM 0 H VAL A 6 11.476 3.258 -4.920 1.00 0.00 H new ATOM 0 HA VAL A 6 10.048 0.996 -6.135 1.00 0.00 H new ATOM 0 HB VAL A 6 9.897 3.937 -6.007 1.00 0.00 H new ATOM 0 HG11 VAL A 6 8.656 4.199 -8.139 1.00 0.00 H new ATOM 0 HG12 VAL A 6 10.351 3.737 -8.423 1.00 0.00 H new ATOM 0 HG13 VAL A 6 9.060 2.522 -8.576 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.452 3.390 -6.146 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.864 1.702 -6.533 1.00 0.00 H new ATOM 0 HG23 VAL A 6 8.273 2.374 -4.937 1.00 0.00 H new ATOM 106 N ASP A 7 12.425 2.599 -7.764 1.00 0.00 N ATOM 107 CA ASP A 7 13.291 2.491 -8.969 1.00 0.00 C ATOM 108 C ASP A 7 14.516 1.615 -8.683 1.00 0.00 C ATOM 109 O ASP A 7 15.503 1.674 -9.389 1.00 0.00 O ATOM 110 CB ASP A 7 13.741 3.894 -9.384 1.00 0.00 C ATOM 111 CG ASP A 7 14.941 4.340 -8.542 1.00 0.00 C ATOM 112 OD1 ASP A 7 14.845 4.274 -7.329 1.00 0.00 O ATOM 113 OD2 ASP A 7 15.936 4.738 -9.126 1.00 0.00 O ATOM 0 H ASP A 7 12.655 3.364 -7.130 1.00 0.00 H new ATOM 0 HA ASP A 7 12.723 2.027 -9.775 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.008 3.900 -10.441 1.00 0.00 H new ATOM 0 HB3 ASP A 7 12.919 4.599 -9.259 1.00 0.00 H new ATOM 118 N THR A 8 14.473 0.812 -7.659 1.00 0.00 N ATOM 119 CA THR A 8 15.654 -0.042 -7.354 1.00 0.00 C ATOM 120 C THR A 8 15.230 -1.512 -7.218 1.00 0.00 C ATOM 121 O THR A 8 14.948 -2.176 -8.197 1.00 0.00 O ATOM 122 CB THR A 8 16.311 0.440 -6.054 1.00 0.00 C ATOM 123 OG1 THR A 8 15.319 0.603 -5.045 1.00 0.00 O ATOM 124 CG2 THR A 8 17.013 1.776 -6.301 1.00 0.00 C ATOM 0 H THR A 8 13.680 0.710 -7.025 1.00 0.00 H new ATOM 0 HA THR A 8 16.371 0.036 -8.171 1.00 0.00 H new ATOM 0 HB THR A 8 17.041 -0.299 -5.724 1.00 0.00 H new ATOM 0 HG1 THR A 8 14.812 1.424 -5.215 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.480 2.118 -5.377 1.00 0.00 H new ATOM 0 HG22 THR A 8 17.777 1.649 -7.068 1.00 0.00 H new ATOM 0 HG23 THR A 8 16.283 2.514 -6.634 1.00 0.00 H new ATOM 132 N ASN A 9 15.202 -2.033 -6.020 1.00 0.00 N ATOM 133 CA ASN A 9 14.820 -3.463 -5.830 1.00 0.00 C ATOM 134 C ASN A 9 13.377 -3.571 -5.335 1.00 0.00 C ATOM 135 O ASN A 9 12.520 -4.054 -6.034 1.00 0.00 O ATOM 136 CB ASN A 9 15.754 -4.096 -4.797 1.00 0.00 C ATOM 137 CG ASN A 9 15.985 -5.567 -5.147 1.00 0.00 C ATOM 138 OD1 ASN A 9 15.435 -6.447 -4.516 1.00 0.00 O ATOM 139 ND2 ASN A 9 16.785 -5.872 -6.132 1.00 0.00 N ATOM 0 H ASN A 9 15.428 -1.529 -5.163 1.00 0.00 H new ATOM 0 HA ASN A 9 14.904 -3.982 -6.785 1.00 0.00 H new ATOM 0 HB2 ASN A 9 16.705 -3.563 -4.777 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.320 -4.013 -3.800 1.00 0.00 H new ATOM 0 HD21 ASN A 9 16.949 -6.850 -6.372 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.247 -5.133 -6.662 1.00 0.00 H new ATOM 146 N LEU A 10 13.128 -3.149 -4.120 1.00 0.00 N ATOM 147 CA LEU A 10 11.756 -3.237 -3.517 1.00 0.00 C ATOM 148 C LEU A 10 10.654 -3.273 -4.584 1.00 0.00 C ATOM 149 O LEU A 10 9.701 -4.016 -4.465 1.00 0.00 O ATOM 150 CB LEU A 10 11.525 -2.033 -2.602 1.00 0.00 C ATOM 151 CG LEU A 10 11.408 -2.515 -1.154 1.00 0.00 C ATOM 152 CD1 LEU A 10 12.526 -1.895 -0.311 1.00 0.00 C ATOM 153 CD2 LEU A 10 10.050 -2.093 -0.589 1.00 0.00 C ATOM 0 H LEU A 10 13.831 -2.738 -3.506 1.00 0.00 H new ATOM 0 HA LEU A 10 11.705 -4.168 -2.952 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.349 -1.326 -2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.617 -1.506 -2.897 1.00 0.00 H new ATOM 0 HG LEU A 10 11.496 -3.601 -1.125 1.00 0.00 H new ATOM 0 HD11 LEU A 10 12.439 -2.241 0.719 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.494 -2.194 -0.714 1.00 0.00 H new ATOM 0 HD13 LEU A 10 12.442 -0.809 -0.338 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.963 -2.435 0.442 1.00 0.00 H new ATOM 0 HD22 LEU A 10 9.965 -1.007 -0.620 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.254 -2.537 -1.187 1.00 0.00 H new ATOM 165 N VAL A 11 10.756 -2.481 -5.613 1.00 0.00 N ATOM 166 CA VAL A 11 9.684 -2.494 -6.650 1.00 0.00 C ATOM 167 C VAL A 11 9.936 -3.627 -7.653 1.00 0.00 C ATOM 168 O VAL A 11 9.157 -4.556 -7.740 1.00 0.00 O ATOM 169 CB VAL A 11 9.640 -1.119 -7.354 1.00 0.00 C ATOM 170 CG1 VAL A 11 9.633 -1.266 -8.883 1.00 0.00 C ATOM 171 CG2 VAL A 11 8.373 -0.378 -6.921 1.00 0.00 C ATOM 0 H VAL A 11 11.524 -1.832 -5.782 1.00 0.00 H new ATOM 0 HA VAL A 11 8.717 -2.675 -6.181 1.00 0.00 H new ATOM 0 HB VAL A 11 10.533 -0.562 -7.069 1.00 0.00 H new ATOM 0 HG11 VAL A 11 9.602 -0.278 -9.343 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.536 -1.787 -9.203 1.00 0.00 H new ATOM 0 HG13 VAL A 11 8.757 -1.837 -9.190 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.334 0.594 -7.413 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.496 -0.962 -7.201 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.385 -0.237 -5.840 1.00 0.00 H new ATOM 181 N GLY A 12 11.003 -3.551 -8.414 1.00 0.00 N ATOM 182 CA GLY A 12 11.293 -4.625 -9.417 1.00 0.00 C ATOM 183 C GLY A 12 10.889 -5.978 -8.834 1.00 0.00 C ATOM 184 O GLY A 12 10.324 -6.819 -9.507 1.00 0.00 O ATOM 0 H GLY A 12 11.684 -2.793 -8.384 1.00 0.00 H new ATOM 0 HA2 GLY A 12 10.745 -4.435 -10.340 1.00 0.00 H new ATOM 0 HA3 GLY A 12 12.353 -4.626 -9.670 1.00 0.00 H new ATOM 188 N THR A 13 11.159 -6.172 -7.574 1.00 0.00 N ATOM 189 CA THR A 13 10.789 -7.442 -6.895 1.00 0.00 C ATOM 190 C THR A 13 11.656 -7.623 -5.654 1.00 0.00 C ATOM 191 O THR A 13 12.073 -8.715 -5.323 1.00 0.00 O ATOM 192 CB THR A 13 10.995 -8.625 -7.829 1.00 0.00 C ATOM 193 OG1 THR A 13 11.139 -9.820 -7.073 1.00 0.00 O ATOM 194 CG2 THR A 13 12.244 -8.396 -8.685 1.00 0.00 C ATOM 0 H THR A 13 11.629 -5.491 -6.977 1.00 0.00 H new ATOM 0 HA THR A 13 9.737 -7.395 -6.612 1.00 0.00 H new ATOM 0 HB THR A 13 10.127 -8.721 -8.481 1.00 0.00 H new ATOM 0 HG1 THR A 13 11.927 -9.748 -6.495 1.00 0.00 H new ATOM 0 HG21 THR A 13 12.388 -9.245 -9.353 1.00 0.00 H new ATOM 0 HG22 THR A 13 12.119 -7.488 -9.275 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.115 -8.291 -8.038 1.00 0.00 H new ATOM 202 N GLY A 14 11.899 -6.571 -4.931 1.00 0.00 N ATOM 203 CA GLY A 14 12.697 -6.710 -3.687 1.00 0.00 C ATOM 204 C GLY A 14 11.732 -7.089 -2.564 1.00 0.00 C ATOM 205 O GLY A 14 12.004 -6.890 -1.397 1.00 0.00 O ATOM 0 H GLY A 14 11.582 -5.626 -5.146 1.00 0.00 H new ATOM 0 HA2 GLY A 14 13.465 -7.474 -3.807 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.210 -5.777 -3.454 1.00 0.00 H new ATOM 209 N ALA A 15 10.592 -7.625 -2.931 1.00 0.00 N ATOM 210 CA ALA A 15 9.564 -8.018 -1.933 1.00 0.00 C ATOM 211 C ALA A 15 8.224 -7.987 -2.656 1.00 0.00 C ATOM 212 O ALA A 15 7.335 -8.772 -2.395 1.00 0.00 O ATOM 213 CB ALA A 15 9.544 -7.025 -0.766 1.00 0.00 C ATOM 0 H ALA A 15 10.332 -7.807 -3.900 1.00 0.00 H new ATOM 0 HA ALA A 15 9.777 -9.006 -1.525 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.786 -7.327 -0.044 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.521 -7.012 -0.282 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.311 -6.028 -1.140 1.00 0.00 H new ATOM 219 N VAL A 16 8.097 -7.089 -3.597 1.00 0.00 N ATOM 220 CA VAL A 16 6.847 -6.995 -4.386 1.00 0.00 C ATOM 221 C VAL A 16 7.233 -6.806 -5.852 1.00 0.00 C ATOM 222 O VAL A 16 8.081 -6.000 -6.178 1.00 0.00 O ATOM 223 CB VAL A 16 6.017 -5.798 -3.908 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.052 -6.251 -2.811 1.00 0.00 C ATOM 225 CG2 VAL A 16 6.941 -4.712 -3.350 1.00 0.00 C ATOM 0 H VAL A 16 8.817 -6.412 -3.851 1.00 0.00 H new ATOM 0 HA VAL A 16 6.250 -7.899 -4.262 1.00 0.00 H new ATOM 0 HB VAL A 16 5.454 -5.396 -4.750 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.462 -5.400 -2.471 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.387 -7.019 -3.206 1.00 0.00 H new ATOM 0 HG13 VAL A 16 5.619 -6.657 -1.973 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.344 -3.865 -3.012 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.509 -5.113 -2.511 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.629 -4.384 -4.129 1.00 0.00 H new ATOM 235 N THR A 17 6.623 -7.535 -6.744 1.00 0.00 N ATOM 236 CA THR A 17 6.968 -7.381 -8.184 1.00 0.00 C ATOM 237 C THR A 17 6.272 -6.134 -8.732 1.00 0.00 C ATOM 238 O THR A 17 6.312 -5.856 -9.913 1.00 0.00 O ATOM 239 CB THR A 17 6.487 -8.610 -8.957 1.00 0.00 C ATOM 240 OG1 THR A 17 6.885 -8.498 -10.317 1.00 0.00 O ATOM 241 CG2 THR A 17 4.962 -8.700 -8.872 1.00 0.00 C ATOM 0 H THR A 17 5.903 -8.228 -6.539 1.00 0.00 H new ATOM 0 HA THR A 17 8.048 -7.282 -8.296 1.00 0.00 H new ATOM 0 HB THR A 17 6.926 -9.509 -8.525 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.828 -7.561 -10.599 1.00 0.00 H new ATOM 0 HG21 THR A 17 4.618 -9.576 -9.423 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.660 -8.786 -7.828 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.520 -7.803 -9.305 1.00 0.00 H new ATOM 249 N GLN A 18 5.636 -5.384 -7.875 1.00 0.00 N ATOM 250 CA GLN A 18 4.932 -4.153 -8.323 1.00 0.00 C ATOM 251 C GLN A 18 4.744 -3.224 -7.121 1.00 0.00 C ATOM 252 O GLN A 18 4.677 -3.664 -5.991 1.00 0.00 O ATOM 253 CB GLN A 18 3.560 -4.527 -8.896 1.00 0.00 C ATOM 254 CG GLN A 18 3.714 -5.679 -9.892 1.00 0.00 C ATOM 255 CD GLN A 18 2.358 -5.991 -10.526 1.00 0.00 C ATOM 256 OE1 GLN A 18 2.256 -6.146 -11.726 1.00 0.00 O ATOM 257 NE2 GLN A 18 1.305 -6.093 -9.763 1.00 0.00 N ATOM 0 H GLN A 18 5.574 -5.574 -6.875 1.00 0.00 H new ATOM 0 HA GLN A 18 5.519 -3.651 -9.092 1.00 0.00 H new ATOM 0 HB2 GLN A 18 2.886 -4.818 -8.090 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.114 -3.664 -9.390 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.435 -5.412 -10.664 1.00 0.00 H new ATOM 0 HG3 GLN A 18 4.102 -6.562 -9.385 1.00 0.00 H new ATOM 0 HE21 GLN A 18 1.391 -5.963 -8.755 1.00 0.00 H new ATOM 0 HE22 GLN A 18 0.396 -6.303 -10.174 1.00 0.00 H new ATOM 266 N ALA A 19 4.658 -1.945 -7.353 1.00 0.00 N ATOM 267 CA ALA A 19 4.472 -0.995 -6.222 1.00 0.00 C ATOM 268 C ALA A 19 4.163 0.393 -6.778 1.00 0.00 C ATOM 269 O ALA A 19 4.559 0.730 -7.875 1.00 0.00 O ATOM 270 CB ALA A 19 5.751 -0.937 -5.385 1.00 0.00 C ATOM 0 H ALA A 19 4.708 -1.516 -8.277 1.00 0.00 H new ATOM 0 HA ALA A 19 3.646 -1.331 -5.595 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.613 -0.241 -4.558 1.00 0.00 H new ATOM 0 HB2 ALA A 19 5.974 -1.929 -4.992 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.579 -0.600 -6.009 1.00 0.00 H new ATOM 276 N ALA A 20 3.455 1.198 -6.039 1.00 0.00 N ATOM 277 CA ALA A 20 3.124 2.556 -6.547 1.00 0.00 C ATOM 278 C ALA A 20 2.975 3.531 -5.380 1.00 0.00 C ATOM 279 O ALA A 20 2.267 3.275 -4.427 1.00 0.00 O ATOM 280 CB ALA A 20 1.807 2.495 -7.324 1.00 0.00 C ATOM 0 H ALA A 20 3.093 0.977 -5.111 1.00 0.00 H new ATOM 0 HA ALA A 20 3.927 2.900 -7.199 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.559 3.488 -7.699 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.911 1.806 -8.162 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.012 2.147 -6.665 1.00 0.00 H new ATOM 286 N ILE A 21 3.619 4.661 -5.462 1.00 0.00 N ATOM 287 CA ILE A 21 3.493 5.668 -4.376 1.00 0.00 C ATOM 288 C ILE A 21 2.218 6.457 -4.634 1.00 0.00 C ATOM 289 O ILE A 21 2.224 7.424 -5.365 1.00 0.00 O ATOM 290 CB ILE A 21 4.687 6.627 -4.392 1.00 0.00 C ATOM 291 CG1 ILE A 21 5.972 5.865 -4.731 1.00 0.00 C ATOM 292 CG2 ILE A 21 4.832 7.272 -3.012 1.00 0.00 C ATOM 293 CD1 ILE A 21 6.374 4.989 -3.546 1.00 0.00 C ATOM 0 H ILE A 21 4.227 4.930 -6.235 1.00 0.00 H new ATOM 0 HA ILE A 21 3.465 5.171 -3.407 1.00 0.00 H new ATOM 0 HB ILE A 21 4.519 7.395 -5.147 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.819 5.249 -5.617 1.00 0.00 H new ATOM 0 HG13 ILE A 21 6.772 6.567 -4.966 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.681 7.956 -3.017 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.923 7.823 -2.771 1.00 0.00 H new ATOM 0 HG23 ILE A 21 4.996 6.497 -2.263 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.288 4.447 -3.788 1.00 0.00 H new ATOM 0 HD12 ILE A 21 6.545 5.616 -2.671 1.00 0.00 H new ATOM 0 HD13 ILE A 21 5.576 4.278 -3.332 1.00 0.00 H new ATOM 305 N LEU A 22 1.123 6.041 -4.067 1.00 0.00 N ATOM 306 CA LEU A 22 -0.155 6.761 -4.310 1.00 0.00 C ATOM 307 C LEU A 22 -0.168 8.076 -3.531 1.00 0.00 C ATOM 308 O LEU A 22 -0.304 8.098 -2.324 1.00 0.00 O ATOM 309 CB LEU A 22 -1.324 5.873 -3.882 1.00 0.00 C ATOM 310 CG LEU A 22 -1.733 4.988 -5.063 1.00 0.00 C ATOM 311 CD1 LEU A 22 -0.561 4.085 -5.456 1.00 0.00 C ATOM 312 CD2 LEU A 22 -2.932 4.123 -4.671 1.00 0.00 C ATOM 0 H LEU A 22 1.057 5.234 -3.446 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.251 6.989 -5.372 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.037 5.256 -3.030 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.166 6.487 -3.561 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.006 5.621 -5.908 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -0.853 3.455 -6.297 1.00 0.00 H new ATOM 0 HD12 LEU A 22 0.292 4.700 -5.742 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -0.287 3.456 -4.609 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.219 3.495 -5.515 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -2.664 3.492 -3.824 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.769 4.765 -4.395 1.00 0.00 H new ATOM 324 N GLY A 23 -0.018 9.173 -4.225 1.00 0.00 N ATOM 325 CA GLY A 23 -0.011 10.502 -3.549 1.00 0.00 C ATOM 326 C GLY A 23 -1.164 10.581 -2.547 1.00 0.00 C ATOM 327 O GLY A 23 -1.985 9.690 -2.457 1.00 0.00 O ATOM 0 H GLY A 23 0.101 9.205 -5.238 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.939 10.654 -3.037 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -0.105 11.297 -4.289 1.00 0.00 H new ATOM 331 N LEU A 24 -1.228 11.640 -1.791 1.00 0.00 N ATOM 332 CA LEU A 24 -2.323 11.775 -0.792 1.00 0.00 C ATOM 333 C LEU A 24 -3.645 12.071 -1.506 1.00 0.00 C ATOM 334 O LEU A 24 -4.688 12.158 -0.889 1.00 0.00 O ATOM 335 CB LEU A 24 -1.987 12.914 0.172 1.00 0.00 C ATOM 336 CG LEU A 24 -0.562 12.725 0.697 1.00 0.00 C ATOM 337 CD1 LEU A 24 0.254 13.994 0.435 1.00 0.00 C ATOM 338 CD2 LEU A 24 -0.605 12.449 2.202 1.00 0.00 C ATOM 0 H LEU A 24 -0.569 12.418 -1.822 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.424 10.844 -0.235 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -2.076 13.874 -0.336 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -2.694 12.925 1.001 1.00 0.00 H new ATOM 0 HG LEU A 24 -0.097 11.883 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.269 13.858 0.809 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.286 14.191 -0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.211 14.837 0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.410 12.314 2.576 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.072 13.291 2.713 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.184 11.545 2.390 1.00 0.00 H new ATOM 350 N ASP A 25 -3.613 12.220 -2.803 1.00 0.00 N ATOM 351 CA ASP A 25 -4.871 12.505 -3.552 1.00 0.00 C ATOM 352 C ASP A 25 -5.038 11.471 -4.668 1.00 0.00 C ATOM 353 O ASP A 25 -5.909 11.583 -5.507 1.00 0.00 O ATOM 354 CB ASP A 25 -4.795 13.906 -4.161 1.00 0.00 C ATOM 355 CG ASP A 25 -6.069 14.684 -3.820 1.00 0.00 C ATOM 356 OD1 ASP A 25 -7.142 14.182 -4.109 1.00 0.00 O ATOM 357 OD2 ASP A 25 -5.946 15.769 -3.277 1.00 0.00 O ATOM 0 H ASP A 25 -2.771 12.157 -3.376 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.722 12.451 -2.873 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -3.921 14.433 -3.778 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.677 13.838 -5.242 1.00 0.00 H new ATOM 362 N GLY A 26 -4.208 10.463 -4.684 1.00 0.00 N ATOM 363 CA GLY A 26 -4.317 9.423 -5.744 1.00 0.00 C ATOM 364 C GLY A 26 -3.790 9.981 -7.067 1.00 0.00 C ATOM 365 O GLY A 26 -4.256 9.622 -8.131 1.00 0.00 O ATOM 0 H GLY A 26 -3.459 10.316 -4.008 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.748 8.538 -5.459 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.356 9.112 -5.857 1.00 0.00 H new ATOM 369 N ASN A 27 -2.822 10.855 -7.014 1.00 0.00 N ATOM 370 CA ASN A 27 -2.267 11.429 -8.274 1.00 0.00 C ATOM 371 C ASN A 27 -1.033 10.628 -8.696 1.00 0.00 C ATOM 372 O ASN A 27 -0.130 11.152 -9.315 1.00 0.00 O ATOM 373 CB ASN A 27 -1.875 12.888 -8.041 1.00 0.00 C ATOM 374 CG ASN A 27 -1.692 13.591 -9.388 1.00 0.00 C ATOM 375 OD1 ASN A 27 -2.024 13.046 -10.422 1.00 0.00 O ATOM 376 ND2 ASN A 27 -1.171 14.787 -9.419 1.00 0.00 N ATOM 0 H ASN A 27 -2.392 11.196 -6.154 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.020 11.379 -9.060 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -2.644 13.393 -7.457 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -0.952 12.939 -7.464 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.042 15.264 -10.311 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -0.892 15.245 -8.551 1.00 0.00 H new ATOM 383 N THR A 28 -1.005 9.360 -8.364 1.00 0.00 N ATOM 384 CA THR A 28 0.149 8.483 -8.726 1.00 0.00 C ATOM 385 C THR A 28 1.457 9.280 -8.738 1.00 0.00 C ATOM 386 O THR A 28 1.796 9.931 -9.706 1.00 0.00 O ATOM 387 CB THR A 28 -0.095 7.879 -10.104 1.00 0.00 C ATOM 388 OG1 THR A 28 -1.248 7.049 -10.056 1.00 0.00 O ATOM 389 CG2 THR A 28 1.122 7.050 -10.517 1.00 0.00 C ATOM 0 H THR A 28 -1.748 8.889 -7.848 1.00 0.00 H new ATOM 0 HA THR A 28 0.236 7.692 -7.981 1.00 0.00 H new ATOM 0 HB THR A 28 -0.253 8.675 -10.832 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.408 6.660 -10.941 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.950 6.617 -11.502 1.00 0.00 H new ATOM 0 HG22 THR A 28 2.004 7.690 -10.551 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.281 6.251 -9.792 1.00 0.00 H new ATOM 397 N TRP A 29 2.191 9.227 -7.663 1.00 0.00 N ATOM 398 CA TRP A 29 3.478 9.975 -7.586 1.00 0.00 C ATOM 399 C TRP A 29 4.578 9.205 -8.324 1.00 0.00 C ATOM 400 O TRP A 29 5.310 9.764 -9.116 1.00 0.00 O ATOM 401 CB TRP A 29 3.887 10.125 -6.119 1.00 0.00 C ATOM 402 CG TRP A 29 3.258 11.349 -5.533 1.00 0.00 C ATOM 403 CD1 TRP A 29 2.071 11.876 -5.913 1.00 0.00 C ATOM 404 CD2 TRP A 29 3.764 12.201 -4.465 1.00 0.00 C ATOM 405 NE1 TRP A 29 1.817 12.999 -5.144 1.00 0.00 N ATOM 406 CE2 TRP A 29 2.832 13.240 -4.238 1.00 0.00 C ATOM 407 CE3 TRP A 29 4.930 12.172 -3.680 1.00 0.00 C ATOM 408 CZ2 TRP A 29 3.049 14.217 -3.265 1.00 0.00 C ATOM 409 CZ3 TRP A 29 5.153 13.152 -2.701 1.00 0.00 C ATOM 410 CH2 TRP A 29 4.214 14.172 -2.494 1.00 0.00 C ATOM 0 H TRP A 29 1.953 8.693 -6.827 1.00 0.00 H new ATOM 0 HA TRP A 29 3.346 10.955 -8.046 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.580 9.244 -5.556 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.972 10.191 -6.041 1.00 0.00 H new ATOM 0 HD1 TRP A 29 1.428 11.485 -6.688 1.00 0.00 H new ATOM 0 HE1 TRP A 29 0.982 13.578 -5.235 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.659 11.390 -3.832 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 2.323 15.001 -3.109 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 6.052 13.120 -2.104 1.00 0.00 H new ATOM 0 HH2 TRP A 29 4.391 14.923 -1.739 1.00 0.00 H new ATOM 421 N ALA A 30 4.713 7.931 -8.062 1.00 0.00 N ATOM 422 CA ALA A 30 5.786 7.146 -8.744 1.00 0.00 C ATOM 423 C ALA A 30 5.442 5.657 -8.715 1.00 0.00 C ATOM 424 O ALA A 30 5.598 4.999 -7.706 1.00 0.00 O ATOM 425 CB ALA A 30 7.111 7.365 -8.012 1.00 0.00 C ATOM 0 H ALA A 30 4.132 7.403 -7.411 1.00 0.00 H new ATOM 0 HA ALA A 30 5.869 7.478 -9.779 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.898 6.794 -8.505 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.366 8.425 -8.030 1.00 0.00 H new ATOM 0 HB3 ALA A 30 7.015 7.032 -6.979 1.00 0.00 H new ATOM 431 N THR A 31 4.982 5.114 -9.807 1.00 0.00 N ATOM 432 CA THR A 31 4.632 3.667 -9.820 1.00 0.00 C ATOM 433 C THR A 31 5.563 2.905 -10.764 1.00 0.00 C ATOM 434 O THR A 31 6.271 3.483 -11.563 1.00 0.00 O ATOM 435 CB THR A 31 3.188 3.497 -10.298 1.00 0.00 C ATOM 436 OG1 THR A 31 2.778 2.153 -10.093 1.00 0.00 O ATOM 437 CG2 THR A 31 3.100 3.835 -11.786 1.00 0.00 C ATOM 0 H THR A 31 4.834 5.607 -10.687 1.00 0.00 H new ATOM 0 HA THR A 31 4.741 3.270 -8.811 1.00 0.00 H new ATOM 0 HB THR A 31 2.537 4.166 -9.735 1.00 0.00 H new ATOM 0 HG1 THR A 31 1.853 2.043 -10.397 1.00 0.00 H new ATOM 0 HG21 THR A 31 2.072 3.714 -12.126 1.00 0.00 H new ATOM 0 HG22 THR A 31 3.416 4.866 -11.944 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.750 3.166 -12.350 1.00 0.00 H new ATOM 445 N SER A 32 5.552 1.604 -10.673 1.00 0.00 N ATOM 446 CA SER A 32 6.416 0.774 -11.556 1.00 0.00 C ATOM 447 C SER A 32 5.722 -0.567 -11.804 1.00 0.00 C ATOM 448 O SER A 32 5.070 -1.107 -10.933 1.00 0.00 O ATOM 449 CB SER A 32 7.768 0.539 -10.880 1.00 0.00 C ATOM 450 OG SER A 32 8.808 0.756 -11.823 1.00 0.00 O ATOM 0 H SER A 32 4.975 1.076 -10.018 1.00 0.00 H new ATOM 0 HA SER A 32 6.579 1.287 -12.504 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.885 1.212 -10.031 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.821 -0.478 -10.490 1.00 0.00 H new ATOM 0 HG SER A 32 9.676 0.608 -11.393 1.00 0.00 H new ATOM 456 N ALA A 33 5.847 -1.101 -12.989 1.00 0.00 N ATOM 457 CA ALA A 33 5.184 -2.401 -13.296 1.00 0.00 C ATOM 458 C ALA A 33 3.694 -2.159 -13.541 1.00 0.00 C ATOM 459 O ALA A 33 3.189 -1.075 -13.327 1.00 0.00 O ATOM 460 CB ALA A 33 5.356 -3.361 -12.118 1.00 0.00 C ATOM 0 H ALA A 33 6.379 -0.693 -13.758 1.00 0.00 H new ATOM 0 HA ALA A 33 5.638 -2.839 -14.185 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.870 -4.309 -12.347 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.418 -3.531 -11.940 1.00 0.00 H new ATOM 0 HB3 ALA A 33 4.903 -2.928 -11.226 1.00 0.00 H new ATOM 466 N GLY A 34 2.986 -3.156 -13.991 1.00 0.00 N ATOM 467 CA GLY A 34 1.529 -2.978 -14.253 1.00 0.00 C ATOM 468 C GLY A 34 0.849 -2.393 -13.014 1.00 0.00 C ATOM 469 O GLY A 34 1.169 -2.737 -11.893 1.00 0.00 O ATOM 0 H GLY A 34 3.352 -4.087 -14.189 1.00 0.00 H new ATOM 0 HA2 GLY A 34 1.382 -2.317 -15.107 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.076 -3.936 -14.510 1.00 0.00 H new ATOM 473 N PHE A 35 -0.091 -1.511 -13.211 1.00 0.00 N ATOM 474 CA PHE A 35 -0.803 -0.900 -12.054 1.00 0.00 C ATOM 475 C PHE A 35 -1.807 0.131 -12.571 1.00 0.00 C ATOM 476 O PHE A 35 -1.441 1.115 -13.182 1.00 0.00 O ATOM 477 CB PHE A 35 0.207 -0.210 -11.133 1.00 0.00 C ATOM 478 CG PHE A 35 -0.282 -0.268 -9.701 1.00 0.00 C ATOM 479 CD1 PHE A 35 -1.636 -0.505 -9.426 1.00 0.00 C ATOM 480 CD2 PHE A 35 0.621 -0.084 -8.647 1.00 0.00 C ATOM 481 CE1 PHE A 35 -2.085 -0.558 -8.101 1.00 0.00 C ATOM 482 CE2 PHE A 35 0.171 -0.135 -7.321 1.00 0.00 C ATOM 483 CZ PHE A 35 -1.181 -0.373 -7.049 1.00 0.00 C ATOM 0 H PHE A 35 -0.398 -1.186 -14.128 1.00 0.00 H new ATOM 0 HA PHE A 35 -1.326 -1.677 -11.496 1.00 0.00 H new ATOM 0 HB2 PHE A 35 1.179 -0.696 -11.215 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.343 0.827 -11.439 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -2.334 -0.647 -10.238 1.00 0.00 H new ATOM 0 HD2 PHE A 35 1.665 0.097 -8.856 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -3.128 -0.742 -7.891 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.868 0.009 -6.509 1.00 0.00 H new ATOM 0 HZ PHE A 35 -1.527 -0.414 -6.027 1.00 0.00 H new ATOM 493 N ALA A 36 -3.073 -0.088 -12.340 1.00 0.00 N ATOM 494 CA ALA A 36 -4.091 0.881 -12.830 1.00 0.00 C ATOM 495 C ALA A 36 -4.760 1.581 -11.646 1.00 0.00 C ATOM 496 O ALA A 36 -5.301 0.952 -10.760 1.00 0.00 O ATOM 497 CB ALA A 36 -5.149 0.136 -13.644 1.00 0.00 C ATOM 0 H ALA A 36 -3.444 -0.893 -11.835 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.602 1.628 -13.456 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.896 0.844 -14.004 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.675 -0.355 -14.494 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.632 -0.612 -13.015 1.00 0.00 H new ATOM 503 N VAL A 37 -4.738 2.885 -11.638 1.00 0.00 N ATOM 504 CA VAL A 37 -5.382 3.644 -10.530 1.00 0.00 C ATOM 505 C VAL A 37 -5.918 4.961 -11.096 1.00 0.00 C ATOM 506 O VAL A 37 -5.235 5.650 -11.826 1.00 0.00 O ATOM 507 CB VAL A 37 -4.355 3.934 -9.431 1.00 0.00 C ATOM 508 CG1 VAL A 37 -5.031 4.687 -8.284 1.00 0.00 C ATOM 509 CG2 VAL A 37 -3.787 2.614 -8.904 1.00 0.00 C ATOM 0 H VAL A 37 -4.299 3.461 -12.356 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.196 3.060 -10.101 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.549 4.542 -9.841 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -4.299 4.893 -7.503 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -5.439 5.627 -8.656 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -5.837 4.079 -7.875 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.056 2.819 -8.122 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.595 2.007 -8.495 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.305 2.074 -9.719 1.00 0.00 H new ATOM 519 N THR A 38 -7.132 5.318 -10.777 1.00 0.00 N ATOM 520 CA THR A 38 -7.684 6.595 -11.319 1.00 0.00 C ATOM 521 C THR A 38 -8.843 7.099 -10.442 1.00 0.00 C ATOM 522 O THR A 38 -8.734 8.159 -9.861 1.00 0.00 O ATOM 523 CB THR A 38 -8.145 6.414 -12.777 1.00 0.00 C ATOM 524 OG1 THR A 38 -9.472 6.902 -12.923 1.00 0.00 O ATOM 525 CG2 THR A 38 -8.082 4.936 -13.185 1.00 0.00 C ATOM 0 H THR A 38 -7.760 4.789 -10.172 1.00 0.00 H new ATOM 0 HA THR A 38 -6.892 7.343 -11.303 1.00 0.00 H new ATOM 0 HB THR A 38 -7.478 6.979 -13.428 1.00 0.00 H new ATOM 0 HG1 THR A 38 -9.762 6.787 -13.852 1.00 0.00 H new ATOM 0 HG21 THR A 38 -8.412 4.829 -14.218 1.00 0.00 H new ATOM 0 HG22 THR A 38 -7.057 4.576 -13.092 1.00 0.00 H new ATOM 0 HG23 THR A 38 -8.732 4.351 -12.535 1.00 0.00 H new ATOM 533 N PRO A 39 -9.918 6.344 -10.350 1.00 0.00 N ATOM 534 CA PRO A 39 -11.062 6.757 -9.522 1.00 0.00 C ATOM 535 C PRO A 39 -10.579 7.134 -8.122 1.00 0.00 C ATOM 536 O PRO A 39 -9.801 6.425 -7.524 1.00 0.00 O ATOM 537 CB PRO A 39 -11.983 5.531 -9.482 1.00 0.00 C ATOM 538 CG PRO A 39 -11.433 4.506 -10.505 1.00 0.00 C ATOM 539 CD PRO A 39 -10.091 5.044 -11.031 1.00 0.00 C ATOM 0 HA PRO A 39 -11.579 7.630 -9.920 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.006 5.100 -8.481 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.006 5.811 -9.732 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -11.297 3.532 -10.035 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -12.138 4.368 -11.325 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -9.272 4.363 -10.799 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -10.109 5.163 -12.114 1.00 0.00 H new ATOM 547 N ALA A 40 -11.035 8.255 -7.620 1.00 0.00 N ATOM 548 CA ALA A 40 -10.625 8.740 -6.261 1.00 0.00 C ATOM 549 C ALA A 40 -10.308 7.564 -5.309 1.00 0.00 C ATOM 550 O ALA A 40 -11.141 7.177 -4.513 1.00 0.00 O ATOM 551 CB ALA A 40 -11.782 9.547 -5.671 1.00 0.00 C ATOM 0 H ALA A 40 -11.689 8.869 -8.105 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.725 9.347 -6.365 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -11.505 9.910 -4.681 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.002 10.395 -6.320 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -12.665 8.912 -5.591 1.00 0.00 H new ATOM 557 N GLN A 41 -9.124 6.986 -5.366 1.00 0.00 N ATOM 558 CA GLN A 41 -8.812 5.854 -4.450 1.00 0.00 C ATOM 559 C GLN A 41 -8.184 6.400 -3.167 1.00 0.00 C ATOM 560 O GLN A 41 -8.338 5.839 -2.100 1.00 0.00 O ATOM 561 CB GLN A 41 -7.834 4.897 -5.134 1.00 0.00 C ATOM 562 CG GLN A 41 -8.568 3.612 -5.524 1.00 0.00 C ATOM 563 CD GLN A 41 -8.473 3.409 -7.037 1.00 0.00 C ATOM 564 OE1 GLN A 41 -9.327 3.857 -7.777 1.00 0.00 O ATOM 565 NE2 GLN A 41 -7.468 2.742 -7.533 1.00 0.00 N ATOM 0 H GLN A 41 -8.373 7.252 -6.003 1.00 0.00 H new ATOM 0 HA GLN A 41 -9.729 5.318 -4.206 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -7.407 5.368 -6.019 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.005 4.667 -4.464 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.132 2.759 -5.004 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.613 3.671 -5.219 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.750 2.365 -6.914 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.400 2.597 -8.540 1.00 0.00 H new ATOM 574 N GLY A 42 -7.477 7.494 -3.261 1.00 0.00 N ATOM 575 CA GLY A 42 -6.839 8.077 -2.047 1.00 0.00 C ATOM 576 C GLY A 42 -7.914 8.704 -1.159 1.00 0.00 C ATOM 577 O GLY A 42 -7.705 8.936 0.015 1.00 0.00 O ATOM 0 H GLY A 42 -7.314 8.009 -4.126 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.303 7.303 -1.497 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.105 8.830 -2.335 1.00 0.00 H new ATOM 581 N GLN A 43 -9.065 8.983 -1.708 1.00 0.00 N ATOM 582 CA GLN A 43 -10.151 9.594 -0.893 1.00 0.00 C ATOM 583 C GLN A 43 -10.856 8.502 -0.087 1.00 0.00 C ATOM 584 O GLN A 43 -10.848 8.508 1.127 1.00 0.00 O ATOM 585 CB GLN A 43 -11.158 10.282 -1.816 1.00 0.00 C ATOM 586 CG GLN A 43 -11.464 11.682 -1.282 1.00 0.00 C ATOM 587 CD GLN A 43 -12.706 11.627 -0.393 1.00 0.00 C ATOM 588 OE1 GLN A 43 -13.445 10.663 -0.418 1.00 0.00 O ATOM 589 NE2 GLN A 43 -12.970 12.629 0.401 1.00 0.00 N ATOM 0 H GLN A 43 -9.299 8.814 -2.686 1.00 0.00 H new ATOM 0 HA GLN A 43 -9.725 10.331 -0.212 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -10.756 10.347 -2.827 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -12.074 9.695 -1.874 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -10.614 12.060 -0.715 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -11.627 12.371 -2.110 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -12.351 13.439 0.423 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -13.796 12.602 0.999 1.00 0.00 H new ATOM 598 N THR A 44 -11.466 7.562 -0.755 1.00 0.00 N ATOM 599 CA THR A 44 -12.168 6.470 -0.025 1.00 0.00 C ATOM 600 C THR A 44 -11.159 5.718 0.844 1.00 0.00 C ATOM 601 O THR A 44 -11.503 5.144 1.859 1.00 0.00 O ATOM 602 CB THR A 44 -12.800 5.504 -1.033 1.00 0.00 C ATOM 603 OG1 THR A 44 -13.756 6.202 -1.819 1.00 0.00 O ATOM 604 CG2 THR A 44 -13.487 4.363 -0.284 1.00 0.00 C ATOM 0 H THR A 44 -11.509 7.503 -1.772 1.00 0.00 H new ATOM 0 HA THR A 44 -12.950 6.893 0.606 1.00 0.00 H new ATOM 0 HB THR A 44 -12.025 5.095 -1.682 1.00 0.00 H new ATOM 0 HG1 THR A 44 -14.160 5.586 -2.466 1.00 0.00 H new ATOM 0 HG21 THR A 44 -13.937 3.676 -1.001 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.752 3.829 0.319 1.00 0.00 H new ATOM 0 HG23 THR A 44 -14.263 4.769 0.365 1.00 0.00 H new ATOM 612 N LEU A 45 -9.914 5.720 0.453 1.00 0.00 N ATOM 613 CA LEU A 45 -8.876 5.010 1.254 1.00 0.00 C ATOM 614 C LEU A 45 -8.522 5.851 2.483 1.00 0.00 C ATOM 615 O LEU A 45 -8.447 5.352 3.590 1.00 0.00 O ATOM 616 CB LEU A 45 -7.626 4.808 0.393 1.00 0.00 C ATOM 617 CG LEU A 45 -6.518 4.168 1.231 1.00 0.00 C ATOM 618 CD1 LEU A 45 -6.151 2.808 0.635 1.00 0.00 C ATOM 619 CD2 LEU A 45 -5.285 5.075 1.221 1.00 0.00 C ATOM 0 H LEU A 45 -9.570 6.183 -0.388 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.257 4.041 1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -7.861 4.174 -0.462 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -7.288 5.765 -0.004 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.866 4.036 2.255 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.361 2.351 1.231 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -7.028 2.161 0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.801 2.942 -0.389 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.494 4.621 1.818 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -4.937 5.205 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.544 6.046 1.642 1.00 0.00 H new ATOM 631 N ALA A 46 -8.305 7.124 2.297 1.00 0.00 N ATOM 632 CA ALA A 46 -7.956 8.001 3.450 1.00 0.00 C ATOM 633 C ALA A 46 -9.125 8.043 4.437 1.00 0.00 C ATOM 634 O ALA A 46 -8.999 8.532 5.543 1.00 0.00 O ATOM 635 CB ALA A 46 -7.666 9.414 2.941 1.00 0.00 C ATOM 0 H ALA A 46 -8.354 7.596 1.394 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.074 7.605 3.954 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -7.410 10.058 3.782 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -6.832 9.384 2.240 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -8.549 9.808 2.438 1.00 0.00 H new ATOM 641 N SER A 47 -10.263 7.536 4.046 1.00 0.00 N ATOM 642 CA SER A 47 -11.439 7.547 4.961 1.00 0.00 C ATOM 643 C SER A 47 -11.558 6.191 5.662 1.00 0.00 C ATOM 644 O SER A 47 -12.063 6.092 6.763 1.00 0.00 O ATOM 645 CB SER A 47 -12.707 7.818 4.151 1.00 0.00 C ATOM 646 OG SER A 47 -12.529 7.337 2.824 1.00 0.00 O ATOM 0 H SER A 47 -10.429 7.115 3.132 1.00 0.00 H new ATOM 0 HA SER A 47 -11.310 8.328 5.710 1.00 0.00 H new ATOM 0 HB2 SER A 47 -13.562 7.327 4.616 1.00 0.00 H new ATOM 0 HB3 SER A 47 -12.922 8.886 4.137 1.00 0.00 H new ATOM 0 HG SER A 47 -12.002 7.983 2.310 1.00 0.00 H new ATOM 652 N ALA A 48 -11.095 5.143 5.034 1.00 0.00 N ATOM 653 CA ALA A 48 -11.181 3.794 5.665 1.00 0.00 C ATOM 654 C ALA A 48 -10.280 3.746 6.902 1.00 0.00 C ATOM 655 O ALA A 48 -10.478 2.944 7.794 1.00 0.00 O ATOM 656 CB ALA A 48 -10.720 2.733 4.661 1.00 0.00 C ATOM 0 H ALA A 48 -10.661 5.163 4.111 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.212 3.598 5.959 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.782 1.746 5.120 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.360 2.764 3.779 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.689 2.933 4.368 1.00 0.00 H new ATOM 662 N PHE A 49 -9.287 4.591 6.960 1.00 0.00 N ATOM 663 CA PHE A 49 -8.370 4.587 8.138 1.00 0.00 C ATOM 664 C PHE A 49 -9.103 5.113 9.375 1.00 0.00 C ATOM 665 O PHE A 49 -8.587 5.073 10.475 1.00 0.00 O ATOM 666 CB PHE A 49 -7.166 5.483 7.847 1.00 0.00 C ATOM 667 CG PHE A 49 -6.328 4.865 6.755 1.00 0.00 C ATOM 668 CD1 PHE A 49 -5.662 3.655 6.985 1.00 0.00 C ATOM 669 CD2 PHE A 49 -6.217 5.499 5.513 1.00 0.00 C ATOM 670 CE1 PHE A 49 -4.884 3.081 5.973 1.00 0.00 C ATOM 671 CE2 PHE A 49 -5.440 4.925 4.499 1.00 0.00 C ATOM 672 CZ PHE A 49 -4.774 3.715 4.730 1.00 0.00 C ATOM 0 H PHE A 49 -9.070 5.284 6.244 1.00 0.00 H new ATOM 0 HA PHE A 49 -8.036 3.567 8.326 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.502 6.475 7.544 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.568 5.611 8.750 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -5.749 3.165 7.943 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -6.731 6.432 5.336 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -4.369 2.149 6.151 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -5.355 5.415 3.540 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.175 3.271 3.949 1.00 0.00 H new ATOM 682 N ASN A 50 -10.296 5.612 9.208 1.00 0.00 N ATOM 683 CA ASN A 50 -11.050 6.144 10.379 1.00 0.00 C ATOM 684 C ASN A 50 -11.709 4.990 11.136 1.00 0.00 C ATOM 685 O ASN A 50 -11.313 4.649 12.233 1.00 0.00 O ATOM 686 CB ASN A 50 -12.128 7.115 9.892 1.00 0.00 C ATOM 687 CG ASN A 50 -12.425 8.141 10.986 1.00 0.00 C ATOM 688 OD1 ASN A 50 -12.322 9.331 10.764 1.00 0.00 O ATOM 689 ND2 ASN A 50 -12.792 7.729 12.169 1.00 0.00 N ATOM 0 H ASN A 50 -10.781 5.675 8.313 1.00 0.00 H new ATOM 0 HA ASN A 50 -10.362 6.665 11.044 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -11.794 7.621 8.986 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -13.036 6.568 9.636 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -12.992 8.406 12.905 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.879 6.730 12.357 1.00 0.00 H new ATOM 696 N ASN A 51 -12.714 4.388 10.564 1.00 0.00 N ATOM 697 CA ASN A 51 -13.398 3.262 11.256 1.00 0.00 C ATOM 698 C ASN A 51 -12.833 1.933 10.753 1.00 0.00 C ATOM 699 O ASN A 51 -12.005 1.894 9.864 1.00 0.00 O ATOM 700 CB ASN A 51 -14.898 3.330 10.967 1.00 0.00 C ATOM 701 CG ASN A 51 -15.527 4.437 11.814 1.00 0.00 C ATOM 702 OD1 ASN A 51 -14.845 5.343 12.253 1.00 0.00 O ATOM 703 ND2 ASN A 51 -16.807 4.407 12.062 1.00 0.00 N ATOM 0 H ASN A 51 -13.091 4.628 9.647 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.232 3.336 12.331 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -15.067 3.526 9.908 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.367 2.372 11.193 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -17.235 5.143 12.624 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -17.380 3.648 11.694 1.00 0.00 H new ATOM 710 N ALA A 52 -13.268 0.845 11.320 1.00 0.00 N ATOM 711 CA ALA A 52 -12.752 -0.483 10.883 1.00 0.00 C ATOM 712 C ALA A 52 -13.920 -1.377 10.459 1.00 0.00 C ATOM 713 O ALA A 52 -13.729 -2.491 10.015 1.00 0.00 O ATOM 714 CB ALA A 52 -12.007 -1.144 12.044 1.00 0.00 C ATOM 0 H ALA A 52 -13.960 0.816 12.069 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.075 -0.347 10.040 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -11.628 -2.116 11.727 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -11.173 -0.511 12.348 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -12.688 -1.276 12.885 1.00 0.00 H new ATOM 720 N ASP A 53 -15.128 -0.901 10.592 1.00 0.00 N ATOM 721 CA ASP A 53 -16.299 -1.732 10.198 1.00 0.00 C ATOM 722 C ASP A 53 -16.512 -1.685 8.676 1.00 0.00 C ATOM 723 O ASP A 53 -16.750 -2.709 8.068 1.00 0.00 O ATOM 724 CB ASP A 53 -17.559 -1.231 10.914 1.00 0.00 C ATOM 725 CG ASP A 53 -18.695 -2.234 10.707 1.00 0.00 C ATOM 726 OD1 ASP A 53 -18.695 -2.896 9.682 1.00 0.00 O ATOM 727 OD2 ASP A 53 -19.546 -2.322 11.577 1.00 0.00 O ATOM 0 H ASP A 53 -15.354 0.025 10.956 1.00 0.00 H new ATOM 0 HA ASP A 53 -16.103 -2.764 10.489 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -17.360 -1.105 11.978 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -17.847 -0.254 10.526 1.00 0.00 H new ATOM 732 N PRO A 54 -16.435 -0.507 8.093 1.00 0.00 N ATOM 733 CA PRO A 54 -16.637 -0.350 6.640 1.00 0.00 C ATOM 734 C PRO A 54 -15.526 -1.062 5.862 1.00 0.00 C ATOM 735 O PRO A 54 -15.626 -1.262 4.668 1.00 0.00 O ATOM 736 CB PRO A 54 -16.578 1.163 6.393 1.00 0.00 C ATOM 737 CG PRO A 54 -16.273 1.850 7.747 1.00 0.00 C ATOM 738 CD PRO A 54 -16.146 0.750 8.812 1.00 0.00 C ATOM 0 HA PRO A 54 -17.580 -0.785 6.309 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -15.806 1.401 5.661 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -17.524 1.521 5.987 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -15.351 2.428 7.683 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -17.069 2.547 8.010 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -15.147 0.735 9.248 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -16.849 0.908 9.630 1.00 0.00 H new ATOM 746 N ILE A 55 -14.466 -1.442 6.522 1.00 0.00 N ATOM 747 CA ILE A 55 -13.356 -2.134 5.804 1.00 0.00 C ATOM 748 C ILE A 55 -13.423 -3.636 6.086 1.00 0.00 C ATOM 749 O ILE A 55 -13.467 -4.445 5.181 1.00 0.00 O ATOM 750 CB ILE A 55 -11.988 -1.593 6.262 1.00 0.00 C ATOM 751 CG1 ILE A 55 -12.160 -0.543 7.368 1.00 0.00 C ATOM 752 CG2 ILE A 55 -11.276 -0.951 5.071 1.00 0.00 C ATOM 753 CD1 ILE A 55 -12.900 0.675 6.811 1.00 0.00 C ATOM 0 H ILE A 55 -14.320 -1.305 7.522 1.00 0.00 H new ATOM 0 HA ILE A 55 -13.467 -1.949 4.736 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.399 -2.423 6.654 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.716 -0.968 8.203 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.185 -0.244 7.754 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.307 -0.567 5.390 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -11.131 -1.696 4.289 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.882 -0.132 4.683 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -13.021 1.419 7.599 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -12.326 1.105 5.990 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -13.881 0.370 6.447 1.00 0.00 H new ATOM 765 N ARG A 56 -13.432 -4.016 7.333 1.00 0.00 N ATOM 766 CA ARG A 56 -13.497 -5.467 7.666 1.00 0.00 C ATOM 767 C ARG A 56 -14.647 -6.114 6.895 1.00 0.00 C ATOM 768 O ARG A 56 -14.665 -7.308 6.673 1.00 0.00 O ATOM 769 CB ARG A 56 -13.733 -5.635 9.168 1.00 0.00 C ATOM 770 CG ARG A 56 -15.099 -5.053 9.535 1.00 0.00 C ATOM 771 CD ARG A 56 -15.924 -6.102 10.279 1.00 0.00 C ATOM 772 NE ARG A 56 -16.570 -5.478 11.477 1.00 0.00 N ATOM 773 CZ ARG A 56 -15.879 -4.756 12.320 1.00 0.00 C ATOM 774 NH1 ARG A 56 -14.575 -4.716 12.254 1.00 0.00 N ATOM 775 NH2 ARG A 56 -16.495 -4.117 13.278 1.00 0.00 N ATOM 0 H ARG A 56 -13.397 -3.386 8.135 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.558 -5.946 7.390 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -13.690 -6.690 9.438 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -12.947 -5.130 9.730 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -14.972 -4.168 10.158 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -15.624 -4.736 8.634 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -16.685 -6.516 9.618 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -15.285 -6.929 10.588 1.00 0.00 H new ATOM 0 HE ARG A 56 -17.567 -5.619 11.638 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -14.084 -5.252 11.539 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.048 -4.149 12.918 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -17.509 -4.183 13.365 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -15.962 -3.552 13.939 1.00 0.00 H new ATOM 789 N ALA A 57 -15.611 -5.335 6.487 1.00 0.00 N ATOM 790 CA ALA A 57 -16.763 -5.906 5.735 1.00 0.00 C ATOM 791 C ALA A 57 -16.772 -5.352 4.309 1.00 0.00 C ATOM 792 O ALA A 57 -16.910 -4.163 4.103 1.00 0.00 O ATOM 793 CB ALA A 57 -18.065 -5.522 6.436 1.00 0.00 C ATOM 0 H ALA A 57 -15.650 -4.328 6.642 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.671 -6.992 5.701 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.910 -5.939 5.888 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.061 -5.917 7.452 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.154 -4.436 6.469 1.00 0.00 H new ATOM 799 N SER A 58 -16.630 -6.210 3.329 1.00 0.00 N ATOM 800 CA SER A 58 -16.632 -5.753 1.905 1.00 0.00 C ATOM 801 C SER A 58 -15.231 -5.274 1.511 1.00 0.00 C ATOM 802 O SER A 58 -14.674 -5.711 0.524 1.00 0.00 O ATOM 803 CB SER A 58 -17.629 -4.608 1.725 1.00 0.00 C ATOM 804 OG SER A 58 -18.799 -4.880 2.487 1.00 0.00 O ATOM 0 H SER A 58 -16.512 -7.215 3.456 1.00 0.00 H new ATOM 0 HA SER A 58 -16.923 -6.588 1.268 1.00 0.00 H new ATOM 0 HB2 SER A 58 -17.182 -3.667 2.047 1.00 0.00 H new ATOM 0 HB3 SER A 58 -17.885 -4.496 0.671 1.00 0.00 H new ATOM 0 HG SER A 58 -18.764 -4.380 3.329 1.00 0.00 H new ATOM 810 N GLY A 59 -14.657 -4.378 2.268 1.00 0.00 N ATOM 811 CA GLY A 59 -13.297 -3.878 1.923 1.00 0.00 C ATOM 812 C GLY A 59 -13.421 -2.725 0.927 1.00 0.00 C ATOM 813 O GLY A 59 -14.355 -1.950 0.973 1.00 0.00 O ATOM 0 H GLY A 59 -15.070 -3.972 3.108 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.781 -3.543 2.823 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.699 -4.682 1.494 1.00 0.00 H new ATOM 817 N PHE A 60 -12.487 -2.607 0.023 1.00 0.00 N ATOM 818 CA PHE A 60 -12.554 -1.505 -0.975 1.00 0.00 C ATOM 819 C PHE A 60 -11.956 -1.989 -2.298 1.00 0.00 C ATOM 820 O PHE A 60 -11.636 -3.150 -2.454 1.00 0.00 O ATOM 821 CB PHE A 60 -11.764 -0.302 -0.460 1.00 0.00 C ATOM 822 CG PHE A 60 -10.314 -0.685 -0.297 1.00 0.00 C ATOM 823 CD1 PHE A 60 -9.942 -1.608 0.686 1.00 0.00 C ATOM 824 CD2 PHE A 60 -9.344 -0.114 -1.128 1.00 0.00 C ATOM 825 CE1 PHE A 60 -8.596 -1.962 0.838 1.00 0.00 C ATOM 826 CE2 PHE A 60 -7.999 -0.469 -0.977 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.624 -1.392 0.007 1.00 0.00 C ATOM 0 H PHE A 60 -11.681 -3.226 -0.067 1.00 0.00 H new ATOM 0 HA PHE A 60 -13.592 -1.211 -1.131 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -11.855 0.531 -1.157 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -12.172 0.033 0.493 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.692 -2.047 1.327 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -9.633 0.600 -1.885 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -8.307 -2.675 1.596 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -7.250 -0.031 -1.620 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.585 -1.664 0.125 1.00 0.00 H new ATOM 837 N ASP A 61 -11.805 -1.114 -3.252 1.00 0.00 N ATOM 838 CA ASP A 61 -11.229 -1.540 -4.558 1.00 0.00 C ATOM 839 C ASP A 61 -10.264 -0.473 -5.078 1.00 0.00 C ATOM 840 O ASP A 61 -10.249 0.648 -4.610 1.00 0.00 O ATOM 841 CB ASP A 61 -12.360 -1.745 -5.570 1.00 0.00 C ATOM 842 CG ASP A 61 -13.457 -2.608 -4.943 1.00 0.00 C ATOM 843 OD1 ASP A 61 -14.077 -2.151 -3.998 1.00 0.00 O ATOM 844 OD2 ASP A 61 -13.660 -3.713 -5.421 1.00 0.00 O ATOM 0 H ASP A 61 -12.054 -0.127 -3.185 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.685 -2.475 -4.422 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.770 -0.782 -5.873 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -11.975 -2.225 -6.470 1.00 0.00 H new ATOM 849 N LEU A 62 -9.459 -0.817 -6.048 1.00 0.00 N ATOM 850 CA LEU A 62 -8.494 0.172 -6.606 1.00 0.00 C ATOM 851 C LEU A 62 -8.486 0.064 -8.130 1.00 0.00 C ATOM 852 O LEU A 62 -7.702 -0.668 -8.703 1.00 0.00 O ATOM 853 CB LEU A 62 -7.091 -0.121 -6.069 1.00 0.00 C ATOM 854 CG LEU A 62 -7.020 0.257 -4.590 1.00 0.00 C ATOM 855 CD1 LEU A 62 -7.063 -1.013 -3.738 1.00 0.00 C ATOM 856 CD2 LEU A 62 -5.715 1.010 -4.320 1.00 0.00 C ATOM 0 H LEU A 62 -9.429 -1.742 -6.478 1.00 0.00 H new ATOM 0 HA LEU A 62 -8.792 1.178 -6.310 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -6.855 -1.177 -6.197 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.349 0.442 -6.635 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.867 0.894 -4.335 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.012 -0.745 -2.683 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.992 -1.550 -3.932 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.216 -1.650 -3.992 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.663 1.281 -3.265 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -4.868 0.373 -4.574 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.684 1.914 -4.928 1.00 0.00 H new ATOM 868 N ALA A 63 -9.354 0.788 -8.788 1.00 0.00 N ATOM 869 CA ALA A 63 -9.413 0.742 -10.280 1.00 0.00 C ATOM 870 C ALA A 63 -10.234 -0.471 -10.735 1.00 0.00 C ATOM 871 O ALA A 63 -11.046 -0.376 -11.634 1.00 0.00 O ATOM 872 CB ALA A 63 -7.997 0.647 -10.849 1.00 0.00 C ATOM 0 H ALA A 63 -10.030 1.415 -8.352 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.889 1.652 -10.645 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.044 0.614 -11.937 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.420 1.518 -10.537 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.516 -0.258 -10.479 1.00 0.00 H new ATOM 878 N GLY A 64 -10.034 -1.609 -10.125 1.00 0.00 N ATOM 879 CA GLY A 64 -10.807 -2.819 -10.528 1.00 0.00 C ATOM 880 C GLY A 64 -10.315 -4.030 -9.730 1.00 0.00 C ATOM 881 O GLY A 64 -10.265 -5.136 -10.231 1.00 0.00 O ATOM 0 H GLY A 64 -9.369 -1.753 -9.365 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -11.870 -2.660 -10.349 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -10.687 -3.001 -11.596 1.00 0.00 H new ATOM 885 N VAL A 65 -9.953 -3.830 -8.493 1.00 0.00 N ATOM 886 CA VAL A 65 -9.465 -4.967 -7.663 1.00 0.00 C ATOM 887 C VAL A 65 -10.277 -5.037 -6.366 1.00 0.00 C ATOM 888 O VAL A 65 -10.187 -4.169 -5.523 1.00 0.00 O ATOM 889 CB VAL A 65 -7.988 -4.750 -7.329 1.00 0.00 C ATOM 890 CG1 VAL A 65 -7.519 -5.830 -6.353 1.00 0.00 C ATOM 891 CG2 VAL A 65 -7.160 -4.829 -8.614 1.00 0.00 C ATOM 0 H VAL A 65 -9.974 -2.926 -8.020 1.00 0.00 H new ATOM 0 HA VAL A 65 -9.582 -5.900 -8.214 1.00 0.00 H new ATOM 0 HB VAL A 65 -7.859 -3.769 -6.871 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.467 -5.674 -6.116 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.109 -5.775 -5.438 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.647 -6.812 -6.808 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -6.107 -4.675 -8.378 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -7.290 -5.810 -9.071 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.493 -4.058 -9.309 1.00 0.00 H new ATOM 901 N HIS A 66 -11.077 -6.056 -6.204 1.00 0.00 N ATOM 902 CA HIS A 66 -11.901 -6.165 -4.962 1.00 0.00 C ATOM 903 C HIS A 66 -11.128 -6.906 -3.865 1.00 0.00 C ATOM 904 O HIS A 66 -11.258 -8.102 -3.699 1.00 0.00 O ATOM 905 CB HIS A 66 -13.197 -6.922 -5.268 1.00 0.00 C ATOM 906 CG HIS A 66 -12.905 -8.135 -6.112 1.00 0.00 C ATOM 907 ND1 HIS A 66 -11.650 -8.724 -6.173 1.00 0.00 N ATOM 908 CD2 HIS A 66 -13.709 -8.887 -6.932 1.00 0.00 C ATOM 909 CE1 HIS A 66 -11.737 -9.780 -7.004 1.00 0.00 C ATOM 910 NE2 HIS A 66 -12.970 -9.925 -7.493 1.00 0.00 N ATOM 0 H HIS A 66 -11.197 -6.816 -6.874 1.00 0.00 H new ATOM 0 HA HIS A 66 -12.134 -5.159 -4.612 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -13.678 -7.225 -4.338 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -13.895 -6.267 -5.789 1.00 0.00 H new ATOM 0 HD1 HIS A 66 -10.814 -8.414 -5.678 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -14.757 -8.701 -7.115 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -10.909 -10.431 -7.245 1.00 0.00 H new ATOM 918 N TYR A 67 -10.337 -6.202 -3.103 1.00 0.00 N ATOM 919 CA TYR A 67 -9.570 -6.866 -2.008 1.00 0.00 C ATOM 920 C TYR A 67 -10.306 -6.665 -0.682 1.00 0.00 C ATOM 921 O TYR A 67 -11.157 -5.807 -0.557 1.00 0.00 O ATOM 922 CB TYR A 67 -8.173 -6.246 -1.910 1.00 0.00 C ATOM 923 CG TYR A 67 -7.275 -6.793 -3.004 1.00 0.00 C ATOM 924 CD1 TYR A 67 -7.775 -7.691 -3.958 1.00 0.00 C ATOM 925 CD2 TYR A 67 -5.933 -6.394 -3.060 1.00 0.00 C ATOM 926 CE1 TYR A 67 -6.935 -8.187 -4.963 1.00 0.00 C ATOM 927 CE2 TYR A 67 -5.094 -6.892 -4.065 1.00 0.00 C ATOM 928 CZ TYR A 67 -5.595 -7.788 -5.016 1.00 0.00 C ATOM 929 OH TYR A 67 -4.766 -8.277 -6.006 1.00 0.00 O ATOM 0 H TYR A 67 -10.188 -5.197 -3.190 1.00 0.00 H new ATOM 0 HA TYR A 67 -9.480 -7.931 -2.222 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -8.242 -5.162 -1.996 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -7.740 -6.462 -0.933 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -8.809 -8.000 -3.918 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -5.545 -5.702 -2.327 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -7.322 -8.878 -5.697 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.060 -6.584 -4.106 1.00 0.00 H new ATOM 0 HH TYR A 67 -3.869 -7.898 -5.898 1.00 0.00 H new ATOM 939 N VAL A 68 -9.985 -7.449 0.312 1.00 0.00 N ATOM 940 CA VAL A 68 -10.667 -7.302 1.629 1.00 0.00 C ATOM 941 C VAL A 68 -9.703 -6.677 2.638 1.00 0.00 C ATOM 942 O VAL A 68 -8.533 -6.492 2.364 1.00 0.00 O ATOM 943 CB VAL A 68 -11.112 -8.679 2.131 1.00 0.00 C ATOM 944 CG1 VAL A 68 -9.895 -9.467 2.621 1.00 0.00 C ATOM 945 CG2 VAL A 68 -12.102 -8.505 3.286 1.00 0.00 C ATOM 0 H VAL A 68 -9.280 -8.185 0.268 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.539 -6.658 1.515 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.591 -9.222 1.316 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.215 -10.446 2.977 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.188 -9.593 1.801 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.414 -8.924 3.434 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -12.419 -9.484 3.644 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.621 -7.960 4.098 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -12.971 -7.946 2.939 1.00 0.00 H new ATOM 955 N THR A 69 -10.184 -6.354 3.807 1.00 0.00 N ATOM 956 CA THR A 69 -9.296 -5.743 4.836 1.00 0.00 C ATOM 957 C THR A 69 -9.408 -6.536 6.140 1.00 0.00 C ATOM 958 O THR A 69 -10.416 -6.495 6.817 1.00 0.00 O ATOM 959 CB THR A 69 -9.722 -4.294 5.082 1.00 0.00 C ATOM 960 OG1 THR A 69 -9.480 -3.526 3.910 1.00 0.00 O ATOM 961 CG2 THR A 69 -8.920 -3.714 6.248 1.00 0.00 C ATOM 0 H THR A 69 -11.154 -6.487 4.094 1.00 0.00 H new ATOM 0 HA THR A 69 -8.264 -5.763 4.485 1.00 0.00 H new ATOM 0 HB THR A 69 -10.784 -4.264 5.325 1.00 0.00 H new ATOM 0 HG1 THR A 69 -8.869 -4.014 3.319 1.00 0.00 H new ATOM 0 HG21 THR A 69 -9.225 -2.682 6.422 1.00 0.00 H new ATOM 0 HG22 THR A 69 -9.106 -4.303 7.146 1.00 0.00 H new ATOM 0 HG23 THR A 69 -7.857 -3.743 6.008 1.00 0.00 H new ATOM 969 N LEU A 70 -8.381 -7.258 6.496 1.00 0.00 N ATOM 970 CA LEU A 70 -8.432 -8.051 7.757 1.00 0.00 C ATOM 971 C LEU A 70 -7.407 -7.501 8.751 1.00 0.00 C ATOM 972 O LEU A 70 -7.232 -8.028 9.831 1.00 0.00 O ATOM 973 CB LEU A 70 -8.109 -9.516 7.455 1.00 0.00 C ATOM 974 CG LEU A 70 -9.194 -10.411 8.054 1.00 0.00 C ATOM 975 CD1 LEU A 70 -10.310 -10.617 7.029 1.00 0.00 C ATOM 976 CD2 LEU A 70 -8.587 -11.767 8.426 1.00 0.00 C ATOM 0 H LEU A 70 -7.511 -7.333 5.970 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.431 -7.979 8.187 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -8.048 -9.671 6.378 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.136 -9.778 7.870 1.00 0.00 H new ATOM 0 HG LEU A 70 -9.604 -9.938 8.946 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -11.083 -11.255 7.456 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -10.742 -9.652 6.763 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.901 -11.091 6.136 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.359 -12.406 8.853 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.178 -12.240 7.533 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.791 -11.621 9.157 1.00 0.00 H new ATOM 988 N ARG A 71 -6.729 -6.445 8.397 1.00 0.00 N ATOM 989 CA ARG A 71 -5.719 -5.865 9.325 1.00 0.00 C ATOM 990 C ARG A 71 -5.877 -4.345 9.359 1.00 0.00 C ATOM 991 O ARG A 71 -5.260 -3.628 8.596 1.00 0.00 O ATOM 992 CB ARG A 71 -4.314 -6.221 8.837 1.00 0.00 C ATOM 993 CG ARG A 71 -3.550 -6.931 9.956 1.00 0.00 C ATOM 994 CD ARG A 71 -2.115 -7.198 9.503 1.00 0.00 C ATOM 995 NE ARG A 71 -1.617 -8.452 10.136 1.00 0.00 N ATOM 996 CZ ARG A 71 -0.548 -9.039 9.671 1.00 0.00 C ATOM 997 NH1 ARG A 71 0.080 -8.538 8.642 1.00 0.00 N ATOM 998 NH2 ARG A 71 -0.108 -10.132 10.233 1.00 0.00 N ATOM 0 H ARG A 71 -6.831 -5.959 7.506 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.868 -6.270 10.326 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.375 -6.864 7.959 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -3.783 -5.318 8.535 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -3.550 -6.318 10.857 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.043 -7.869 10.209 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.076 -7.286 8.417 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.474 -6.360 9.778 1.00 0.00 H new ATOM 0 HE ARG A 71 -2.112 -8.852 10.933 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -0.265 -7.686 8.200 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.915 -8.999 8.280 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -0.600 -10.527 11.035 1.00 0.00 H new ATOM 0 HH22 ARG A 71 0.727 -10.591 9.870 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.703 -3.847 10.237 1.00 0.00 N ATOM 1013 CA ALA A 72 -6.902 -2.375 10.318 1.00 0.00 C ATOM 1014 C ALA A 72 -7.211 -1.981 11.764 1.00 0.00 C ATOM 1015 O ALA A 72 -8.256 -2.300 12.295 1.00 0.00 O ATOM 1016 CB ALA A 72 -8.072 -1.969 9.418 1.00 0.00 C ATOM 0 H ALA A 72 -7.248 -4.397 10.901 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.996 -1.867 9.989 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.219 -0.891 9.477 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.853 -2.250 8.388 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.978 -2.477 9.748 1.00 0.00 H new ATOM 1022 N ASP A 73 -6.308 -1.290 12.406 1.00 0.00 N ATOM 1023 CA ASP A 73 -6.548 -0.875 13.816 1.00 0.00 C ATOM 1024 C ASP A 73 -5.663 0.329 14.147 1.00 0.00 C ATOM 1025 O ASP A 73 -6.108 1.295 14.732 1.00 0.00 O ATOM 1026 CB ASP A 73 -6.205 -2.029 14.760 1.00 0.00 C ATOM 1027 CG ASP A 73 -7.488 -2.747 15.182 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -8.519 -2.096 15.231 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -7.418 -3.936 15.447 1.00 0.00 O ATOM 0 H ASP A 73 -5.414 -0.995 12.014 1.00 0.00 H new ATOM 0 HA ASP A 73 -7.597 -0.607 13.940 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -5.531 -2.728 14.265 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -5.683 -1.650 15.639 1.00 0.00 H new ATOM 1034 N ASP A 74 -4.411 0.277 13.777 1.00 0.00 N ATOM 1035 CA ASP A 74 -3.501 1.419 14.073 1.00 0.00 C ATOM 1036 C ASP A 74 -3.731 2.533 13.046 1.00 0.00 C ATOM 1037 O ASP A 74 -4.608 3.358 13.203 1.00 0.00 O ATOM 1038 CB ASP A 74 -2.047 0.947 14.005 1.00 0.00 C ATOM 1039 CG ASP A 74 -1.777 -0.047 15.136 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -2.699 -0.330 15.884 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -0.652 -0.509 15.236 1.00 0.00 O ATOM 0 H ASP A 74 -3.981 -0.505 13.284 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.708 1.800 15.073 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.851 0.478 13.041 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.373 1.800 14.088 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.954 2.565 11.998 1.00 0.00 N ATOM 1047 CA ARG A 75 -3.138 3.627 10.969 1.00 0.00 C ATOM 1048 C ARG A 75 -2.713 3.099 9.598 1.00 0.00 C ATOM 1049 O ARG A 75 -2.404 3.855 8.699 1.00 0.00 O ATOM 1050 CB ARG A 75 -2.287 4.845 11.332 1.00 0.00 C ATOM 1051 CG ARG A 75 -0.816 4.435 11.406 1.00 0.00 C ATOM 1052 CD ARG A 75 -0.166 5.082 12.626 1.00 0.00 C ATOM 1053 NE ARG A 75 1.125 5.725 12.223 1.00 0.00 N ATOM 1054 CZ ARG A 75 2.018 5.074 11.520 1.00 0.00 C ATOM 1055 NH1 ARG A 75 1.892 3.789 11.306 1.00 0.00 N ATOM 1056 NH2 ARG A 75 3.072 5.702 11.073 1.00 0.00 N ATOM 0 H ARG A 75 -2.201 1.903 11.810 1.00 0.00 H new ATOM 0 HA ARG A 75 -4.189 3.914 10.935 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -2.420 5.630 10.587 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -2.610 5.255 12.289 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -0.733 3.350 11.469 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -0.296 4.742 10.498 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.836 5.826 13.056 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.014 4.332 13.396 1.00 0.00 H new ATOM 0 HE ARG A 75 1.312 6.688 12.501 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.092 3.284 11.688 1.00 0.00 H new ATOM 0 HH12 ARG A 75 2.594 3.292 10.757 1.00 0.00 H new ATOM 0 HH21 ARG A 75 3.197 6.695 11.272 1.00 0.00 H new ATOM 0 HH22 ARG A 75 3.771 5.200 10.525 1.00 0.00 H new ATOM 1070 N SER A 76 -2.693 1.805 9.427 1.00 0.00 N ATOM 1071 CA SER A 76 -2.286 1.238 8.111 1.00 0.00 C ATOM 1072 C SER A 76 -3.293 0.169 7.682 1.00 0.00 C ATOM 1073 O SER A 76 -4.143 -0.241 8.448 1.00 0.00 O ATOM 1074 CB SER A 76 -0.898 0.610 8.230 1.00 0.00 C ATOM 1075 OG SER A 76 -0.573 -0.047 7.012 1.00 0.00 O ATOM 0 H SER A 76 -2.940 1.118 10.140 1.00 0.00 H new ATOM 0 HA SER A 76 -2.261 2.034 7.367 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.157 1.378 8.451 1.00 0.00 H new ATOM 0 HB3 SER A 76 -0.877 -0.100 9.056 1.00 0.00 H new ATOM 0 HG SER A 76 -0.414 -0.998 7.186 1.00 0.00 H new ATOM 1081 N ILE A 77 -3.205 -0.283 6.463 1.00 0.00 N ATOM 1082 CA ILE A 77 -4.155 -1.325 5.982 1.00 0.00 C ATOM 1083 C ILE A 77 -3.464 -2.199 4.933 1.00 0.00 C ATOM 1084 O ILE A 77 -3.437 -1.875 3.762 1.00 0.00 O ATOM 1085 CB ILE A 77 -5.384 -0.646 5.368 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -6.287 -0.130 6.490 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -6.164 -1.648 4.510 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -7.515 0.550 5.886 1.00 0.00 C ATOM 0 H ILE A 77 -2.515 0.024 5.777 1.00 0.00 H new ATOM 0 HA ILE A 77 -4.469 -1.950 6.818 1.00 0.00 H new ATOM 0 HB ILE A 77 -5.059 0.184 4.741 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -6.595 -0.955 7.132 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -5.740 0.574 7.116 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -7.036 -1.156 4.078 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.523 -2.019 3.710 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -6.489 -2.483 5.131 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -8.158 0.917 6.686 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -7.198 1.386 5.262 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -8.066 -0.168 5.278 1.00 0.00 H new ATOM 1100 N TYR A 78 -2.917 -3.312 5.341 1.00 0.00 N ATOM 1101 CA TYR A 78 -2.241 -4.210 4.363 1.00 0.00 C ATOM 1102 C TYR A 78 -3.273 -5.191 3.811 1.00 0.00 C ATOM 1103 O TYR A 78 -3.431 -6.291 4.304 1.00 0.00 O ATOM 1104 CB TYR A 78 -1.117 -4.979 5.061 1.00 0.00 C ATOM 1105 CG TYR A 78 -0.412 -4.069 6.039 1.00 0.00 C ATOM 1106 CD1 TYR A 78 -0.888 -3.953 7.351 1.00 0.00 C ATOM 1107 CD2 TYR A 78 0.718 -3.344 5.636 1.00 0.00 C ATOM 1108 CE1 TYR A 78 -0.235 -3.112 8.260 1.00 0.00 C ATOM 1109 CE2 TYR A 78 1.369 -2.503 6.547 1.00 0.00 C ATOM 1110 CZ TYR A 78 0.893 -2.387 7.857 1.00 0.00 C ATOM 1111 OH TYR A 78 1.537 -1.560 8.754 1.00 0.00 O ATOM 0 H TYR A 78 -2.909 -3.637 6.308 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.813 -3.623 3.550 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -1.525 -5.845 5.583 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -0.408 -5.356 4.324 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.758 -4.512 7.661 1.00 0.00 H new ATOM 0 HD2 TYR A 78 1.086 -3.434 4.625 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.601 -3.022 9.272 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.239 -1.943 6.238 1.00 0.00 H new ATOM 0 HH TYR A 78 2.301 -1.132 8.314 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.992 -4.788 2.801 1.00 0.00 N ATOM 1122 CA GLY A 79 -5.037 -5.675 2.216 1.00 0.00 C ATOM 1123 C GLY A 79 -4.457 -7.055 1.902 1.00 0.00 C ATOM 1124 O GLY A 79 -3.264 -7.222 1.736 1.00 0.00 O ATOM 0 H GLY A 79 -3.900 -3.876 2.353 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.869 -5.774 2.913 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.435 -5.226 1.306 1.00 0.00 H new ATOM 1128 N LYS A 80 -5.306 -8.043 1.809 1.00 0.00 N ATOM 1129 CA LYS A 80 -4.835 -9.421 1.494 1.00 0.00 C ATOM 1130 C LYS A 80 -5.819 -10.068 0.517 1.00 0.00 C ATOM 1131 O LYS A 80 -6.736 -9.432 0.039 1.00 0.00 O ATOM 1132 CB LYS A 80 -4.770 -10.251 2.779 1.00 0.00 C ATOM 1133 CG LYS A 80 -3.721 -11.354 2.625 1.00 0.00 C ATOM 1134 CD LYS A 80 -2.592 -11.125 3.630 1.00 0.00 C ATOM 1135 CE LYS A 80 -1.795 -9.884 3.224 1.00 0.00 C ATOM 1136 NZ LYS A 80 -1.238 -9.230 4.442 1.00 0.00 N ATOM 0 H LYS A 80 -6.314 -7.953 1.939 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.842 -9.378 1.047 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -4.518 -9.611 3.625 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -5.745 -10.690 2.990 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -4.177 -12.330 2.790 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -3.324 -11.355 1.610 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -3.002 -10.996 4.632 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.938 -11.996 3.664 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.988 -10.163 2.547 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.437 -9.187 2.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -0.696 -8.386 4.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.016 -8.951 5.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -0.612 -9.896 4.938 1.00 0.00 H new ATOM 1150 N LYS A 81 -5.642 -11.325 0.217 1.00 0.00 N ATOM 1151 CA LYS A 81 -6.580 -11.998 -0.730 1.00 0.00 C ATOM 1152 C LYS A 81 -6.225 -13.482 -0.857 1.00 0.00 C ATOM 1153 O LYS A 81 -7.075 -14.316 -1.099 1.00 0.00 O ATOM 1154 CB LYS A 81 -6.476 -11.331 -2.103 1.00 0.00 C ATOM 1155 CG LYS A 81 -7.880 -11.034 -2.635 1.00 0.00 C ATOM 1156 CD LYS A 81 -8.581 -12.347 -2.994 1.00 0.00 C ATOM 1157 CE LYS A 81 -7.823 -13.042 -4.126 1.00 0.00 C ATOM 1158 NZ LYS A 81 -8.543 -14.289 -4.514 1.00 0.00 N ATOM 0 H LYS A 81 -4.894 -11.914 0.583 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.598 -11.907 -0.350 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.901 -10.408 -2.028 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -5.943 -11.982 -2.796 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -8.458 -10.495 -1.884 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.819 -10.391 -3.513 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.626 -12.997 -2.120 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -9.609 -12.150 -3.298 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.739 -12.376 -4.985 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.808 -13.280 -3.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -8.028 -14.762 -5.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -8.601 -14.926 -3.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -9.503 -14.050 -4.835 1.00 0.00 H new ATOM 1172 N GLY A 82 -4.973 -13.818 -0.709 1.00 0.00 N ATOM 1173 CA GLY A 82 -4.557 -15.243 -0.833 1.00 0.00 C ATOM 1174 C GLY A 82 -3.332 -15.307 -1.739 1.00 0.00 C ATOM 1175 O GLY A 82 -3.444 -15.360 -2.948 1.00 0.00 O ATOM 0 H GLY A 82 -4.217 -13.164 -0.507 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.326 -15.658 0.148 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -5.368 -15.841 -1.249 1.00 0.00 H new ATOM 1179 N SER A 83 -2.162 -15.269 -1.170 1.00 0.00 N ATOM 1180 CA SER A 83 -0.936 -15.290 -2.010 1.00 0.00 C ATOM 1181 C SER A 83 -0.778 -13.916 -2.667 1.00 0.00 C ATOM 1182 O SER A 83 0.102 -13.698 -3.475 1.00 0.00 O ATOM 1183 CB SER A 83 -1.068 -16.366 -3.088 1.00 0.00 C ATOM 1184 OG SER A 83 -2.011 -17.343 -2.668 1.00 0.00 O ATOM 0 H SER A 83 -2.002 -15.224 -0.164 1.00 0.00 H new ATOM 0 HA SER A 83 -0.064 -15.514 -1.396 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.388 -15.917 -4.028 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.101 -16.834 -3.271 1.00 0.00 H new ATOM 0 HG SER A 83 -2.912 -17.063 -2.933 1.00 0.00 H new ATOM 1190 N ALA A 84 -1.634 -12.987 -2.320 1.00 0.00 N ATOM 1191 CA ALA A 84 -1.549 -11.623 -2.910 1.00 0.00 C ATOM 1192 C ALA A 84 -2.061 -10.603 -1.889 1.00 0.00 C ATOM 1193 O ALA A 84 -2.930 -10.895 -1.086 1.00 0.00 O ATOM 1194 CB ALA A 84 -2.415 -11.556 -4.171 1.00 0.00 C ATOM 0 H ALA A 84 -2.391 -13.119 -1.649 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.514 -11.400 -3.169 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.352 -10.557 -4.603 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.059 -12.288 -4.896 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.451 -11.776 -3.913 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.531 -9.410 -1.909 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.986 -8.374 -0.940 1.00 0.00 C ATOM 1202 C GLY A 85 -1.428 -7.009 -1.349 1.00 0.00 C ATOM 1203 O GLY A 85 -0.648 -6.899 -2.273 1.00 0.00 O ATOM 0 H GLY A 85 -0.802 -9.108 -2.555 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.075 -8.340 -0.913 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.650 -8.629 0.065 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.822 -5.967 -0.668 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.315 -4.610 -1.018 1.00 0.00 C ATOM 1209 C VAL A 86 -0.866 -3.892 0.257 1.00 0.00 C ATOM 1210 O VAL A 86 -1.514 -3.963 1.283 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.429 -3.807 -1.691 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.650 -3.750 -0.771 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -1.932 -2.386 -1.968 1.00 0.00 C ATOM 0 H VAL A 86 -2.474 -5.997 0.116 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.471 -4.701 -1.702 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.707 -4.287 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.442 -3.177 -1.253 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.003 -4.762 -0.572 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.376 -3.270 0.169 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.724 -1.811 -2.448 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.654 -1.908 -1.029 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.063 -2.426 -2.625 1.00 0.00 H new ATOM 1223 N ILE A 87 0.246 -3.208 0.203 1.00 0.00 N ATOM 1224 CA ILE A 87 0.747 -2.493 1.410 1.00 0.00 C ATOM 1225 C ILE A 87 0.369 -1.011 1.336 1.00 0.00 C ATOM 1226 O ILE A 87 1.171 -0.174 0.971 1.00 0.00 O ATOM 1227 CB ILE A 87 2.269 -2.625 1.471 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.664 -4.071 1.166 1.00 0.00 C ATOM 1229 CG2 ILE A 87 2.762 -2.248 2.869 1.00 0.00 C ATOM 1230 CD1 ILE A 87 2.089 -4.997 2.240 1.00 0.00 C ATOM 0 H ILE A 87 0.830 -3.114 -0.628 1.00 0.00 H new ATOM 0 HA ILE A 87 0.298 -2.930 2.302 1.00 0.00 H new ATOM 0 HB ILE A 87 2.721 -1.958 0.737 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.291 -4.361 0.184 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.750 -4.163 1.135 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.847 -2.343 2.910 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.479 -1.219 3.089 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.312 -2.913 3.605 1.00 0.00 H new ATOM 0 HD11 ILE A 87 2.371 -6.027 2.021 1.00 0.00 H new ATOM 0 HD12 ILE A 87 2.483 -4.712 3.215 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.002 -4.913 2.249 1.00 0.00 H new ATOM 1242 N THR A 88 -0.841 -0.676 1.691 1.00 0.00 N ATOM 1243 CA THR A 88 -1.258 0.753 1.651 1.00 0.00 C ATOM 1244 C THR A 88 -1.109 1.355 3.050 1.00 0.00 C ATOM 1245 O THR A 88 -1.867 1.051 3.950 1.00 0.00 O ATOM 1246 CB THR A 88 -2.719 0.856 1.203 1.00 0.00 C ATOM 1247 OG1 THR A 88 -3.573 0.546 2.296 1.00 0.00 O ATOM 1248 CG2 THR A 88 -2.977 -0.124 0.057 1.00 0.00 C ATOM 0 H THR A 88 -1.558 -1.330 2.007 1.00 0.00 H new ATOM 0 HA THR A 88 -0.630 1.296 0.945 1.00 0.00 H new ATOM 0 HB THR A 88 -2.921 1.871 0.861 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.048 0.137 3.015 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.017 -0.048 -0.259 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.324 0.117 -0.782 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.774 -1.140 0.395 1.00 0.00 H new ATOM 1256 N VAL A 89 -0.134 2.200 3.244 1.00 0.00 N ATOM 1257 CA VAL A 89 0.062 2.810 4.591 1.00 0.00 C ATOM 1258 C VAL A 89 0.139 4.332 4.464 1.00 0.00 C ATOM 1259 O VAL A 89 0.742 4.861 3.549 1.00 0.00 O ATOM 1260 CB VAL A 89 1.364 2.287 5.202 1.00 0.00 C ATOM 1261 CG1 VAL A 89 1.562 2.907 6.588 1.00 0.00 C ATOM 1262 CG2 VAL A 89 1.291 0.764 5.331 1.00 0.00 C ATOM 0 H VAL A 89 0.534 2.494 2.531 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.778 2.543 5.232 1.00 0.00 H new ATOM 0 HB VAL A 89 2.202 2.558 4.559 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.489 2.535 7.024 1.00 0.00 H new ATOM 0 HG12 VAL A 89 1.613 3.992 6.497 1.00 0.00 H new ATOM 0 HG13 VAL A 89 0.725 2.636 7.231 1.00 0.00 H new ATOM 0 HG21 VAL A 89 2.218 0.391 5.766 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.454 0.493 5.974 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.149 0.322 4.345 1.00 0.00 H new ATOM 1272 N LYS A 90 -0.462 5.042 5.380 1.00 0.00 N ATOM 1273 CA LYS A 90 -0.420 6.529 5.320 1.00 0.00 C ATOM 1274 C LYS A 90 0.691 7.039 6.240 1.00 0.00 C ATOM 1275 O LYS A 90 0.754 6.693 7.403 1.00 0.00 O ATOM 1276 CB LYS A 90 -1.765 7.100 5.774 1.00 0.00 C ATOM 1277 CG LYS A 90 -2.473 7.742 4.580 1.00 0.00 C ATOM 1278 CD LYS A 90 -2.920 9.156 4.952 1.00 0.00 C ATOM 1279 CE LYS A 90 -4.203 9.084 5.782 1.00 0.00 C ATOM 1280 NZ LYS A 90 -3.898 9.423 7.201 1.00 0.00 N ATOM 0 H LYS A 90 -0.981 4.655 6.168 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.222 6.848 4.297 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.385 6.309 6.196 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.612 7.839 6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.803 7.775 3.721 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.335 7.142 4.289 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.136 9.660 5.518 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.090 9.744 4.050 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.946 9.775 5.384 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.633 8.084 5.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -4.786 9.507 7.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.311 8.673 7.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.384 10.326 7.239 1.00 0.00 H new ATOM 1294 N THR A 91 1.574 7.851 5.725 1.00 0.00 N ATOM 1295 CA THR A 91 2.686 8.373 6.566 1.00 0.00 C ATOM 1296 C THR A 91 2.371 9.800 7.020 1.00 0.00 C ATOM 1297 O THR A 91 1.901 10.022 8.118 1.00 0.00 O ATOM 1298 CB THR A 91 3.977 8.370 5.746 1.00 0.00 C ATOM 1299 OG1 THR A 91 3.692 8.784 4.417 1.00 0.00 O ATOM 1300 CG2 THR A 91 4.564 6.957 5.728 1.00 0.00 C ATOM 0 H THR A 91 1.572 8.175 4.758 1.00 0.00 H new ATOM 0 HA THR A 91 2.805 7.739 7.445 1.00 0.00 H new ATOM 0 HB THR A 91 4.697 9.056 6.193 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.412 8.490 3.821 1.00 0.00 H new ATOM 0 HG21 THR A 91 5.484 6.953 5.144 1.00 0.00 H new ATOM 0 HG22 THR A 91 4.780 6.640 6.748 1.00 0.00 H new ATOM 0 HG23 THR A 91 3.846 6.271 5.279 1.00 0.00 H new ATOM 1308 N SER A 92 2.633 10.771 6.188 1.00 0.00 N ATOM 1309 CA SER A 92 2.353 12.181 6.580 1.00 0.00 C ATOM 1310 C SER A 92 2.052 13.011 5.331 1.00 0.00 C ATOM 1311 O SER A 92 1.150 13.826 5.318 1.00 0.00 O ATOM 1312 CB SER A 92 3.576 12.760 7.295 1.00 0.00 C ATOM 1313 OG SER A 92 4.580 11.759 7.394 1.00 0.00 O ATOM 0 H SER A 92 3.028 10.649 5.256 1.00 0.00 H new ATOM 0 HA SER A 92 1.492 12.209 7.248 1.00 0.00 H new ATOM 0 HB2 SER A 92 3.958 13.621 6.747 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.298 13.112 8.288 1.00 0.00 H new ATOM 0 HG SER A 92 5.365 12.127 7.850 1.00 0.00 H new ATOM 1319 N LYS A 93 2.801 12.815 4.280 1.00 0.00 N ATOM 1320 CA LYS A 93 2.558 13.597 3.035 1.00 0.00 C ATOM 1321 C LYS A 93 2.715 12.684 1.816 1.00 0.00 C ATOM 1322 O LYS A 93 3.269 13.071 0.806 1.00 0.00 O ATOM 1323 CB LYS A 93 3.570 14.742 2.949 1.00 0.00 C ATOM 1324 CG LYS A 93 3.361 15.698 4.126 1.00 0.00 C ATOM 1325 CD LYS A 93 2.339 16.767 3.735 1.00 0.00 C ATOM 1326 CE LYS A 93 2.311 17.867 4.797 1.00 0.00 C ATOM 1327 NZ LYS A 93 1.084 18.694 4.624 1.00 0.00 N ATOM 0 H LYS A 93 3.570 12.147 4.230 1.00 0.00 H new ATOM 0 HA LYS A 93 1.547 14.004 3.053 1.00 0.00 H new ATOM 0 HB2 LYS A 93 4.585 14.346 2.964 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.451 15.277 2.007 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.012 15.147 4.999 1.00 0.00 H new ATOM 0 HG3 LYS A 93 4.306 16.166 4.401 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.596 17.192 2.765 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.350 16.319 3.635 1.00 0.00 H new ATOM 0 HE2 LYS A 93 2.327 17.426 5.793 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.199 18.493 4.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.065 19.442 5.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.087 19.126 3.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.242 18.092 4.727 1.00 0.00 H new ATOM 1341 N SER A 94 2.232 11.475 1.902 1.00 0.00 N ATOM 1342 CA SER A 94 2.356 10.538 0.749 1.00 0.00 C ATOM 1343 C SER A 94 1.864 9.151 1.170 1.00 0.00 C ATOM 1344 O SER A 94 1.773 8.846 2.342 1.00 0.00 O ATOM 1345 CB SER A 94 3.820 10.452 0.320 1.00 0.00 C ATOM 1346 OG SER A 94 3.903 10.570 -1.094 1.00 0.00 O ATOM 0 H SER A 94 1.757 11.095 2.721 1.00 0.00 H new ATOM 0 HA SER A 94 1.755 10.901 -0.085 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.398 11.244 0.797 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.251 9.504 0.643 1.00 0.00 H new ATOM 0 HG SER A 94 4.326 11.423 -1.327 1.00 0.00 H new ATOM 1352 N ILE A 95 1.546 8.306 0.227 1.00 0.00 N ATOM 1353 CA ILE A 95 1.062 6.946 0.592 1.00 0.00 C ATOM 1354 C ILE A 95 1.781 5.896 -0.258 1.00 0.00 C ATOM 1355 O ILE A 95 2.107 6.125 -1.406 1.00 0.00 O ATOM 1356 CB ILE A 95 -0.444 6.848 0.341 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -1.142 8.092 0.899 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -0.993 5.604 1.039 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -2.636 8.025 0.568 1.00 0.00 C ATOM 0 H ILE A 95 1.600 8.497 -0.773 1.00 0.00 H new ATOM 0 HA ILE A 95 1.269 6.767 1.647 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.628 6.780 -0.731 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.999 8.150 1.978 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -0.703 8.993 0.470 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.066 5.531 0.862 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.499 4.717 0.643 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -0.806 5.676 2.110 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.136 8.909 0.964 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -2.768 7.987 -0.513 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.069 7.131 1.018 1.00 0.00 H new ATOM 1371 N LEU A 96 2.020 4.740 0.297 1.00 0.00 N ATOM 1372 CA LEU A 96 2.704 3.663 -0.472 1.00 0.00 C ATOM 1373 C LEU A 96 1.677 2.597 -0.846 1.00 0.00 C ATOM 1374 O LEU A 96 0.635 2.491 -0.228 1.00 0.00 O ATOM 1375 CB LEU A 96 3.793 3.033 0.394 1.00 0.00 C ATOM 1376 CG LEU A 96 3.229 2.765 1.787 1.00 0.00 C ATOM 1377 CD1 LEU A 96 3.877 1.509 2.370 1.00 0.00 C ATOM 1378 CD2 LEU A 96 3.524 3.963 2.691 1.00 0.00 C ATOM 0 H LEU A 96 1.770 4.494 1.255 1.00 0.00 H new ATOM 0 HA LEU A 96 3.154 4.080 -1.373 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.141 2.103 -0.056 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.654 3.698 0.458 1.00 0.00 H new ATOM 0 HG LEU A 96 2.151 2.615 1.722 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.473 1.319 3.364 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.665 0.657 1.724 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.955 1.654 2.438 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.123 3.775 3.687 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.602 4.113 2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.058 4.856 2.275 1.00 0.00 H new ATOM 1390 N VAL A 97 1.951 1.809 -1.847 1.00 0.00 N ATOM 1391 CA VAL A 97 0.969 0.762 -2.242 1.00 0.00 C ATOM 1392 C VAL A 97 1.699 -0.488 -2.737 1.00 0.00 C ATOM 1393 O VAL A 97 1.690 -0.796 -3.911 1.00 0.00 O ATOM 1394 CB VAL A 97 0.082 1.304 -3.362 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -0.939 0.239 -3.765 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.653 2.554 -2.873 1.00 0.00 C ATOM 0 H VAL A 97 2.804 1.843 -2.405 1.00 0.00 H new ATOM 0 HA VAL A 97 0.361 0.499 -1.377 1.00 0.00 H new ATOM 0 HB VAL A 97 0.701 1.559 -4.222 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.572 0.625 -4.564 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.417 -0.652 -4.114 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.557 -0.017 -2.904 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.286 2.940 -3.672 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.271 2.299 -2.012 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.073 3.314 -2.586 1.00 0.00 H new ATOM 1406 N GLY A 98 2.317 -1.225 -1.854 1.00 0.00 N ATOM 1407 CA GLY A 98 3.024 -2.461 -2.293 1.00 0.00 C ATOM 1408 C GLY A 98 2.023 -3.361 -3.020 1.00 0.00 C ATOM 1409 O GLY A 98 0.862 -3.413 -2.674 1.00 0.00 O ATOM 0 H GLY A 98 2.363 -1.026 -0.855 1.00 0.00 H new ATOM 0 HA2 GLY A 98 3.854 -2.208 -2.952 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.446 -2.981 -1.433 1.00 0.00 H new ATOM 1413 N VAL A 99 2.448 -4.063 -4.032 1.00 0.00 N ATOM 1414 CA VAL A 99 1.488 -4.938 -4.762 1.00 0.00 C ATOM 1415 C VAL A 99 2.200 -6.210 -5.227 1.00 0.00 C ATOM 1416 O VAL A 99 3.072 -6.174 -6.076 1.00 0.00 O ATOM 1417 CB VAL A 99 0.915 -4.195 -5.981 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.604 -4.377 -6.024 1.00 0.00 C ATOM 1419 CG2 VAL A 99 1.231 -2.698 -5.892 1.00 0.00 C ATOM 0 H VAL A 99 3.406 -4.070 -4.383 1.00 0.00 H new ATOM 0 HA VAL A 99 0.671 -5.203 -4.090 1.00 0.00 H new ATOM 0 HB VAL A 99 1.369 -4.606 -6.883 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.009 -3.850 -6.888 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.841 -5.438 -6.102 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.045 -3.973 -5.113 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.819 -2.187 -6.762 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.788 -2.286 -4.985 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.311 -2.555 -5.865 1.00 0.00 H new ATOM 1429 N TYR A 100 1.828 -7.338 -4.682 1.00 0.00 N ATOM 1430 CA TYR A 100 2.468 -8.618 -5.097 1.00 0.00 C ATOM 1431 C TYR A 100 1.394 -9.680 -5.296 1.00 0.00 C ATOM 1432 O TYR A 100 0.435 -9.760 -4.553 1.00 0.00 O ATOM 1433 CB TYR A 100 3.444 -9.098 -4.026 1.00 0.00 C ATOM 1434 CG TYR A 100 2.714 -9.280 -2.716 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.307 -8.162 -1.975 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.445 -10.570 -2.240 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.630 -8.336 -0.760 1.00 0.00 C ATOM 1438 CE2 TYR A 100 1.769 -10.743 -1.025 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.362 -9.626 -0.286 1.00 0.00 C ATOM 1440 OH TYR A 100 0.695 -9.798 0.911 1.00 0.00 O ATOM 0 H TYR A 100 1.107 -7.427 -3.966 1.00 0.00 H new ATOM 0 HA TYR A 100 3.010 -8.451 -6.028 1.00 0.00 H new ATOM 0 HB2 TYR A 100 3.901 -10.039 -4.332 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.251 -8.376 -3.906 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.515 -7.167 -2.340 1.00 0.00 H new ATOM 0 HD2 TYR A 100 2.759 -11.432 -2.810 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.315 -7.475 -0.189 1.00 0.00 H new ATOM 0 HE2 TYR A 100 1.562 -11.738 -0.659 1.00 0.00 H new ATOM 0 HH TYR A 100 0.590 -10.755 1.092 1.00 0.00 H new ATOM 1450 N ASN A 101 1.551 -10.499 -6.292 1.00 0.00 N ATOM 1451 CA ASN A 101 0.542 -11.568 -6.549 1.00 0.00 C ATOM 1452 C ASN A 101 1.211 -12.758 -7.238 1.00 0.00 C ATOM 1453 O ASN A 101 1.705 -12.649 -8.342 1.00 0.00 O ATOM 1454 CB ASN A 101 -0.582 -11.029 -7.440 1.00 0.00 C ATOM 1455 CG ASN A 101 -0.102 -9.792 -8.206 1.00 0.00 C ATOM 1456 OD1 ASN A 101 0.227 -8.785 -7.611 1.00 0.00 O ATOM 1457 ND2 ASN A 101 -0.047 -9.826 -9.508 1.00 0.00 N ATOM 0 H ASN A 101 2.335 -10.478 -6.944 1.00 0.00 H new ATOM 0 HA ASN A 101 0.121 -11.889 -5.596 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -0.901 -11.800 -8.142 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -1.449 -10.775 -6.830 1.00 0.00 H new ATOM 0 HD21 ASN A 101 0.272 -9.008 -10.027 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -0.323 -10.671 -10.008 1.00 0.00 H new ATOM 1464 N GLU A 102 1.218 -13.894 -6.597 1.00 0.00 N ATOM 1465 CA GLU A 102 1.844 -15.101 -7.207 1.00 0.00 C ATOM 1466 C GLU A 102 2.146 -16.124 -6.112 1.00 0.00 C ATOM 1467 O GLU A 102 1.667 -17.237 -6.144 1.00 0.00 O ATOM 1468 CB GLU A 102 3.146 -14.710 -7.909 1.00 0.00 C ATOM 1469 CG GLU A 102 2.908 -14.653 -9.418 1.00 0.00 C ATOM 1470 CD GLU A 102 4.006 -15.432 -10.146 1.00 0.00 C ATOM 1471 OE1 GLU A 102 4.814 -16.051 -9.473 1.00 0.00 O ATOM 1472 OE2 GLU A 102 4.021 -15.397 -11.365 1.00 0.00 O ATOM 0 H GLU A 102 0.815 -14.039 -5.671 1.00 0.00 H new ATOM 0 HA GLU A 102 1.158 -15.534 -7.935 1.00 0.00 H new ATOM 0 HB2 GLU A 102 3.491 -13.742 -7.547 1.00 0.00 H new ATOM 0 HB3 GLU A 102 3.928 -15.434 -7.680 1.00 0.00 H new ATOM 0 HG2 GLU A 102 1.931 -15.074 -9.657 1.00 0.00 H new ATOM 0 HG3 GLU A 102 2.900 -13.617 -9.755 1.00 0.00 H new ATOM 1479 N LYS A 103 2.943 -15.751 -5.149 1.00 0.00 N ATOM 1480 CA LYS A 103 3.290 -16.683 -4.048 1.00 0.00 C ATOM 1481 C LYS A 103 4.330 -16.029 -3.137 1.00 0.00 C ATOM 1482 O LYS A 103 5.329 -16.626 -2.790 1.00 0.00 O ATOM 1483 CB LYS A 103 3.861 -17.965 -4.639 1.00 0.00 C ATOM 1484 CG LYS A 103 2.810 -19.060 -4.528 1.00 0.00 C ATOM 1485 CD LYS A 103 2.910 -19.709 -3.151 1.00 0.00 C ATOM 1486 CE LYS A 103 1.562 -20.329 -2.777 1.00 0.00 C ATOM 1487 NZ LYS A 103 1.713 -21.804 -2.631 1.00 0.00 N ATOM 0 H LYS A 103 3.372 -14.828 -5.080 1.00 0.00 H new ATOM 0 HA LYS A 103 2.398 -16.915 -3.467 1.00 0.00 H new ATOM 0 HB2 LYS A 103 4.138 -17.810 -5.682 1.00 0.00 H new ATOM 0 HB3 LYS A 103 4.768 -18.255 -4.108 1.00 0.00 H new ATOM 0 HG2 LYS A 103 1.814 -18.642 -4.675 1.00 0.00 H new ATOM 0 HG3 LYS A 103 2.961 -19.807 -5.308 1.00 0.00 H new ATOM 0 HD2 LYS A 103 3.686 -20.475 -3.154 1.00 0.00 H new ATOM 0 HD3 LYS A 103 3.199 -18.966 -2.408 1.00 0.00 H new ATOM 0 HE2 LYS A 103 1.198 -19.897 -1.845 1.00 0.00 H new ATOM 0 HE3 LYS A 103 0.821 -20.103 -3.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 0.796 -22.223 -2.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 2.042 -22.210 -3.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 2.407 -22.010 -1.884 1.00 0.00 H new ATOM 1501 N ILE A 104 4.099 -14.806 -2.745 1.00 0.00 N ATOM 1502 CA ILE A 104 5.070 -14.110 -1.854 1.00 0.00 C ATOM 1503 C ILE A 104 4.483 -14.042 -0.439 1.00 0.00 C ATOM 1504 O ILE A 104 3.353 -13.641 -0.243 1.00 0.00 O ATOM 1505 CB ILE A 104 5.332 -12.697 -2.398 1.00 0.00 C ATOM 1506 CG1 ILE A 104 6.407 -12.771 -3.487 1.00 0.00 C ATOM 1507 CG2 ILE A 104 5.817 -11.774 -1.276 1.00 0.00 C ATOM 1508 CD1 ILE A 104 5.988 -11.910 -4.680 1.00 0.00 C ATOM 0 H ILE A 104 3.279 -14.258 -3.004 1.00 0.00 H new ATOM 0 HA ILE A 104 6.014 -14.653 -1.822 1.00 0.00 H new ATOM 0 HB ILE A 104 4.405 -12.298 -2.809 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.363 -12.425 -3.093 1.00 0.00 H new ATOM 0 HG13 ILE A 104 6.548 -13.805 -3.803 1.00 0.00 H new ATOM 0 HG21 ILE A 104 5.998 -10.777 -1.678 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.057 -11.719 -0.496 1.00 0.00 H new ATOM 0 HG23 ILE A 104 6.741 -12.169 -0.854 1.00 0.00 H new ATOM 0 HD11 ILE A 104 6.754 -11.963 -5.454 1.00 0.00 H new ATOM 0 HD12 ILE A 104 5.042 -12.277 -5.079 1.00 0.00 H new ATOM 0 HD13 ILE A 104 5.869 -10.875 -4.358 1.00 0.00 H new ATOM 1520 N GLN A 105 5.239 -14.442 0.547 1.00 0.00 N ATOM 1521 CA GLN A 105 4.721 -14.407 1.944 1.00 0.00 C ATOM 1522 C GLN A 105 4.497 -12.952 2.377 1.00 0.00 C ATOM 1523 O GLN A 105 5.315 -12.097 2.105 1.00 0.00 O ATOM 1524 CB GLN A 105 5.734 -15.071 2.878 1.00 0.00 C ATOM 1525 CG GLN A 105 5.296 -16.508 3.163 1.00 0.00 C ATOM 1526 CD GLN A 105 6.498 -17.324 3.642 1.00 0.00 C ATOM 1527 OE1 GLN A 105 6.610 -18.496 3.341 1.00 0.00 O ATOM 1528 NE2 GLN A 105 7.408 -16.750 4.381 1.00 0.00 N ATOM 0 H GLN A 105 6.192 -14.791 0.446 1.00 0.00 H new ATOM 0 HA GLN A 105 3.774 -14.945 1.993 1.00 0.00 H new ATOM 0 HB2 GLN A 105 6.724 -15.065 2.422 1.00 0.00 H new ATOM 0 HB3 GLN A 105 5.808 -14.510 3.810 1.00 0.00 H new ATOM 0 HG2 GLN A 105 4.512 -16.517 3.920 1.00 0.00 H new ATOM 0 HG3 GLN A 105 4.875 -16.956 2.263 1.00 0.00 H new ATOM 0 HE21 GLN A 105 7.314 -15.766 4.634 1.00 0.00 H new ATOM 0 HE22 GLN A 105 8.213 -17.285 4.706 1.00 0.00 H new ATOM 1537 N PRO A 106 3.390 -12.713 3.040 1.00 0.00 N ATOM 1538 CA PRO A 106 3.037 -11.364 3.518 1.00 0.00 C ATOM 1539 C PRO A 106 4.028 -10.901 4.589 1.00 0.00 C ATOM 1540 O PRO A 106 4.230 -9.719 4.793 1.00 0.00 O ATOM 1541 CB PRO A 106 1.635 -11.518 4.126 1.00 0.00 C ATOM 1542 CG PRO A 106 1.267 -13.024 4.084 1.00 0.00 C ATOM 1543 CD PRO A 106 2.405 -13.761 3.362 1.00 0.00 C ATOM 0 HA PRO A 106 3.064 -10.624 2.718 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.620 -11.149 5.151 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.908 -10.931 3.565 1.00 0.00 H new ATOM 0 HG2 PRO A 106 1.138 -13.415 5.093 1.00 0.00 H new ATOM 0 HG3 PRO A 106 0.322 -13.173 3.561 1.00 0.00 H new ATOM 0 HD2 PRO A 106 2.842 -14.532 3.997 1.00 0.00 H new ATOM 0 HD3 PRO A 106 2.046 -14.256 2.460 1.00 0.00 H new ATOM 1551 N GLY A 107 4.644 -11.821 5.281 1.00 0.00 N ATOM 1552 CA GLY A 107 5.615 -11.428 6.343 1.00 0.00 C ATOM 1553 C GLY A 107 6.974 -11.115 5.715 1.00 0.00 C ATOM 1554 O GLY A 107 7.921 -10.780 6.399 1.00 0.00 O ATOM 0 H GLY A 107 4.518 -12.826 5.158 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.244 -10.556 6.882 1.00 0.00 H new ATOM 0 HA3 GLY A 107 5.717 -12.233 7.070 1.00 0.00 H new ATOM 1558 N THR A 108 7.081 -11.219 4.420 1.00 0.00 N ATOM 1559 CA THR A 108 8.381 -10.926 3.754 1.00 0.00 C ATOM 1560 C THR A 108 8.412 -9.459 3.325 1.00 0.00 C ATOM 1561 O THR A 108 9.405 -8.776 3.485 1.00 0.00 O ATOM 1562 CB THR A 108 8.538 -11.822 2.523 1.00 0.00 C ATOM 1563 OG1 THR A 108 8.378 -13.181 2.908 1.00 0.00 O ATOM 1564 CG2 THR A 108 9.927 -11.621 1.915 1.00 0.00 C ATOM 0 H THR A 108 6.325 -11.494 3.794 1.00 0.00 H new ATOM 0 HA THR A 108 9.198 -11.119 4.449 1.00 0.00 H new ATOM 0 HB THR A 108 7.781 -11.561 1.783 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.476 -13.758 2.122 1.00 0.00 H new ATOM 0 HG21 THR A 108 10.037 -12.260 1.039 1.00 0.00 H new ATOM 0 HG22 THR A 108 10.048 -10.578 1.621 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.688 -11.881 2.651 1.00 0.00 H new ATOM 1572 N ALA A 109 7.334 -8.969 2.780 1.00 0.00 N ATOM 1573 CA ALA A 109 7.301 -7.546 2.341 1.00 0.00 C ATOM 1574 C ALA A 109 6.807 -6.669 3.492 1.00 0.00 C ATOM 1575 O ALA A 109 7.022 -5.473 3.513 1.00 0.00 O ATOM 1576 CB ALA A 109 6.355 -7.402 1.148 1.00 0.00 C ATOM 0 H ALA A 109 6.474 -9.493 2.619 1.00 0.00 H new ATOM 0 HA ALA A 109 8.303 -7.232 2.049 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.331 -6.361 0.827 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.707 -8.027 0.327 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.352 -7.715 1.439 1.00 0.00 H new ATOM 1582 N ALA A 110 6.142 -7.255 4.450 1.00 0.00 N ATOM 1583 CA ALA A 110 5.629 -6.455 5.598 1.00 0.00 C ATOM 1584 C ALA A 110 6.785 -6.096 6.535 1.00 0.00 C ATOM 1585 O ALA A 110 6.725 -5.128 7.267 1.00 0.00 O ATOM 1586 CB ALA A 110 4.588 -7.271 6.365 1.00 0.00 C ATOM 0 H ALA A 110 5.932 -8.252 4.487 1.00 0.00 H new ATOM 0 HA ALA A 110 5.171 -5.540 5.222 1.00 0.00 H new ATOM 0 HB1 ALA A 110 4.213 -6.685 7.204 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.762 -7.523 5.701 1.00 0.00 H new ATOM 0 HB3 ALA A 110 5.046 -8.187 6.738 1.00 0.00 H new ATOM 1592 N ASN A 111 7.837 -6.868 6.521 1.00 0.00 N ATOM 1593 CA ASN A 111 8.991 -6.566 7.413 1.00 0.00 C ATOM 1594 C ASN A 111 9.871 -5.491 6.771 1.00 0.00 C ATOM 1595 O ASN A 111 10.457 -4.671 7.449 1.00 0.00 O ATOM 1596 CB ASN A 111 9.813 -7.838 7.631 1.00 0.00 C ATOM 1597 CG ASN A 111 9.567 -8.371 9.045 1.00 0.00 C ATOM 1598 OD1 ASN A 111 9.537 -7.613 9.994 1.00 0.00 O ATOM 1599 ND2 ASN A 111 9.389 -9.650 9.227 1.00 0.00 N ATOM 0 H ASN A 111 7.947 -7.693 5.932 1.00 0.00 H new ATOM 0 HA ASN A 111 8.622 -6.203 8.372 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.537 -8.592 6.894 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.873 -7.627 7.490 1.00 0.00 H new ATOM 0 HD21 ASN A 111 9.225 -10.014 10.166 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.414 -10.287 8.431 1.00 0.00 H new ATOM 1606 N VAL A 112 9.969 -5.484 5.469 1.00 0.00 N ATOM 1607 CA VAL A 112 10.813 -4.459 4.791 1.00 0.00 C ATOM 1608 C VAL A 112 10.061 -3.128 4.744 1.00 0.00 C ATOM 1609 O VAL A 112 10.644 -2.081 4.546 1.00 0.00 O ATOM 1610 CB VAL A 112 11.126 -4.913 3.365 1.00 0.00 C ATOM 1611 CG1 VAL A 112 9.844 -4.891 2.532 1.00 0.00 C ATOM 1612 CG2 VAL A 112 12.148 -3.962 2.739 1.00 0.00 C ATOM 0 H VAL A 112 9.502 -6.143 4.846 1.00 0.00 H new ATOM 0 HA VAL A 112 11.743 -4.334 5.346 1.00 0.00 H new ATOM 0 HB VAL A 112 11.533 -5.924 3.388 1.00 0.00 H new ATOM 0 HG11 VAL A 112 10.065 -5.214 1.515 1.00 0.00 H new ATOM 0 HG12 VAL A 112 9.110 -5.564 2.975 1.00 0.00 H new ATOM 0 HG13 VAL A 112 9.441 -3.878 2.511 1.00 0.00 H new ATOM 0 HG21 VAL A 112 12.371 -4.286 1.722 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.739 -2.952 2.717 1.00 0.00 H new ATOM 0 HG23 VAL A 112 13.063 -3.970 3.331 1.00 0.00 H new ATOM 1622 N VAL A 113 8.770 -3.160 4.915 1.00 0.00 N ATOM 1623 CA VAL A 113 7.980 -1.899 4.872 1.00 0.00 C ATOM 1624 C VAL A 113 7.868 -1.306 6.280 1.00 0.00 C ATOM 1625 O VAL A 113 7.643 -0.125 6.449 1.00 0.00 O ATOM 1626 CB VAL A 113 6.583 -2.200 4.329 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.657 -1.014 4.604 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.670 -2.439 2.821 1.00 0.00 C ATOM 0 H VAL A 113 8.227 -4.007 5.083 1.00 0.00 H new ATOM 0 HA VAL A 113 8.480 -1.180 4.223 1.00 0.00 H new ATOM 0 HB VAL A 113 6.185 -3.088 4.820 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.662 -1.232 4.216 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.597 -0.840 5.678 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.051 -0.124 4.114 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.676 -2.654 2.429 1.00 0.00 H new ATOM 0 HG22 VAL A 113 7.067 -1.549 2.334 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.329 -3.285 2.624 1.00 0.00 H new ATOM 1638 N GLU A 114 8.013 -2.116 7.291 1.00 0.00 N ATOM 1639 CA GLU A 114 7.900 -1.593 8.682 1.00 0.00 C ATOM 1640 C GLU A 114 9.171 -0.824 9.055 1.00 0.00 C ATOM 1641 O GLU A 114 9.120 0.194 9.717 1.00 0.00 O ATOM 1642 CB GLU A 114 7.702 -2.762 9.649 1.00 0.00 C ATOM 1643 CG GLU A 114 6.217 -2.875 10.010 1.00 0.00 C ATOM 1644 CD GLU A 114 5.924 -4.275 10.556 1.00 0.00 C ATOM 1645 OE1 GLU A 114 5.822 -5.191 9.758 1.00 0.00 O ATOM 1646 OE2 GLU A 114 5.804 -4.404 11.763 1.00 0.00 O ATOM 0 H GLU A 114 8.204 -3.115 7.215 1.00 0.00 H new ATOM 0 HA GLU A 114 7.046 -0.919 8.746 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.049 -3.689 9.193 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.296 -2.608 10.550 1.00 0.00 H new ATOM 0 HG2 GLU A 114 5.955 -2.122 10.753 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.603 -2.681 9.130 1.00 0.00 H new ATOM 1653 N LYS A 115 10.311 -1.303 8.639 1.00 0.00 N ATOM 1654 CA LYS A 115 11.581 -0.599 8.977 1.00 0.00 C ATOM 1655 C LYS A 115 11.816 0.547 7.990 1.00 0.00 C ATOM 1656 O LYS A 115 11.924 1.697 8.373 1.00 0.00 O ATOM 1657 CB LYS A 115 12.745 -1.591 8.899 1.00 0.00 C ATOM 1658 CG LYS A 115 13.436 -1.675 10.262 1.00 0.00 C ATOM 1659 CD LYS A 115 14.007 -3.082 10.463 1.00 0.00 C ATOM 1660 CE LYS A 115 15.535 -3.017 10.476 1.00 0.00 C ATOM 1661 NZ LYS A 115 16.092 -4.347 10.101 1.00 0.00 N ATOM 0 H LYS A 115 10.418 -2.150 8.081 1.00 0.00 H new ATOM 0 HA LYS A 115 11.513 -0.193 9.986 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.379 -2.574 8.603 1.00 0.00 H new ATOM 0 HB3 LYS A 115 13.457 -1.273 8.137 1.00 0.00 H new ATOM 0 HG2 LYS A 115 14.235 -0.936 10.322 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.726 -1.443 11.056 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.643 -3.503 11.400 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.667 -3.741 9.664 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.883 -2.255 9.778 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.889 -2.729 11.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 17.131 -4.303 10.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 15.770 -5.063 10.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 15.764 -4.604 9.148 1.00 0.00 H new ATOM 1675 N LEU A 116 11.901 0.248 6.724 1.00 0.00 N ATOM 1676 CA LEU A 116 12.132 1.324 5.718 1.00 0.00 C ATOM 1677 C LEU A 116 11.104 2.437 5.916 1.00 0.00 C ATOM 1678 O LEU A 116 11.321 3.572 5.542 1.00 0.00 O ATOM 1679 CB LEU A 116 11.987 0.744 4.310 1.00 0.00 C ATOM 1680 CG LEU A 116 13.273 0.014 3.921 1.00 0.00 C ATOM 1681 CD1 LEU A 116 12.966 -1.018 2.836 1.00 0.00 C ATOM 1682 CD2 LEU A 116 14.291 1.025 3.388 1.00 0.00 C ATOM 0 H LEU A 116 11.821 -0.694 6.342 1.00 0.00 H new ATOM 0 HA LEU A 116 13.136 1.729 5.844 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.142 0.057 4.274 1.00 0.00 H new ATOM 0 HB3 LEU A 116 11.780 1.542 3.597 1.00 0.00 H new ATOM 0 HG LEU A 116 13.683 -0.490 4.796 1.00 0.00 H new ATOM 0 HD11 LEU A 116 13.883 -1.538 2.559 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.240 -1.738 3.214 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.556 -0.515 1.961 1.00 0.00 H new ATOM 0 HD21 LEU A 116 15.208 0.506 3.110 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.880 1.528 2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 116 14.511 1.762 4.161 1.00 0.00 H new ATOM 1694 N ALA A 117 9.982 2.119 6.497 1.00 0.00 N ATOM 1695 CA ALA A 117 8.933 3.154 6.712 1.00 0.00 C ATOM 1696 C ALA A 117 9.356 4.096 7.842 1.00 0.00 C ATOM 1697 O ALA A 117 9.143 5.290 7.775 1.00 0.00 O ATOM 1698 CB ALA A 117 7.616 2.469 7.082 1.00 0.00 C ATOM 0 H ALA A 117 9.745 1.185 6.833 1.00 0.00 H new ATOM 0 HA ALA A 117 8.802 3.731 5.797 1.00 0.00 H new ATOM 0 HB1 ALA A 117 6.845 3.223 7.240 1.00 0.00 H new ATOM 0 HB2 ALA A 117 7.312 1.804 6.274 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.751 1.891 7.996 1.00 0.00 H new ATOM 1704 N ASP A 118 9.947 3.574 8.883 1.00 0.00 N ATOM 1705 CA ASP A 118 10.374 4.448 10.013 1.00 0.00 C ATOM 1706 C ASP A 118 11.448 5.433 9.537 1.00 0.00 C ATOM 1707 O ASP A 118 11.727 6.419 10.188 1.00 0.00 O ATOM 1708 CB ASP A 118 10.938 3.586 11.147 1.00 0.00 C ATOM 1709 CG ASP A 118 11.278 4.476 12.344 1.00 0.00 C ATOM 1710 OD1 ASP A 118 10.634 5.501 12.497 1.00 0.00 O ATOM 1711 OD2 ASP A 118 12.174 4.115 13.089 1.00 0.00 O ATOM 0 H ASP A 118 10.152 2.582 9.000 1.00 0.00 H new ATOM 0 HA ASP A 118 9.511 5.007 10.375 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.210 2.829 11.439 1.00 0.00 H new ATOM 0 HB3 ASP A 118 11.829 3.058 10.808 1.00 0.00 H new ATOM 1716 N TYR A 119 12.057 5.175 8.411 1.00 0.00 N ATOM 1717 CA TYR A 119 13.112 6.106 7.911 1.00 0.00 C ATOM 1718 C TYR A 119 12.459 7.294 7.200 1.00 0.00 C ATOM 1719 O TYR A 119 12.685 8.436 7.547 1.00 0.00 O ATOM 1720 CB TYR A 119 14.027 5.370 6.930 1.00 0.00 C ATOM 1721 CG TYR A 119 15.280 6.182 6.704 1.00 0.00 C ATOM 1722 CD1 TYR A 119 16.066 6.575 7.795 1.00 0.00 C ATOM 1723 CD2 TYR A 119 15.655 6.543 5.405 1.00 0.00 C ATOM 1724 CE1 TYR A 119 17.226 7.330 7.585 1.00 0.00 C ATOM 1725 CE2 TYR A 119 16.816 7.298 5.195 1.00 0.00 C ATOM 1726 CZ TYR A 119 17.601 7.692 6.285 1.00 0.00 C ATOM 1727 OH TYR A 119 18.744 8.436 6.078 1.00 0.00 O ATOM 0 H TYR A 119 11.872 4.366 7.818 1.00 0.00 H new ATOM 0 HA TYR A 119 13.699 6.466 8.756 1.00 0.00 H new ATOM 0 HB2 TYR A 119 14.284 4.387 7.324 1.00 0.00 H new ATOM 0 HB3 TYR A 119 13.510 5.209 5.984 1.00 0.00 H new ATOM 0 HD1 TYR A 119 15.777 6.296 8.797 1.00 0.00 H new ATOM 0 HD2 TYR A 119 15.049 6.239 4.564 1.00 0.00 H new ATOM 0 HE1 TYR A 119 17.832 7.633 8.426 1.00 0.00 H new ATOM 0 HE2 TYR A 119 17.105 7.576 4.192 1.00 0.00 H new ATOM 0 HH TYR A 119 18.859 8.599 5.119 1.00 0.00 H new ATOM 1737 N LEU A 120 11.654 7.036 6.206 1.00 0.00 N ATOM 1738 CA LEU A 120 10.991 8.149 5.471 1.00 0.00 C ATOM 1739 C LEU A 120 10.085 8.929 6.426 1.00 0.00 C ATOM 1740 O LEU A 120 10.141 10.139 6.501 1.00 0.00 O ATOM 1741 CB LEU A 120 10.149 7.570 4.333 1.00 0.00 C ATOM 1742 CG LEU A 120 10.902 7.719 3.010 1.00 0.00 C ATOM 1743 CD1 LEU A 120 10.008 7.259 1.857 1.00 0.00 C ATOM 1744 CD2 LEU A 120 11.284 9.186 2.801 1.00 0.00 C ATOM 0 H LEU A 120 11.427 6.100 5.871 1.00 0.00 H new ATOM 0 HA LEU A 120 11.749 8.819 5.065 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.934 6.519 4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 120 9.190 8.086 4.278 1.00 0.00 H new ATOM 0 HG LEU A 120 11.804 7.108 3.038 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.546 7.366 0.915 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.735 6.214 2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.105 7.869 1.831 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.821 9.291 1.858 1.00 0.00 H new ATOM 0 HD22 LEU A 120 10.382 9.797 2.775 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.922 9.516 3.621 1.00 0.00 H new ATOM 1756 N ILE A 121 9.245 8.244 7.152 1.00 0.00 N ATOM 1757 CA ILE A 121 8.332 8.944 8.097 1.00 0.00 C ATOM 1758 C ILE A 121 9.156 9.725 9.127 1.00 0.00 C ATOM 1759 O ILE A 121 8.782 10.804 9.543 1.00 0.00 O ATOM 1760 CB ILE A 121 7.461 7.912 8.818 1.00 0.00 C ATOM 1761 CG1 ILE A 121 6.656 7.119 7.785 1.00 0.00 C ATOM 1762 CG2 ILE A 121 6.502 8.627 9.770 1.00 0.00 C ATOM 1763 CD1 ILE A 121 6.573 5.652 8.215 1.00 0.00 C ATOM 0 H ILE A 121 9.152 7.228 7.131 1.00 0.00 H new ATOM 0 HA ILE A 121 7.698 9.636 7.543 1.00 0.00 H new ATOM 0 HB ILE A 121 8.096 7.233 9.387 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.654 7.538 7.690 1.00 0.00 H new ATOM 0 HG13 ILE A 121 7.127 7.195 6.805 1.00 0.00 H new ATOM 0 HG21 ILE A 121 5.882 7.891 10.283 1.00 0.00 H new ATOM 0 HG22 ILE A 121 7.074 9.195 10.504 1.00 0.00 H new ATOM 0 HG23 ILE A 121 5.865 9.306 9.203 1.00 0.00 H new ATOM 0 HD11 ILE A 121 6.000 5.089 7.479 1.00 0.00 H new ATOM 0 HD12 ILE A 121 7.578 5.237 8.287 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.082 5.585 9.186 1.00 0.00 H new ATOM 1775 N GLY A 122 10.268 9.186 9.544 1.00 0.00 N ATOM 1776 CA GLY A 122 11.109 9.894 10.553 1.00 0.00 C ATOM 1777 C GLY A 122 11.875 11.043 9.891 1.00 0.00 C ATOM 1778 O GLY A 122 12.410 11.906 10.559 1.00 0.00 O ATOM 0 H GLY A 122 10.632 8.286 9.231 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.480 10.281 11.354 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.810 9.194 11.008 1.00 0.00 H new ATOM 1782 N GLN A 123 11.943 11.061 8.589 1.00 0.00 N ATOM 1783 CA GLN A 123 12.688 12.158 7.906 1.00 0.00 C ATOM 1784 C GLN A 123 11.798 12.824 6.853 1.00 0.00 C ATOM 1785 O GLN A 123 11.414 13.969 6.987 1.00 0.00 O ATOM 1786 CB GLN A 123 13.933 11.582 7.228 1.00 0.00 C ATOM 1787 CG GLN A 123 14.868 10.998 8.289 1.00 0.00 C ATOM 1788 CD GLN A 123 16.042 11.952 8.522 1.00 0.00 C ATOM 1789 OE1 GLN A 123 15.918 12.925 9.238 1.00 0.00 O ATOM 1790 NE2 GLN A 123 17.187 11.711 7.942 1.00 0.00 N ATOM 0 H GLN A 123 11.519 10.369 7.971 1.00 0.00 H new ATOM 0 HA GLN A 123 12.982 12.902 8.646 1.00 0.00 H new ATOM 0 HB2 GLN A 123 13.647 10.809 6.515 1.00 0.00 H new ATOM 0 HB3 GLN A 123 14.447 12.361 6.665 1.00 0.00 H new ATOM 0 HG2 GLN A 123 14.324 10.841 9.220 1.00 0.00 H new ATOM 0 HG3 GLN A 123 15.236 10.024 7.967 1.00 0.00 H new ATOM 0 HE21 GLN A 123 17.292 10.894 7.340 1.00 0.00 H new ATOM 0 HE22 GLN A 123 17.976 12.340 8.091 1.00 0.00 H new ATOM 1799 N GLY A 124 11.474 12.123 5.801 1.00 0.00 N ATOM 1800 CA GLY A 124 10.618 12.726 4.741 1.00 0.00 C ATOM 1801 C GLY A 124 9.143 12.560 5.105 1.00 0.00 C ATOM 1802 O GLY A 124 8.631 13.228 5.982 1.00 0.00 O ATOM 0 H GLY A 124 11.765 11.160 5.630 1.00 0.00 H new ATOM 0 HA2 GLY A 124 10.856 13.783 4.627 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.821 12.248 3.782 1.00 0.00 H new ATOM 1806 N PHE A 125 8.454 11.679 4.433 1.00 0.00 N ATOM 1807 CA PHE A 125 7.006 11.472 4.736 1.00 0.00 C ATOM 1808 C PHE A 125 6.582 10.089 4.240 1.00 0.00 C ATOM 1809 O PHE A 125 6.207 9.985 3.084 1.00 0.00 O ATOM 1810 CB PHE A 125 6.153 12.545 4.037 1.00 0.00 C ATOM 1811 CG PHE A 125 7.036 13.508 3.273 1.00 0.00 C ATOM 1812 CD1 PHE A 125 7.420 13.212 1.960 1.00 0.00 C ATOM 1813 CD2 PHE A 125 7.472 14.690 3.881 1.00 0.00 C ATOM 1814 CE1 PHE A 125 8.242 14.099 1.254 1.00 0.00 C ATOM 1815 CE2 PHE A 125 8.293 15.578 3.176 1.00 0.00 C ATOM 1816 CZ PHE A 125 8.679 15.282 1.863 1.00 0.00 C ATOM 1817 OXT PHE A 125 6.641 9.157 5.025 1.00 0.00 O ATOM 0 H PHE A 125 8.829 11.093 3.687 1.00 0.00 H new ATOM 0 HA PHE A 125 6.855 11.547 5.813 1.00 0.00 H new ATOM 0 HB2 PHE A 125 5.447 12.070 3.355 1.00 0.00 H new ATOM 0 HB3 PHE A 125 5.565 13.089 4.776 1.00 0.00 H new ATOM 0 HD1 PHE A 125 7.082 12.299 1.491 1.00 0.00 H new ATOM 0 HD2 PHE A 125 7.175 14.917 4.894 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.539 13.871 0.241 1.00 0.00 H new ATOM 0 HE2 PHE A 125 8.629 16.491 3.645 1.00 0.00 H new ATOM 0 HZ PHE A 125 9.314 15.966 1.320 1.00 0.00 H new