USER MOD reduce.3.24.130724 H: found=0, std=0, add=1806, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 1802 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: B 94 GLN : amide:sc= -0.926 K(o=-0.77,f=-3.9!) USER MOD Set 1.2: B 106 THR OG1 : rot 85:sc= 0.152 USER MOD Set 2.1: B 35 THR OG1 : rot 104:sc= -0.693 USER MOD Set 2.2: B 53 HIS : no HE2:sc= 0.302 K(o=-0.39,f=-1.7) USER MOD Set 3.1: B 21 TYR OH : rot 12:sc= 1.25 USER MOD Set 3.2: B 113 HIS : no HD1:sc= -0.944! C(o=0.31!,f=-12!) USER MOD Set 4.1: B 18 THR OG1 : rot 99:sc= 2.03 USER MOD Set 4.2: B 37 SER OG : rot 166:sc= 1.28 USER MOD Set 5.1: A 81 THR OG1 : rot 85:sc= 1.38 USER MOD Set 5.2: B 2 THR OG1 : rot 144:sc= 0.414 USER MOD Set 6.1: A 118 TYR OH : rot -35:sc= 1.49 USER MOD Set 6.2: B 46 LYS NZ :NH3+ -155:sc= 0.624 (180deg=0) USER MOD Set 7.1: A 46 LYS NZ :NH3+ -144:sc= 0.0457 (180deg=-0.00173) USER MOD Set 7.2: B 118 TYR OH : rot -23:sc= 0.964 USER MOD Set 8.1: A 35 THR OG1 : rot 105:sc= -0.655 USER MOD Set 8.2: A 53 HIS : no HE2:sc= 0.044 K(o=-0.61,f=-2.1) USER MOD Set 9.1: A 19 GLN : amide:sc= -0.211 X(o=-0.21,f=0.23) USER MOD Set 9.2: A 22 LYS NZ :NH3+ -132:sc= 0 (180deg=0) USER MOD Set10.1: A 21 TYR OH : rot 7:sc= 1.14 USER MOD Set10.2: A 113 HIS : no HD1:sc= -1.09 K(o=0.042,f=-11!) USER MOD Set11.1: A 7 THR OG1 : rot -170:sc= 0.0256 USER MOD Set11.2: B 7 THR OG1 : rot 171:sc= 0.0232 USER MOD Set12.1: A 2 THR OG1 : rot 73:sc= 1.06 USER MOD Set12.2: B 81 THR OG1 : rot 86:sc= 0.867 USER MOD Single : A 1 MET CE :methyl -115:sc= -2.12 (180deg=-2.39!) USER MOD Single : A 1 MET N :NH3+ 179:sc= -0.0342 (180deg=-0.0397) USER MOD Single : A 3 HIS : no HD1:sc= -0.0144 K(o=-0.014,f=-0.68) USER MOD Single : A 10 TYR OH : rot 86:sc= 1.05 USER MOD Single : A 13 ASN : amide:sc= -3.22! C(o=-3.2!,f=-4.1!) USER MOD Single : A 17 SER OG : rot 121:sc= 0.349 USER MOD Single : A 18 THR OG1 : rot 100:sc= 0.393 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 126:sc= 1.35 USER MOD Single : A 37 SER OG : rot -120:sc= -0.155 USER MOD Single : A 43 ASN : amide:sc= -1.87! K(o=-1.9!,f=-1.4) USER MOD Single : A 45 MET CE :methyl 137:sc= -0.115 (180deg=-0.985) USER MOD Single : A 51 SER OG : rot 81:sc= -0.646 USER MOD Single : A 54 THR OG1 : rot -42:sc= 0.376 USER MOD Single : A 58 LYS NZ :NH3+ -171:sc= -0.0191 (180deg=-0.139) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -1.61 K(o=-1.6,f=-2.4) USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 86 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.0116) USER MOD Single : A 88 SER OG : rot 86:sc= 0.713 USER MOD Single : A 92 MET CE :methyl -142:sc= -0.26 (180deg=-2.5!) USER MOD Single : A 94 GLN : amide:sc= 0.138 X(o=0.14,f=-0.34) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0307) USER MOD Single : A 99 MET CE :methyl -113:sc= -0.777 (180deg=-2.67!) USER MOD Single : A 103 TYR OH : rot -59:sc= 0.442 USER MOD Single : A 104 THR OG1 : rot -140:sc= 0.311 USER MOD Single : A 106 THR OG1 : rot 140:sc= 0.00167 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -176:sc= -1.22 (180deg=-1.44!) USER MOD Single : B 1 MET N :NH3+ -118:sc= 0.0837 (180deg=0) USER MOD Single : B 3 HIS : no HD1:sc= -0.097 K(o=-0.097,f=-0.76) USER MOD Single : B 10 TYR OH : rot 85:sc= 0.972 USER MOD Single : B 13 ASN : amide:sc= -3.36! C(o=-3.4!,f=-3.8!) USER MOD Single : B 17 SER OG : rot 119:sc= 0.473 USER MOD Single : B 19 GLN : amide:sc= -0.545 K(o=-0.55,f=0) USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 SER OG : rot 143:sc= 1.41 USER MOD Single : B 43 ASN : amide:sc= -2.2! K(o=-2.2!,f=-0.91) USER MOD Single : B 45 MET CE :methyl 138:sc= -0.133 (180deg=-0.998) USER MOD Single : B 51 SER OG : rot 83:sc= -0.677 USER MOD Single : B 54 THR OG1 : rot -45:sc= 0.143 USER MOD Single : B 58 LYS NZ :NH3+ -174:sc=-0.00842 (180deg=-0.0851) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 ASN : amide:sc= -1.98! X(o=-2!,f=-2) USER MOD Single : B 77 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 SER OG : rot 87:sc= 0.68 USER MOD Single : B 92 MET CE :methyl -152:sc= -2.02 (180deg=-2.82!) USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 98 LYS NZ :NH3+ -110:sc= -0.372 (180deg=-2.07!) USER MOD Single : B 99 MET CE :methyl -120:sc= -0.542 (180deg=-2.45!) USER MOD Single : B 103 TYR OH : rot -74:sc= 0.858 USER MOD Single : B 104 THR OG1 : rot -140:sc= 0.302 USER MOD Single : B 112 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.708 18.328 -3.815 1.00 0.00 N ATOM 2 CA MET A 1 4.287 18.301 -5.183 1.00 0.00 C ATOM 3 C MET A 1 4.127 16.906 -5.840 1.00 0.00 C ATOM 4 O MET A 1 3.785 16.808 -7.028 1.00 0.00 O ATOM 5 CB MET A 1 5.773 18.804 -5.159 1.00 0.00 C ATOM 6 CG MET A 1 6.598 18.402 -3.918 1.00 0.00 C ATOM 7 SD MET A 1 6.817 16.621 -3.754 1.00 0.00 S ATOM 8 CE MET A 1 7.589 16.511 -2.139 1.00 0.00 C ATOM 0 H1 MET A 1 3.847 19.270 -3.398 1.00 0.00 H new ATOM 0 H2 MET A 1 2.691 18.118 -3.864 1.00 0.00 H new ATOM 0 H3 MET A 1 4.181 17.615 -3.224 1.00 0.00 H new ATOM 0 HA MET A 1 3.728 18.992 -5.814 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.279 18.425 -6.047 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.770 19.891 -5.233 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.577 18.878 -3.971 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.106 18.784 -3.024 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.602 16.123 -2.246 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.625 17.501 -1.685 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.009 15.842 -1.503 1.00 0.00 H new ATOM 18 N THR A 2 4.363 15.839 -5.059 1.00 0.00 N ATOM 19 CA THR A 2 4.162 14.440 -5.489 1.00 0.00 C ATOM 20 C THR A 2 3.011 13.787 -4.686 1.00 0.00 C ATOM 21 O THR A 2 2.968 13.891 -3.451 1.00 0.00 O ATOM 22 CB THR A 2 5.479 13.607 -5.306 1.00 0.00 C ATOM 23 OG1 THR A 2 6.575 14.287 -5.938 1.00 0.00 O ATOM 24 CG2 THR A 2 5.355 12.192 -5.906 1.00 0.00 C ATOM 0 H THR A 2 4.702 15.921 -4.101 1.00 0.00 H new ATOM 0 HA THR A 2 3.897 14.447 -6.546 1.00 0.00 H new ATOM 0 HB THR A 2 5.656 13.509 -4.235 1.00 0.00 H new ATOM 0 HG1 THR A 2 6.821 15.074 -5.408 1.00 0.00 H new ATOM 0 HG21 THR A 2 6.289 11.650 -5.757 1.00 0.00 H new ATOM 0 HG22 THR A 2 4.543 11.658 -5.413 1.00 0.00 H new ATOM 0 HG23 THR A 2 5.145 12.266 -6.973 1.00 0.00 H new ATOM 32 N HIS A 3 2.078 13.129 -5.399 1.00 0.00 N ATOM 33 CA HIS A 3 0.946 12.397 -4.793 1.00 0.00 C ATOM 34 C HIS A 3 1.001 10.918 -5.237 1.00 0.00 C ATOM 35 O HIS A 3 0.897 10.650 -6.437 1.00 0.00 O ATOM 36 CB HIS A 3 -0.407 13.033 -5.208 1.00 0.00 C ATOM 37 CG HIS A 3 -0.536 14.481 -4.819 1.00 0.00 C ATOM 38 ND1 HIS A 3 -0.495 15.510 -5.734 1.00 0.00 N ATOM 39 CD2 HIS A 3 -0.697 15.068 -3.607 1.00 0.00 C ATOM 40 CE1 HIS A 3 -0.616 16.659 -5.110 1.00 0.00 C ATOM 41 NE2 HIS A 3 -0.741 16.422 -3.818 1.00 0.00 N ATOM 0 H HIS A 3 2.087 13.089 -6.418 1.00 0.00 H new ATOM 0 HA HIS A 3 1.025 12.455 -3.707 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -0.525 12.944 -6.288 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -1.220 12.469 -4.751 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -0.776 14.564 -2.655 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -0.614 17.633 -5.576 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -0.852 17.131 -3.093 1.00 0.00 H new ATOM 50 N PRO A 4 1.169 9.944 -4.284 1.00 0.00 N ATOM 51 CA PRO A 4 1.264 8.501 -4.614 1.00 0.00 C ATOM 52 C PRO A 4 -0.110 7.887 -4.959 1.00 0.00 C ATOM 53 O PRO A 4 -1.069 8.069 -4.216 1.00 0.00 O ATOM 54 CB PRO A 4 1.845 7.886 -3.317 1.00 0.00 C ATOM 55 CG PRO A 4 1.324 8.771 -2.224 1.00 0.00 C ATOM 56 CD PRO A 4 1.281 10.170 -2.814 1.00 0.00 C ATOM 0 HA PRO A 4 1.875 8.313 -5.497 1.00 0.00 H new ATOM 0 HB2 PRO A 4 1.518 6.855 -3.184 1.00 0.00 H new ATOM 0 HB3 PRO A 4 2.935 7.875 -3.335 1.00 0.00 H new ATOM 0 HG2 PRO A 4 0.333 8.452 -1.900 1.00 0.00 H new ATOM 0 HG3 PRO A 4 1.972 8.735 -1.348 1.00 0.00 H new ATOM 0 HD2 PRO A 4 0.432 10.737 -2.432 1.00 0.00 H new ATOM 0 HD3 PRO A 4 2.179 10.735 -2.565 1.00 0.00 H new ATOM 64 N ASP A 5 -0.195 7.188 -6.101 1.00 0.00 N ATOM 65 CA ASP A 5 -1.386 6.377 -6.473 1.00 0.00 C ATOM 66 C ASP A 5 -1.032 4.891 -6.485 1.00 0.00 C ATOM 67 O ASP A 5 -1.832 4.036 -6.895 1.00 0.00 O ATOM 68 CB ASP A 5 -1.943 6.800 -7.852 1.00 0.00 C ATOM 69 CG ASP A 5 -0.965 6.563 -9.006 1.00 0.00 C ATOM 70 OD1 ASP A 5 -0.070 7.404 -9.202 1.00 0.00 O ATOM 71 OD2 ASP A 5 -1.082 5.543 -9.728 1.00 0.00 O ATOM 0 H ASP A 5 0.551 7.163 -6.796 1.00 0.00 H new ATOM 0 HA ASP A 5 -2.159 6.554 -5.725 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -2.863 6.249 -8.047 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -2.205 7.858 -7.820 1.00 0.00 H new ATOM 76 N PHE A 6 0.154 4.599 -5.956 1.00 0.00 N ATOM 77 CA PHE A 6 0.800 3.306 -6.071 1.00 0.00 C ATOM 78 C PHE A 6 1.154 2.841 -4.652 1.00 0.00 C ATOM 79 O PHE A 6 1.837 3.544 -3.911 1.00 0.00 O ATOM 80 CB PHE A 6 2.052 3.440 -6.988 1.00 0.00 C ATOM 81 CG PHE A 6 2.782 2.146 -7.395 1.00 0.00 C ATOM 82 CD1 PHE A 6 2.312 0.875 -7.076 1.00 0.00 C ATOM 83 CD2 PHE A 6 3.959 2.225 -8.131 1.00 0.00 C ATOM 84 CE1 PHE A 6 2.999 -0.248 -7.477 1.00 0.00 C ATOM 85 CE2 PHE A 6 4.642 1.096 -8.524 1.00 0.00 C ATOM 86 CZ PHE A 6 4.164 -0.135 -8.197 1.00 0.00 C ATOM 0 H PHE A 6 0.701 5.276 -5.424 1.00 0.00 H new ATOM 0 HA PHE A 6 0.150 2.561 -6.530 1.00 0.00 H new ATOM 0 HB2 PHE A 6 1.747 3.954 -7.899 1.00 0.00 H new ATOM 0 HB3 PHE A 6 2.770 4.086 -6.483 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.399 0.769 -6.508 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.347 3.196 -8.401 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.619 -1.227 -7.224 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.556 1.188 -9.091 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.699 -1.022 -8.503 1.00 0.00 H new ATOM 96 N THR A 7 0.612 1.687 -4.276 1.00 0.00 N ATOM 97 CA THR A 7 0.950 0.996 -3.028 1.00 0.00 C ATOM 98 C THR A 7 1.552 -0.368 -3.378 1.00 0.00 C ATOM 99 O THR A 7 1.098 -1.047 -4.303 1.00 0.00 O ATOM 100 CB THR A 7 -0.290 0.843 -2.083 1.00 0.00 C ATOM 101 OG1 THR A 7 0.079 0.138 -0.878 1.00 0.00 O ATOM 102 CG2 THR A 7 -1.474 0.129 -2.763 1.00 0.00 C ATOM 0 H THR A 7 -0.085 1.195 -4.835 1.00 0.00 H new ATOM 0 HA THR A 7 1.677 1.593 -2.477 1.00 0.00 H new ATOM 0 HB THR A 7 -0.619 1.852 -1.835 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.729 -0.089 -0.372 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.304 0.052 -2.061 1.00 0.00 H new ATOM 0 HG22 THR A 7 -1.790 0.699 -3.637 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.167 -0.870 -3.073 1.00 0.00 H new ATOM 110 N ILE A 8 2.612 -0.734 -2.659 1.00 0.00 N ATOM 111 CA ILE A 8 3.352 -1.978 -2.868 1.00 0.00 C ATOM 112 C ILE A 8 3.371 -2.746 -1.552 1.00 0.00 C ATOM 113 O ILE A 8 3.754 -2.197 -0.519 1.00 0.00 O ATOM 114 CB ILE A 8 4.830 -1.693 -3.336 1.00 0.00 C ATOM 115 CG1 ILE A 8 4.837 -0.820 -4.618 1.00 0.00 C ATOM 116 CG2 ILE A 8 5.634 -3.007 -3.539 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.207 -0.421 -5.118 1.00 0.00 C ATOM 0 H ILE A 8 2.988 -0.164 -1.901 1.00 0.00 H new ATOM 0 HA ILE A 8 2.863 -2.559 -3.650 1.00 0.00 H new ATOM 0 HB ILE A 8 5.329 -1.136 -2.543 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.322 -1.363 -5.411 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.260 0.085 -4.425 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.647 -2.767 -3.861 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.673 -3.559 -2.600 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.147 -3.618 -4.299 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.103 0.187 -6.017 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.722 0.154 -4.349 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.785 -1.316 -5.349 1.00 0.00 H new ATOM 129 N LEU A 9 2.944 -4.000 -1.590 1.00 0.00 N ATOM 130 CA LEU A 9 3.037 -4.913 -0.439 1.00 0.00 C ATOM 131 C LEU A 9 4.289 -5.768 -0.630 1.00 0.00 C ATOM 132 O LEU A 9 4.807 -5.901 -1.731 1.00 0.00 O ATOM 133 CB LEU A 9 1.745 -5.761 -0.318 1.00 0.00 C ATOM 134 CG LEU A 9 0.430 -4.930 -0.121 1.00 0.00 C ATOM 135 CD1 LEU A 9 -0.814 -5.828 -0.148 1.00 0.00 C ATOM 136 CD2 LEU A 9 0.480 -4.082 1.174 1.00 0.00 C ATOM 0 H LEU A 9 2.521 -4.422 -2.417 1.00 0.00 H new ATOM 0 HA LEU A 9 3.124 -4.363 0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.642 -6.371 -1.216 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.854 -6.447 0.522 1.00 0.00 H new ATOM 0 HG LEU A 9 0.357 -4.241 -0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -1.706 -5.218 -0.008 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.872 -6.341 -1.108 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.749 -6.564 0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.448 -3.520 1.277 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.603 -4.739 2.035 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.320 -3.389 1.123 1.00 0.00 H new ATOM 148 N TYR A 10 4.767 -6.335 0.467 1.00 0.00 N ATOM 149 CA TYR A 10 6.026 -7.102 0.519 1.00 0.00 C ATOM 150 C TYR A 10 5.706 -8.605 0.650 1.00 0.00 C ATOM 151 O TYR A 10 4.824 -8.958 1.417 1.00 0.00 O ATOM 152 CB TYR A 10 6.876 -6.619 1.738 1.00 0.00 C ATOM 153 CG TYR A 10 6.237 -6.973 3.101 1.00 0.00 C ATOM 154 CD1 TYR A 10 5.104 -6.299 3.567 1.00 0.00 C ATOM 155 CD2 TYR A 10 6.726 -8.025 3.879 1.00 0.00 C ATOM 156 CE1 TYR A 10 4.490 -6.658 4.745 1.00 0.00 C ATOM 157 CE2 TYR A 10 6.114 -8.376 5.062 1.00 0.00 C ATOM 158 CZ TYR A 10 4.999 -7.693 5.489 1.00 0.00 C ATOM 159 OH TYR A 10 4.383 -8.050 6.659 1.00 0.00 O ATOM 0 H TYR A 10 4.291 -6.281 1.368 1.00 0.00 H new ATOM 0 HA TYR A 10 6.596 -6.942 -0.396 1.00 0.00 H new ATOM 0 HB2 TYR A 10 7.868 -7.066 1.681 1.00 0.00 H new ATOM 0 HB3 TYR A 10 7.009 -5.539 1.675 1.00 0.00 H new ATOM 0 HD1 TYR A 10 4.702 -5.479 2.990 1.00 0.00 H new ATOM 0 HD2 TYR A 10 7.597 -8.571 3.548 1.00 0.00 H new ATOM 0 HE1 TYR A 10 3.612 -6.128 5.083 1.00 0.00 H new ATOM 0 HE2 TYR A 10 6.510 -9.188 5.654 1.00 0.00 H new ATOM 0 HH TYR A 10 3.661 -8.684 6.468 1.00 0.00 H new ATOM 169 N VAL A 11 6.379 -9.487 -0.103 1.00 0.00 N ATOM 170 CA VAL A 11 6.181 -10.959 0.015 1.00 0.00 C ATOM 171 C VAL A 11 7.539 -11.651 0.208 1.00 0.00 C ATOM 172 O VAL A 11 8.576 -10.989 0.309 1.00 0.00 O ATOM 173 CB VAL A 11 5.425 -11.546 -1.248 1.00 0.00 C ATOM 174 CG1 VAL A 11 4.077 -10.824 -1.479 1.00 0.00 C ATOM 175 CG2 VAL A 11 6.293 -11.517 -2.538 1.00 0.00 C ATOM 0 H VAL A 11 7.069 -9.217 -0.804 1.00 0.00 H new ATOM 0 HA VAL A 11 5.555 -11.153 0.886 1.00 0.00 H new ATOM 0 HB VAL A 11 5.225 -12.594 -1.025 1.00 0.00 H new ATOM 0 HG11 VAL A 11 3.582 -11.249 -2.352 1.00 0.00 H new ATOM 0 HG12 VAL A 11 3.441 -10.952 -0.603 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.257 -9.762 -1.645 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.723 -11.931 -3.370 1.00 0.00 H new ATOM 0 HG22 VAL A 11 6.572 -10.488 -2.766 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.194 -12.111 -2.384 1.00 0.00 H new ATOM 185 N ASP A 12 7.506 -12.986 0.342 1.00 0.00 N ATOM 186 CA ASP A 12 8.705 -13.822 0.538 1.00 0.00 C ATOM 187 C ASP A 12 8.585 -15.071 -0.365 1.00 0.00 C ATOM 188 O ASP A 12 8.894 -16.196 0.051 1.00 0.00 O ATOM 189 CB ASP A 12 8.851 -14.167 2.053 1.00 0.00 C ATOM 190 CG ASP A 12 10.179 -14.870 2.428 1.00 0.00 C ATOM 191 OD1 ASP A 12 11.243 -14.221 2.368 1.00 0.00 O ATOM 192 OD2 ASP A 12 10.161 -16.066 2.798 1.00 0.00 O ATOM 0 H ASP A 12 6.639 -13.522 0.317 1.00 0.00 H new ATOM 0 HA ASP A 12 9.614 -13.295 0.249 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.766 -13.247 2.632 1.00 0.00 H new ATOM 0 HB3 ASP A 12 8.020 -14.807 2.348 1.00 0.00 H new ATOM 197 N ASN A 13 8.229 -14.817 -1.647 1.00 0.00 N ATOM 198 CA ASN A 13 7.809 -15.870 -2.613 1.00 0.00 C ATOM 199 C ASN A 13 7.178 -15.227 -3.869 1.00 0.00 C ATOM 200 O ASN A 13 5.949 -15.074 -3.942 1.00 0.00 O ATOM 201 CB ASN A 13 6.824 -16.909 -1.970 1.00 0.00 C ATOM 202 CG ASN A 13 6.560 -18.149 -2.826 1.00 0.00 C ATOM 203 OD1 ASN A 13 7.286 -18.444 -3.780 1.00 0.00 O ATOM 204 ND2 ASN A 13 5.560 -18.921 -2.444 1.00 0.00 N ATOM 0 H ASN A 13 8.224 -13.877 -2.044 1.00 0.00 H new ATOM 0 HA ASN A 13 8.705 -16.418 -2.905 1.00 0.00 H new ATOM 0 HB2 ASN A 13 7.228 -17.226 -1.009 1.00 0.00 H new ATOM 0 HB3 ASN A 13 5.874 -16.413 -1.769 1.00 0.00 H new ATOM 0 HD21 ASN A 13 5.368 -19.791 -2.941 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.979 -18.648 -1.651 1.00 0.00 H new ATOM 211 N PRO A 14 8.018 -14.783 -4.864 1.00 0.00 N ATOM 212 CA PRO A 14 7.518 -14.240 -6.147 1.00 0.00 C ATOM 213 C PRO A 14 6.497 -15.168 -6.896 1.00 0.00 C ATOM 214 O PRO A 14 5.408 -14.685 -7.187 1.00 0.00 O ATOM 215 CB PRO A 14 8.807 -13.960 -6.972 1.00 0.00 C ATOM 216 CG PRO A 14 9.881 -13.788 -5.937 1.00 0.00 C ATOM 217 CD PRO A 14 9.508 -14.705 -4.789 1.00 0.00 C ATOM 0 HA PRO A 14 6.922 -13.342 -5.985 1.00 0.00 H new ATOM 0 HB2 PRO A 14 9.034 -14.785 -7.647 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.700 -13.066 -7.586 1.00 0.00 H new ATOM 0 HG2 PRO A 14 10.859 -14.049 -6.343 1.00 0.00 H new ATOM 0 HG3 PRO A 14 9.940 -12.752 -5.605 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.966 -15.688 -4.898 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.840 -14.303 -3.832 1.00 0.00 H new ATOM 225 N PRO A 15 6.784 -16.508 -7.197 1.00 0.00 N ATOM 226 CA PRO A 15 5.834 -17.370 -7.970 1.00 0.00 C ATOM 227 C PRO A 15 4.399 -17.386 -7.386 1.00 0.00 C ATOM 228 O PRO A 15 3.461 -16.841 -7.976 1.00 0.00 O ATOM 229 CB PRO A 15 6.490 -18.779 -7.917 1.00 0.00 C ATOM 230 CG PRO A 15 7.949 -18.498 -7.740 1.00 0.00 C ATOM 231 CD PRO A 15 8.012 -17.284 -6.840 1.00 0.00 C ATOM 0 HA PRO A 15 5.692 -16.997 -8.984 1.00 0.00 H new ATOM 0 HB2 PRO A 15 6.095 -19.371 -7.091 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.301 -19.341 -8.831 1.00 0.00 H new ATOM 0 HG2 PRO A 15 8.462 -19.348 -7.291 1.00 0.00 H new ATOM 0 HG3 PRO A 15 8.432 -18.304 -8.698 1.00 0.00 H new ATOM 0 HD2 PRO A 15 8.014 -17.567 -5.787 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.917 -16.703 -7.016 1.00 0.00 H new ATOM 239 N ALA A 16 4.291 -17.932 -6.164 1.00 0.00 N ATOM 240 CA ALA A 16 2.997 -18.345 -5.589 1.00 0.00 C ATOM 241 C ALA A 16 2.212 -17.156 -5.032 1.00 0.00 C ATOM 242 O ALA A 16 0.985 -17.109 -5.174 1.00 0.00 O ATOM 243 CB ALA A 16 3.188 -19.427 -4.520 1.00 0.00 C ATOM 0 H ALA A 16 5.089 -18.099 -5.551 1.00 0.00 H new ATOM 0 HA ALA A 16 2.406 -18.770 -6.401 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.218 -19.712 -4.114 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.665 -20.299 -4.967 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.817 -19.040 -3.719 1.00 0.00 H new ATOM 249 N SER A 17 2.915 -16.183 -4.420 1.00 0.00 N ATOM 250 CA SER A 17 2.250 -15.060 -3.739 1.00 0.00 C ATOM 251 C SER A 17 1.782 -14.000 -4.756 1.00 0.00 C ATOM 252 O SER A 17 0.815 -13.268 -4.494 1.00 0.00 O ATOM 253 CB SER A 17 3.179 -14.431 -2.686 1.00 0.00 C ATOM 254 OG SER A 17 2.496 -13.465 -1.911 1.00 0.00 O ATOM 0 H SER A 17 3.934 -16.153 -4.384 1.00 0.00 H new ATOM 0 HA SER A 17 1.370 -15.450 -3.227 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.574 -15.210 -2.034 1.00 0.00 H new ATOM 0 HB3 SER A 17 4.032 -13.967 -3.181 1.00 0.00 H new ATOM 0 HG SER A 17 2.534 -13.718 -0.965 1.00 0.00 H new ATOM 260 N THR A 18 2.434 -13.949 -5.938 1.00 0.00 N ATOM 261 CA THR A 18 1.986 -13.091 -7.042 1.00 0.00 C ATOM 262 C THR A 18 0.728 -13.632 -7.731 1.00 0.00 C ATOM 263 O THR A 18 -0.230 -12.898 -7.971 1.00 0.00 O ATOM 264 CB THR A 18 3.124 -12.890 -8.095 1.00 0.00 C ATOM 265 OG1 THR A 18 4.173 -12.101 -7.507 1.00 0.00 O ATOM 266 CG2 THR A 18 2.650 -12.222 -9.404 1.00 0.00 C ATOM 0 H THR A 18 3.271 -14.494 -6.146 1.00 0.00 H new ATOM 0 HA THR A 18 1.733 -12.127 -6.600 1.00 0.00 H new ATOM 0 HB THR A 18 3.480 -13.883 -8.368 1.00 0.00 H new ATOM 0 HG1 THR A 18 4.901 -12.689 -7.217 1.00 0.00 H new ATOM 0 HG21 THR A 18 3.495 -12.116 -10.085 1.00 0.00 H new ATOM 0 HG22 THR A 18 1.883 -12.840 -9.871 1.00 0.00 H new ATOM 0 HG23 THR A 18 2.238 -11.238 -9.182 1.00 0.00 H new ATOM 274 N GLN A 19 0.737 -14.970 -7.946 1.00 0.00 N ATOM 275 CA GLN A 19 -0.422 -15.730 -8.457 1.00 0.00 C ATOM 276 C GLN A 19 -1.584 -15.676 -7.445 1.00 0.00 C ATOM 277 O GLN A 19 -2.754 -15.762 -7.837 1.00 0.00 O ATOM 278 CB GLN A 19 -0.001 -17.195 -8.738 1.00 0.00 C ATOM 279 CG GLN A 19 0.971 -17.392 -9.937 1.00 0.00 C ATOM 280 CD GLN A 19 0.300 -17.719 -11.286 1.00 0.00 C ATOM 281 OE1 GLN A 19 0.888 -18.403 -12.124 1.00 0.00 O ATOM 282 NE2 GLN A 19 -0.921 -17.253 -11.519 1.00 0.00 N ATOM 0 H GLN A 19 1.555 -15.552 -7.768 1.00 0.00 H new ATOM 0 HA GLN A 19 -0.765 -15.281 -9.389 1.00 0.00 H new ATOM 0 HB2 GLN A 19 0.469 -17.598 -7.841 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -0.899 -17.785 -8.920 1.00 0.00 H new ATOM 0 HG2 GLN A 19 1.563 -16.485 -10.056 1.00 0.00 H new ATOM 0 HG3 GLN A 19 1.665 -18.196 -9.692 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -1.394 -16.688 -10.814 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -1.386 -17.460 -12.403 1.00 0.00 H new ATOM 291 N PHE A 20 -1.241 -15.537 -6.148 1.00 0.00 N ATOM 292 CA PHE A 20 -2.233 -15.424 -5.071 1.00 0.00 C ATOM 293 C PHE A 20 -3.018 -14.115 -5.226 1.00 0.00 C ATOM 294 O PHE A 20 -4.246 -14.145 -5.203 1.00 0.00 O ATOM 295 CB PHE A 20 -1.567 -15.481 -3.664 1.00 0.00 C ATOM 296 CG PHE A 20 -2.570 -15.465 -2.487 1.00 0.00 C ATOM 297 CD1 PHE A 20 -3.053 -14.262 -1.948 1.00 0.00 C ATOM 298 CD2 PHE A 20 -3.051 -16.653 -1.940 1.00 0.00 C ATOM 299 CE1 PHE A 20 -3.967 -14.259 -0.910 1.00 0.00 C ATOM 300 CE2 PHE A 20 -3.966 -16.643 -0.906 1.00 0.00 C ATOM 301 CZ PHE A 20 -4.425 -15.450 -0.394 1.00 0.00 C ATOM 0 H PHE A 20 -0.274 -15.501 -5.824 1.00 0.00 H new ATOM 0 HA PHE A 20 -2.912 -16.273 -5.150 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -0.961 -16.384 -3.598 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -0.889 -14.634 -3.561 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -2.705 -13.322 -2.351 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -2.702 -17.597 -2.331 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -4.321 -13.323 -0.505 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -4.324 -17.576 -0.496 1.00 0.00 H new ATOM 0 HZ PHE A 20 -5.144 -15.449 0.412 1.00 0.00 H new ATOM 311 N TYR A 21 -2.309 -12.979 -5.434 1.00 0.00 N ATOM 312 CA TYR A 21 -2.964 -11.671 -5.670 1.00 0.00 C ATOM 313 C TYR A 21 -3.678 -11.666 -7.033 1.00 0.00 C ATOM 314 O TYR A 21 -4.672 -10.943 -7.187 1.00 0.00 O ATOM 315 CB TYR A 21 -1.955 -10.500 -5.524 1.00 0.00 C ATOM 316 CG TYR A 21 -1.749 -10.069 -4.063 1.00 0.00 C ATOM 317 CD1 TYR A 21 -0.784 -10.671 -3.252 1.00 0.00 C ATOM 318 CD2 TYR A 21 -2.551 -9.073 -3.494 1.00 0.00 C ATOM 319 CE1 TYR A 21 -0.625 -10.294 -1.935 1.00 0.00 C ATOM 320 CE2 TYR A 21 -2.391 -8.691 -2.180 1.00 0.00 C ATOM 321 CZ TYR A 21 -1.429 -9.303 -1.408 1.00 0.00 C ATOM 322 OH TYR A 21 -1.284 -8.938 -0.095 1.00 0.00 O ATOM 0 H TYR A 21 -1.290 -12.943 -5.443 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.724 -11.519 -4.904 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -0.996 -10.798 -5.949 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.309 -9.647 -6.103 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -0.152 -11.444 -3.663 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -3.309 -8.595 -4.096 1.00 0.00 H new ATOM 0 HE1 TYR A 21 0.124 -10.771 -1.320 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -3.016 -7.917 -1.759 1.00 0.00 H new ATOM 0 HH TYR A 21 -0.502 -9.390 0.286 1.00 0.00 H new ATOM 332 N LYS A 22 -3.171 -12.436 -8.021 1.00 0.00 N ATOM 333 CA LYS A 22 -3.798 -12.518 -9.360 1.00 0.00 C ATOM 334 C LYS A 22 -5.257 -12.991 -9.284 1.00 0.00 C ATOM 335 O LYS A 22 -6.145 -12.390 -9.874 1.00 0.00 O ATOM 336 CB LYS A 22 -2.982 -13.415 -10.320 1.00 0.00 C ATOM 337 CG LYS A 22 -1.651 -12.797 -10.795 1.00 0.00 C ATOM 338 CD LYS A 22 -0.807 -13.771 -11.652 1.00 0.00 C ATOM 339 CE LYS A 22 -1.481 -14.161 -12.980 1.00 0.00 C ATOM 340 NZ LYS A 22 -0.633 -15.083 -13.787 1.00 0.00 N ATOM 0 H LYS A 22 -2.333 -13.008 -7.918 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.799 -11.506 -9.765 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.771 -14.361 -9.822 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -3.594 -13.643 -11.193 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.860 -11.898 -11.375 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.069 -12.488 -9.927 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.159 -13.312 -11.865 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.611 -14.674 -11.074 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.440 -14.637 -12.774 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.690 -13.261 -13.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -0.584 -14.741 -14.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 0.325 -15.116 -13.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -1.047 -16.037 -13.773 1.00 0.00 H new ATOM 354 N ALA A 23 -5.470 -14.083 -8.526 1.00 0.00 N ATOM 355 CA ALA A 23 -6.812 -14.653 -8.281 1.00 0.00 C ATOM 356 C ALA A 23 -7.607 -13.776 -7.291 1.00 0.00 C ATOM 357 O ALA A 23 -8.812 -13.567 -7.456 1.00 0.00 O ATOM 358 CB ALA A 23 -6.670 -16.090 -7.742 1.00 0.00 C ATOM 0 H ALA A 23 -4.718 -14.596 -8.066 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.364 -14.678 -9.221 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -7.659 -16.510 -7.561 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -6.144 -16.703 -8.474 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.106 -16.075 -6.809 1.00 0.00 H new ATOM 364 N LEU A 24 -6.885 -13.264 -6.276 1.00 0.00 N ATOM 365 CA LEU A 24 -7.452 -12.486 -5.144 1.00 0.00 C ATOM 366 C LEU A 24 -8.146 -11.188 -5.604 1.00 0.00 C ATOM 367 O LEU A 24 -9.096 -10.714 -4.968 1.00 0.00 O ATOM 368 CB LEU A 24 -6.310 -12.110 -4.162 1.00 0.00 C ATOM 369 CG LEU A 24 -6.729 -11.539 -2.771 1.00 0.00 C ATOM 370 CD1 LEU A 24 -7.266 -12.656 -1.863 1.00 0.00 C ATOM 371 CD2 LEU A 24 -5.567 -10.774 -2.099 1.00 0.00 C ATOM 0 H LEU A 24 -5.873 -13.378 -6.213 1.00 0.00 H new ATOM 0 HA LEU A 24 -8.201 -13.115 -4.664 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.702 -12.999 -3.994 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.671 -11.375 -4.651 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.534 -10.822 -2.933 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.552 -12.235 -0.899 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.136 -13.118 -2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.491 -13.409 -1.715 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.895 -10.390 -1.133 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.723 -11.448 -1.955 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.263 -9.943 -2.735 1.00 0.00 H new ATOM 383 N LEU A 25 -7.641 -10.628 -6.715 1.00 0.00 N ATOM 384 CA LEU A 25 -8.208 -9.430 -7.363 1.00 0.00 C ATOM 385 C LEU A 25 -8.944 -9.822 -8.656 1.00 0.00 C ATOM 386 O LEU A 25 -9.887 -9.137 -9.059 1.00 0.00 O ATOM 387 CB LEU A 25 -7.071 -8.416 -7.638 1.00 0.00 C ATOM 388 CG LEU A 25 -6.234 -8.017 -6.378 1.00 0.00 C ATOM 389 CD1 LEU A 25 -5.097 -7.051 -6.735 1.00 0.00 C ATOM 390 CD2 LEU A 25 -7.133 -7.431 -5.280 1.00 0.00 C ATOM 0 H LEU A 25 -6.820 -10.996 -7.195 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.938 -8.961 -6.703 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.399 -8.838 -8.385 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.503 -7.514 -8.071 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.777 -8.927 -5.989 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.539 -6.797 -5.834 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.429 -7.525 -7.454 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.514 -6.143 -7.171 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.525 -7.163 -4.416 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.638 -6.542 -5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.876 -8.172 -4.984 1.00 0.00 H new ATOM 402 N GLY A 26 -8.501 -10.913 -9.298 1.00 0.00 N ATOM 403 CA GLY A 26 -9.014 -11.324 -10.614 1.00 0.00 C ATOM 404 C GLY A 26 -8.272 -10.654 -11.773 1.00 0.00 C ATOM 405 O GLY A 26 -8.798 -10.576 -12.892 1.00 0.00 O ATOM 0 H GLY A 26 -7.782 -11.532 -8.923 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -8.929 -12.406 -10.711 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.075 -11.081 -10.678 1.00 0.00 H new ATOM 409 N VAL A 27 -7.033 -10.188 -11.504 1.00 0.00 N ATOM 410 CA VAL A 27 -6.197 -9.437 -12.477 1.00 0.00 C ATOM 411 C VAL A 27 -4.908 -10.226 -12.828 1.00 0.00 C ATOM 412 O VAL A 27 -4.714 -11.342 -12.344 1.00 0.00 O ATOM 413 CB VAL A 27 -5.825 -8.013 -11.913 1.00 0.00 C ATOM 414 CG1 VAL A 27 -7.102 -7.202 -11.577 1.00 0.00 C ATOM 415 CG2 VAL A 27 -4.865 -8.105 -10.693 1.00 0.00 C ATOM 0 H VAL A 27 -6.578 -10.321 -10.601 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.782 -9.309 -13.388 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.286 -7.479 -12.696 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -6.820 -6.223 -11.190 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.701 -7.076 -12.479 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.685 -7.735 -10.826 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.634 -7.102 -10.335 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.344 -8.673 -9.895 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.944 -8.605 -10.992 1.00 0.00 H new ATOM 425 N ASP A 28 -4.047 -9.635 -13.682 1.00 0.00 N ATOM 426 CA ASP A 28 -2.719 -10.188 -14.031 1.00 0.00 C ATOM 427 C ASP A 28 -1.666 -9.053 -13.987 1.00 0.00 C ATOM 428 O ASP A 28 -2.032 -7.878 -14.155 1.00 0.00 O ATOM 429 CB ASP A 28 -2.763 -10.872 -15.434 1.00 0.00 C ATOM 430 CG ASP A 28 -2.999 -9.897 -16.605 1.00 0.00 C ATOM 431 OD1 ASP A 28 -4.153 -9.467 -16.813 1.00 0.00 O ATOM 432 OD2 ASP A 28 -2.032 -9.563 -17.334 1.00 0.00 O ATOM 0 H ASP A 28 -4.254 -8.754 -14.153 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.438 -10.952 -13.306 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -1.823 -11.399 -15.598 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -3.554 -11.622 -15.435 1.00 0.00 H new ATOM 437 N PRO A 29 -0.348 -9.358 -13.735 1.00 0.00 N ATOM 438 CA PRO A 29 0.713 -8.332 -13.695 1.00 0.00 C ATOM 439 C PRO A 29 1.041 -7.782 -15.095 1.00 0.00 C ATOM 440 O PRO A 29 1.164 -8.557 -16.052 1.00 0.00 O ATOM 441 CB PRO A 29 1.940 -9.075 -13.064 1.00 0.00 C ATOM 442 CG PRO A 29 1.392 -10.386 -12.565 1.00 0.00 C ATOM 443 CD PRO A 29 0.220 -10.698 -13.471 1.00 0.00 C ATOM 0 HA PRO A 29 0.414 -7.456 -13.119 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.727 -9.232 -13.801 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.376 -8.495 -12.251 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.146 -11.171 -12.613 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.076 -10.310 -11.525 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.538 -11.192 -14.389 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -0.502 -11.357 -12.988 1.00 0.00 H new ATOM 451 N VAL A 30 1.148 -6.445 -15.207 1.00 0.00 N ATOM 452 CA VAL A 30 1.647 -5.777 -16.424 1.00 0.00 C ATOM 453 C VAL A 30 3.158 -6.056 -16.573 1.00 0.00 C ATOM 454 O VAL A 30 3.640 -6.382 -17.664 1.00 0.00 O ATOM 455 CB VAL A 30 1.345 -4.220 -16.420 1.00 0.00 C ATOM 456 CG1 VAL A 30 1.896 -3.512 -15.157 1.00 0.00 C ATOM 457 CG2 VAL A 30 1.858 -3.535 -17.716 1.00 0.00 C ATOM 0 H VAL A 30 0.892 -5.799 -14.460 1.00 0.00 H new ATOM 0 HA VAL A 30 1.117 -6.187 -17.284 1.00 0.00 H new ATOM 0 HB VAL A 30 0.260 -4.116 -16.393 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.662 -2.448 -15.205 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.437 -3.945 -14.268 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.977 -3.644 -15.108 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.633 -2.469 -17.678 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.936 -3.676 -17.800 1.00 0.00 H new ATOM 0 HG23 VAL A 30 1.366 -3.979 -18.581 1.00 0.00 H new ATOM 467 N GLU A 31 3.874 -5.986 -15.438 1.00 0.00 N ATOM 468 CA GLU A 31 5.323 -6.224 -15.358 1.00 0.00 C ATOM 469 C GLU A 31 5.588 -7.368 -14.372 1.00 0.00 C ATOM 470 O GLU A 31 4.898 -7.483 -13.350 1.00 0.00 O ATOM 471 CB GLU A 31 6.056 -4.943 -14.876 1.00 0.00 C ATOM 472 CG GLU A 31 5.840 -3.684 -15.740 1.00 0.00 C ATOM 473 CD GLU A 31 6.345 -3.842 -17.186 1.00 0.00 C ATOM 474 OE1 GLU A 31 7.574 -3.825 -17.394 1.00 0.00 O ATOM 475 OE2 GLU A 31 5.521 -3.967 -18.117 1.00 0.00 O ATOM 0 H GLU A 31 3.454 -5.759 -14.537 1.00 0.00 H new ATOM 0 HA GLU A 31 5.697 -6.489 -16.347 1.00 0.00 H new ATOM 0 HB2 GLU A 31 5.733 -4.723 -13.859 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.125 -5.153 -14.833 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.777 -3.443 -15.758 1.00 0.00 H new ATOM 0 HG3 GLU A 31 6.350 -2.841 -15.275 1.00 0.00 H new ATOM 482 N SER A 32 6.592 -8.200 -14.679 1.00 0.00 N ATOM 483 CA SER A 32 7.031 -9.295 -13.800 1.00 0.00 C ATOM 484 C SER A 32 8.564 -9.383 -13.829 1.00 0.00 C ATOM 485 O SER A 32 9.187 -9.192 -14.876 1.00 0.00 O ATOM 486 CB SER A 32 6.379 -10.635 -14.217 1.00 0.00 C ATOM 487 OG SER A 32 6.691 -10.988 -15.555 1.00 0.00 O ATOM 0 H SER A 32 7.125 -8.133 -15.546 1.00 0.00 H new ATOM 0 HA SER A 32 6.710 -9.089 -12.779 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.716 -11.425 -13.546 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.297 -10.561 -14.105 1.00 0.00 H new ATOM 0 HG SER A 32 6.261 -11.840 -15.777 1.00 0.00 H new ATOM 493 N SER A 33 9.147 -9.653 -12.662 1.00 0.00 N ATOM 494 CA SER A 33 10.602 -9.708 -12.446 1.00 0.00 C ATOM 495 C SER A 33 10.910 -10.820 -11.423 1.00 0.00 C ATOM 496 O SER A 33 9.991 -11.243 -10.704 1.00 0.00 O ATOM 497 CB SER A 33 11.090 -8.327 -11.943 1.00 0.00 C ATOM 498 OG SER A 33 10.831 -7.323 -12.904 1.00 0.00 O ATOM 0 H SER A 33 8.612 -9.845 -11.815 1.00 0.00 H new ATOM 0 HA SER A 33 11.125 -9.938 -13.375 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.590 -8.078 -11.007 1.00 0.00 H new ATOM 0 HB3 SER A 33 12.159 -8.368 -11.732 1.00 0.00 H new ATOM 0 HG SER A 33 10.322 -6.596 -12.488 1.00 0.00 H new ATOM 504 N PRO A 34 12.198 -11.323 -11.333 1.00 0.00 N ATOM 505 CA PRO A 34 12.581 -12.414 -10.392 1.00 0.00 C ATOM 506 C PRO A 34 12.184 -12.133 -8.921 1.00 0.00 C ATOM 507 O PRO A 34 11.941 -13.077 -8.176 1.00 0.00 O ATOM 508 CB PRO A 34 14.134 -12.524 -10.557 1.00 0.00 C ATOM 509 CG PRO A 34 14.535 -11.253 -11.245 1.00 0.00 C ATOM 510 CD PRO A 34 13.374 -10.911 -12.149 1.00 0.00 C ATOM 0 HA PRO A 34 12.055 -13.340 -10.626 1.00 0.00 H new ATOM 0 HB2 PRO A 34 14.629 -12.624 -9.591 1.00 0.00 H new ATOM 0 HB3 PRO A 34 14.409 -13.398 -11.148 1.00 0.00 H new ATOM 0 HG2 PRO A 34 14.721 -10.457 -10.524 1.00 0.00 H new ATOM 0 HG3 PRO A 34 15.453 -11.387 -11.817 1.00 0.00 H new ATOM 0 HD2 PRO A 34 13.348 -9.849 -12.391 1.00 0.00 H new ATOM 0 HD3 PRO A 34 13.422 -11.452 -13.094 1.00 0.00 H new ATOM 518 N THR A 35 12.121 -10.838 -8.513 1.00 0.00 N ATOM 519 CA THR A 35 11.816 -10.461 -7.112 1.00 0.00 C ATOM 520 C THR A 35 10.658 -9.439 -6.967 1.00 0.00 C ATOM 521 O THR A 35 10.253 -9.127 -5.840 1.00 0.00 O ATOM 522 CB THR A 35 13.106 -9.904 -6.417 1.00 0.00 C ATOM 523 OG1 THR A 35 12.894 -9.732 -5.003 1.00 0.00 O ATOM 524 CG2 THR A 35 13.575 -8.566 -7.038 1.00 0.00 C ATOM 0 H THR A 35 12.277 -10.043 -9.133 1.00 0.00 H new ATOM 0 HA THR A 35 11.477 -11.374 -6.622 1.00 0.00 H new ATOM 0 HB THR A 35 13.891 -10.643 -6.578 1.00 0.00 H new ATOM 0 HG1 THR A 35 13.345 -10.452 -4.515 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.471 -8.220 -6.523 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.798 -8.714 -8.095 1.00 0.00 H new ATOM 0 HG23 THR A 35 12.787 -7.820 -6.934 1.00 0.00 H new ATOM 532 N PHE A 36 10.095 -8.942 -8.091 1.00 0.00 N ATOM 533 CA PHE A 36 9.066 -7.872 -8.045 1.00 0.00 C ATOM 534 C PHE A 36 7.955 -8.150 -9.073 1.00 0.00 C ATOM 535 O PHE A 36 8.226 -8.597 -10.187 1.00 0.00 O ATOM 536 CB PHE A 36 9.706 -6.465 -8.288 1.00 0.00 C ATOM 537 CG PHE A 36 8.775 -5.269 -7.976 1.00 0.00 C ATOM 538 CD1 PHE A 36 7.858 -4.788 -8.912 1.00 0.00 C ATOM 539 CD2 PHE A 36 8.809 -4.641 -6.737 1.00 0.00 C ATOM 540 CE1 PHE A 36 7.023 -3.727 -8.621 1.00 0.00 C ATOM 541 CE2 PHE A 36 7.971 -3.584 -6.448 1.00 0.00 C ATOM 542 CZ PHE A 36 7.079 -3.130 -7.389 1.00 0.00 C ATOM 0 H PHE A 36 10.330 -9.258 -9.032 1.00 0.00 H new ATOM 0 HA PHE A 36 8.623 -7.870 -7.049 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.604 -6.379 -7.676 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.023 -6.400 -9.329 1.00 0.00 H new ATOM 0 HD1 PHE A 36 7.800 -5.255 -9.884 1.00 0.00 H new ATOM 0 HD2 PHE A 36 9.504 -4.987 -5.986 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.326 -3.368 -9.364 1.00 0.00 H new ATOM 0 HE2 PHE A 36 8.016 -3.111 -5.478 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.423 -2.304 -7.158 1.00 0.00 H new ATOM 552 N SER A 37 6.713 -7.863 -8.674 1.00 0.00 N ATOM 553 CA SER A 37 5.522 -7.976 -9.519 1.00 0.00 C ATOM 554 C SER A 37 4.793 -6.629 -9.526 1.00 0.00 C ATOM 555 O SER A 37 4.659 -5.992 -8.483 1.00 0.00 O ATOM 556 CB SER A 37 4.594 -9.073 -8.966 1.00 0.00 C ATOM 557 OG SER A 37 3.384 -9.145 -9.706 1.00 0.00 O ATOM 0 H SER A 37 6.503 -7.537 -7.730 1.00 0.00 H new ATOM 0 HA SER A 37 5.812 -8.242 -10.535 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.103 -10.036 -9.003 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.371 -8.870 -7.919 1.00 0.00 H new ATOM 0 HG SER A 37 2.625 -8.975 -9.110 1.00 0.00 H new ATOM 563 N LEU A 38 4.319 -6.206 -10.697 1.00 0.00 N ATOM 564 CA LEU A 38 3.572 -4.953 -10.861 1.00 0.00 C ATOM 565 C LEU A 38 2.260 -5.271 -11.586 1.00 0.00 C ATOM 566 O LEU A 38 2.275 -5.680 -12.743 1.00 0.00 O ATOM 567 CB LEU A 38 4.447 -3.914 -11.615 1.00 0.00 C ATOM 568 CG LEU A 38 3.778 -2.553 -12.014 1.00 0.00 C ATOM 569 CD1 LEU A 38 2.940 -1.964 -10.864 1.00 0.00 C ATOM 570 CD2 LEU A 38 4.849 -1.540 -12.496 1.00 0.00 C ATOM 0 H LEU A 38 4.442 -6.725 -11.567 1.00 0.00 H new ATOM 0 HA LEU A 38 3.326 -4.507 -9.897 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.315 -3.692 -10.994 1.00 0.00 H new ATOM 0 HB3 LEU A 38 4.818 -4.385 -12.525 1.00 0.00 H new ATOM 0 HG LEU A 38 3.094 -2.753 -12.838 1.00 0.00 H new ATOM 0 HD11 LEU A 38 2.495 -1.022 -11.184 1.00 0.00 H new ATOM 0 HD12 LEU A 38 2.150 -2.665 -10.593 1.00 0.00 H new ATOM 0 HD13 LEU A 38 3.581 -1.788 -10.000 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.366 -0.602 -12.769 1.00 0.00 H new ATOM 0 HD22 LEU A 38 5.566 -1.360 -11.695 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.369 -1.946 -13.364 1.00 0.00 H new ATOM 582 N PHE A 39 1.141 -5.079 -10.877 1.00 0.00 N ATOM 583 CA PHE A 39 -0.226 -5.297 -11.381 1.00 0.00 C ATOM 584 C PHE A 39 -1.070 -4.041 -11.075 1.00 0.00 C ATOM 585 O PHE A 39 -1.381 -3.732 -9.920 1.00 0.00 O ATOM 586 CB PHE A 39 -0.847 -6.605 -10.769 1.00 0.00 C ATOM 587 CG PHE A 39 -0.672 -6.777 -9.250 1.00 0.00 C ATOM 588 CD1 PHE A 39 0.577 -7.088 -8.707 1.00 0.00 C ATOM 589 CD2 PHE A 39 -1.747 -6.628 -8.366 1.00 0.00 C ATOM 590 CE1 PHE A 39 0.743 -7.239 -7.353 1.00 0.00 C ATOM 591 CE2 PHE A 39 -1.568 -6.788 -7.002 1.00 0.00 C ATOM 592 CZ PHE A 39 -0.327 -7.091 -6.498 1.00 0.00 C ATOM 0 H PHE A 39 1.159 -4.759 -9.909 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.210 -5.447 -12.460 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -1.913 -6.621 -10.998 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.401 -7.465 -11.268 1.00 0.00 H new ATOM 0 HD1 PHE A 39 1.426 -7.212 -9.363 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -2.726 -6.386 -8.752 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.719 -7.475 -6.955 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -2.408 -6.674 -6.332 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.190 -7.213 -5.434 1.00 0.00 H new ATOM 602 N VAL A 40 -1.380 -3.295 -12.142 1.00 0.00 N ATOM 603 CA VAL A 40 -2.155 -2.050 -12.077 1.00 0.00 C ATOM 604 C VAL A 40 -3.657 -2.359 -12.221 1.00 0.00 C ATOM 605 O VAL A 40 -4.034 -3.154 -13.089 1.00 0.00 O ATOM 606 CB VAL A 40 -1.725 -1.065 -13.236 1.00 0.00 C ATOM 607 CG1 VAL A 40 -2.367 0.338 -13.067 1.00 0.00 C ATOM 608 CG2 VAL A 40 -0.181 -0.976 -13.357 1.00 0.00 C ATOM 0 H VAL A 40 -1.095 -3.543 -13.089 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.961 -1.579 -11.113 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.104 -1.479 -14.171 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.047 0.985 -13.883 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.453 0.245 -13.082 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.053 0.770 -12.117 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.082 -0.291 -14.163 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.237 -0.610 -12.419 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.224 -1.964 -13.574 1.00 0.00 H new ATOM 618 N LEU A 41 -4.501 -1.753 -11.369 1.00 0.00 N ATOM 619 CA LEU A 41 -5.939 -2.077 -11.309 1.00 0.00 C ATOM 620 C LEU A 41 -6.756 -1.100 -12.169 1.00 0.00 C ATOM 621 O LEU A 41 -6.490 0.114 -12.179 1.00 0.00 O ATOM 622 CB LEU A 41 -6.450 -2.075 -9.841 1.00 0.00 C ATOM 623 CG LEU A 41 -5.724 -3.055 -8.857 1.00 0.00 C ATOM 624 CD1 LEU A 41 -6.405 -3.069 -7.474 1.00 0.00 C ATOM 625 CD2 LEU A 41 -5.626 -4.479 -9.440 1.00 0.00 C ATOM 0 H LEU A 41 -4.211 -1.032 -10.708 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.073 -3.081 -11.712 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.358 -1.063 -9.447 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.512 -2.319 -9.847 1.00 0.00 H new ATOM 0 HG LEU A 41 -4.708 -2.684 -8.725 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -5.877 -3.759 -6.815 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.380 -2.067 -7.046 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.441 -3.391 -7.582 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.117 -5.129 -8.729 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.628 -4.864 -9.630 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.064 -4.452 -10.374 1.00 0.00 H new ATOM 637 N ALA A 42 -7.774 -1.649 -12.868 1.00 0.00 N ATOM 638 CA ALA A 42 -8.690 -0.890 -13.758 1.00 0.00 C ATOM 639 C ALA A 42 -9.629 0.057 -12.966 1.00 0.00 C ATOM 640 O ALA A 42 -10.387 0.837 -13.556 1.00 0.00 O ATOM 641 CB ALA A 42 -9.505 -1.881 -14.612 1.00 0.00 C ATOM 0 H ALA A 42 -7.988 -2.646 -12.831 1.00 0.00 H new ATOM 0 HA ALA A 42 -8.086 -0.256 -14.407 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.179 -1.328 -15.267 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -8.827 -2.485 -15.215 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -10.086 -2.532 -13.959 1.00 0.00 H new ATOM 647 N ASN A 43 -9.574 -0.039 -11.625 1.00 0.00 N ATOM 648 CA ASN A 43 -10.283 0.859 -10.690 1.00 0.00 C ATOM 649 C ASN A 43 -9.677 2.290 -10.728 1.00 0.00 C ATOM 650 O ASN A 43 -10.313 3.246 -10.279 1.00 0.00 O ATOM 651 CB ASN A 43 -10.219 0.237 -9.257 1.00 0.00 C ATOM 652 CG ASN A 43 -11.052 0.943 -8.179 1.00 0.00 C ATOM 653 OD1 ASN A 43 -11.975 1.705 -8.467 1.00 0.00 O ATOM 654 ND2 ASN A 43 -10.771 0.629 -6.918 1.00 0.00 N ATOM 0 H ASN A 43 -9.026 -0.756 -11.150 1.00 0.00 H new ATOM 0 HA ASN A 43 -11.327 0.956 -10.987 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -10.546 -0.801 -9.318 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.178 0.225 -8.934 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -11.327 1.022 -6.158 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -10.000 -0.005 -6.710 1.00 0.00 H new ATOM 661 N GLY A 44 -8.455 2.421 -11.307 1.00 0.00 N ATOM 662 CA GLY A 44 -7.766 3.717 -11.440 1.00 0.00 C ATOM 663 C GLY A 44 -6.592 3.874 -10.479 1.00 0.00 C ATOM 664 O GLY A 44 -6.108 4.992 -10.261 1.00 0.00 O ATOM 0 H GLY A 44 -7.930 1.635 -11.689 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -7.407 3.827 -12.463 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -8.481 4.521 -11.265 1.00 0.00 H new ATOM 668 N MET A 45 -6.121 2.747 -9.912 1.00 0.00 N ATOM 669 CA MET A 45 -5.005 2.729 -8.937 1.00 0.00 C ATOM 670 C MET A 45 -3.920 1.745 -9.413 1.00 0.00 C ATOM 671 O MET A 45 -4.108 1.050 -10.418 1.00 0.00 O ATOM 672 CB MET A 45 -5.554 2.351 -7.529 1.00 0.00 C ATOM 673 CG MET A 45 -5.999 0.883 -7.374 1.00 0.00 C ATOM 674 SD MET A 45 -4.627 -0.244 -7.017 1.00 0.00 S ATOM 675 CE MET A 45 -4.108 0.301 -5.385 1.00 0.00 C ATOM 0 H MET A 45 -6.501 1.822 -10.114 1.00 0.00 H new ATOM 0 HA MET A 45 -4.549 3.717 -8.865 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.784 2.561 -6.787 1.00 0.00 H new ATOM 0 HB3 MET A 45 -6.401 2.998 -7.301 1.00 0.00 H new ATOM 0 HG2 MET A 45 -6.734 0.816 -6.572 1.00 0.00 H new ATOM 0 HG3 MET A 45 -6.496 0.562 -8.290 1.00 0.00 H new ATOM 0 HE1 MET A 45 -3.915 -0.568 -4.756 1.00 0.00 H new ATOM 0 HE2 MET A 45 -3.198 0.895 -5.472 1.00 0.00 H new ATOM 0 HE3 MET A 45 -4.895 0.906 -4.936 1.00 0.00 H new ATOM 685 N LYS A 46 -2.801 1.674 -8.678 1.00 0.00 N ATOM 686 CA LYS A 46 -1.629 0.873 -9.075 1.00 0.00 C ATOM 687 C LYS A 46 -1.110 0.066 -7.865 1.00 0.00 C ATOM 688 O LYS A 46 -0.994 0.614 -6.763 1.00 0.00 O ATOM 689 CB LYS A 46 -0.559 1.846 -9.639 1.00 0.00 C ATOM 690 CG LYS A 46 0.629 1.178 -10.348 1.00 0.00 C ATOM 691 CD LYS A 46 1.492 2.204 -11.113 1.00 0.00 C ATOM 692 CE LYS A 46 2.604 1.558 -11.951 1.00 0.00 C ATOM 693 NZ LYS A 46 3.311 2.551 -12.791 1.00 0.00 N ATOM 0 H LYS A 46 -2.681 2.168 -7.794 1.00 0.00 H new ATOM 0 HA LYS A 46 -1.887 0.148 -9.847 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.044 2.526 -10.340 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.176 2.454 -8.819 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.246 0.660 -9.614 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.260 0.424 -11.043 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.849 2.793 -11.767 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.940 2.896 -10.399 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.318 1.068 -11.290 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.176 0.784 -12.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.568 2.116 -13.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 2.690 3.367 -12.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 4.173 2.868 -12.303 1.00 0.00 H new ATOM 707 N LEU A 47 -0.801 -1.237 -8.071 1.00 0.00 N ATOM 708 CA LEU A 47 -0.419 -2.158 -6.965 1.00 0.00 C ATOM 709 C LEU A 47 0.876 -2.941 -7.317 1.00 0.00 C ATOM 710 O LEU A 47 1.104 -3.303 -8.472 1.00 0.00 O ATOM 711 CB LEU A 47 -1.612 -3.122 -6.626 1.00 0.00 C ATOM 712 CG LEU A 47 -2.051 -3.185 -5.122 1.00 0.00 C ATOM 713 CD1 LEU A 47 -3.377 -3.958 -4.974 1.00 0.00 C ATOM 714 CD2 LEU A 47 -0.944 -3.790 -4.217 1.00 0.00 C ATOM 0 H LEU A 47 -0.808 -1.677 -8.991 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.203 -1.568 -6.074 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.474 -2.821 -7.221 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.340 -4.128 -6.945 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.211 -2.161 -4.785 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.664 -3.990 -3.923 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.156 -3.457 -5.548 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.249 -4.974 -5.347 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.291 -3.814 -3.184 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -0.717 -4.804 -4.548 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -0.045 -3.177 -4.283 1.00 0.00 H new ATOM 726 N GLY A 48 1.722 -3.164 -6.288 1.00 0.00 N ATOM 727 CA GLY A 48 3.012 -3.872 -6.417 1.00 0.00 C ATOM 728 C GLY A 48 3.128 -5.034 -5.431 1.00 0.00 C ATOM 729 O GLY A 48 2.335 -5.145 -4.490 1.00 0.00 O ATOM 0 H GLY A 48 1.526 -2.854 -5.336 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.119 -4.248 -7.435 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.829 -3.171 -6.249 1.00 0.00 H new ATOM 733 N LEU A 49 4.175 -5.865 -5.643 1.00 0.00 N ATOM 734 CA LEU A 49 4.695 -6.854 -4.671 1.00 0.00 C ATOM 735 C LEU A 49 6.231 -6.841 -4.764 1.00 0.00 C ATOM 736 O LEU A 49 6.767 -6.932 -5.865 1.00 0.00 O ATOM 737 CB LEU A 49 4.178 -8.300 -4.939 1.00 0.00 C ATOM 738 CG LEU A 49 2.656 -8.554 -4.717 1.00 0.00 C ATOM 739 CD1 LEU A 49 2.287 -10.016 -5.030 1.00 0.00 C ATOM 740 CD2 LEU A 49 2.200 -8.148 -3.297 1.00 0.00 C ATOM 0 H LEU A 49 4.696 -5.866 -6.520 1.00 0.00 H new ATOM 0 HA LEU A 49 4.343 -6.573 -3.678 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.420 -8.562 -5.969 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.734 -8.984 -4.298 1.00 0.00 H new ATOM 0 HG LEU A 49 2.117 -7.915 -5.416 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.220 -10.165 -4.867 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.529 -10.238 -6.069 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.850 -10.681 -4.376 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.133 -8.343 -3.188 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.752 -8.728 -2.558 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.393 -7.086 -3.143 1.00 0.00 H new ATOM 752 N TRP A 50 6.935 -6.732 -3.617 1.00 0.00 N ATOM 753 CA TRP A 50 8.417 -6.785 -3.571 1.00 0.00 C ATOM 754 C TRP A 50 8.855 -7.827 -2.540 1.00 0.00 C ATOM 755 O TRP A 50 8.425 -7.784 -1.388 1.00 0.00 O ATOM 756 CB TRP A 50 9.024 -5.393 -3.216 1.00 0.00 C ATOM 757 CG TRP A 50 10.482 -5.195 -3.629 1.00 0.00 C ATOM 758 CD1 TRP A 50 11.354 -6.122 -4.154 1.00 0.00 C ATOM 759 CD2 TRP A 50 11.215 -3.967 -3.568 1.00 0.00 C ATOM 760 NE1 TRP A 50 12.559 -5.532 -4.428 1.00 0.00 N ATOM 761 CE2 TRP A 50 12.497 -4.210 -4.081 1.00 0.00 C ATOM 762 CE3 TRP A 50 10.898 -2.683 -3.140 1.00 0.00 C ATOM 763 CZ2 TRP A 50 13.462 -3.214 -4.162 1.00 0.00 C ATOM 764 CZ3 TRP A 50 11.852 -1.691 -3.217 1.00 0.00 C ATOM 765 CH2 TRP A 50 13.120 -1.959 -3.726 1.00 0.00 C ATOM 0 H TRP A 50 6.500 -6.606 -2.703 1.00 0.00 H new ATOM 0 HA TRP A 50 8.784 -7.065 -4.558 1.00 0.00 H new ATOM 0 HB2 TRP A 50 8.420 -4.619 -3.691 1.00 0.00 H new ATOM 0 HB3 TRP A 50 8.944 -5.244 -2.139 1.00 0.00 H new ATOM 0 HD1 TRP A 50 11.122 -7.163 -4.325 1.00 0.00 H new ATOM 0 HE1 TRP A 50 13.372 -6.002 -4.827 1.00 0.00 H new ATOM 0 HE3 TRP A 50 9.914 -2.465 -2.751 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 14.447 -3.420 -4.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 11.613 -0.694 -2.878 1.00 0.00 H new ATOM 0 HH2 TRP A 50 13.848 -1.163 -3.779 1.00 0.00 H new ATOM 776 N SER A 51 9.733 -8.745 -2.950 1.00 0.00 N ATOM 777 CA SER A 51 10.234 -9.810 -2.083 1.00 0.00 C ATOM 778 C SER A 51 11.363 -9.289 -1.159 1.00 0.00 C ATOM 779 O SER A 51 12.372 -8.752 -1.641 1.00 0.00 O ATOM 780 CB SER A 51 10.678 -11.004 -2.938 1.00 0.00 C ATOM 781 OG SER A 51 9.597 -11.475 -3.724 1.00 0.00 O ATOM 0 H SER A 51 10.116 -8.770 -3.895 1.00 0.00 H new ATOM 0 HA SER A 51 9.433 -10.150 -1.426 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.505 -10.710 -3.584 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.045 -11.804 -2.295 1.00 0.00 H new ATOM 0 HG SER A 51 9.501 -10.911 -4.519 1.00 0.00 H new ATOM 787 N ARG A 52 11.175 -9.487 0.162 1.00 0.00 N ATOM 788 CA ARG A 52 11.965 -8.836 1.237 1.00 0.00 C ATOM 789 C ARG A 52 13.461 -9.250 1.270 1.00 0.00 C ATOM 790 O ARG A 52 14.272 -8.577 1.913 1.00 0.00 O ATOM 791 CB ARG A 52 11.321 -9.141 2.618 1.00 0.00 C ATOM 792 CG ARG A 52 11.338 -10.638 3.009 1.00 0.00 C ATOM 793 CD ARG A 52 10.918 -10.896 4.461 1.00 0.00 C ATOM 794 NE ARG A 52 11.124 -12.315 4.812 1.00 0.00 N ATOM 795 CZ ARG A 52 11.371 -12.793 6.037 1.00 0.00 C ATOM 796 NH1 ARG A 52 11.407 -11.991 7.095 1.00 0.00 N ATOM 797 NH2 ARG A 52 11.592 -14.088 6.200 1.00 0.00 N ATOM 0 H ARG A 52 10.457 -10.115 0.522 1.00 0.00 H new ATOM 0 HA ARG A 52 11.945 -7.769 1.017 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.845 -8.571 3.385 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.289 -8.791 2.610 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.672 -11.187 2.343 1.00 0.00 H new ATOM 0 HG3 ARG A 52 12.341 -11.035 2.853 1.00 0.00 H new ATOM 0 HD2 ARG A 52 11.497 -10.261 5.132 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.870 -10.630 4.596 1.00 0.00 H new ATOM 0 HE ARG A 52 11.073 -12.993 4.051 1.00 0.00 H new ATOM 0 HH11 ARG A 52 11.245 -10.990 6.982 1.00 0.00 H new ATOM 0 HH12 ARG A 52 11.597 -12.376 8.020 1.00 0.00 H new ATOM 0 HH21 ARG A 52 11.573 -14.714 5.395 1.00 0.00 H new ATOM 0 HH22 ARG A 52 11.781 -14.460 7.131 1.00 0.00 H new ATOM 811 N HIS A 53 13.813 -10.352 0.580 1.00 0.00 N ATOM 812 CA HIS A 53 15.184 -10.922 0.603 1.00 0.00 C ATOM 813 C HIS A 53 16.197 -9.983 -0.090 1.00 0.00 C ATOM 814 O HIS A 53 17.394 -10.046 0.186 1.00 0.00 O ATOM 815 CB HIS A 53 15.219 -12.334 -0.057 1.00 0.00 C ATOM 816 CG HIS A 53 15.086 -12.334 -1.557 1.00 0.00 C ATOM 817 ND1 HIS A 53 16.088 -12.764 -2.402 1.00 0.00 N ATOM 818 CD2 HIS A 53 14.074 -11.935 -2.357 1.00 0.00 C ATOM 819 CE1 HIS A 53 15.697 -12.621 -3.650 1.00 0.00 C ATOM 820 NE2 HIS A 53 14.479 -12.119 -3.647 1.00 0.00 N ATOM 0 H HIS A 53 13.163 -10.874 -0.008 1.00 0.00 H new ATOM 0 HA HIS A 53 15.473 -11.023 1.649 1.00 0.00 H new ATOM 0 HB2 HIS A 53 16.157 -12.821 0.210 1.00 0.00 H new ATOM 0 HB3 HIS A 53 14.415 -12.937 0.365 1.00 0.00 H new ATOM 0 HD1 HIS A 53 16.991 -13.135 -2.106 1.00 0.00 H new ATOM 0 HD2 HIS A 53 13.121 -11.543 -2.035 1.00 0.00 H new ATOM 0 HE1 HIS A 53 16.275 -12.872 -4.527 1.00 0.00 H new ATOM 829 N THR A 54 15.698 -9.120 -1.004 1.00 0.00 N ATOM 830 CA THR A 54 16.539 -8.161 -1.741 1.00 0.00 C ATOM 831 C THR A 54 15.783 -6.826 -1.957 1.00 0.00 C ATOM 832 O THR A 54 16.125 -6.038 -2.855 1.00 0.00 O ATOM 833 CB THR A 54 17.036 -8.785 -3.099 1.00 0.00 C ATOM 834 OG1 THR A 54 18.041 -7.953 -3.700 1.00 0.00 O ATOM 835 CG2 THR A 54 15.895 -8.994 -4.099 1.00 0.00 C ATOM 0 H THR A 54 14.709 -9.072 -1.247 1.00 0.00 H new ATOM 0 HA THR A 54 17.424 -7.940 -1.144 1.00 0.00 H new ATOM 0 HB THR A 54 17.456 -9.761 -2.856 1.00 0.00 H new ATOM 0 HG1 THR A 54 17.775 -7.013 -3.624 1.00 0.00 H new ATOM 0 HG21 THR A 54 16.291 -9.426 -5.018 1.00 0.00 H new ATOM 0 HG22 THR A 54 15.155 -9.669 -3.670 1.00 0.00 H new ATOM 0 HG23 THR A 54 15.426 -8.036 -4.322 1.00 0.00 H new ATOM 843 N VAL A 55 14.772 -6.563 -1.084 1.00 0.00 N ATOM 844 CA VAL A 55 14.109 -5.238 -0.990 1.00 0.00 C ATOM 845 C VAL A 55 15.170 -4.153 -0.679 1.00 0.00 C ATOM 846 O VAL A 55 16.212 -4.462 -0.102 1.00 0.00 O ATOM 847 CB VAL A 55 12.948 -5.238 0.098 1.00 0.00 C ATOM 848 CG1 VAL A 55 13.486 -5.445 1.535 1.00 0.00 C ATOM 849 CG2 VAL A 55 12.068 -3.964 0.024 1.00 0.00 C ATOM 0 H VAL A 55 14.400 -7.256 -0.435 1.00 0.00 H new ATOM 0 HA VAL A 55 13.640 -5.014 -1.948 1.00 0.00 H new ATOM 0 HB VAL A 55 12.316 -6.092 -0.146 1.00 0.00 H new ATOM 0 HG11 VAL A 55 12.654 -5.437 2.240 1.00 0.00 H new ATOM 0 HG12 VAL A 55 14.004 -6.402 1.595 1.00 0.00 H new ATOM 0 HG13 VAL A 55 14.179 -4.641 1.783 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.291 -4.014 0.787 1.00 0.00 H new ATOM 0 HG22 VAL A 55 12.688 -3.083 0.194 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.606 -3.898 -0.961 1.00 0.00 H new ATOM 859 N GLU A 56 14.951 -2.907 -1.128 1.00 0.00 N ATOM 860 CA GLU A 56 15.919 -1.800 -0.927 1.00 0.00 C ATOM 861 C GLU A 56 15.214 -0.595 -0.269 1.00 0.00 C ATOM 862 O GLU A 56 14.283 -0.038 -0.864 1.00 0.00 O ATOM 863 CB GLU A 56 16.633 -1.423 -2.261 1.00 0.00 C ATOM 864 CG GLU A 56 17.639 -2.506 -2.728 1.00 0.00 C ATOM 865 CD GLU A 56 18.479 -2.150 -3.967 1.00 0.00 C ATOM 866 OE1 GLU A 56 19.095 -1.061 -3.987 1.00 0.00 O ATOM 867 OE2 GLU A 56 18.574 -2.972 -4.906 1.00 0.00 O ATOM 0 H GLU A 56 14.110 -2.633 -1.636 1.00 0.00 H new ATOM 0 HA GLU A 56 16.703 -2.133 -0.247 1.00 0.00 H new ATOM 0 HB2 GLU A 56 15.884 -1.269 -3.038 1.00 0.00 H new ATOM 0 HB3 GLU A 56 17.158 -0.477 -2.132 1.00 0.00 H new ATOM 0 HG2 GLU A 56 18.317 -2.725 -1.903 1.00 0.00 H new ATOM 0 HG3 GLU A 56 17.087 -3.422 -2.938 1.00 0.00 H new ATOM 874 N PRO A 57 15.600 -0.193 1.001 1.00 0.00 N ATOM 875 CA PRO A 57 16.647 -0.860 1.842 1.00 0.00 C ATOM 876 C PRO A 57 16.191 -2.242 2.371 1.00 0.00 C ATOM 877 O PRO A 57 15.012 -2.434 2.679 1.00 0.00 O ATOM 878 CB PRO A 57 16.881 0.141 3.014 1.00 0.00 C ATOM 879 CG PRO A 57 16.168 1.390 2.602 1.00 0.00 C ATOM 880 CD PRO A 57 15.033 0.965 1.713 1.00 0.00 C ATOM 0 HA PRO A 57 17.551 -1.069 1.270 1.00 0.00 H new ATOM 0 HB2 PRO A 57 16.485 -0.249 3.952 1.00 0.00 H new ATOM 0 HB3 PRO A 57 17.944 0.326 3.169 1.00 0.00 H new ATOM 0 HG2 PRO A 57 15.796 1.929 3.473 1.00 0.00 H new ATOM 0 HG3 PRO A 57 16.842 2.064 2.074 1.00 0.00 H new ATOM 0 HD2 PRO A 57 14.147 0.694 2.288 1.00 0.00 H new ATOM 0 HD3 PRO A 57 14.737 1.758 1.026 1.00 0.00 H new ATOM 888 N LYS A 58 17.134 -3.201 2.423 1.00 0.00 N ATOM 889 CA LYS A 58 16.854 -4.587 2.845 1.00 0.00 C ATOM 890 C LYS A 58 16.391 -4.622 4.313 1.00 0.00 C ATOM 891 O LYS A 58 17.171 -4.390 5.238 1.00 0.00 O ATOM 892 CB LYS A 58 18.098 -5.483 2.556 1.00 0.00 C ATOM 893 CG LYS A 58 17.820 -7.016 2.478 1.00 0.00 C ATOM 894 CD LYS A 58 17.902 -7.739 3.837 1.00 0.00 C ATOM 895 CE LYS A 58 19.307 -7.647 4.466 1.00 0.00 C ATOM 896 NZ LYS A 58 20.369 -8.170 3.560 1.00 0.00 N ATOM 0 H LYS A 58 18.110 -3.038 2.174 1.00 0.00 H new ATOM 0 HA LYS A 58 16.028 -4.999 2.265 1.00 0.00 H new ATOM 0 HB2 LYS A 58 18.542 -5.164 1.613 1.00 0.00 H new ATOM 0 HB3 LYS A 58 18.840 -5.305 3.334 1.00 0.00 H new ATOM 0 HG2 LYS A 58 16.828 -7.174 2.054 1.00 0.00 H new ATOM 0 HG3 LYS A 58 18.536 -7.470 1.793 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.171 -7.306 4.521 1.00 0.00 H new ATOM 0 HD3 LYS A 58 17.634 -8.787 3.705 1.00 0.00 H new ATOM 0 HE2 LYS A 58 19.524 -6.608 4.714 1.00 0.00 H new ATOM 0 HE3 LYS A 58 19.321 -8.208 5.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 21.269 -8.230 4.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 20.101 -9.116 3.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 20.479 -7.530 2.748 1.00 0.00 H new ATOM 910 N ALA A 59 15.098 -4.930 4.485 1.00 0.00 N ATOM 911 CA ALA A 59 14.372 -4.796 5.750 1.00 0.00 C ATOM 912 C ALA A 59 13.731 -6.130 6.133 1.00 0.00 C ATOM 913 O ALA A 59 12.973 -6.712 5.340 1.00 0.00 O ATOM 914 CB ALA A 59 13.295 -3.698 5.606 1.00 0.00 C ATOM 0 H ALA A 59 14.516 -5.288 3.728 1.00 0.00 H new ATOM 0 HA ALA A 59 15.067 -4.513 6.541 1.00 0.00 H new ATOM 0 HB1 ALA A 59 12.752 -3.595 6.546 1.00 0.00 H new ATOM 0 HB2 ALA A 59 13.773 -2.750 5.357 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.599 -3.973 4.813 1.00 0.00 H new ATOM 920 N SER A 60 14.052 -6.624 7.341 1.00 0.00 N ATOM 921 CA SER A 60 13.373 -7.780 7.925 1.00 0.00 C ATOM 922 C SER A 60 12.033 -7.309 8.519 1.00 0.00 C ATOM 923 O SER A 60 11.974 -6.867 9.675 1.00 0.00 O ATOM 924 CB SER A 60 14.260 -8.441 9.010 1.00 0.00 C ATOM 925 OG SER A 60 15.509 -8.847 8.480 1.00 0.00 O ATOM 0 H SER A 60 14.785 -6.232 7.932 1.00 0.00 H new ATOM 0 HA SER A 60 13.187 -8.530 7.156 1.00 0.00 H new ATOM 0 HB2 SER A 60 14.421 -7.739 9.828 1.00 0.00 H new ATOM 0 HB3 SER A 60 13.743 -9.304 9.429 1.00 0.00 H new ATOM 0 HG SER A 60 16.047 -9.259 9.188 1.00 0.00 H new ATOM 931 N VAL A 61 10.981 -7.322 7.684 1.00 0.00 N ATOM 932 CA VAL A 61 9.601 -7.034 8.107 1.00 0.00 C ATOM 933 C VAL A 61 8.701 -8.197 7.664 1.00 0.00 C ATOM 934 O VAL A 61 8.811 -8.663 6.526 1.00 0.00 O ATOM 935 CB VAL A 61 9.056 -5.656 7.528 1.00 0.00 C ATOM 936 CG1 VAL A 61 9.824 -4.446 8.121 1.00 0.00 C ATOM 937 CG2 VAL A 61 9.094 -5.619 5.977 1.00 0.00 C ATOM 0 H VAL A 61 11.065 -7.534 6.690 1.00 0.00 H new ATOM 0 HA VAL A 61 9.591 -6.934 9.192 1.00 0.00 H new ATOM 0 HB VAL A 61 8.013 -5.581 7.834 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.425 -3.522 7.703 1.00 0.00 H new ATOM 0 HG12 VAL A 61 9.705 -4.435 9.204 1.00 0.00 H new ATOM 0 HG13 VAL A 61 10.882 -4.529 7.873 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.713 -4.660 5.626 1.00 0.00 H new ATOM 0 HG22 VAL A 61 10.121 -5.748 5.635 1.00 0.00 H new ATOM 0 HG23 VAL A 61 8.475 -6.423 5.579 1.00 0.00 H new ATOM 947 N THR A 62 7.876 -8.694 8.606 1.00 0.00 N ATOM 948 CA THR A 62 6.829 -9.713 8.374 1.00 0.00 C ATOM 949 C THR A 62 5.794 -9.614 9.516 1.00 0.00 C ATOM 950 O THR A 62 6.160 -9.711 10.691 1.00 0.00 O ATOM 951 CB THR A 62 7.394 -11.187 8.284 1.00 0.00 C ATOM 952 OG1 THR A 62 8.427 -11.381 9.257 1.00 0.00 O ATOM 953 CG2 THR A 62 7.931 -11.559 6.887 1.00 0.00 C ATOM 0 H THR A 62 7.919 -8.390 9.579 1.00 0.00 H new ATOM 0 HA THR A 62 6.373 -9.506 7.406 1.00 0.00 H new ATOM 0 HB THR A 62 6.549 -11.846 8.485 1.00 0.00 H new ATOM 0 HG1 THR A 62 8.768 -12.297 9.193 1.00 0.00 H new ATOM 0 HG21 THR A 62 8.302 -12.584 6.901 1.00 0.00 H new ATOM 0 HG22 THR A 62 7.129 -11.473 6.154 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.742 -10.883 6.617 1.00 0.00 H new ATOM 961 N GLY A 63 4.521 -9.418 9.158 1.00 0.00 N ATOM 962 CA GLY A 63 3.433 -9.272 10.130 1.00 0.00 C ATOM 963 C GLY A 63 2.276 -8.466 9.562 1.00 0.00 C ATOM 964 O GLY A 63 1.107 -8.736 9.862 1.00 0.00 O ATOM 0 H GLY A 63 4.216 -9.356 8.187 1.00 0.00 H new ATOM 0 HA2 GLY A 63 3.077 -10.258 10.429 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.811 -8.783 11.028 1.00 0.00 H new ATOM 968 N GLY A 64 2.617 -7.457 8.747 1.00 0.00 N ATOM 969 CA GLY A 64 1.631 -6.661 8.032 1.00 0.00 C ATOM 970 C GLY A 64 2.156 -5.275 7.712 1.00 0.00 C ATOM 971 O GLY A 64 2.328 -4.920 6.539 1.00 0.00 O ATOM 0 H GLY A 64 3.582 -7.177 8.571 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.355 -7.168 7.108 1.00 0.00 H new ATOM 0 HA3 GLY A 64 0.725 -6.578 8.633 1.00 0.00 H new ATOM 975 N GLY A 65 2.458 -4.510 8.779 1.00 0.00 N ATOM 976 CA GLY A 65 2.816 -3.100 8.657 1.00 0.00 C ATOM 977 C GLY A 65 1.612 -2.272 8.228 1.00 0.00 C ATOM 978 O GLY A 65 0.616 -2.209 8.964 1.00 0.00 O ATOM 0 H GLY A 65 2.458 -4.857 9.738 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.195 -2.732 9.611 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.620 -2.986 7.929 1.00 0.00 H new ATOM 982 N GLY A 66 1.700 -1.651 7.036 1.00 0.00 N ATOM 983 CA GLY A 66 0.571 -0.931 6.443 1.00 0.00 C ATOM 984 C GLY A 66 -0.473 -1.890 5.861 1.00 0.00 C ATOM 985 O GLY A 66 -0.122 -2.998 5.422 1.00 0.00 O ATOM 0 H GLY A 66 2.547 -1.637 6.468 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.104 -0.301 7.200 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.934 -0.269 5.657 1.00 0.00 H new ATOM 989 N GLU A 67 -1.752 -1.466 5.844 1.00 0.00 N ATOM 990 CA GLU A 67 -2.868 -2.276 5.309 1.00 0.00 C ATOM 991 C GLU A 67 -3.323 -1.791 3.926 1.00 0.00 C ATOM 992 O GLU A 67 -3.025 -0.670 3.496 1.00 0.00 O ATOM 993 CB GLU A 67 -4.079 -2.332 6.299 1.00 0.00 C ATOM 994 CG GLU A 67 -4.442 -1.017 6.998 1.00 0.00 C ATOM 995 CD GLU A 67 -5.687 -1.108 7.900 1.00 0.00 C ATOM 996 OE1 GLU A 67 -5.934 -2.183 8.505 1.00 0.00 O ATOM 997 OE2 GLU A 67 -6.413 -0.100 8.017 1.00 0.00 O ATOM 0 H GLU A 67 -2.042 -0.555 6.199 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.482 -3.289 5.195 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.954 -2.682 5.751 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.863 -3.078 7.063 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.593 -0.691 7.600 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.610 -0.250 6.242 1.00 0.00 H new ATOM 1004 N LEU A 68 -4.055 -2.682 3.245 1.00 0.00 N ATOM 1005 CA LEU A 68 -4.576 -2.471 1.902 1.00 0.00 C ATOM 1006 C LEU A 68 -6.105 -2.547 1.968 1.00 0.00 C ATOM 1007 O LEU A 68 -6.645 -3.647 2.110 1.00 0.00 O ATOM 1008 CB LEU A 68 -3.998 -3.540 0.936 1.00 0.00 C ATOM 1009 CG LEU A 68 -4.478 -3.438 -0.547 1.00 0.00 C ATOM 1010 CD1 LEU A 68 -4.038 -2.110 -1.203 1.00 0.00 C ATOM 1011 CD2 LEU A 68 -4.027 -4.662 -1.372 1.00 0.00 C ATOM 0 H LEU A 68 -4.304 -3.593 3.630 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.280 -1.493 1.522 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.910 -3.469 0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.259 -4.527 1.317 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.568 -3.439 -0.535 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.392 -2.079 -2.234 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.461 -1.272 -0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.950 -2.041 -1.190 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.378 -4.558 -2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -2.939 -4.725 -1.365 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.445 -5.569 -0.936 1.00 0.00 H new ATOM 1023 N ALA A 69 -6.799 -1.407 1.941 1.00 0.00 N ATOM 1024 CA ALA A 69 -8.251 -1.361 2.200 1.00 0.00 C ATOM 1025 C ALA A 69 -9.080 -1.633 0.919 1.00 0.00 C ATOM 1026 O ALA A 69 -9.047 -0.848 -0.037 1.00 0.00 O ATOM 1027 CB ALA A 69 -8.631 -0.023 2.854 1.00 0.00 C ATOM 0 H ALA A 69 -6.383 -0.497 1.742 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.495 -2.163 2.897 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.705 -0.001 3.040 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -8.097 0.085 3.798 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.361 0.797 2.188 1.00 0.00 H new ATOM 1033 N PHE A 70 -9.824 -2.759 0.928 1.00 0.00 N ATOM 1034 CA PHE A 70 -10.734 -3.192 -0.144 1.00 0.00 C ATOM 1035 C PHE A 70 -12.132 -2.625 0.147 1.00 0.00 C ATOM 1036 O PHE A 70 -12.807 -3.060 1.084 1.00 0.00 O ATOM 1037 CB PHE A 70 -10.801 -4.751 -0.180 1.00 0.00 C ATOM 1038 CG PHE A 70 -9.502 -5.463 -0.556 1.00 0.00 C ATOM 1039 CD1 PHE A 70 -8.389 -5.414 0.278 1.00 0.00 C ATOM 1040 CD2 PHE A 70 -9.405 -6.205 -1.731 1.00 0.00 C ATOM 1041 CE1 PHE A 70 -7.223 -6.070 -0.052 1.00 0.00 C ATOM 1042 CE2 PHE A 70 -8.236 -6.862 -2.055 1.00 0.00 C ATOM 1043 CZ PHE A 70 -7.145 -6.798 -1.216 1.00 0.00 C ATOM 0 H PHE A 70 -9.804 -3.412 1.711 1.00 0.00 H new ATOM 0 HA PHE A 70 -10.374 -2.831 -1.107 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -11.117 -5.105 0.801 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -11.574 -5.047 -0.889 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -8.440 -4.853 1.199 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -10.254 -6.267 -2.395 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -6.368 -6.012 0.605 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -8.176 -7.430 -2.972 1.00 0.00 H new ATOM 0 HZ PHE A 70 -6.233 -7.317 -1.471 1.00 0.00 H new ATOM 1053 N ARG A 71 -12.540 -1.627 -0.639 1.00 0.00 N ATOM 1054 CA ARG A 71 -13.798 -0.901 -0.416 1.00 0.00 C ATOM 1055 C ARG A 71 -14.981 -1.531 -1.166 1.00 0.00 C ATOM 1056 O ARG A 71 -14.879 -1.882 -2.347 1.00 0.00 O ATOM 1057 CB ARG A 71 -13.656 0.564 -0.878 1.00 0.00 C ATOM 1058 CG ARG A 71 -12.434 1.301 -0.309 1.00 0.00 C ATOM 1059 CD ARG A 71 -12.619 2.812 -0.355 1.00 0.00 C ATOM 1060 NE ARG A 71 -12.601 3.365 -1.724 1.00 0.00 N ATOM 1061 CZ ARG A 71 -13.505 4.214 -2.228 1.00 0.00 C ATOM 1062 NH1 ARG A 71 -14.607 4.516 -1.555 1.00 0.00 N ATOM 1063 NH2 ARG A 71 -13.316 4.727 -3.428 1.00 0.00 N ATOM 0 H ARG A 71 -12.011 -1.298 -1.447 1.00 0.00 H new ATOM 0 HA ARG A 71 -14.001 -0.953 0.654 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.601 0.584 -1.966 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.556 1.109 -0.595 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -12.265 0.986 0.721 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -11.545 1.025 -0.877 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -13.566 3.069 0.120 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -11.830 3.285 0.230 1.00 0.00 H new ATOM 0 HE ARG A 71 -11.837 3.077 -2.336 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -14.776 4.100 -0.639 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -15.286 5.165 -1.953 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -12.486 4.476 -3.965 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -14.000 5.375 -3.819 1.00 0.00 H new ATOM 1077 N VAL A 72 -16.097 -1.674 -0.433 1.00 0.00 N ATOM 1078 CA VAL A 72 -17.375 -2.222 -0.955 1.00 0.00 C ATOM 1079 C VAL A 72 -18.574 -1.406 -0.424 1.00 0.00 C ATOM 1080 O VAL A 72 -18.455 -0.680 0.579 1.00 0.00 O ATOM 1081 CB VAL A 72 -17.600 -3.738 -0.573 1.00 0.00 C ATOM 1082 CG1 VAL A 72 -16.584 -4.688 -1.246 1.00 0.00 C ATOM 1083 CG2 VAL A 72 -17.614 -3.938 0.958 1.00 0.00 C ATOM 0 H VAL A 72 -16.145 -1.411 0.551 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.307 -2.150 -2.040 1.00 0.00 H new ATOM 0 HB VAL A 72 -18.582 -4.006 -0.963 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -16.791 -5.715 -0.944 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -16.670 -4.604 -2.329 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -15.574 -4.416 -0.940 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -17.771 -4.992 1.186 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -16.661 -3.614 1.376 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -18.420 -3.349 1.395 1.00 0.00 H new ATOM 1093 N GLU A 73 -19.725 -1.551 -1.113 1.00 0.00 N ATOM 1094 CA GLU A 73 -20.933 -0.732 -0.879 1.00 0.00 C ATOM 1095 C GLU A 73 -21.570 -0.955 0.517 1.00 0.00 C ATOM 1096 O GLU A 73 -21.965 0.020 1.165 1.00 0.00 O ATOM 1097 CB GLU A 73 -21.990 -0.985 -2.000 1.00 0.00 C ATOM 1098 CG GLU A 73 -22.499 -2.435 -2.075 1.00 0.00 C ATOM 1099 CD GLU A 73 -23.675 -2.653 -3.037 1.00 0.00 C ATOM 1100 OE1 GLU A 73 -24.732 -2.022 -2.838 1.00 0.00 O ATOM 1101 OE2 GLU A 73 -23.567 -3.481 -3.966 1.00 0.00 O ATOM 0 H GLU A 73 -19.843 -2.244 -1.852 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.606 0.307 -0.908 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -22.840 -0.322 -1.838 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.554 -0.715 -2.962 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -21.674 -3.080 -2.379 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -22.800 -2.752 -1.077 1.00 0.00 H new ATOM 1108 N ASN A 74 -21.659 -2.227 0.991 1.00 0.00 N ATOM 1109 CA ASN A 74 -22.293 -2.528 2.296 1.00 0.00 C ATOM 1110 C ASN A 74 -21.829 -3.883 2.858 1.00 0.00 C ATOM 1111 O ASN A 74 -21.023 -4.592 2.247 1.00 0.00 O ATOM 1112 CB ASN A 74 -23.843 -2.495 2.207 1.00 0.00 C ATOM 1113 CG ASN A 74 -24.442 -3.649 1.402 1.00 0.00 C ATOM 1114 OD1 ASN A 74 -24.689 -4.731 1.939 1.00 0.00 O ATOM 1115 ND2 ASN A 74 -24.660 -3.439 0.122 1.00 0.00 N ATOM 0 H ASN A 74 -21.305 -3.045 0.496 1.00 0.00 H new ATOM 0 HA ASN A 74 -21.972 -1.743 2.981 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -24.256 -2.516 3.216 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -24.151 -1.552 1.756 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -25.045 -4.184 -0.459 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -24.444 -2.531 -0.290 1.00 0.00 H new ATOM 1122 N ASP A 75 -22.381 -4.196 4.051 1.00 0.00 N ATOM 1123 CA ASP A 75 -21.919 -5.271 4.954 1.00 0.00 C ATOM 1124 C ASP A 75 -21.884 -6.638 4.273 1.00 0.00 C ATOM 1125 O ASP A 75 -21.015 -7.471 4.567 1.00 0.00 O ATOM 1126 CB ASP A 75 -22.823 -5.310 6.216 1.00 0.00 C ATOM 1127 CG ASP A 75 -24.308 -5.580 5.892 1.00 0.00 C ATOM 1128 OD1 ASP A 75 -25.013 -4.631 5.472 1.00 0.00 O ATOM 1129 OD2 ASP A 75 -24.776 -6.733 6.047 1.00 0.00 O ATOM 0 H ASP A 75 -23.185 -3.691 4.423 1.00 0.00 H new ATOM 0 HA ASP A 75 -20.892 -5.044 5.241 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -22.459 -6.084 6.892 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -22.740 -4.360 6.744 1.00 0.00 H new ATOM 1134 N ALA A 76 -22.854 -6.854 3.373 1.00 0.00 N ATOM 1135 CA ALA A 76 -23.027 -8.128 2.678 1.00 0.00 C ATOM 1136 C ALA A 76 -21.819 -8.408 1.782 1.00 0.00 C ATOM 1137 O ALA A 76 -21.231 -9.480 1.834 1.00 0.00 O ATOM 1138 CB ALA A 76 -24.326 -8.120 1.857 1.00 0.00 C ATOM 0 H ALA A 76 -23.539 -6.146 3.109 1.00 0.00 H new ATOM 0 HA ALA A 76 -23.099 -8.925 3.418 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -24.439 -9.076 1.346 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -25.175 -7.961 2.521 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -24.286 -7.317 1.121 1.00 0.00 H new ATOM 1144 N GLN A 77 -21.419 -7.367 1.023 1.00 0.00 N ATOM 1145 CA GLN A 77 -20.300 -7.424 0.073 1.00 0.00 C ATOM 1146 C GLN A 77 -18.931 -7.685 0.763 1.00 0.00 C ATOM 1147 O GLN A 77 -18.011 -8.227 0.141 1.00 0.00 O ATOM 1148 CB GLN A 77 -20.248 -6.090 -0.716 1.00 0.00 C ATOM 1149 CG GLN A 77 -21.453 -5.786 -1.626 1.00 0.00 C ATOM 1150 CD GLN A 77 -21.492 -6.582 -2.935 1.00 0.00 C ATOM 1151 OE1 GLN A 77 -20.459 -6.985 -3.476 1.00 0.00 O ATOM 1152 NE2 GLN A 77 -22.683 -6.772 -3.481 1.00 0.00 N ATOM 0 H GLN A 77 -21.873 -6.454 1.057 1.00 0.00 H new ATOM 0 HA GLN A 77 -20.475 -8.266 -0.597 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -20.145 -5.274 -0.001 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -19.348 -6.091 -1.330 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -22.369 -5.985 -1.070 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -21.450 -4.722 -1.865 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -23.520 -6.428 -3.011 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -22.763 -7.263 -4.372 1.00 0.00 H new ATOM 1161 N VAL A 78 -18.831 -7.328 2.063 1.00 0.00 N ATOM 1162 CA VAL A 78 -17.651 -7.644 2.909 1.00 0.00 C ATOM 1163 C VAL A 78 -17.564 -9.161 3.158 1.00 0.00 C ATOM 1164 O VAL A 78 -16.498 -9.778 3.048 1.00 0.00 O ATOM 1165 CB VAL A 78 -17.714 -6.919 4.315 1.00 0.00 C ATOM 1166 CG1 VAL A 78 -16.501 -7.276 5.221 1.00 0.00 C ATOM 1167 CG2 VAL A 78 -17.833 -5.396 4.151 1.00 0.00 C ATOM 0 H VAL A 78 -19.561 -6.815 2.557 1.00 0.00 H new ATOM 0 HA VAL A 78 -16.774 -7.289 2.367 1.00 0.00 H new ATOM 0 HB VAL A 78 -18.611 -7.286 4.813 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -16.592 -6.753 6.173 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -16.483 -8.351 5.398 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.577 -6.974 4.728 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -17.874 -4.926 5.134 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -16.968 -5.020 3.605 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -18.742 -5.160 3.598 1.00 0.00 H new ATOM 1177 N ASP A 79 -18.745 -9.734 3.461 1.00 0.00 N ATOM 1178 CA ASP A 79 -18.913 -11.137 3.854 1.00 0.00 C ATOM 1179 C ASP A 79 -18.802 -12.073 2.633 1.00 0.00 C ATOM 1180 O ASP A 79 -18.392 -13.230 2.763 1.00 0.00 O ATOM 1181 CB ASP A 79 -20.280 -11.297 4.579 1.00 0.00 C ATOM 1182 CG ASP A 79 -20.554 -12.734 5.045 1.00 0.00 C ATOM 1183 OD1 ASP A 79 -19.846 -13.207 5.957 1.00 0.00 O ATOM 1184 OD2 ASP A 79 -21.448 -13.407 4.481 1.00 0.00 O ATOM 0 H ASP A 79 -19.625 -9.219 3.437 1.00 0.00 H new ATOM 0 HA ASP A 79 -18.114 -11.422 4.539 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -20.306 -10.631 5.442 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -21.079 -10.981 3.908 1.00 0.00 H new ATOM 1189 N GLU A 80 -19.163 -11.554 1.446 1.00 0.00 N ATOM 1190 CA GLU A 80 -19.009 -12.287 0.171 1.00 0.00 C ATOM 1191 C GLU A 80 -17.516 -12.417 -0.169 1.00 0.00 C ATOM 1192 O GLU A 80 -17.032 -13.493 -0.542 1.00 0.00 O ATOM 1193 CB GLU A 80 -19.786 -11.579 -0.965 1.00 0.00 C ATOM 1194 CG GLU A 80 -21.269 -11.338 -0.641 1.00 0.00 C ATOM 1195 CD GLU A 80 -22.092 -10.847 -1.842 1.00 0.00 C ATOM 1196 OE1 GLU A 80 -22.500 -11.687 -2.676 1.00 0.00 O ATOM 1197 OE2 GLU A 80 -22.330 -9.626 -1.962 1.00 0.00 O ATOM 0 H GLU A 80 -19.567 -10.623 1.340 1.00 0.00 H new ATOM 0 HA GLU A 80 -19.430 -13.287 0.278 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -19.309 -10.622 -1.178 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -19.714 -12.180 -1.872 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -21.705 -12.264 -0.267 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -21.342 -10.605 0.162 1.00 0.00 H new ATOM 1204 N THR A 81 -16.802 -11.282 -0.003 1.00 0.00 N ATOM 1205 CA THR A 81 -15.345 -11.196 -0.189 1.00 0.00 C ATOM 1206 C THR A 81 -14.615 -12.097 0.839 1.00 0.00 C ATOM 1207 O THR A 81 -13.615 -12.730 0.504 1.00 0.00 O ATOM 1208 CB THR A 81 -14.870 -9.706 -0.074 1.00 0.00 C ATOM 1209 OG1 THR A 81 -15.547 -8.905 -1.059 1.00 0.00 O ATOM 1210 CG2 THR A 81 -13.349 -9.544 -0.257 1.00 0.00 C ATOM 0 H THR A 81 -17.228 -10.395 0.266 1.00 0.00 H new ATOM 0 HA THR A 81 -15.095 -11.555 -1.187 1.00 0.00 H new ATOM 0 HB THR A 81 -15.116 -9.374 0.935 1.00 0.00 H new ATOM 0 HG1 THR A 81 -16.414 -8.616 -0.706 1.00 0.00 H new ATOM 0 HG21 THR A 81 -13.082 -8.491 -0.167 1.00 0.00 H new ATOM 0 HG22 THR A 81 -12.827 -10.118 0.509 1.00 0.00 H new ATOM 0 HG23 THR A 81 -13.060 -9.908 -1.243 1.00 0.00 H new ATOM 1218 N PHE A 82 -15.170 -12.169 2.072 1.00 0.00 N ATOM 1219 CA PHE A 82 -14.683 -13.056 3.158 1.00 0.00 C ATOM 1220 C PHE A 82 -14.634 -14.514 2.661 1.00 0.00 C ATOM 1221 O PHE A 82 -13.590 -15.158 2.662 1.00 0.00 O ATOM 1222 CB PHE A 82 -15.624 -12.896 4.397 1.00 0.00 C ATOM 1223 CG PHE A 82 -15.296 -13.711 5.662 1.00 0.00 C ATOM 1224 CD1 PHE A 82 -15.586 -15.078 5.746 1.00 0.00 C ATOM 1225 CD2 PHE A 82 -14.736 -13.100 6.784 1.00 0.00 C ATOM 1226 CE1 PHE A 82 -15.322 -15.798 6.896 1.00 0.00 C ATOM 1227 CE2 PHE A 82 -14.471 -13.822 7.930 1.00 0.00 C ATOM 1228 CZ PHE A 82 -14.764 -15.172 7.986 1.00 0.00 C ATOM 0 H PHE A 82 -15.977 -11.608 2.345 1.00 0.00 H new ATOM 0 HA PHE A 82 -13.671 -12.779 3.453 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.637 -11.842 4.673 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -16.635 -13.156 4.085 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -16.024 -15.580 4.896 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -14.506 -12.045 6.755 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -15.554 -16.852 6.939 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -14.033 -13.331 8.786 1.00 0.00 H new ATOM 0 HZ PHE A 82 -14.555 -15.734 8.884 1.00 0.00 H new ATOM 1238 N ALA A 83 -15.807 -14.979 2.193 1.00 0.00 N ATOM 1239 CA ALA A 83 -16.042 -16.367 1.753 1.00 0.00 C ATOM 1240 C ALA A 83 -15.097 -16.805 0.621 1.00 0.00 C ATOM 1241 O ALA A 83 -14.513 -17.894 0.672 1.00 0.00 O ATOM 1242 CB ALA A 83 -17.504 -16.515 1.307 1.00 0.00 C ATOM 0 H ALA A 83 -16.635 -14.389 2.108 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.834 -17.019 2.601 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -17.683 -17.540 0.981 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -18.165 -16.279 2.141 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -17.704 -15.831 0.482 1.00 0.00 H new ATOM 1248 N GLY A 84 -14.968 -15.934 -0.394 1.00 0.00 N ATOM 1249 CA GLY A 84 -14.134 -16.208 -1.566 1.00 0.00 C ATOM 1250 C GLY A 84 -12.642 -16.280 -1.253 1.00 0.00 C ATOM 1251 O GLY A 84 -11.938 -17.161 -1.760 1.00 0.00 O ATOM 0 H GLY A 84 -15.437 -15.028 -0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -14.449 -17.151 -2.012 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -14.303 -15.431 -2.311 1.00 0.00 H new ATOM 1255 N TRP A 85 -12.181 -15.377 -0.374 1.00 0.00 N ATOM 1256 CA TRP A 85 -10.793 -15.364 0.127 1.00 0.00 C ATOM 1257 C TRP A 85 -10.510 -16.645 0.928 1.00 0.00 C ATOM 1258 O TRP A 85 -9.446 -17.254 0.777 1.00 0.00 O ATOM 1259 CB TRP A 85 -10.581 -14.111 0.994 1.00 0.00 C ATOM 1260 CG TRP A 85 -10.462 -12.825 0.228 1.00 0.00 C ATOM 1261 CD1 TRP A 85 -10.823 -12.570 -1.071 1.00 0.00 C ATOM 1262 CD2 TRP A 85 -9.941 -11.609 0.739 1.00 0.00 C ATOM 1263 NE1 TRP A 85 -10.522 -11.278 -1.391 1.00 0.00 N ATOM 1264 CE2 TRP A 85 -9.988 -10.670 -0.294 1.00 0.00 C ATOM 1265 CE3 TRP A 85 -9.437 -11.232 1.975 1.00 0.00 C ATOM 1266 CZ2 TRP A 85 -9.546 -9.378 -0.128 1.00 0.00 C ATOM 1267 CZ3 TRP A 85 -8.996 -9.945 2.138 1.00 0.00 C ATOM 1268 CH2 TRP A 85 -9.054 -9.030 1.090 1.00 0.00 C ATOM 0 H TRP A 85 -12.760 -14.632 0.012 1.00 0.00 H new ATOM 0 HA TRP A 85 -10.097 -15.333 -0.711 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -11.413 -14.025 1.693 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.678 -14.247 1.589 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -11.278 -13.285 -1.740 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -10.672 -10.840 -2.300 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.393 -11.938 2.791 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -9.589 -8.665 -0.938 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -8.598 -9.636 3.093 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -8.700 -8.022 1.249 1.00 0.00 H new ATOM 1279 N LYS A 86 -11.458 -17.011 1.795 1.00 0.00 N ATOM 1280 CA LYS A 86 -11.368 -18.204 2.655 1.00 0.00 C ATOM 1281 C LYS A 86 -11.206 -19.472 1.804 1.00 0.00 C ATOM 1282 O LYS A 86 -10.387 -20.345 2.105 1.00 0.00 O ATOM 1283 CB LYS A 86 -12.636 -18.264 3.545 1.00 0.00 C ATOM 1284 CG LYS A 86 -12.826 -19.541 4.382 1.00 0.00 C ATOM 1285 CD LYS A 86 -14.066 -19.467 5.312 1.00 0.00 C ATOM 1286 CE LYS A 86 -15.344 -19.002 4.585 1.00 0.00 C ATOM 1287 NZ LYS A 86 -16.545 -19.091 5.453 1.00 0.00 N ATOM 0 H LYS A 86 -12.322 -16.484 1.924 1.00 0.00 H new ATOM 0 HA LYS A 86 -10.489 -18.142 3.296 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -12.618 -17.411 4.223 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -13.509 -18.143 2.904 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -12.928 -20.397 3.714 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -11.934 -19.712 4.985 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -14.242 -20.449 5.751 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -13.855 -18.784 6.135 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -15.215 -17.973 4.249 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -15.495 -19.611 3.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -17.384 -19.273 4.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -16.424 -19.867 6.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -16.669 -18.195 5.967 1.00 0.00 H new ATOM 1301 N ALA A 87 -11.983 -19.518 0.715 1.00 0.00 N ATOM 1302 CA ALA A 87 -11.966 -20.627 -0.248 1.00 0.00 C ATOM 1303 C ALA A 87 -10.655 -20.660 -1.061 1.00 0.00 C ATOM 1304 O ALA A 87 -10.214 -21.721 -1.517 1.00 0.00 O ATOM 1305 CB ALA A 87 -13.186 -20.522 -1.181 1.00 0.00 C ATOM 0 H ALA A 87 -12.646 -18.781 0.475 1.00 0.00 H new ATOM 0 HA ALA A 87 -12.019 -21.562 0.309 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.171 -21.346 -1.894 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -14.101 -20.570 -0.590 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -13.152 -19.575 -1.720 1.00 0.00 H new ATOM 1311 N SER A 88 -10.042 -19.470 -1.221 1.00 0.00 N ATOM 1312 CA SER A 88 -8.808 -19.267 -2.012 1.00 0.00 C ATOM 1313 C SER A 88 -7.558 -19.107 -1.106 1.00 0.00 C ATOM 1314 O SER A 88 -6.522 -18.595 -1.537 1.00 0.00 O ATOM 1315 CB SER A 88 -8.993 -18.017 -2.902 1.00 0.00 C ATOM 1316 OG SER A 88 -10.134 -18.148 -3.743 1.00 0.00 O ATOM 0 H SER A 88 -10.394 -18.610 -0.799 1.00 0.00 H new ATOM 0 HA SER A 88 -8.639 -20.149 -2.630 1.00 0.00 H new ATOM 0 HB2 SER A 88 -9.101 -17.133 -2.274 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.103 -17.867 -3.513 1.00 0.00 H new ATOM 0 HG SER A 88 -10.933 -17.854 -3.258 1.00 0.00 H new ATOM 1322 N GLY A 89 -7.704 -19.539 0.163 1.00 0.00 N ATOM 1323 CA GLY A 89 -6.571 -19.807 1.057 1.00 0.00 C ATOM 1324 C GLY A 89 -5.916 -18.575 1.682 1.00 0.00 C ATOM 1325 O GLY A 89 -4.683 -18.456 1.671 1.00 0.00 O ATOM 0 H GLY A 89 -8.613 -19.710 0.592 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.911 -20.462 1.859 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.813 -20.355 0.498 1.00 0.00 H new ATOM 1329 N VAL A 90 -6.732 -17.663 2.241 1.00 0.00 N ATOM 1330 CA VAL A 90 -6.224 -16.540 3.063 1.00 0.00 C ATOM 1331 C VAL A 90 -6.326 -16.942 4.560 1.00 0.00 C ATOM 1332 O VAL A 90 -7.275 -17.638 4.949 1.00 0.00 O ATOM 1333 CB VAL A 90 -7.006 -15.198 2.758 1.00 0.00 C ATOM 1334 CG1 VAL A 90 -8.381 -15.160 3.444 1.00 0.00 C ATOM 1335 CG2 VAL A 90 -6.168 -13.943 3.115 1.00 0.00 C ATOM 0 H VAL A 90 -7.747 -17.678 2.141 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.181 -16.345 2.813 1.00 0.00 H new ATOM 0 HB VAL A 90 -7.179 -15.181 1.682 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -8.880 -14.221 3.206 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -8.988 -15.994 3.090 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -8.251 -15.239 4.523 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.743 -13.045 2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.922 -13.960 4.177 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.248 -13.941 2.530 1.00 0.00 H new ATOM 1345 N ALA A 91 -5.328 -16.545 5.376 1.00 0.00 N ATOM 1346 CA ALA A 91 -5.259 -16.913 6.814 1.00 0.00 C ATOM 1347 C ALA A 91 -6.391 -16.241 7.622 1.00 0.00 C ATOM 1348 O ALA A 91 -6.981 -16.873 8.506 1.00 0.00 O ATOM 1349 CB ALA A 91 -3.881 -16.563 7.397 1.00 0.00 C ATOM 0 H ALA A 91 -4.550 -15.964 5.064 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.398 -17.991 6.891 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -3.851 -16.840 8.451 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -3.108 -17.108 6.856 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.706 -15.492 7.298 1.00 0.00 H new ATOM 1355 N MET A 92 -6.649 -14.947 7.302 1.00 0.00 N ATOM 1356 CA MET A 92 -7.837 -14.155 7.743 1.00 0.00 C ATOM 1357 C MET A 92 -8.130 -14.251 9.263 1.00 0.00 C ATOM 1358 O MET A 92 -8.928 -15.071 9.730 1.00 0.00 O ATOM 1359 CB MET A 92 -9.100 -14.463 6.861 1.00 0.00 C ATOM 1360 CG MET A 92 -9.684 -15.889 6.960 1.00 0.00 C ATOM 1361 SD MET A 92 -10.675 -16.386 5.536 1.00 0.00 S ATOM 1362 CE MET A 92 -11.772 -14.993 5.310 1.00 0.00 C ATOM 0 H MET A 92 -6.019 -14.405 6.711 1.00 0.00 H new ATOM 0 HA MET A 92 -7.575 -13.110 7.579 1.00 0.00 H new ATOM 0 HB2 MET A 92 -9.884 -13.755 7.130 1.00 0.00 H new ATOM 0 HB3 MET A 92 -8.842 -14.272 5.819 1.00 0.00 H new ATOM 0 HG2 MET A 92 -8.864 -16.597 7.082 1.00 0.00 H new ATOM 0 HG3 MET A 92 -10.299 -15.956 7.857 1.00 0.00 H new ATOM 0 HE1 MET A 92 -12.760 -15.351 5.019 1.00 0.00 H new ATOM 0 HE2 MET A 92 -11.848 -14.435 6.243 1.00 0.00 H new ATOM 0 HE3 MET A 92 -11.378 -14.342 4.529 1.00 0.00 H new ATOM 1372 N LEU A 93 -7.412 -13.431 10.048 1.00 0.00 N ATOM 1373 CA LEU A 93 -7.608 -13.366 11.506 1.00 0.00 C ATOM 1374 C LEU A 93 -8.312 -12.045 11.876 1.00 0.00 C ATOM 1375 O LEU A 93 -7.664 -11.053 12.206 1.00 0.00 O ATOM 1376 CB LEU A 93 -6.261 -13.591 12.310 1.00 0.00 C ATOM 1377 CG LEU A 93 -4.884 -13.186 11.661 1.00 0.00 C ATOM 1378 CD1 LEU A 93 -4.458 -14.163 10.549 1.00 0.00 C ATOM 1379 CD2 LEU A 93 -4.856 -11.721 11.171 1.00 0.00 C ATOM 0 H LEU A 93 -6.689 -12.803 9.697 1.00 0.00 H new ATOM 0 HA LEU A 93 -8.255 -14.191 11.805 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.349 -13.047 13.251 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.204 -14.651 12.558 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.146 -13.258 12.460 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.503 -13.844 10.131 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.355 -15.165 10.965 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.214 -14.172 9.763 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.882 -11.502 10.734 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.632 -11.574 10.420 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.034 -11.052 12.013 1.00 0.00 H new ATOM 1391 N GLN A 94 -9.654 -12.076 11.806 1.00 0.00 N ATOM 1392 CA GLN A 94 -10.550 -10.988 12.254 1.00 0.00 C ATOM 1393 C GLN A 94 -12.000 -11.407 11.993 1.00 0.00 C ATOM 1394 O GLN A 94 -12.332 -11.865 10.892 1.00 0.00 O ATOM 1395 CB GLN A 94 -10.272 -9.619 11.535 1.00 0.00 C ATOM 1396 CG GLN A 94 -11.212 -8.442 11.902 1.00 0.00 C ATOM 1397 CD GLN A 94 -11.139 -8.000 13.366 1.00 0.00 C ATOM 1398 OE1 GLN A 94 -10.096 -8.099 14.015 1.00 0.00 O ATOM 1399 NE2 GLN A 94 -12.247 -7.497 13.889 1.00 0.00 N ATOM 0 H GLN A 94 -10.161 -12.876 11.428 1.00 0.00 H new ATOM 0 HA GLN A 94 -10.363 -10.831 13.316 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -9.248 -9.319 11.756 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.332 -9.781 10.459 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.971 -7.590 11.267 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.238 -8.729 11.674 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -13.093 -7.430 13.323 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.254 -7.177 14.857 1.00 0.00 H new ATOM 1408 N GLN A 95 -12.844 -11.277 13.017 1.00 0.00 N ATOM 1409 CA GLN A 95 -14.292 -11.362 12.875 1.00 0.00 C ATOM 1410 C GLN A 95 -14.799 -9.983 12.410 1.00 0.00 C ATOM 1411 O GLN A 95 -14.611 -9.001 13.145 1.00 0.00 O ATOM 1412 CB GLN A 95 -14.946 -11.788 14.214 1.00 0.00 C ATOM 1413 CG GLN A 95 -14.587 -13.216 14.665 1.00 0.00 C ATOM 1414 CD GLN A 95 -15.357 -13.659 15.910 1.00 0.00 C ATOM 1415 OE1 GLN A 95 -14.893 -13.486 17.037 1.00 0.00 O ATOM 1416 NE2 GLN A 95 -16.548 -14.212 15.721 1.00 0.00 N ATOM 0 H GLN A 95 -12.536 -11.108 13.975 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.563 -12.119 12.139 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.645 -11.087 14.992 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -16.029 -11.711 14.117 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.792 -13.911 13.851 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -13.517 -13.269 14.868 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -16.905 -14.342 14.775 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -17.106 -14.507 16.522 1.00 0.00 H new ATOM 1425 N PRO A 96 -15.378 -9.872 11.159 1.00 0.00 N ATOM 1426 CA PRO A 96 -15.916 -8.599 10.625 1.00 0.00 C ATOM 1427 C PRO A 96 -16.875 -7.914 11.618 1.00 0.00 C ATOM 1428 O PRO A 96 -17.898 -8.492 11.996 1.00 0.00 O ATOM 1429 CB PRO A 96 -16.650 -9.020 9.321 1.00 0.00 C ATOM 1430 CG PRO A 96 -15.988 -10.297 8.900 1.00 0.00 C ATOM 1431 CD PRO A 96 -15.540 -10.982 10.177 1.00 0.00 C ATOM 0 HA PRO A 96 -15.131 -7.864 10.447 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -17.716 -9.167 9.497 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -16.557 -8.254 8.551 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -16.679 -10.928 8.342 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -15.139 -10.098 8.246 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -16.278 -11.709 10.517 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -14.605 -11.522 10.031 1.00 0.00 H new ATOM 1439 N ALA A 97 -16.511 -6.704 12.059 1.00 0.00 N ATOM 1440 CA ALA A 97 -17.237 -5.966 13.105 1.00 0.00 C ATOM 1441 C ALA A 97 -17.499 -4.528 12.651 1.00 0.00 C ATOM 1442 O ALA A 97 -16.704 -3.949 11.898 1.00 0.00 O ATOM 1443 CB ALA A 97 -16.433 -5.996 14.413 1.00 0.00 C ATOM 0 H ALA A 97 -15.698 -6.204 11.699 1.00 0.00 H new ATOM 0 HA ALA A 97 -18.201 -6.443 13.282 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -16.974 -5.449 15.185 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -16.294 -7.029 14.731 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -15.460 -5.531 14.253 1.00 0.00 H new ATOM 1449 N LYS A 98 -18.636 -3.973 13.093 1.00 0.00 N ATOM 1450 CA LYS A 98 -19.019 -2.582 12.815 1.00 0.00 C ATOM 1451 C LYS A 98 -18.083 -1.596 13.556 1.00 0.00 C ATOM 1452 O LYS A 98 -17.944 -1.651 14.781 1.00 0.00 O ATOM 1453 CB LYS A 98 -20.518 -2.353 13.193 1.00 0.00 C ATOM 1454 CG LYS A 98 -21.542 -2.780 12.116 1.00 0.00 C ATOM 1455 CD LYS A 98 -21.480 -1.913 10.835 1.00 0.00 C ATOM 1456 CE LYS A 98 -22.065 -0.509 11.013 1.00 0.00 C ATOM 1457 NZ LYS A 98 -23.543 -0.526 11.213 1.00 0.00 N ATOM 0 H LYS A 98 -19.319 -4.479 13.656 1.00 0.00 H new ATOM 0 HA LYS A 98 -18.909 -2.390 11.748 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -20.732 -2.900 14.112 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -20.664 -1.295 13.410 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -21.366 -3.822 11.850 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -22.546 -2.724 12.536 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -20.441 -1.826 10.515 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -22.018 -2.423 10.036 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -21.592 -0.028 11.869 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -21.827 0.094 10.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -23.905 0.449 11.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -23.991 -1.064 10.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -23.765 -0.974 12.125 1.00 0.00 H new ATOM 1471 N MET A 99 -17.446 -0.707 12.774 1.00 0.00 N ATOM 1472 CA MET A 99 -16.483 0.315 13.254 1.00 0.00 C ATOM 1473 C MET A 99 -16.986 1.718 12.852 1.00 0.00 C ATOM 1474 O MET A 99 -17.955 1.829 12.091 1.00 0.00 O ATOM 1475 CB MET A 99 -15.083 -0.012 12.639 1.00 0.00 C ATOM 1476 CG MET A 99 -13.918 0.917 13.027 1.00 0.00 C ATOM 1477 SD MET A 99 -12.305 0.260 12.553 1.00 0.00 S ATOM 1478 CE MET A 99 -12.177 -1.160 13.648 1.00 0.00 C ATOM 0 H MET A 99 -17.586 -0.674 11.764 1.00 0.00 H new ATOM 0 HA MET A 99 -16.395 0.303 14.340 1.00 0.00 H new ATOM 0 HB2 MET A 99 -14.816 -1.029 12.925 1.00 0.00 H new ATOM 0 HB3 MET A 99 -15.178 -0.001 11.553 1.00 0.00 H new ATOM 0 HG2 MET A 99 -14.062 1.888 12.554 1.00 0.00 H new ATOM 0 HG3 MET A 99 -13.935 1.082 14.104 1.00 0.00 H new ATOM 0 HE1 MET A 99 -11.378 -0.992 14.370 1.00 0.00 H new ATOM 0 HE2 MET A 99 -13.120 -1.298 14.177 1.00 0.00 H new ATOM 0 HE3 MET A 99 -11.955 -2.052 13.062 1.00 0.00 H new ATOM 1488 N GLU A 100 -16.332 2.777 13.374 1.00 0.00 N ATOM 1489 CA GLU A 100 -16.632 4.193 13.050 1.00 0.00 C ATOM 1490 C GLU A 100 -16.673 4.450 11.524 1.00 0.00 C ATOM 1491 O GLU A 100 -17.587 5.109 11.027 1.00 0.00 O ATOM 1492 CB GLU A 100 -15.560 5.101 13.730 1.00 0.00 C ATOM 1493 CG GLU A 100 -15.699 6.621 13.485 1.00 0.00 C ATOM 1494 CD GLU A 100 -17.081 7.191 13.857 1.00 0.00 C ATOM 1495 OE1 GLU A 100 -17.466 7.116 15.044 1.00 0.00 O ATOM 1496 OE2 GLU A 100 -17.786 7.733 12.971 1.00 0.00 O ATOM 0 H GLU A 100 -15.569 2.674 14.043 1.00 0.00 H new ATOM 0 HA GLU A 100 -17.625 4.431 13.432 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.592 4.923 14.805 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -14.575 4.787 13.384 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -14.935 7.143 14.061 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -15.503 6.829 12.433 1.00 0.00 H new ATOM 1503 N PHE A 101 -15.706 3.871 10.792 1.00 0.00 N ATOM 1504 CA PHE A 101 -15.582 4.043 9.318 1.00 0.00 C ATOM 1505 C PHE A 101 -16.359 2.962 8.544 1.00 0.00 C ATOM 1506 O PHE A 101 -16.354 2.953 7.305 1.00 0.00 O ATOM 1507 CB PHE A 101 -14.080 4.093 8.917 1.00 0.00 C ATOM 1508 CG PHE A 101 -13.402 5.382 9.396 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -13.042 5.549 10.734 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -13.184 6.447 8.521 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -12.489 6.733 11.176 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -12.623 7.628 8.963 1.00 0.00 C ATOM 1513 CZ PHE A 101 -12.280 7.774 10.290 1.00 0.00 C ATOM 0 H PHE A 101 -14.986 3.271 11.195 1.00 0.00 H new ATOM 0 HA PHE A 101 -16.039 4.993 9.041 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -13.563 3.232 9.340 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -13.991 4.017 7.833 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.198 4.740 11.433 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -13.459 6.345 7.481 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.219 6.847 12.215 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -12.453 8.438 8.269 1.00 0.00 H new ATOM 0 HZ PHE A 101 -11.848 8.701 10.638 1.00 0.00 H new ATOM 1523 N GLY A 102 -17.035 2.066 9.284 1.00 0.00 N ATOM 1524 CA GLY A 102 -18.002 1.131 8.706 1.00 0.00 C ATOM 1525 C GLY A 102 -17.736 -0.319 9.083 1.00 0.00 C ATOM 1526 O GLY A 102 -16.857 -0.593 9.907 1.00 0.00 O ATOM 0 H GLY A 102 -16.924 1.974 10.294 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -19.004 1.407 9.034 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -17.985 1.226 7.620 1.00 0.00 H new ATOM 1530 N TYR A 103 -18.487 -1.252 8.462 1.00 0.00 N ATOM 1531 CA TYR A 103 -18.389 -2.693 8.770 1.00 0.00 C ATOM 1532 C TYR A 103 -17.080 -3.242 8.189 1.00 0.00 C ATOM 1533 O TYR A 103 -17.007 -3.509 6.992 1.00 0.00 O ATOM 1534 CB TYR A 103 -19.604 -3.458 8.178 1.00 0.00 C ATOM 1535 CG TYR A 103 -19.735 -4.903 8.680 1.00 0.00 C ATOM 1536 CD1 TYR A 103 -19.964 -5.140 10.025 1.00 0.00 C ATOM 1537 CD2 TYR A 103 -19.662 -6.010 7.830 1.00 0.00 C ATOM 1538 CE1 TYR A 103 -20.119 -6.399 10.522 1.00 0.00 C ATOM 1539 CE2 TYR A 103 -19.813 -7.295 8.320 1.00 0.00 C ATOM 1540 CZ TYR A 103 -20.045 -7.488 9.670 1.00 0.00 C ATOM 1541 OH TYR A 103 -20.200 -8.767 10.166 1.00 0.00 O ATOM 0 H TYR A 103 -19.172 -1.030 7.740 1.00 0.00 H new ATOM 0 HA TYR A 103 -18.394 -2.833 9.851 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -20.517 -2.915 8.423 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -19.520 -3.468 7.091 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -20.022 -4.300 10.701 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -19.485 -5.860 6.775 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -20.299 -6.547 11.577 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -19.750 -8.142 7.653 1.00 0.00 H new ATOM 0 HH TYR A 103 -19.520 -8.937 10.851 1.00 0.00 H new ATOM 1551 N THR A 104 -16.066 -3.425 9.041 1.00 0.00 N ATOM 1552 CA THR A 104 -14.685 -3.667 8.595 1.00 0.00 C ATOM 1553 C THR A 104 -14.221 -5.085 8.956 1.00 0.00 C ATOM 1554 O THR A 104 -14.696 -5.695 9.921 1.00 0.00 O ATOM 1555 CB THR A 104 -13.710 -2.606 9.212 1.00 0.00 C ATOM 1556 OG1 THR A 104 -12.403 -2.715 8.620 1.00 0.00 O ATOM 1557 CG2 THR A 104 -13.586 -2.751 10.740 1.00 0.00 C ATOM 0 H THR A 104 -16.176 -3.410 10.055 1.00 0.00 H new ATOM 0 HA THR A 104 -14.668 -3.571 7.509 1.00 0.00 H new ATOM 0 HB THR A 104 -14.135 -1.626 8.995 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.719 -2.595 9.312 1.00 0.00 H new ATOM 0 HG21 THR A 104 -12.900 -1.995 11.123 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.566 -2.618 11.199 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.204 -3.743 10.982 1.00 0.00 H new ATOM 1565 N PHE A 105 -13.277 -5.573 8.163 1.00 0.00 N ATOM 1566 CA PHE A 105 -12.664 -6.893 8.299 1.00 0.00 C ATOM 1567 C PHE A 105 -11.234 -6.819 7.777 1.00 0.00 C ATOM 1568 O PHE A 105 -11.010 -6.179 6.761 1.00 0.00 O ATOM 1569 CB PHE A 105 -13.512 -7.934 7.493 1.00 0.00 C ATOM 1570 CG PHE A 105 -12.784 -9.196 6.991 1.00 0.00 C ATOM 1571 CD1 PHE A 105 -12.220 -10.114 7.875 1.00 0.00 C ATOM 1572 CD2 PHE A 105 -12.662 -9.441 5.619 1.00 0.00 C ATOM 1573 CE1 PHE A 105 -11.563 -11.231 7.402 1.00 0.00 C ATOM 1574 CE2 PHE A 105 -12.004 -10.556 5.149 1.00 0.00 C ATOM 1575 CZ PHE A 105 -11.453 -11.451 6.039 1.00 0.00 C ATOM 0 H PHE A 105 -12.901 -5.043 7.377 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.639 -7.208 9.342 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.344 -8.251 8.121 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -13.941 -7.425 6.630 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -12.298 -9.949 8.940 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.092 -8.743 4.916 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -11.133 -11.937 8.097 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -11.920 -10.728 4.086 1.00 0.00 H new ATOM 0 HZ PHE A 105 -10.935 -12.325 5.674 1.00 0.00 H new ATOM 1585 N THR A 106 -10.274 -7.442 8.458 1.00 0.00 N ATOM 1586 CA THR A 106 -8.871 -7.421 8.025 1.00 0.00 C ATOM 1587 C THR A 106 -8.317 -8.853 7.999 1.00 0.00 C ATOM 1588 O THR A 106 -8.382 -9.580 8.993 1.00 0.00 O ATOM 1589 CB THR A 106 -7.986 -6.495 8.926 1.00 0.00 C ATOM 1590 OG1 THR A 106 -8.594 -5.193 9.041 1.00 0.00 O ATOM 1591 CG2 THR A 106 -6.557 -6.336 8.359 1.00 0.00 C ATOM 0 H THR A 106 -10.439 -7.970 9.315 1.00 0.00 H new ATOM 0 HA THR A 106 -8.836 -7.002 7.019 1.00 0.00 H new ATOM 0 HB THR A 106 -7.915 -6.966 9.906 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.492 -4.864 9.959 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.976 -5.686 9.014 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.078 -7.313 8.300 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.608 -5.896 7.363 1.00 0.00 H new ATOM 1599 N ALA A 107 -7.779 -9.240 6.842 1.00 0.00 N ATOM 1600 CA ALA A 107 -7.241 -10.575 6.596 1.00 0.00 C ATOM 1601 C ALA A 107 -5.710 -10.550 6.575 1.00 0.00 C ATOM 1602 O ALA A 107 -5.089 -9.475 6.607 1.00 0.00 O ATOM 1603 CB ALA A 107 -7.800 -11.111 5.270 1.00 0.00 C ATOM 0 H ALA A 107 -7.704 -8.621 6.035 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.546 -11.239 7.405 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.400 -12.108 5.083 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -8.887 -11.161 5.327 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -7.510 -10.445 4.457 1.00 0.00 H new ATOM 1609 N ALA A 108 -5.115 -11.745 6.522 1.00 0.00 N ATOM 1610 CA ALA A 108 -3.664 -11.925 6.415 1.00 0.00 C ATOM 1611 C ALA A 108 -3.363 -12.973 5.354 1.00 0.00 C ATOM 1612 O ALA A 108 -3.907 -14.074 5.406 1.00 0.00 O ATOM 1613 CB ALA A 108 -3.065 -12.338 7.765 1.00 0.00 C ATOM 0 H ALA A 108 -5.632 -12.624 6.552 1.00 0.00 H new ATOM 0 HA ALA A 108 -3.209 -10.978 6.125 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -1.988 -12.466 7.661 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -3.269 -11.565 8.505 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.512 -13.278 8.089 1.00 0.00 H new ATOM 1619 N ASP A 109 -2.549 -12.596 4.365 1.00 0.00 N ATOM 1620 CA ASP A 109 -2.001 -13.522 3.351 1.00 0.00 C ATOM 1621 C ASP A 109 -1.106 -14.607 3.996 1.00 0.00 C ATOM 1622 O ASP A 109 -0.788 -14.511 5.190 1.00 0.00 O ATOM 1623 CB ASP A 109 -1.179 -12.704 2.324 1.00 0.00 C ATOM 1624 CG ASP A 109 -2.010 -11.646 1.600 1.00 0.00 C ATOM 1625 OD1 ASP A 109 -2.226 -10.573 2.192 1.00 0.00 O ATOM 1626 OD2 ASP A 109 -2.419 -11.865 0.449 1.00 0.00 O ATOM 0 H ASP A 109 -2.244 -11.631 4.238 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.829 -14.030 2.858 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -0.349 -12.218 2.836 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -0.746 -13.383 1.590 1.00 0.00 H new ATOM 1631 N PRO A 110 -0.702 -15.678 3.227 1.00 0.00 N ATOM 1632 CA PRO A 110 0.346 -16.645 3.669 1.00 0.00 C ATOM 1633 C PRO A 110 1.661 -15.956 4.107 1.00 0.00 C ATOM 1634 O PRO A 110 2.387 -16.468 4.958 1.00 0.00 O ATOM 1635 CB PRO A 110 0.562 -17.528 2.411 1.00 0.00 C ATOM 1636 CG PRO A 110 -0.757 -17.491 1.702 1.00 0.00 C ATOM 1637 CD PRO A 110 -1.288 -16.086 1.910 1.00 0.00 C ATOM 0 HA PRO A 110 0.039 -17.206 4.551 1.00 0.00 H new ATOM 0 HB2 PRO A 110 1.362 -17.137 1.783 1.00 0.00 H new ATOM 0 HB3 PRO A 110 0.839 -18.547 2.683 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -0.639 -17.713 0.641 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.443 -18.234 2.109 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -0.976 -15.417 1.108 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -2.378 -16.069 1.934 1.00 0.00 H new ATOM 1645 N ASP A 111 1.935 -14.781 3.513 1.00 0.00 N ATOM 1646 CA ASP A 111 3.140 -13.968 3.793 1.00 0.00 C ATOM 1647 C ASP A 111 2.875 -12.899 4.883 1.00 0.00 C ATOM 1648 O ASP A 111 3.690 -11.983 5.061 1.00 0.00 O ATOM 1649 CB ASP A 111 3.614 -13.301 2.476 1.00 0.00 C ATOM 1650 CG ASP A 111 3.980 -14.329 1.392 1.00 0.00 C ATOM 1651 OD1 ASP A 111 3.064 -14.815 0.697 1.00 0.00 O ATOM 1652 OD2 ASP A 111 5.177 -14.671 1.252 1.00 0.00 O ATOM 0 H ASP A 111 1.320 -14.361 2.816 1.00 0.00 H new ATOM 0 HA ASP A 111 3.921 -14.624 4.178 1.00 0.00 H new ATOM 0 HB2 ASP A 111 2.827 -12.647 2.101 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.480 -12.672 2.683 1.00 0.00 H new ATOM 1657 N SER A 112 1.739 -13.049 5.603 1.00 0.00 N ATOM 1658 CA SER A 112 1.317 -12.192 6.736 1.00 0.00 C ATOM 1659 C SER A 112 1.264 -10.696 6.357 1.00 0.00 C ATOM 1660 O SER A 112 2.218 -9.944 6.586 1.00 0.00 O ATOM 1661 CB SER A 112 2.211 -12.428 7.981 1.00 0.00 C ATOM 1662 OG SER A 112 2.289 -13.811 8.296 1.00 0.00 O ATOM 0 H SER A 112 1.070 -13.793 5.405 1.00 0.00 H new ATOM 0 HA SER A 112 0.299 -12.485 6.991 1.00 0.00 H new ATOM 0 HB2 SER A 112 3.211 -12.037 7.795 1.00 0.00 H new ATOM 0 HB3 SER A 112 1.808 -11.880 8.832 1.00 0.00 H new ATOM 0 HG SER A 112 2.859 -13.936 9.083 1.00 0.00 H new ATOM 1668 N HIS A 113 0.161 -10.285 5.710 1.00 0.00 N ATOM 1669 CA HIS A 113 -0.093 -8.864 5.377 1.00 0.00 C ATOM 1670 C HIS A 113 -1.372 -8.404 6.086 1.00 0.00 C ATOM 1671 O HIS A 113 -1.935 -9.129 6.913 1.00 0.00 O ATOM 1672 CB HIS A 113 -0.226 -8.640 3.841 1.00 0.00 C ATOM 1673 CG HIS A 113 0.852 -9.276 3.004 1.00 0.00 C ATOM 1674 ND1 HIS A 113 0.599 -9.826 1.771 1.00 0.00 N ATOM 1675 CD2 HIS A 113 2.162 -9.494 3.237 1.00 0.00 C ATOM 1676 CE1 HIS A 113 1.693 -10.349 1.280 1.00 0.00 C ATOM 1677 NE2 HIS A 113 2.652 -10.167 2.151 1.00 0.00 N ATOM 0 H HIS A 113 -0.577 -10.918 5.403 1.00 0.00 H new ATOM 0 HA HIS A 113 0.760 -8.277 5.717 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -1.192 -9.027 3.516 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -0.230 -7.568 3.646 1.00 0.00 H new ATOM 0 HD2 HIS A 113 2.718 -9.195 4.113 1.00 0.00 H new ATOM 0 HE1 HIS A 113 1.788 -10.844 0.325 1.00 0.00 H new ATOM 0 HE2 HIS A 113 3.617 -10.479 2.038 1.00 0.00 H new ATOM 1686 N ARG A 114 -1.800 -7.187 5.767 1.00 0.00 N ATOM 1687 CA ARG A 114 -3.026 -6.582 6.286 1.00 0.00 C ATOM 1688 C ARG A 114 -3.927 -6.223 5.080 1.00 0.00 C ATOM 1689 O ARG A 114 -3.550 -5.380 4.265 1.00 0.00 O ATOM 1690 CB ARG A 114 -2.641 -5.318 7.096 1.00 0.00 C ATOM 1691 CG ARG A 114 -1.903 -5.544 8.440 1.00 0.00 C ATOM 1692 CD ARG A 114 -2.864 -5.880 9.593 1.00 0.00 C ATOM 1693 NE ARG A 114 -3.870 -4.805 9.804 1.00 0.00 N ATOM 1694 CZ ARG A 114 -4.602 -4.640 10.916 1.00 0.00 C ATOM 1695 NH1 ARG A 114 -4.346 -5.355 11.999 1.00 0.00 N ATOM 1696 NH2 ARG A 114 -5.572 -3.737 10.941 1.00 0.00 N ATOM 0 H ARG A 114 -1.293 -6.578 5.125 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.568 -7.263 6.943 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.012 -4.689 6.465 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -3.552 -4.755 7.300 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -1.184 -6.355 8.323 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -1.336 -4.649 8.694 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -3.375 -6.819 9.379 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -2.294 -6.029 10.510 1.00 0.00 H new ATOM 0 HE ARG A 114 -4.015 -4.141 9.043 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -3.588 -6.037 11.992 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -4.907 -5.224 12.841 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -5.761 -3.169 10.115 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -6.129 -3.611 11.786 1.00 0.00 H new ATOM 1710 N LEU A 115 -5.076 -6.912 4.940 1.00 0.00 N ATOM 1711 CA LEU A 115 -6.043 -6.659 3.840 1.00 0.00 C ATOM 1712 C LEU A 115 -7.404 -6.261 4.445 1.00 0.00 C ATOM 1713 O LEU A 115 -8.156 -7.130 4.881 1.00 0.00 O ATOM 1714 CB LEU A 115 -6.221 -7.939 2.971 1.00 0.00 C ATOM 1715 CG LEU A 115 -4.948 -8.583 2.343 1.00 0.00 C ATOM 1716 CD1 LEU A 115 -5.325 -9.838 1.518 1.00 0.00 C ATOM 1717 CD2 LEU A 115 -4.142 -7.576 1.492 1.00 0.00 C ATOM 0 H LEU A 115 -5.364 -7.655 5.577 1.00 0.00 H new ATOM 0 HA LEU A 115 -5.663 -5.854 3.210 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.708 -8.695 3.587 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.908 -7.698 2.160 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.299 -8.890 3.163 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -4.424 -10.274 1.087 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.807 -10.569 2.167 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -6.010 -9.556 0.718 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.265 -8.071 1.076 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.767 -7.203 0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -3.825 -6.742 2.118 1.00 0.00 H new ATOM 1729 N ARG A 116 -7.733 -4.963 4.445 1.00 0.00 N ATOM 1730 CA ARG A 116 -8.916 -4.454 5.165 1.00 0.00 C ATOM 1731 C ARG A 116 -10.146 -4.302 4.230 1.00 0.00 C ATOM 1732 O ARG A 116 -10.313 -3.275 3.585 1.00 0.00 O ATOM 1733 CB ARG A 116 -8.569 -3.095 5.834 1.00 0.00 C ATOM 1734 CG ARG A 116 -9.711 -2.506 6.694 1.00 0.00 C ATOM 1735 CD ARG A 116 -9.403 -1.088 7.181 1.00 0.00 C ATOM 1736 NE ARG A 116 -10.477 -0.528 8.020 1.00 0.00 N ATOM 1737 CZ ARG A 116 -10.355 0.562 8.791 1.00 0.00 C ATOM 1738 NH1 ARG A 116 -9.190 1.205 8.879 1.00 0.00 N ATOM 1739 NH2 ARG A 116 -11.391 0.987 9.501 1.00 0.00 N ATOM 0 H ARG A 116 -7.200 -4.244 3.956 1.00 0.00 H new ATOM 0 HA ARG A 116 -9.186 -5.182 5.930 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -7.687 -3.225 6.461 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -8.305 -2.377 5.058 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -10.632 -2.495 6.112 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -9.885 -3.153 7.554 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -8.472 -1.097 7.748 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -9.245 -0.439 6.320 1.00 0.00 H new ATOM 0 HE ARG A 116 -11.379 -1.004 8.014 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -8.381 0.868 8.357 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -9.108 2.033 9.468 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -12.278 0.485 9.460 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -11.301 1.816 10.088 1.00 0.00 H new ATOM 1753 N VAL A 117 -11.035 -5.306 4.203 1.00 0.00 N ATOM 1754 CA VAL A 117 -12.316 -5.209 3.473 1.00 0.00 C ATOM 1755 C VAL A 117 -13.324 -4.515 4.384 1.00 0.00 C ATOM 1756 O VAL A 117 -13.674 -5.068 5.427 1.00 0.00 O ATOM 1757 CB VAL A 117 -12.888 -6.614 3.046 1.00 0.00 C ATOM 1758 CG1 VAL A 117 -14.087 -6.462 2.069 1.00 0.00 C ATOM 1759 CG2 VAL A 117 -11.788 -7.500 2.441 1.00 0.00 C ATOM 0 H VAL A 117 -10.894 -6.198 4.678 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.141 -4.647 2.556 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.256 -7.108 3.945 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.459 -7.449 1.793 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.883 -5.897 2.555 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.761 -5.934 1.173 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.212 -8.463 2.156 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.371 -7.012 1.560 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.999 -7.655 3.177 1.00 0.00 H new ATOM 1769 N TYR A 118 -13.794 -3.310 4.012 1.00 0.00 N ATOM 1770 CA TYR A 118 -14.748 -2.563 4.857 1.00 0.00 C ATOM 1771 C TYR A 118 -15.979 -2.123 4.055 1.00 0.00 C ATOM 1772 O TYR A 118 -15.920 -2.023 2.820 1.00 0.00 O ATOM 1773 CB TYR A 118 -14.077 -1.386 5.621 1.00 0.00 C ATOM 1774 CG TYR A 118 -13.851 -0.105 4.818 1.00 0.00 C ATOM 1775 CD1 TYR A 118 -12.761 0.028 3.968 1.00 0.00 C ATOM 1776 CD2 TYR A 118 -14.738 0.979 4.924 1.00 0.00 C ATOM 1777 CE1 TYR A 118 -12.556 1.188 3.259 1.00 0.00 C ATOM 1778 CE2 TYR A 118 -14.539 2.140 4.212 1.00 0.00 C ATOM 1779 CZ TYR A 118 -13.447 2.243 3.380 1.00 0.00 C ATOM 1780 OH TYR A 118 -13.235 3.408 2.678 1.00 0.00 O ATOM 0 H TYR A 118 -13.535 -2.837 3.146 1.00 0.00 H new ATOM 0 HA TYR A 118 -15.098 -3.250 5.628 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -14.693 -1.144 6.487 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -13.114 -1.728 6.000 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -12.065 -0.791 3.862 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -15.594 0.900 5.578 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -11.700 1.277 2.607 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -15.233 2.962 4.305 1.00 0.00 H new ATOM 0 HH TYR A 118 -12.273 3.583 2.617 1.00 0.00 H new ATOM 1790 N ALA A 119 -17.055 -1.793 4.765 1.00 0.00 N ATOM 1791 CA ALA A 119 -18.311 -1.322 4.177 1.00 0.00 C ATOM 1792 C ALA A 119 -18.592 0.084 4.670 1.00 0.00 C ATOM 1793 O ALA A 119 -18.762 0.272 5.871 1.00 0.00 O ATOM 1794 CB ALA A 119 -19.445 -2.250 4.599 1.00 0.00 C ATOM 0 H ALA A 119 -17.081 -1.846 5.783 1.00 0.00 H new ATOM 0 HA ALA A 119 -18.234 -1.319 3.090 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.381 -1.902 4.163 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -19.236 -3.261 4.251 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -19.529 -2.251 5.686 1.00 0.00 H new ATOM 1800 N PHE A 120 -18.646 1.065 3.763 1.00 0.00 N ATOM 1801 CA PHE A 120 -18.854 2.468 4.144 1.00 0.00 C ATOM 1802 C PHE A 120 -20.349 2.703 4.427 1.00 0.00 C ATOM 1803 O PHE A 120 -21.192 2.434 3.561 1.00 0.00 O ATOM 1804 CB PHE A 120 -18.354 3.407 3.017 1.00 0.00 C ATOM 1805 CG PHE A 120 -18.567 4.895 3.296 1.00 0.00 C ATOM 1806 CD1 PHE A 120 -17.765 5.563 4.215 1.00 0.00 C ATOM 1807 CD2 PHE A 120 -19.566 5.624 2.645 1.00 0.00 C ATOM 1808 CE1 PHE A 120 -17.952 6.904 4.474 1.00 0.00 C ATOM 1809 CE2 PHE A 120 -19.750 6.964 2.907 1.00 0.00 C ATOM 1810 CZ PHE A 120 -18.941 7.606 3.818 1.00 0.00 C ATOM 0 H PHE A 120 -18.549 0.914 2.759 1.00 0.00 H new ATOM 0 HA PHE A 120 -18.284 2.689 5.047 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -17.291 3.228 2.856 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -18.865 3.147 2.090 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -16.985 5.024 4.733 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -20.203 5.130 1.926 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -17.322 7.406 5.193 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -20.529 7.511 2.398 1.00 0.00 H new ATOM 0 HZ PHE A 120 -19.081 8.658 4.018 1.00 0.00 H new ATOM 1820 N ALA A 121 -20.661 3.129 5.663 1.00 0.00 N ATOM 1821 CA ALA A 121 -22.034 3.425 6.089 1.00 0.00 C ATOM 1822 C ALA A 121 -22.577 4.606 5.266 1.00 0.00 C ATOM 1823 O ALA A 121 -22.261 5.767 5.544 1.00 0.00 O ATOM 1824 CB ALA A 121 -22.096 3.705 7.607 1.00 0.00 C ATOM 0 H ALA A 121 -19.965 3.277 6.394 1.00 0.00 H new ATOM 0 HA ALA A 121 -22.665 2.555 5.906 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -23.125 3.921 7.895 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -21.742 2.830 8.153 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -21.465 4.561 7.845 1.00 0.00 H new ATOM 1830 N GLY A 122 -23.330 4.276 4.203 1.00 0.00 N ATOM 1831 CA GLY A 122 -23.872 5.264 3.274 1.00 0.00 C ATOM 1832 C GLY A 122 -23.636 4.838 1.821 1.00 0.00 C ATOM 1833 O GLY A 122 -22.586 5.192 1.248 1.00 0.00 O ATOM 1834 OXT GLY A 122 -24.487 4.124 1.252 1.00 0.00 O ATOM 0 H GLY A 122 -23.576 3.314 3.969 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -24.940 5.388 3.452 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -23.405 6.232 3.453 1.00 0.00 H new TER 1838 GLY A 122 ATOM 1839 N MET B 1 -14.581 -9.198 -9.035 1.00 0.00 N ATOM 1840 CA MET B 1 -14.724 -9.048 -7.571 1.00 0.00 C ATOM 1841 C MET B 1 -14.047 -7.736 -7.089 1.00 0.00 C ATOM 1842 O MET B 1 -13.724 -6.870 -7.912 1.00 0.00 O ATOM 1843 CB MET B 1 -14.166 -10.303 -6.838 1.00 0.00 C ATOM 1844 CG MET B 1 -12.641 -10.496 -6.903 1.00 0.00 C ATOM 1845 SD MET B 1 -12.060 -11.737 -5.720 1.00 0.00 S ATOM 1846 CE MET B 1 -12.610 -11.030 -4.156 1.00 0.00 C ATOM 0 H1 MET B 1 -15.522 -9.204 -9.477 1.00 0.00 H new ATOM 0 H2 MET B 1 -14.026 -8.404 -9.413 1.00 0.00 H new ATOM 0 H3 MET B 1 -14.094 -10.092 -9.246 1.00 0.00 H new ATOM 0 HA MET B 1 -15.783 -8.973 -7.323 1.00 0.00 H new ATOM 0 HB2 MET B 1 -14.462 -10.249 -5.790 1.00 0.00 H new ATOM 0 HB3 MET B 1 -14.643 -11.188 -7.259 1.00 0.00 H new ATOM 0 HG2 MET B 1 -12.357 -10.796 -7.912 1.00 0.00 H new ATOM 0 HG3 MET B 1 -12.147 -9.545 -6.702 1.00 0.00 H new ATOM 0 HE1 MET B 1 -12.259 -11.652 -3.332 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.205 -10.024 -4.049 1.00 0.00 H new ATOM 0 HE3 MET B 1 -13.699 -10.987 -4.139 1.00 0.00 H new ATOM 1856 N THR B 2 -13.827 -7.611 -5.757 1.00 0.00 N ATOM 1857 CA THR B 2 -13.391 -6.360 -5.100 1.00 0.00 C ATOM 1858 C THR B 2 -11.947 -5.949 -5.494 1.00 0.00 C ATOM 1859 O THR B 2 -11.028 -6.777 -5.467 1.00 0.00 O ATOM 1860 CB THR B 2 -13.493 -6.506 -3.538 1.00 0.00 C ATOM 1861 OG1 THR B 2 -14.788 -7.032 -3.189 1.00 0.00 O ATOM 1862 CG2 THR B 2 -13.277 -5.158 -2.818 1.00 0.00 C ATOM 0 H THR B 2 -13.949 -8.385 -5.105 1.00 0.00 H new ATOM 0 HA THR B 2 -14.059 -5.571 -5.446 1.00 0.00 H new ATOM 0 HB THR B 2 -12.706 -7.188 -3.215 1.00 0.00 H new ATOM 0 HG1 THR B 2 -14.699 -7.639 -2.425 1.00 0.00 H new ATOM 0 HG21 THR B 2 -13.356 -5.304 -1.741 1.00 0.00 H new ATOM 0 HG22 THR B 2 -12.287 -4.771 -3.060 1.00 0.00 H new ATOM 0 HG23 THR B 2 -14.035 -4.446 -3.144 1.00 0.00 H new ATOM 1870 N HIS B 3 -11.779 -4.662 -5.872 1.00 0.00 N ATOM 1871 CA HIS B 3 -10.470 -4.067 -6.216 1.00 0.00 C ATOM 1872 C HIS B 3 -10.190 -2.865 -5.286 1.00 0.00 C ATOM 1873 O HIS B 3 -10.952 -1.890 -5.305 1.00 0.00 O ATOM 1874 CB HIS B 3 -10.442 -3.621 -7.699 1.00 0.00 C ATOM 1875 CG HIS B 3 -10.597 -4.752 -8.673 1.00 0.00 C ATOM 1876 ND1 HIS B 3 -11.729 -4.942 -9.432 1.00 0.00 N ATOM 1877 CD2 HIS B 3 -9.741 -5.740 -9.030 1.00 0.00 C ATOM 1878 CE1 HIS B 3 -11.565 -5.988 -10.212 1.00 0.00 C ATOM 1879 NE2 HIS B 3 -10.369 -6.492 -9.987 1.00 0.00 N ATOM 0 H HIS B 3 -12.554 -4.003 -5.947 1.00 0.00 H new ATOM 0 HA HIS B 3 -9.693 -4.818 -6.077 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -11.240 -2.897 -7.866 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -9.500 -3.109 -7.897 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -8.750 -5.904 -8.634 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -12.288 -6.369 -10.918 1.00 0.00 H new ATOM 0 HE2 HIS B 3 -9.974 -7.310 -10.451 1.00 0.00 H new ATOM 1888 N PRO B 4 -9.102 -2.913 -4.455 1.00 0.00 N ATOM 1889 CA PRO B 4 -8.766 -1.822 -3.511 1.00 0.00 C ATOM 1890 C PRO B 4 -8.121 -0.612 -4.222 1.00 0.00 C ATOM 1891 O PRO B 4 -7.187 -0.777 -4.997 1.00 0.00 O ATOM 1892 CB PRO B 4 -7.766 -2.503 -2.544 1.00 0.00 C ATOM 1893 CG PRO B 4 -7.069 -3.525 -3.394 1.00 0.00 C ATOM 1894 CD PRO B 4 -8.119 -4.032 -4.364 1.00 0.00 C ATOM 0 HA PRO B 4 -9.644 -1.410 -3.014 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -7.061 -1.783 -2.128 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -8.280 -2.968 -1.703 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -6.225 -3.084 -3.925 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -6.673 -4.338 -2.785 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -7.685 -4.261 -5.337 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -8.588 -4.946 -4.001 1.00 0.00 H new ATOM 1902 N ASP B 5 -8.650 0.590 -3.961 1.00 0.00 N ATOM 1903 CA ASP B 5 -8.041 1.873 -4.409 1.00 0.00 C ATOM 1904 C ASP B 5 -7.542 2.673 -3.204 1.00 0.00 C ATOM 1905 O ASP B 5 -7.119 3.832 -3.328 1.00 0.00 O ATOM 1906 CB ASP B 5 -9.075 2.710 -5.197 1.00 0.00 C ATOM 1907 CG ASP B 5 -10.336 3.043 -4.364 1.00 0.00 C ATOM 1908 OD1 ASP B 5 -11.281 2.219 -4.335 1.00 0.00 O ATOM 1909 OD2 ASP B 5 -10.391 4.116 -3.718 1.00 0.00 O ATOM 0 H ASP B 5 -9.514 0.713 -3.433 1.00 0.00 H new ATOM 0 HA ASP B 5 -7.196 1.645 -5.059 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -8.608 3.638 -5.528 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -9.371 2.164 -6.093 1.00 0.00 H new ATOM 1914 N PHE B 6 -7.553 2.004 -2.052 1.00 0.00 N ATOM 1915 CA PHE B 6 -7.369 2.622 -0.750 1.00 0.00 C ATOM 1916 C PHE B 6 -6.237 1.870 -0.042 1.00 0.00 C ATOM 1917 O PHE B 6 -6.296 0.653 0.120 1.00 0.00 O ATOM 1918 CB PHE B 6 -8.714 2.563 0.041 1.00 0.00 C ATOM 1919 CG PHE B 6 -8.804 3.334 1.374 1.00 0.00 C ATOM 1920 CD1 PHE B 6 -7.802 4.187 1.828 1.00 0.00 C ATOM 1921 CD2 PHE B 6 -9.944 3.210 2.165 1.00 0.00 C ATOM 1922 CE1 PHE B 6 -7.947 4.876 3.017 1.00 0.00 C ATOM 1923 CE2 PHE B 6 -10.080 3.900 3.352 1.00 0.00 C ATOM 1924 CZ PHE B 6 -9.083 4.732 3.776 1.00 0.00 C ATOM 0 H PHE B 6 -7.694 0.995 -2.002 1.00 0.00 H new ATOM 0 HA PHE B 6 -7.094 3.674 -0.830 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -9.503 2.934 -0.613 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -8.936 1.516 0.245 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -6.902 4.312 1.245 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -10.741 2.557 1.841 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -7.159 5.534 3.353 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -10.974 3.782 3.946 1.00 0.00 H new ATOM 0 HZ PHE B 6 -9.187 5.274 4.704 1.00 0.00 H new ATOM 1934 N THR B 7 -5.188 2.610 0.302 1.00 0.00 N ATOM 1935 CA THR B 7 -4.079 2.116 1.123 1.00 0.00 C ATOM 1936 C THR B 7 -4.021 2.946 2.409 1.00 0.00 C ATOM 1937 O THR B 7 -4.224 4.163 2.391 1.00 0.00 O ATOM 1938 CB THR B 7 -2.712 2.166 0.357 1.00 0.00 C ATOM 1939 OG1 THR B 7 -1.646 1.685 1.199 1.00 0.00 O ATOM 1940 CG2 THR B 7 -2.366 3.576 -0.159 1.00 0.00 C ATOM 0 H THR B 7 -5.079 3.583 0.017 1.00 0.00 H new ATOM 0 HA THR B 7 -4.255 1.068 1.364 1.00 0.00 H new ATOM 0 HB THR B 7 -2.821 1.518 -0.513 1.00 0.00 H new ATOM 0 HG1 THR B 7 -0.829 1.584 0.667 1.00 0.00 H new ATOM 0 HG21 THR B 7 -1.409 3.548 -0.681 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.143 3.913 -0.845 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.300 4.265 0.683 1.00 0.00 H new ATOM 1948 N ILE B 8 -3.795 2.260 3.526 1.00 0.00 N ATOM 1949 CA ILE B 8 -3.753 2.864 4.858 1.00 0.00 C ATOM 1950 C ILE B 8 -2.409 2.521 5.494 1.00 0.00 C ATOM 1951 O ILE B 8 -2.033 1.350 5.556 1.00 0.00 O ATOM 1952 CB ILE B 8 -4.924 2.328 5.766 1.00 0.00 C ATOM 1953 CG1 ILE B 8 -6.299 2.527 5.061 1.00 0.00 C ATOM 1954 CG2 ILE B 8 -4.904 2.975 7.177 1.00 0.00 C ATOM 1955 CD1 ILE B 8 -7.503 2.037 5.834 1.00 0.00 C ATOM 0 H ILE B 8 -3.633 1.253 3.533 1.00 0.00 H new ATOM 0 HA ILE B 8 -3.873 3.943 4.767 1.00 0.00 H new ATOM 0 HB ILE B 8 -4.771 1.259 5.911 1.00 0.00 H new ATOM 0 HG12 ILE B 8 -6.430 3.589 4.852 1.00 0.00 H new ATOM 0 HG13 ILE B 8 -6.273 2.014 4.100 1.00 0.00 H new ATOM 0 HG21 ILE B 8 -5.727 2.578 7.771 1.00 0.00 H new ATOM 0 HG22 ILE B 8 -3.959 2.746 7.669 1.00 0.00 H new ATOM 0 HG23 ILE B 8 -5.012 4.056 7.083 1.00 0.00 H new ATOM 0 HD11 ILE B 8 -8.408 2.223 5.255 1.00 0.00 H new ATOM 0 HD12 ILE B 8 -7.405 0.968 6.020 1.00 0.00 H new ATOM 0 HD13 ILE B 8 -7.565 2.567 6.785 1.00 0.00 H new ATOM 1967 N LEU B 9 -1.684 3.538 5.939 1.00 0.00 N ATOM 1968 CA LEU B 9 -0.439 3.357 6.709 1.00 0.00 C ATOM 1969 C LEU B 9 -0.792 3.476 8.195 1.00 0.00 C ATOM 1970 O LEU B 9 -1.821 4.024 8.564 1.00 0.00 O ATOM 1971 CB LEU B 9 0.665 4.372 6.262 1.00 0.00 C ATOM 1972 CG LEU B 9 1.493 3.959 4.989 1.00 0.00 C ATOM 1973 CD1 LEU B 9 0.619 3.853 3.725 1.00 0.00 C ATOM 1974 CD2 LEU B 9 2.687 4.905 4.755 1.00 0.00 C ATOM 0 H LEU B 9 -1.933 4.515 5.782 1.00 0.00 H new ATOM 0 HA LEU B 9 -0.011 2.372 6.521 1.00 0.00 H new ATOM 0 HB2 LEU B 9 0.192 5.335 6.069 1.00 0.00 H new ATOM 0 HB3 LEU B 9 1.357 4.518 7.092 1.00 0.00 H new ATOM 0 HG LEU B 9 1.886 2.963 5.191 1.00 0.00 H new ATOM 0 HD11 LEU B 9 1.240 3.565 2.876 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -0.155 3.101 3.880 1.00 0.00 H new ATOM 0 HD13 LEU B 9 0.153 4.817 3.523 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.234 4.588 3.867 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.323 5.922 4.612 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.350 4.875 5.620 1.00 0.00 H new ATOM 1986 N TYR B 10 0.083 2.938 9.032 1.00 0.00 N ATOM 1987 CA TYR B 10 -0.117 2.841 10.490 1.00 0.00 C ATOM 1988 C TYR B 10 0.795 3.855 11.200 1.00 0.00 C ATOM 1989 O TYR B 10 1.944 3.982 10.822 1.00 0.00 O ATOM 1990 CB TYR B 10 0.216 1.390 10.963 1.00 0.00 C ATOM 1991 CG TYR B 10 1.710 1.030 10.822 1.00 0.00 C ATOM 1992 CD1 TYR B 10 2.287 0.807 9.569 1.00 0.00 C ATOM 1993 CD2 TYR B 10 2.550 0.982 11.935 1.00 0.00 C ATOM 1994 CE1 TYR B 10 3.634 0.557 9.434 1.00 0.00 C ATOM 1995 CE2 TYR B 10 3.895 0.721 11.798 1.00 0.00 C ATOM 1996 CZ TYR B 10 4.433 0.512 10.551 1.00 0.00 C ATOM 1997 OH TYR B 10 5.772 0.267 10.417 1.00 0.00 O ATOM 0 H TYR B 10 0.972 2.546 8.721 1.00 0.00 H new ATOM 0 HA TYR B 10 -1.155 3.065 10.737 1.00 0.00 H new ATOM 0 HB2 TYR B 10 -0.081 1.278 12.006 1.00 0.00 H new ATOM 0 HB3 TYR B 10 -0.377 0.682 10.385 1.00 0.00 H new ATOM 0 HD1 TYR B 10 1.663 0.831 8.688 1.00 0.00 H new ATOM 0 HD2 TYR B 10 2.139 1.152 12.919 1.00 0.00 H new ATOM 0 HE1 TYR B 10 4.061 0.397 8.455 1.00 0.00 H new ATOM 0 HE2 TYR B 10 4.528 0.680 12.672 1.00 0.00 H new ATOM 0 HH TYR B 10 6.241 1.107 10.230 1.00 0.00 H new ATOM 2007 N VAL B 11 0.295 4.604 12.192 1.00 0.00 N ATOM 2008 CA VAL B 11 1.127 5.562 12.973 1.00 0.00 C ATOM 2009 C VAL B 11 0.959 5.289 14.474 1.00 0.00 C ATOM 2010 O VAL B 11 0.267 4.345 14.869 1.00 0.00 O ATOM 2011 CB VAL B 11 0.765 7.064 12.632 1.00 0.00 C ATOM 2012 CG1 VAL B 11 0.919 7.338 11.116 1.00 0.00 C ATOM 2013 CG2 VAL B 11 -0.649 7.473 13.127 1.00 0.00 C ATOM 0 H VAL B 11 -0.682 4.573 12.482 1.00 0.00 H new ATOM 0 HA VAL B 11 2.170 5.412 12.696 1.00 0.00 H new ATOM 0 HB VAL B 11 1.476 7.686 13.176 1.00 0.00 H new ATOM 0 HG11 VAL B 11 0.665 8.377 10.906 1.00 0.00 H new ATOM 0 HG12 VAL B 11 1.949 7.149 10.815 1.00 0.00 H new ATOM 0 HG13 VAL B 11 0.252 6.681 10.558 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -0.840 8.513 12.864 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.398 6.836 12.656 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -0.703 7.357 14.209 1.00 0.00 H new ATOM 2023 N ASP B 12 1.669 6.074 15.299 1.00 0.00 N ATOM 2024 CA ASP B 12 1.638 5.961 16.768 1.00 0.00 C ATOM 2025 C ASP B 12 1.546 7.378 17.376 1.00 0.00 C ATOM 2026 O ASP B 12 2.216 7.701 18.369 1.00 0.00 O ATOM 2027 CB ASP B 12 2.897 5.174 17.243 1.00 0.00 C ATOM 2028 CG ASP B 12 2.905 4.843 18.750 1.00 0.00 C ATOM 2029 OD1 ASP B 12 1.994 4.127 19.205 1.00 0.00 O ATOM 2030 OD2 ASP B 12 3.854 5.234 19.466 1.00 0.00 O ATOM 0 H ASP B 12 2.287 6.813 14.963 1.00 0.00 H new ATOM 0 HA ASP B 12 0.764 5.405 17.107 1.00 0.00 H new ATOM 0 HB2 ASP B 12 2.965 4.244 16.678 1.00 0.00 H new ATOM 0 HB3 ASP B 12 3.787 5.757 17.006 1.00 0.00 H new ATOM 2035 N ASN B 13 0.614 8.179 16.807 1.00 0.00 N ATOM 2036 CA ASN B 13 0.527 9.645 17.050 1.00 0.00 C ATOM 2037 C ASN B 13 -0.429 10.305 16.032 1.00 0.00 C ATOM 2038 O ASN B 13 0.015 10.791 14.982 1.00 0.00 O ATOM 2039 CB ASN B 13 1.929 10.346 17.013 1.00 0.00 C ATOM 2040 CG ASN B 13 1.926 11.783 17.542 1.00 0.00 C ATOM 2041 OD1 ASN B 13 1.016 12.205 18.258 1.00 0.00 O ATOM 2042 ND2 ASN B 13 2.972 12.523 17.241 1.00 0.00 N ATOM 0 H ASN B 13 -0.100 7.831 16.167 1.00 0.00 H new ATOM 0 HA ASN B 13 0.130 9.776 18.057 1.00 0.00 H new ATOM 0 HB2 ASN B 13 2.633 9.756 17.600 1.00 0.00 H new ATOM 0 HB3 ASN B 13 2.294 10.349 15.986 1.00 0.00 H new ATOM 0 HD21 ASN B 13 3.045 13.474 17.603 1.00 0.00 H new ATOM 0 HD22 ASN B 13 3.709 12.146 16.646 1.00 0.00 H new ATOM 2049 N PRO B 14 -1.774 10.285 16.305 1.00 0.00 N ATOM 2050 CA PRO B 14 -2.772 10.963 15.444 1.00 0.00 C ATOM 2051 C PRO B 14 -2.471 12.479 15.165 1.00 0.00 C ATOM 2052 O PRO B 14 -2.399 12.832 13.993 1.00 0.00 O ATOM 2053 CB PRO B 14 -4.127 10.734 16.166 1.00 0.00 C ATOM 2054 CG PRO B 14 -3.894 9.511 17.001 1.00 0.00 C ATOM 2055 CD PRO B 14 -2.438 9.557 17.424 1.00 0.00 C ATOM 0 HA PRO B 14 -2.763 10.545 14.437 1.00 0.00 H new ATOM 0 HB2 PRO B 14 -4.400 11.591 16.782 1.00 0.00 H new ATOM 0 HB3 PRO B 14 -4.938 10.582 15.453 1.00 0.00 H new ATOM 0 HG2 PRO B 14 -4.552 9.502 17.870 1.00 0.00 H new ATOM 0 HG3 PRO B 14 -4.106 8.606 16.432 1.00 0.00 H new ATOM 0 HD2 PRO B 14 -2.312 10.078 18.373 1.00 0.00 H new ATOM 0 HD3 PRO B 14 -2.025 8.556 17.553 1.00 0.00 H new ATOM 2063 N PRO B 15 -2.243 13.396 16.194 1.00 0.00 N ATOM 2064 CA PRO B 15 -2.017 14.850 15.929 1.00 0.00 C ATOM 2065 C PRO B 15 -0.899 15.120 14.891 1.00 0.00 C ATOM 2066 O PRO B 15 -1.159 15.556 13.767 1.00 0.00 O ATOM 2067 CB PRO B 15 -1.662 15.432 17.328 1.00 0.00 C ATOM 2068 CG PRO B 15 -2.339 14.502 18.285 1.00 0.00 C ATOM 2069 CD PRO B 15 -2.200 13.127 17.665 1.00 0.00 C ATOM 0 HA PRO B 15 -2.895 15.316 15.482 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -0.584 15.457 17.489 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -2.024 16.454 17.440 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -1.871 14.540 19.269 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -3.387 14.769 18.420 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -1.265 12.648 17.957 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -3.008 12.464 17.975 1.00 0.00 H new ATOM 2077 N ALA B 16 0.333 14.753 15.274 1.00 0.00 N ATOM 2078 CA ALA B 16 1.549 15.222 14.586 1.00 0.00 C ATOM 2079 C ALA B 16 1.808 14.448 13.293 1.00 0.00 C ATOM 2080 O ALA B 16 2.240 15.038 12.301 1.00 0.00 O ATOM 2081 CB ALA B 16 2.767 15.162 15.512 1.00 0.00 C ATOM 0 H ALA B 16 0.516 14.130 16.060 1.00 0.00 H new ATOM 0 HA ALA B 16 1.380 16.264 14.313 1.00 0.00 H new ATOM 0 HB1 ALA B 16 3.649 15.514 14.977 1.00 0.00 H new ATOM 0 HB2 ALA B 16 2.594 15.795 16.382 1.00 0.00 H new ATOM 0 HB3 ALA B 16 2.926 14.134 15.837 1.00 0.00 H new ATOM 2087 N SER B 17 1.529 13.133 13.290 1.00 0.00 N ATOM 2088 CA SER B 17 1.865 12.276 12.140 1.00 0.00 C ATOM 2089 C SER B 17 0.833 12.445 11.013 1.00 0.00 C ATOM 2090 O SER B 17 1.152 12.231 9.834 1.00 0.00 O ATOM 2091 CB SER B 17 1.973 10.797 12.558 1.00 0.00 C ATOM 2092 OG SER B 17 2.488 10.006 11.500 1.00 0.00 O ATOM 0 H SER B 17 1.076 12.644 14.063 1.00 0.00 H new ATOM 0 HA SER B 17 2.839 12.591 11.765 1.00 0.00 H new ATOM 0 HB2 SER B 17 2.620 10.708 13.431 1.00 0.00 H new ATOM 0 HB3 SER B 17 0.991 10.425 12.850 1.00 0.00 H new ATOM 0 HG SER B 17 3.330 9.591 11.782 1.00 0.00 H new ATOM 2098 N THR B 18 -0.392 12.885 11.362 1.00 0.00 N ATOM 2099 CA THR B 18 -1.411 13.222 10.365 1.00 0.00 C ATOM 2100 C THR B 18 -1.127 14.554 9.666 1.00 0.00 C ATOM 2101 O THR B 18 -1.199 14.653 8.440 1.00 0.00 O ATOM 2102 CB THR B 18 -2.825 13.259 11.004 1.00 0.00 C ATOM 2103 OG1 THR B 18 -3.120 11.950 11.505 1.00 0.00 O ATOM 2104 CG2 THR B 18 -3.931 13.724 10.027 1.00 0.00 C ATOM 0 H THR B 18 -0.694 13.013 12.328 1.00 0.00 H new ATOM 0 HA THR B 18 -1.376 12.435 9.612 1.00 0.00 H new ATOM 0 HB THR B 18 -2.814 13.997 11.807 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.948 11.923 12.469 1.00 0.00 H new ATOM 0 HG21 THR B 18 -4.893 13.726 10.540 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.706 14.731 9.675 1.00 0.00 H new ATOM 0 HG23 THR B 18 -3.975 13.043 9.177 1.00 0.00 H new ATOM 2112 N GLN B 19 -0.697 15.543 10.491 1.00 0.00 N ATOM 2113 CA GLN B 19 -0.225 16.862 10.017 1.00 0.00 C ATOM 2114 C GLN B 19 1.058 16.693 9.183 1.00 0.00 C ATOM 2115 O GLN B 19 1.337 17.506 8.292 1.00 0.00 O ATOM 2116 CB GLN B 19 0.031 17.814 11.213 1.00 0.00 C ATOM 2117 CG GLN B 19 -1.220 18.165 12.043 1.00 0.00 C ATOM 2118 CD GLN B 19 -0.975 19.191 13.163 1.00 0.00 C ATOM 2119 OE1 GLN B 19 -1.599 19.128 14.225 1.00 0.00 O ATOM 2120 NE2 GLN B 19 -0.113 20.177 12.918 1.00 0.00 N ATOM 0 H GLN B 19 -0.669 15.444 11.506 1.00 0.00 H new ATOM 0 HA GLN B 19 -0.999 17.304 9.390 1.00 0.00 H new ATOM 0 HB2 GLN B 19 0.769 17.356 11.871 1.00 0.00 H new ATOM 0 HB3 GLN B 19 0.470 18.738 10.836 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -1.988 18.553 11.373 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -1.615 17.251 12.485 1.00 0.00 H new ATOM 0 HE21 GLN B 19 0.390 20.206 12.031 1.00 0.00 H new ATOM 0 HE22 GLN B 19 0.044 20.903 13.617 1.00 0.00 H new ATOM 2129 N PHE B 20 1.835 15.639 9.499 1.00 0.00 N ATOM 2130 CA PHE B 20 3.073 15.312 8.782 1.00 0.00 C ATOM 2131 C PHE B 20 2.750 14.911 7.334 1.00 0.00 C ATOM 2132 O PHE B 20 3.345 15.460 6.412 1.00 0.00 O ATOM 2133 CB PHE B 20 3.824 14.164 9.505 1.00 0.00 C ATOM 2134 CG PHE B 20 5.209 13.848 8.953 1.00 0.00 C ATOM 2135 CD1 PHE B 20 6.320 14.553 9.403 1.00 0.00 C ATOM 2136 CD2 PHE B 20 5.405 12.857 7.986 1.00 0.00 C ATOM 2137 CE1 PHE B 20 7.572 14.284 8.910 1.00 0.00 C ATOM 2138 CE2 PHE B 20 6.665 12.593 7.495 1.00 0.00 C ATOM 2139 CZ PHE B 20 7.746 13.308 7.961 1.00 0.00 C ATOM 0 H PHE B 20 1.618 14.994 10.259 1.00 0.00 H new ATOM 0 HA PHE B 20 3.717 16.192 8.768 1.00 0.00 H new ATOM 0 HB2 PHE B 20 3.921 14.422 10.560 1.00 0.00 H new ATOM 0 HB3 PHE B 20 3.214 13.262 9.452 1.00 0.00 H new ATOM 0 HD1 PHE B 20 6.196 15.323 10.151 1.00 0.00 H new ATOM 0 HD2 PHE B 20 4.560 12.293 7.620 1.00 0.00 H new ATOM 0 HE1 PHE B 20 8.423 14.842 9.270 1.00 0.00 H new ATOM 0 HE2 PHE B 20 6.805 11.827 6.746 1.00 0.00 H new ATOM 0 HZ PHE B 20 8.734 13.100 7.578 1.00 0.00 H new ATOM 2149 N TYR B 21 1.757 14.005 7.145 1.00 0.00 N ATOM 2150 CA TYR B 21 1.293 13.609 5.793 1.00 0.00 C ATOM 2151 C TYR B 21 0.569 14.779 5.103 1.00 0.00 C ATOM 2152 O TYR B 21 0.590 14.850 3.866 1.00 0.00 O ATOM 2153 CB TYR B 21 0.424 12.322 5.850 1.00 0.00 C ATOM 2154 CG TYR B 21 1.266 11.031 5.898 1.00 0.00 C ATOM 2155 CD1 TYR B 21 1.723 10.505 7.108 1.00 0.00 C ATOM 2156 CD2 TYR B 21 1.622 10.361 4.721 1.00 0.00 C ATOM 2157 CE1 TYR B 21 2.498 9.365 7.144 1.00 0.00 C ATOM 2158 CE2 TYR B 21 2.392 9.218 4.756 1.00 0.00 C ATOM 2159 CZ TYR B 21 2.827 8.727 5.965 1.00 0.00 C ATOM 2160 OH TYR B 21 3.613 7.606 5.995 1.00 0.00 O ATOM 0 H TYR B 21 1.266 13.538 7.907 1.00 0.00 H new ATOM 0 HA TYR B 21 2.165 13.367 5.185 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -0.220 12.363 6.729 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -0.229 12.292 4.978 1.00 0.00 H new ATOM 0 HD1 TYR B 21 1.465 11.000 8.033 1.00 0.00 H new ATOM 0 HD2 TYR B 21 1.287 10.746 3.769 1.00 0.00 H new ATOM 0 HE1 TYR B 21 2.845 8.974 8.089 1.00 0.00 H new ATOM 0 HE2 TYR B 21 2.652 8.711 3.839 1.00 0.00 H new ATOM 0 HH TYR B 21 3.690 7.285 6.918 1.00 0.00 H new ATOM 2170 N LYS B 22 -0.083 15.674 5.879 1.00 0.00 N ATOM 2171 CA LYS B 22 -0.786 16.848 5.309 1.00 0.00 C ATOM 2172 C LYS B 22 0.155 17.738 4.483 1.00 0.00 C ATOM 2173 O LYS B 22 -0.159 18.117 3.362 1.00 0.00 O ATOM 2174 CB LYS B 22 -1.488 17.688 6.403 1.00 0.00 C ATOM 2175 CG LYS B 22 -2.735 17.033 7.023 1.00 0.00 C ATOM 2176 CD LYS B 22 -3.401 17.943 8.078 1.00 0.00 C ATOM 2177 CE LYS B 22 -3.956 19.257 7.478 1.00 0.00 C ATOM 2178 NZ LYS B 22 -4.459 20.195 8.509 1.00 0.00 N ATOM 0 H LYS B 22 -0.138 15.608 6.895 1.00 0.00 H new ATOM 0 HA LYS B 22 -1.550 16.450 4.641 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -0.771 17.895 7.198 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -1.775 18.648 5.975 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -3.454 16.804 6.236 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -2.456 16.086 7.485 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -4.213 17.398 8.559 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -2.674 18.183 8.854 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -3.172 19.746 6.901 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -4.763 19.021 6.784 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -4.818 21.056 8.049 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -5.227 19.743 9.045 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -3.685 20.445 9.158 1.00 0.00 H new ATOM 2192 N ALA B 23 1.321 18.053 5.080 1.00 0.00 N ATOM 2193 CA ALA B 23 2.377 18.854 4.429 1.00 0.00 C ATOM 2194 C ALA B 23 3.118 18.015 3.367 1.00 0.00 C ATOM 2195 O ALA B 23 3.448 18.514 2.283 1.00 0.00 O ATOM 2196 CB ALA B 23 3.366 19.373 5.488 1.00 0.00 C ATOM 0 H ALA B 23 1.558 17.759 6.028 1.00 0.00 H new ATOM 0 HA ALA B 23 1.914 19.705 3.929 1.00 0.00 H new ATOM 0 HB1 ALA B 23 4.143 19.963 5.002 1.00 0.00 H new ATOM 0 HB2 ALA B 23 2.835 19.995 6.208 1.00 0.00 H new ATOM 0 HB3 ALA B 23 3.822 18.529 6.005 1.00 0.00 H new ATOM 2202 N LEU B 24 3.347 16.734 3.705 1.00 0.00 N ATOM 2203 CA LEU B 24 4.133 15.769 2.896 1.00 0.00 C ATOM 2204 C LEU B 24 3.522 15.531 1.504 1.00 0.00 C ATOM 2205 O LEU B 24 4.239 15.234 0.547 1.00 0.00 O ATOM 2206 CB LEU B 24 4.187 14.406 3.646 1.00 0.00 C ATOM 2207 CG LEU B 24 5.199 13.338 3.125 1.00 0.00 C ATOM 2208 CD1 LEU B 24 6.634 13.710 3.528 1.00 0.00 C ATOM 2209 CD2 LEU B 24 4.827 11.918 3.609 1.00 0.00 C ATOM 0 H LEU B 24 2.985 16.326 4.567 1.00 0.00 H new ATOM 0 HA LEU B 24 5.128 16.193 2.760 1.00 0.00 H new ATOM 0 HB2 LEU B 24 4.418 14.606 4.692 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.190 13.967 3.618 1.00 0.00 H new ATOM 0 HG LEU B 24 5.145 13.329 2.036 1.00 0.00 H new ATOM 0 HD11 LEU B 24 7.324 12.953 3.156 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.892 14.679 3.100 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.705 13.762 4.614 1.00 0.00 H new ATOM 0 HD21 LEU B 24 5.554 11.201 3.227 1.00 0.00 H new ATOM 0 HD22 LEU B 24 4.831 11.892 4.699 1.00 0.00 H new ATOM 0 HD23 LEU B 24 3.834 11.658 3.243 1.00 0.00 H new ATOM 2221 N LEU B 25 2.185 15.657 1.423 1.00 0.00 N ATOM 2222 CA LEU B 25 1.419 15.545 0.166 1.00 0.00 C ATOM 2223 C LEU B 25 0.937 16.937 -0.290 1.00 0.00 C ATOM 2224 O LEU B 25 0.761 17.170 -1.492 1.00 0.00 O ATOM 2225 CB LEU B 25 0.238 14.570 0.376 1.00 0.00 C ATOM 2226 CG LEU B 25 0.641 13.156 0.910 1.00 0.00 C ATOM 2227 CD1 LEU B 25 -0.584 12.255 1.118 1.00 0.00 C ATOM 2228 CD2 LEU B 25 1.665 12.487 -0.019 1.00 0.00 C ATOM 0 H LEU B 25 1.599 15.842 2.237 1.00 0.00 H new ATOM 0 HA LEU B 25 2.056 15.148 -0.624 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -0.466 15.020 1.076 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -0.288 14.449 -0.571 1.00 0.00 H new ATOM 0 HG LEU B 25 1.109 13.299 1.884 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.261 11.282 1.489 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.256 12.716 1.843 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -1.106 12.126 0.170 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.928 11.506 0.376 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.235 12.375 -1.014 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.560 13.106 -0.079 1.00 0.00 H new ATOM 2240 N GLY B 26 0.719 17.844 0.678 1.00 0.00 N ATOM 2241 CA GLY B 26 0.125 19.165 0.406 1.00 0.00 C ATOM 2242 C GLY B 26 -1.406 19.142 0.442 1.00 0.00 C ATOM 2243 O GLY B 26 -2.059 20.026 -0.118 1.00 0.00 O ATOM 0 H GLY B 26 0.946 17.685 1.660 1.00 0.00 H new ATOM 0 HA2 GLY B 26 0.491 19.882 1.141 1.00 0.00 H new ATOM 0 HA3 GLY B 26 0.456 19.514 -0.572 1.00 0.00 H new ATOM 2247 N VAL B 27 -1.978 18.124 1.128 1.00 0.00 N ATOM 2248 CA VAL B 27 -3.445 17.890 1.205 1.00 0.00 C ATOM 2249 C VAL B 27 -3.955 18.048 2.658 1.00 0.00 C ATOM 2250 O VAL B 27 -3.179 18.368 3.556 1.00 0.00 O ATOM 2251 CB VAL B 27 -3.817 16.458 0.656 1.00 0.00 C ATOM 2252 CG1 VAL B 27 -3.339 16.282 -0.804 1.00 0.00 C ATOM 2253 CG2 VAL B 27 -3.270 15.328 1.576 1.00 0.00 C ATOM 0 H VAL B 27 -1.433 17.436 1.648 1.00 0.00 H new ATOM 0 HA VAL B 27 -3.932 18.640 0.581 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.904 16.376 0.662 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -3.608 15.287 -1.157 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -3.815 17.032 -1.436 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -2.257 16.403 -0.850 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -3.547 14.358 1.164 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -2.184 15.401 1.635 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -3.696 15.433 2.574 1.00 0.00 H new ATOM 2263 N ASP B 28 -5.269 17.831 2.864 1.00 0.00 N ATOM 2264 CA ASP B 28 -5.910 17.827 4.200 1.00 0.00 C ATOM 2265 C ASP B 28 -6.863 16.611 4.301 1.00 0.00 C ATOM 2266 O ASP B 28 -7.347 16.130 3.266 1.00 0.00 O ATOM 2267 CB ASP B 28 -6.672 19.164 4.444 1.00 0.00 C ATOM 2268 CG ASP B 28 -7.898 19.366 3.524 1.00 0.00 C ATOM 2269 OD1 ASP B 28 -7.725 19.828 2.380 1.00 0.00 O ATOM 2270 OD2 ASP B 28 -9.040 19.077 3.943 1.00 0.00 O ATOM 0 H ASP B 28 -5.924 17.652 2.103 1.00 0.00 H new ATOM 0 HA ASP B 28 -5.146 17.741 4.973 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -7.000 19.199 5.483 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -5.982 19.995 4.300 1.00 0.00 H new ATOM 2275 N PRO B 29 -7.136 16.065 5.535 1.00 0.00 N ATOM 2276 CA PRO B 29 -8.053 14.919 5.714 1.00 0.00 C ATOM 2277 C PRO B 29 -9.528 15.304 5.475 1.00 0.00 C ATOM 2278 O PRO B 29 -9.986 16.343 5.961 1.00 0.00 O ATOM 2279 CB PRO B 29 -7.810 14.465 7.192 1.00 0.00 C ATOM 2280 CG PRO B 29 -6.565 15.191 7.619 1.00 0.00 C ATOM 2281 CD PRO B 29 -6.571 16.483 6.836 1.00 0.00 C ATOM 0 HA PRO B 29 -7.858 14.126 4.992 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -8.656 14.723 7.829 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -7.680 13.385 7.257 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -6.569 15.381 8.692 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -5.673 14.604 7.402 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -7.182 17.247 7.317 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -5.569 16.898 6.729 1.00 0.00 H new ATOM 2289 N VAL B 30 -10.250 14.475 4.699 1.00 0.00 N ATOM 2290 CA VAL B 30 -11.710 14.594 4.552 1.00 0.00 C ATOM 2291 C VAL B 30 -12.393 14.211 5.881 1.00 0.00 C ATOM 2292 O VAL B 30 -13.303 14.901 6.355 1.00 0.00 O ATOM 2293 CB VAL B 30 -12.262 13.722 3.352 1.00 0.00 C ATOM 2294 CG1 VAL B 30 -11.843 12.230 3.462 1.00 0.00 C ATOM 2295 CG2 VAL B 30 -13.800 13.870 3.214 1.00 0.00 C ATOM 0 H VAL B 30 -9.841 13.711 4.161 1.00 0.00 H new ATOM 0 HA VAL B 30 -11.946 15.631 4.313 1.00 0.00 H new ATOM 0 HB VAL B 30 -11.803 14.108 2.442 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -12.247 11.675 2.615 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -10.755 12.156 3.459 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -12.232 11.810 4.390 1.00 0.00 H new ATOM 0 HG21 VAL B 30 -14.151 13.260 2.382 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -14.281 13.540 4.134 1.00 0.00 H new ATOM 0 HG23 VAL B 30 -14.050 14.915 3.029 1.00 0.00 H new ATOM 2305 N GLU B 31 -11.881 13.137 6.505 1.00 0.00 N ATOM 2306 CA GLU B 31 -12.383 12.598 7.775 1.00 0.00 C ATOM 2307 C GLU B 31 -11.245 12.590 8.801 1.00 0.00 C ATOM 2308 O GLU B 31 -10.089 12.327 8.446 1.00 0.00 O ATOM 2309 CB GLU B 31 -12.923 11.157 7.569 1.00 0.00 C ATOM 2310 CG GLU B 31 -14.058 11.033 6.533 1.00 0.00 C ATOM 2311 CD GLU B 31 -15.291 11.885 6.886 1.00 0.00 C ATOM 2312 OE1 GLU B 31 -15.979 11.558 7.877 1.00 0.00 O ATOM 2313 OE2 GLU B 31 -15.599 12.865 6.173 1.00 0.00 O ATOM 0 H GLU B 31 -11.091 12.611 6.131 1.00 0.00 H new ATOM 0 HA GLU B 31 -13.198 13.224 8.138 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -12.097 10.515 7.261 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -13.281 10.778 8.526 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -13.684 11.334 5.554 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -14.356 9.988 6.453 1.00 0.00 H new ATOM 2320 N SER B 32 -11.577 12.876 10.063 1.00 0.00 N ATOM 2321 CA SER B 32 -10.625 12.837 11.181 1.00 0.00 C ATOM 2322 C SER B 32 -11.319 12.239 12.416 1.00 0.00 C ATOM 2323 O SER B 32 -12.503 12.492 12.668 1.00 0.00 O ATOM 2324 CB SER B 32 -10.072 14.255 11.467 1.00 0.00 C ATOM 2325 OG SER B 32 -11.121 15.191 11.666 1.00 0.00 O ATOM 0 H SER B 32 -12.521 13.143 10.342 1.00 0.00 H new ATOM 0 HA SER B 32 -9.776 12.204 10.922 1.00 0.00 H new ATOM 0 HB2 SER B 32 -9.435 14.227 12.351 1.00 0.00 H new ATOM 0 HB3 SER B 32 -9.447 14.578 10.634 1.00 0.00 H new ATOM 0 HG SER B 32 -10.740 16.076 11.846 1.00 0.00 H new ATOM 2331 N SER B 33 -10.571 11.420 13.155 1.00 0.00 N ATOM 2332 CA SER B 33 -11.050 10.680 14.334 1.00 0.00 C ATOM 2333 C SER B 33 -9.911 10.610 15.375 1.00 0.00 C ATOM 2334 O SER B 33 -8.748 10.833 15.007 1.00 0.00 O ATOM 2335 CB SER B 33 -11.505 9.260 13.897 1.00 0.00 C ATOM 2336 OG SER B 33 -12.646 9.328 13.054 1.00 0.00 O ATOM 0 H SER B 33 -9.588 11.245 12.949 1.00 0.00 H new ATOM 0 HA SER B 33 -11.903 11.186 14.786 1.00 0.00 H new ATOM 0 HB2 SER B 33 -10.691 8.759 13.373 1.00 0.00 H new ATOM 0 HB3 SER B 33 -11.735 8.661 14.778 1.00 0.00 H new ATOM 0 HG SER B 33 -12.580 8.641 12.358 1.00 0.00 H new ATOM 2342 N PRO B 34 -10.211 10.304 16.691 1.00 0.00 N ATOM 2343 CA PRO B 34 -9.183 10.242 17.767 1.00 0.00 C ATOM 2344 C PRO B 34 -7.990 9.310 17.441 1.00 0.00 C ATOM 2345 O PRO B 34 -6.891 9.552 17.930 1.00 0.00 O ATOM 2346 CB PRO B 34 -9.977 9.742 19.017 1.00 0.00 C ATOM 2347 CG PRO B 34 -11.261 9.192 18.469 1.00 0.00 C ATOM 2348 CD PRO B 34 -11.568 10.040 17.257 1.00 0.00 C ATOM 0 HA PRO B 34 -8.711 11.213 17.914 1.00 0.00 H new ATOM 0 HB2 PRO B 34 -9.420 8.977 19.558 1.00 0.00 H new ATOM 0 HB3 PRO B 34 -10.164 10.556 19.717 1.00 0.00 H new ATOM 0 HG2 PRO B 34 -11.156 8.141 18.198 1.00 0.00 H new ATOM 0 HG3 PRO B 34 -12.062 9.253 19.206 1.00 0.00 H new ATOM 0 HD2 PRO B 34 -12.208 9.516 16.547 1.00 0.00 H new ATOM 0 HD3 PRO B 34 -12.081 10.963 17.528 1.00 0.00 H new ATOM 2356 N THR B 35 -8.215 8.256 16.618 1.00 0.00 N ATOM 2357 CA THR B 35 -7.160 7.266 16.284 1.00 0.00 C ATOM 2358 C THR B 35 -6.979 7.035 14.763 1.00 0.00 C ATOM 2359 O THR B 35 -6.064 6.300 14.365 1.00 0.00 O ATOM 2360 CB THR B 35 -7.470 5.902 16.989 1.00 0.00 C ATOM 2361 OG1 THR B 35 -6.366 4.985 16.840 1.00 0.00 O ATOM 2362 CG2 THR B 35 -8.763 5.253 16.449 1.00 0.00 C ATOM 0 H THR B 35 -9.114 8.070 16.174 1.00 0.00 H new ATOM 0 HA THR B 35 -6.222 7.685 16.648 1.00 0.00 H new ATOM 0 HB THR B 35 -7.617 6.119 18.047 1.00 0.00 H new ATOM 0 HG1 THR B 35 -5.865 4.937 17.681 1.00 0.00 H new ATOM 0 HG21 THR B 35 -8.940 4.310 16.965 1.00 0.00 H new ATOM 0 HG22 THR B 35 -9.605 5.923 16.620 1.00 0.00 H new ATOM 0 HG23 THR B 35 -8.658 5.067 15.380 1.00 0.00 H new ATOM 2370 N PHE B 36 -7.807 7.671 13.906 1.00 0.00 N ATOM 2371 CA PHE B 36 -7.767 7.404 12.443 1.00 0.00 C ATOM 2372 C PHE B 36 -7.926 8.714 11.656 1.00 0.00 C ATOM 2373 O PHE B 36 -8.711 9.584 12.033 1.00 0.00 O ATOM 2374 CB PHE B 36 -8.870 6.373 12.029 1.00 0.00 C ATOM 2375 CG PHE B 36 -8.733 5.821 10.591 1.00 0.00 C ATOM 2376 CD1 PHE B 36 -9.255 6.504 9.490 1.00 0.00 C ATOM 2377 CD2 PHE B 36 -8.078 4.621 10.347 1.00 0.00 C ATOM 2378 CE1 PHE B 36 -9.125 6.010 8.207 1.00 0.00 C ATOM 2379 CE2 PHE B 36 -7.947 4.129 9.065 1.00 0.00 C ATOM 2380 CZ PHE B 36 -8.470 4.825 7.995 1.00 0.00 C ATOM 0 H PHE B 36 -8.501 8.362 14.190 1.00 0.00 H new ATOM 0 HA PHE B 36 -6.797 6.970 12.203 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -8.847 5.537 12.728 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -9.847 6.846 12.130 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -9.772 7.439 9.646 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -7.664 4.064 11.175 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -9.539 6.556 7.372 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -7.432 3.194 8.898 1.00 0.00 H new ATOM 0 HZ PHE B 36 -8.364 4.437 6.993 1.00 0.00 H new ATOM 2390 N SER B 37 -7.181 8.819 10.550 1.00 0.00 N ATOM 2391 CA SER B 37 -7.226 9.950 9.624 1.00 0.00 C ATOM 2392 C SER B 37 -7.482 9.424 8.212 1.00 0.00 C ATOM 2393 O SER B 37 -6.896 8.417 7.814 1.00 0.00 O ATOM 2394 CB SER B 37 -5.882 10.687 9.676 1.00 0.00 C ATOM 2395 OG SER B 37 -5.545 10.979 11.018 1.00 0.00 O ATOM 0 H SER B 37 -6.514 8.100 10.269 1.00 0.00 H new ATOM 0 HA SER B 37 -8.025 10.638 9.901 1.00 0.00 H new ATOM 0 HB2 SER B 37 -5.104 10.074 9.221 1.00 0.00 H new ATOM 0 HB3 SER B 37 -5.940 11.609 9.098 1.00 0.00 H new ATOM 0 HG SER B 37 -4.600 11.235 11.070 1.00 0.00 H new ATOM 2401 N LEU B 38 -8.351 10.098 7.464 1.00 0.00 N ATOM 2402 CA LEU B 38 -8.677 9.719 6.090 1.00 0.00 C ATOM 2403 C LEU B 38 -8.490 10.955 5.200 1.00 0.00 C ATOM 2404 O LEU B 38 -9.209 11.940 5.351 1.00 0.00 O ATOM 2405 CB LEU B 38 -10.129 9.148 6.018 1.00 0.00 C ATOM 2406 CG LEU B 38 -10.377 8.020 4.961 1.00 0.00 C ATOM 2407 CD1 LEU B 38 -11.839 7.543 4.989 1.00 0.00 C ATOM 2408 CD2 LEU B 38 -9.950 8.442 3.539 1.00 0.00 C ATOM 0 H LEU B 38 -8.851 10.924 7.793 1.00 0.00 H new ATOM 0 HA LEU B 38 -8.016 8.928 5.735 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -10.394 8.760 7.002 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -10.811 9.972 5.806 1.00 0.00 H new ATOM 0 HG LEU B 38 -9.743 7.179 5.241 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -11.981 6.760 4.244 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -12.075 7.150 5.978 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -12.499 8.381 4.765 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -10.143 7.625 2.844 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -10.519 9.320 3.234 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -8.886 8.680 3.534 1.00 0.00 H new ATOM 2420 N PHE B 39 -7.517 10.874 4.285 1.00 0.00 N ATOM 2421 CA PHE B 39 -7.180 11.931 3.317 1.00 0.00 C ATOM 2422 C PHE B 39 -7.113 11.304 1.910 1.00 0.00 C ATOM 2423 O PHE B 39 -6.222 10.508 1.595 1.00 0.00 O ATOM 2424 CB PHE B 39 -5.843 12.651 3.721 1.00 0.00 C ATOM 2425 CG PHE B 39 -4.676 11.728 4.109 1.00 0.00 C ATOM 2426 CD1 PHE B 39 -4.698 11.020 5.316 1.00 0.00 C ATOM 2427 CD2 PHE B 39 -3.563 11.562 3.282 1.00 0.00 C ATOM 2428 CE1 PHE B 39 -3.663 10.191 5.669 1.00 0.00 C ATOM 2429 CE2 PHE B 39 -2.525 10.726 3.652 1.00 0.00 C ATOM 2430 CZ PHE B 39 -2.576 10.041 4.839 1.00 0.00 C ATOM 0 H PHE B 39 -6.924 10.049 4.193 1.00 0.00 H new ATOM 0 HA PHE B 39 -7.950 12.702 3.315 1.00 0.00 H new ATOM 0 HB2 PHE B 39 -5.524 13.278 2.888 1.00 0.00 H new ATOM 0 HB3 PHE B 39 -6.050 13.316 4.560 1.00 0.00 H new ATOM 0 HD1 PHE B 39 -5.543 11.128 5.980 1.00 0.00 H new ATOM 0 HD2 PHE B 39 -3.512 12.093 2.343 1.00 0.00 H new ATOM 0 HE1 PHE B 39 -3.702 9.653 6.605 1.00 0.00 H new ATOM 0 HE2 PHE B 39 -1.670 10.612 3.003 1.00 0.00 H new ATOM 0 HZ PHE B 39 -1.765 9.386 5.121 1.00 0.00 H new ATOM 2440 N VAL B 40 -8.118 11.639 1.096 1.00 0.00 N ATOM 2441 CA VAL B 40 -8.261 11.141 -0.279 1.00 0.00 C ATOM 2442 C VAL B 40 -7.539 12.087 -1.254 1.00 0.00 C ATOM 2443 O VAL B 40 -7.681 13.312 -1.138 1.00 0.00 O ATOM 2444 CB VAL B 40 -9.783 11.067 -0.695 1.00 0.00 C ATOM 2445 CG1 VAL B 40 -9.971 10.359 -2.066 1.00 0.00 C ATOM 2446 CG2 VAL B 40 -10.637 10.407 0.413 1.00 0.00 C ATOM 0 H VAL B 40 -8.867 12.273 1.376 1.00 0.00 H new ATOM 0 HA VAL B 40 -7.824 10.143 -0.322 1.00 0.00 H new ATOM 0 HB VAL B 40 -10.139 12.090 -0.815 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -11.031 10.328 -2.317 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -9.432 10.909 -2.837 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -9.582 9.342 -2.007 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -11.679 10.371 0.096 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -10.278 9.394 0.594 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -10.557 10.990 1.330 1.00 0.00 H new ATOM 2456 N LEU B 41 -6.767 11.531 -2.201 1.00 0.00 N ATOM 2457 CA LEU B 41 -5.916 12.332 -3.103 1.00 0.00 C ATOM 2458 C LEU B 41 -6.639 12.608 -4.433 1.00 0.00 C ATOM 2459 O LEU B 41 -7.301 11.721 -4.993 1.00 0.00 O ATOM 2460 CB LEU B 41 -4.550 11.627 -3.351 1.00 0.00 C ATOM 2461 CG LEU B 41 -3.695 11.317 -2.074 1.00 0.00 C ATOM 2462 CD1 LEU B 41 -2.309 10.762 -2.447 1.00 0.00 C ATOM 2463 CD2 LEU B 41 -3.574 12.550 -1.157 1.00 0.00 C ATOM 0 H LEU B 41 -6.713 10.526 -2.364 1.00 0.00 H new ATOM 0 HA LEU B 41 -5.718 13.289 -2.619 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -4.737 10.690 -3.875 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -3.957 12.252 -4.018 1.00 0.00 H new ATOM 0 HG LEU B 41 -4.221 10.544 -1.514 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -1.742 10.558 -1.539 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -2.427 9.840 -3.016 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -1.774 11.495 -3.051 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -2.975 12.296 -0.283 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -3.094 13.363 -1.702 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -4.567 12.864 -0.837 1.00 0.00 H new ATOM 2475 N ALA B 42 -6.458 13.845 -4.943 1.00 0.00 N ATOM 2476 CA ALA B 42 -7.048 14.324 -6.217 1.00 0.00 C ATOM 2477 C ALA B 42 -6.425 13.626 -7.456 1.00 0.00 C ATOM 2478 O ALA B 42 -6.873 13.830 -8.591 1.00 0.00 O ATOM 2479 CB ALA B 42 -6.882 15.853 -6.308 1.00 0.00 C ATOM 0 H ALA B 42 -5.890 14.552 -4.476 1.00 0.00 H new ATOM 0 HA ALA B 42 -8.107 14.067 -6.219 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -7.314 16.211 -7.243 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -7.392 16.325 -5.468 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.822 16.106 -6.278 1.00 0.00 H new ATOM 2485 N ASN B 43 -5.379 12.813 -7.213 1.00 0.00 N ATOM 2486 CA ASN B 43 -4.734 11.968 -8.236 1.00 0.00 C ATOM 2487 C ASN B 43 -5.676 10.810 -8.676 1.00 0.00 C ATOM 2488 O ASN B 43 -5.453 10.180 -9.717 1.00 0.00 O ATOM 2489 CB ASN B 43 -3.388 11.406 -7.677 1.00 0.00 C ATOM 2490 CG ASN B 43 -2.465 10.856 -8.778 1.00 0.00 C ATOM 2491 OD1 ASN B 43 -1.614 11.573 -9.304 1.00 0.00 O ATOM 2492 ND2 ASN B 43 -2.652 9.605 -9.159 1.00 0.00 N ATOM 0 H ASN B 43 -4.953 12.724 -6.290 1.00 0.00 H new ATOM 0 HA ASN B 43 -4.527 12.576 -9.116 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -2.868 12.196 -7.135 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -3.601 10.614 -6.959 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -2.083 9.209 -9.908 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -3.365 9.035 -8.704 1.00 0.00 H new ATOM 2499 N GLY B 44 -6.740 10.553 -7.873 1.00 0.00 N ATOM 2500 CA GLY B 44 -7.729 9.505 -8.167 1.00 0.00 C ATOM 2501 C GLY B 44 -7.600 8.282 -7.263 1.00 0.00 C ATOM 2502 O GLY B 44 -8.151 7.220 -7.572 1.00 0.00 O ATOM 0 H GLY B 44 -6.928 11.067 -7.012 1.00 0.00 H new ATOM 0 HA2 GLY B 44 -8.731 9.921 -8.063 1.00 0.00 H new ATOM 0 HA3 GLY B 44 -7.620 9.193 -9.206 1.00 0.00 H new ATOM 2506 N MET B 45 -6.884 8.438 -6.134 1.00 0.00 N ATOM 2507 CA MET B 45 -6.643 7.347 -5.160 1.00 0.00 C ATOM 2508 C MET B 45 -7.079 7.799 -3.755 1.00 0.00 C ATOM 2509 O MET B 45 -7.457 8.960 -3.565 1.00 0.00 O ATOM 2510 CB MET B 45 -5.141 6.942 -5.200 1.00 0.00 C ATOM 2511 CG MET B 45 -4.173 7.982 -4.604 1.00 0.00 C ATOM 2512 SD MET B 45 -4.040 7.880 -2.799 1.00 0.00 S ATOM 2513 CE MET B 45 -3.261 6.274 -2.573 1.00 0.00 C ATOM 0 H MET B 45 -6.454 9.324 -5.867 1.00 0.00 H new ATOM 0 HA MET B 45 -7.235 6.470 -5.422 1.00 0.00 H new ATOM 0 HB2 MET B 45 -5.019 6.002 -4.661 1.00 0.00 H new ATOM 0 HB3 MET B 45 -4.858 6.755 -6.236 1.00 0.00 H new ATOM 0 HG2 MET B 45 -3.185 7.843 -5.043 1.00 0.00 H new ATOM 0 HG3 MET B 45 -4.508 8.982 -4.881 1.00 0.00 H new ATOM 0 HE1 MET B 45 -2.497 6.346 -1.799 1.00 0.00 H new ATOM 0 HE2 MET B 45 -4.013 5.544 -2.273 1.00 0.00 H new ATOM 0 HE3 MET B 45 -2.801 5.958 -3.509 1.00 0.00 H new ATOM 2523 N LYS B 46 -7.001 6.889 -2.773 1.00 0.00 N ATOM 2524 CA LYS B 46 -7.495 7.138 -1.405 1.00 0.00 C ATOM 2525 C LYS B 46 -6.444 6.667 -0.373 1.00 0.00 C ATOM 2526 O LYS B 46 -5.889 5.571 -0.516 1.00 0.00 O ATOM 2527 CB LYS B 46 -8.857 6.402 -1.243 1.00 0.00 C ATOM 2528 CG LYS B 46 -9.665 6.770 0.013 1.00 0.00 C ATOM 2529 CD LYS B 46 -11.084 6.141 0.015 1.00 0.00 C ATOM 2530 CE LYS B 46 -11.929 6.576 1.224 1.00 0.00 C ATOM 2531 NZ LYS B 46 -13.288 5.992 1.202 1.00 0.00 N ATOM 0 H LYS B 46 -6.596 5.962 -2.901 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.652 8.202 -1.230 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -9.469 6.610 -2.121 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.670 5.328 -1.232 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -9.123 6.439 0.899 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -9.752 7.854 0.080 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -11.601 6.420 -0.903 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -10.995 5.055 0.012 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -11.424 6.279 2.143 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -12.004 7.663 1.239 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -13.935 6.599 1.744 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -13.620 5.923 0.219 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -13.265 5.043 1.627 1.00 0.00 H new ATOM 2545 N LEU B 47 -6.170 7.495 0.665 1.00 0.00 N ATOM 2546 CA LEU B 47 -5.086 7.223 1.649 1.00 0.00 C ATOM 2547 C LEU B 47 -5.606 7.378 3.104 1.00 0.00 C ATOM 2548 O LEU B 47 -6.447 8.235 3.389 1.00 0.00 O ATOM 2549 CB LEU B 47 -3.851 8.151 1.360 1.00 0.00 C ATOM 2550 CG LEU B 47 -2.461 7.439 1.231 1.00 0.00 C ATOM 2551 CD1 LEU B 47 -1.397 8.419 0.692 1.00 0.00 C ATOM 2552 CD2 LEU B 47 -2.009 6.798 2.569 1.00 0.00 C ATOM 0 H LEU B 47 -6.684 8.358 0.845 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.758 6.189 1.540 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -4.042 8.697 0.436 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.784 8.890 2.159 1.00 0.00 H new ATOM 0 HG LEU B 47 -2.574 6.626 0.514 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -0.439 7.906 0.609 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.700 8.781 -0.290 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -1.300 9.262 1.376 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.041 6.316 2.433 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.925 7.571 3.333 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.743 6.056 2.883 1.00 0.00 H new ATOM 2564 N GLY B 48 -5.106 6.499 4.001 1.00 0.00 N ATOM 2565 CA GLY B 48 -5.488 6.462 5.426 1.00 0.00 C ATOM 2566 C GLY B 48 -4.270 6.541 6.344 1.00 0.00 C ATOM 2567 O GLY B 48 -3.130 6.368 5.899 1.00 0.00 O ATOM 0 H GLY B 48 -4.418 5.788 3.751 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -6.161 7.292 5.643 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -6.038 5.544 5.631 1.00 0.00 H new ATOM 2571 N LEU B 49 -4.551 6.746 7.652 1.00 0.00 N ATOM 2572 CA LEU B 49 -3.606 6.540 8.775 1.00 0.00 C ATOM 2573 C LEU B 49 -4.389 5.917 9.946 1.00 0.00 C ATOM 2574 O LEU B 49 -5.443 6.437 10.303 1.00 0.00 O ATOM 2575 CB LEU B 49 -2.934 7.861 9.256 1.00 0.00 C ATOM 2576 CG LEU B 49 -1.947 8.551 8.267 1.00 0.00 C ATOM 2577 CD1 LEU B 49 -1.375 9.847 8.870 1.00 0.00 C ATOM 2578 CD2 LEU B 49 -0.821 7.597 7.809 1.00 0.00 C ATOM 0 H LEU B 49 -5.467 7.068 7.964 1.00 0.00 H new ATOM 0 HA LEU B 49 -2.805 5.888 8.426 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -3.722 8.573 9.501 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -2.396 7.651 10.181 1.00 0.00 H new ATOM 0 HG LEU B 49 -2.516 8.817 7.377 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -0.689 10.308 8.159 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -2.190 10.537 9.088 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -0.840 9.615 9.791 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -0.158 8.121 7.121 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -0.253 7.262 8.677 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -1.257 6.734 7.306 1.00 0.00 H new ATOM 2590 N TRP B 50 -3.877 4.818 10.538 1.00 0.00 N ATOM 2591 CA TRP B 50 -4.505 4.169 11.716 1.00 0.00 C ATOM 2592 C TRP B 50 -3.453 3.992 12.816 1.00 0.00 C ATOM 2593 O TRP B 50 -2.390 3.428 12.571 1.00 0.00 O ATOM 2594 CB TRP B 50 -5.124 2.790 11.340 1.00 0.00 C ATOM 2595 CG TRP B 50 -6.202 2.276 12.291 1.00 0.00 C ATOM 2596 CD1 TRP B 50 -6.613 2.806 13.493 1.00 0.00 C ATOM 2597 CD2 TRP B 50 -7.028 1.127 12.073 1.00 0.00 C ATOM 2598 NE1 TRP B 50 -7.639 2.059 14.011 1.00 0.00 N ATOM 2599 CE2 TRP B 50 -7.909 1.025 13.155 1.00 0.00 C ATOM 2600 CE3 TRP B 50 -7.098 0.180 11.060 1.00 0.00 C ATOM 2601 CZ2 TRP B 50 -8.848 0.005 13.243 1.00 0.00 C ATOM 2602 CZ3 TRP B 50 -8.025 -0.834 11.146 1.00 0.00 C ATOM 2603 CH2 TRP B 50 -8.895 -0.911 12.228 1.00 0.00 C ATOM 0 H TRP B 50 -3.025 4.356 10.220 1.00 0.00 H new ATOM 0 HA TRP B 50 -5.312 4.808 12.075 1.00 0.00 H new ATOM 0 HB2 TRP B 50 -5.550 2.863 10.340 1.00 0.00 H new ATOM 0 HB3 TRP B 50 -4.323 2.052 11.292 1.00 0.00 H new ATOM 0 HD1 TRP B 50 -6.189 3.683 13.960 1.00 0.00 H new ATOM 0 HE1 TRP B 50 -8.122 2.243 14.890 1.00 0.00 H new ATOM 0 HE3 TRP B 50 -6.431 0.238 10.212 1.00 0.00 H new ATOM 0 HZ2 TRP B 50 -9.520 -0.063 14.086 1.00 0.00 H new ATOM 0 HZ3 TRP B 50 -8.077 -1.578 10.365 1.00 0.00 H new ATOM 0 HH2 TRP B 50 -9.622 -1.709 12.268 1.00 0.00 H new ATOM 2614 N SER B 51 -3.768 4.454 14.028 1.00 0.00 N ATOM 2615 CA SER B 51 -2.860 4.371 15.169 1.00 0.00 C ATOM 2616 C SER B 51 -2.899 2.960 15.804 1.00 0.00 C ATOM 2617 O SER B 51 -3.970 2.474 16.203 1.00 0.00 O ATOM 2618 CB SER B 51 -3.192 5.478 16.176 1.00 0.00 C ATOM 2619 OG SER B 51 -3.072 6.751 15.562 1.00 0.00 O ATOM 0 H SER B 51 -4.661 4.896 14.244 1.00 0.00 H new ATOM 0 HA SER B 51 -1.836 4.528 14.830 1.00 0.00 H new ATOM 0 HB2 SER B 51 -4.205 5.343 16.555 1.00 0.00 H new ATOM 0 HB3 SER B 51 -2.520 5.414 17.032 1.00 0.00 H new ATOM 0 HG SER B 51 -3.897 6.958 15.075 1.00 0.00 H new ATOM 2625 N ARG B 52 -1.711 2.338 15.914 1.00 0.00 N ATOM 2626 CA ARG B 52 -1.530 0.898 16.230 1.00 0.00 C ATOM 2627 C ARG B 52 -2.011 0.492 17.645 1.00 0.00 C ATOM 2628 O ARG B 52 -2.182 -0.697 17.911 1.00 0.00 O ATOM 2629 CB ARG B 52 -0.034 0.510 16.063 1.00 0.00 C ATOM 2630 CG ARG B 52 0.923 1.312 16.978 1.00 0.00 C ATOM 2631 CD ARG B 52 2.378 0.828 16.931 1.00 0.00 C ATOM 2632 NE ARG B 52 3.204 1.644 17.836 1.00 0.00 N ATOM 2633 CZ ARG B 52 4.353 1.279 18.413 1.00 0.00 C ATOM 2634 NH1 ARG B 52 4.852 0.063 18.238 1.00 0.00 N ATOM 2635 NH2 ARG B 52 4.992 2.140 19.186 1.00 0.00 N ATOM 0 H ARG B 52 -0.826 2.829 15.784 1.00 0.00 H new ATOM 0 HA ARG B 52 -2.159 0.354 15.525 1.00 0.00 H new ATOM 0 HB2 ARG B 52 0.082 -0.553 16.274 1.00 0.00 H new ATOM 0 HB3 ARG B 52 0.258 0.663 15.024 1.00 0.00 H new ATOM 0 HG2 ARG B 52 0.890 2.363 16.690 1.00 0.00 H new ATOM 0 HG3 ARG B 52 0.563 1.252 18.005 1.00 0.00 H new ATOM 0 HD2 ARG B 52 2.432 -0.221 17.222 1.00 0.00 H new ATOM 0 HD3 ARG B 52 2.761 0.897 15.913 1.00 0.00 H new ATOM 0 HE ARG B 52 2.865 2.583 18.044 1.00 0.00 H new ATOM 0 HH11 ARG B 52 4.358 -0.612 17.655 1.00 0.00 H new ATOM 0 HH12 ARG B 52 5.730 -0.197 18.687 1.00 0.00 H new ATOM 0 HH21 ARG B 52 4.607 3.073 19.337 1.00 0.00 H new ATOM 0 HH22 ARG B 52 5.870 1.872 19.631 1.00 0.00 H new ATOM 2649 N HIS B 53 -2.218 1.477 18.537 1.00 0.00 N ATOM 2650 CA HIS B 53 -2.584 1.228 19.957 1.00 0.00 C ATOM 2651 C HIS B 53 -4.001 0.617 20.079 1.00 0.00 C ATOM 2652 O HIS B 53 -4.311 -0.048 21.075 1.00 0.00 O ATOM 2653 CB HIS B 53 -2.491 2.538 20.798 1.00 0.00 C ATOM 2654 CG HIS B 53 -3.578 3.559 20.527 1.00 0.00 C ATOM 2655 ND1 HIS B 53 -4.426 4.038 21.503 1.00 0.00 N ATOM 2656 CD2 HIS B 53 -3.953 4.179 19.385 1.00 0.00 C ATOM 2657 CE1 HIS B 53 -5.267 4.903 20.974 1.00 0.00 C ATOM 2658 NE2 HIS B 53 -5.002 5.005 19.687 1.00 0.00 N ATOM 0 H HIS B 53 -2.139 2.467 18.303 1.00 0.00 H new ATOM 0 HA HIS B 53 -1.868 0.508 20.353 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -2.518 2.274 21.855 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -1.523 3.003 20.610 1.00 0.00 H new ATOM 0 HD1 HIS B 53 -4.405 3.764 22.485 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -3.506 4.046 18.411 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -6.041 5.437 21.504 1.00 0.00 H new ATOM 2667 N THR B 54 -4.850 0.848 19.055 1.00 0.00 N ATOM 2668 CA THR B 54 -6.231 0.340 19.033 1.00 0.00 C ATOM 2669 C THR B 54 -6.638 -0.057 17.592 1.00 0.00 C ATOM 2670 O THR B 54 -7.835 -0.151 17.274 1.00 0.00 O ATOM 2671 CB THR B 54 -7.208 1.403 19.664 1.00 0.00 C ATOM 2672 OG1 THR B 54 -8.483 0.823 19.961 1.00 0.00 O ATOM 2673 CG2 THR B 54 -7.405 2.621 18.757 1.00 0.00 C ATOM 0 H THR B 54 -4.596 1.388 18.228 1.00 0.00 H new ATOM 0 HA THR B 54 -6.297 -0.562 19.641 1.00 0.00 H new ATOM 0 HB THR B 54 -6.738 1.738 20.589 1.00 0.00 H new ATOM 0 HG1 THR B 54 -8.778 0.277 19.203 1.00 0.00 H new ATOM 0 HG21 THR B 54 -8.086 3.325 19.236 1.00 0.00 H new ATOM 0 HG22 THR B 54 -6.444 3.106 18.585 1.00 0.00 H new ATOM 0 HG23 THR B 54 -7.825 2.301 17.804 1.00 0.00 H new ATOM 2681 N VAL B 55 -5.620 -0.329 16.733 1.00 0.00 N ATOM 2682 CA VAL B 55 -5.824 -0.944 15.398 1.00 0.00 C ATOM 2683 C VAL B 55 -6.555 -2.300 15.561 1.00 0.00 C ATOM 2684 O VAL B 55 -6.455 -2.926 16.620 1.00 0.00 O ATOM 2685 CB VAL B 55 -4.450 -1.118 14.613 1.00 0.00 C ATOM 2686 CG1 VAL B 55 -3.505 -2.125 15.305 1.00 0.00 C ATOM 2687 CG2 VAL B 55 -4.661 -1.502 13.127 1.00 0.00 C ATOM 0 H VAL B 55 -4.643 -0.129 16.946 1.00 0.00 H new ATOM 0 HA VAL B 55 -6.443 -0.276 14.799 1.00 0.00 H new ATOM 0 HB VAL B 55 -3.970 -0.139 14.635 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -2.581 -2.210 14.732 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -3.277 -1.777 16.312 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -3.989 -3.100 15.359 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -3.693 -1.608 12.638 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -5.203 -2.446 13.069 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -5.236 -0.722 12.628 1.00 0.00 H new ATOM 2697 N GLU B 56 -7.347 -2.720 14.563 1.00 0.00 N ATOM 2698 CA GLU B 56 -8.124 -3.983 14.632 1.00 0.00 C ATOM 2699 C GLU B 56 -7.833 -4.867 13.400 1.00 0.00 C ATOM 2700 O GLU B 56 -8.096 -4.438 12.272 1.00 0.00 O ATOM 2701 CB GLU B 56 -9.639 -3.690 14.804 1.00 0.00 C ATOM 2702 CG GLU B 56 -9.984 -3.157 16.209 1.00 0.00 C ATOM 2703 CD GLU B 56 -11.478 -2.962 16.473 1.00 0.00 C ATOM 2704 OE1 GLU B 56 -12.278 -3.843 16.095 1.00 0.00 O ATOM 2705 OE2 GLU B 56 -11.860 -1.952 17.093 1.00 0.00 O ATOM 0 H GLU B 56 -7.472 -2.206 13.691 1.00 0.00 H new ATOM 0 HA GLU B 56 -7.808 -4.543 15.512 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -9.952 -2.961 14.056 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -10.205 -4.602 14.616 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -9.585 -3.848 16.952 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -9.476 -2.204 16.355 1.00 0.00 H new ATOM 2712 N PRO B 57 -7.245 -6.112 13.579 1.00 0.00 N ATOM 2713 CA PRO B 57 -6.759 -6.661 14.897 1.00 0.00 C ATOM 2714 C PRO B 57 -5.529 -5.901 15.461 1.00 0.00 C ATOM 2715 O PRO B 57 -4.669 -5.447 14.698 1.00 0.00 O ATOM 2716 CB PRO B 57 -6.414 -8.142 14.560 1.00 0.00 C ATOM 2717 CG PRO B 57 -6.124 -8.137 13.088 1.00 0.00 C ATOM 2718 CD PRO B 57 -7.077 -7.119 12.493 1.00 0.00 C ATOM 0 HA PRO B 57 -7.507 -6.556 15.683 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.554 -8.489 15.132 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.244 -8.807 14.798 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.087 -7.865 12.893 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -6.282 -9.124 12.653 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -6.667 -6.668 11.589 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -8.029 -7.574 12.219 1.00 0.00 H new ATOM 2726 N LYS B 58 -5.497 -5.731 16.801 1.00 0.00 N ATOM 2727 CA LYS B 58 -4.429 -4.986 17.497 1.00 0.00 C ATOM 2728 C LYS B 58 -3.074 -5.690 17.293 1.00 0.00 C ATOM 2729 O LYS B 58 -2.832 -6.771 17.831 1.00 0.00 O ATOM 2730 CB LYS B 58 -4.793 -4.801 19.012 1.00 0.00 C ATOM 2731 CG LYS B 58 -4.386 -3.435 19.638 1.00 0.00 C ATOM 2732 CD LYS B 58 -2.866 -3.161 19.665 1.00 0.00 C ATOM 2733 CE LYS B 58 -2.076 -4.166 20.514 1.00 0.00 C ATOM 2734 NZ LYS B 58 -2.553 -4.206 21.921 1.00 0.00 N ATOM 0 H LYS B 58 -6.209 -6.106 17.427 1.00 0.00 H new ATOM 0 HA LYS B 58 -4.339 -3.988 17.069 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -5.870 -4.927 19.127 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -4.316 -5.598 19.582 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -4.875 -2.636 19.081 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -4.767 -3.391 20.658 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -2.484 -3.180 18.644 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -2.693 -2.157 20.051 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -2.163 -5.159 20.074 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -1.019 -3.902 20.497 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -1.929 -4.820 22.482 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -2.542 -3.245 22.319 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -3.523 -4.581 21.948 1.00 0.00 H new ATOM 2748 N ALA B 59 -2.206 -5.032 16.517 1.00 0.00 N ATOM 2749 CA ALA B 59 -0.957 -5.596 16.008 1.00 0.00 C ATOM 2750 C ALA B 59 0.222 -4.696 16.392 1.00 0.00 C ATOM 2751 O ALA B 59 0.216 -3.494 16.094 1.00 0.00 O ATOM 2752 CB ALA B 59 -1.047 -5.732 14.475 1.00 0.00 C ATOM 0 H ALA B 59 -2.359 -4.068 16.220 1.00 0.00 H new ATOM 0 HA ALA B 59 -0.798 -6.580 16.448 1.00 0.00 H new ATOM 0 HB1 ALA B 59 -0.117 -6.152 14.092 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -1.877 -6.390 14.216 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -1.211 -4.750 14.032 1.00 0.00 H new ATOM 2758 N SER B 60 1.216 -5.278 17.078 1.00 0.00 N ATOM 2759 CA SER B 60 2.490 -4.614 17.335 1.00 0.00 C ATOM 2760 C SER B 60 3.357 -4.703 16.068 1.00 0.00 C ATOM 2761 O SER B 60 4.077 -5.686 15.865 1.00 0.00 O ATOM 2762 CB SER B 60 3.203 -5.260 18.549 1.00 0.00 C ATOM 2763 OG SER B 60 2.411 -5.161 19.724 1.00 0.00 O ATOM 0 H SER B 60 1.154 -6.219 17.467 1.00 0.00 H new ATOM 0 HA SER B 60 2.320 -3.565 17.579 1.00 0.00 H new ATOM 0 HB2 SER B 60 3.412 -6.308 18.336 1.00 0.00 H new ATOM 0 HB3 SER B 60 4.163 -4.771 18.712 1.00 0.00 H new ATOM 0 HG SER B 60 2.885 -5.578 20.474 1.00 0.00 H new ATOM 2769 N VAL B 61 3.209 -3.707 15.180 1.00 0.00 N ATOM 2770 CA VAL B 61 4.048 -3.552 13.980 1.00 0.00 C ATOM 2771 C VAL B 61 4.639 -2.133 13.969 1.00 0.00 C ATOM 2772 O VAL B 61 3.919 -1.162 14.233 1.00 0.00 O ATOM 2773 CB VAL B 61 3.258 -3.838 12.631 1.00 0.00 C ATOM 2774 CG1 VAL B 61 2.878 -5.339 12.502 1.00 0.00 C ATOM 2775 CG2 VAL B 61 2.002 -2.935 12.491 1.00 0.00 C ATOM 0 H VAL B 61 2.499 -2.981 15.275 1.00 0.00 H new ATOM 0 HA VAL B 61 4.844 -4.296 14.028 1.00 0.00 H new ATOM 0 HB VAL B 61 3.932 -3.590 11.812 1.00 0.00 H new ATOM 0 HG11 VAL B 61 2.339 -5.499 11.568 1.00 0.00 H new ATOM 0 HG12 VAL B 61 3.784 -5.945 12.507 1.00 0.00 H new ATOM 0 HG13 VAL B 61 2.244 -5.627 13.341 1.00 0.00 H new ATOM 0 HG21 VAL B 61 1.492 -3.164 11.555 1.00 0.00 H new ATOM 0 HG22 VAL B 61 1.327 -3.119 13.327 1.00 0.00 H new ATOM 0 HG23 VAL B 61 2.305 -1.888 12.493 1.00 0.00 H new ATOM 2785 N THR B 62 5.964 -2.053 13.747 1.00 0.00 N ATOM 2786 CA THR B 62 6.721 -0.799 13.541 1.00 0.00 C ATOM 2787 C THR B 62 8.030 -1.133 12.808 1.00 0.00 C ATOM 2788 O THR B 62 8.805 -1.976 13.268 1.00 0.00 O ATOM 2789 CB THR B 62 7.039 -0.013 14.877 1.00 0.00 C ATOM 2790 OG1 THR B 62 7.219 -0.928 15.965 1.00 0.00 O ATOM 2791 CG2 THR B 62 5.960 1.026 15.234 1.00 0.00 C ATOM 0 H THR B 62 6.557 -2.882 13.704 1.00 0.00 H new ATOM 0 HA THR B 62 6.090 -0.136 12.950 1.00 0.00 H new ATOM 0 HB THR B 62 7.964 0.536 14.702 1.00 0.00 H new ATOM 0 HG1 THR B 62 7.417 -0.428 16.784 1.00 0.00 H new ATOM 0 HG21 THR B 62 6.234 1.532 16.160 1.00 0.00 H new ATOM 0 HG22 THR B 62 5.880 1.758 14.430 1.00 0.00 H new ATOM 0 HG23 THR B 62 5.001 0.524 15.365 1.00 0.00 H new ATOM 2799 N GLY B 63 8.248 -0.476 11.661 1.00 0.00 N ATOM 2800 CA GLY B 63 9.434 -0.701 10.829 1.00 0.00 C ATOM 2801 C GLY B 63 9.168 -0.358 9.374 1.00 0.00 C ATOM 2802 O GLY B 63 10.054 0.124 8.667 1.00 0.00 O ATOM 0 H GLY B 63 7.608 0.224 11.286 1.00 0.00 H new ATOM 0 HA2 GLY B 63 10.261 -0.096 11.201 1.00 0.00 H new ATOM 0 HA3 GLY B 63 9.742 -1.744 10.907 1.00 0.00 H new ATOM 2806 N GLY B 64 7.939 -0.632 8.921 1.00 0.00 N ATOM 2807 CA GLY B 64 7.498 -0.258 7.584 1.00 0.00 C ATOM 2808 C GLY B 64 6.398 -1.174 7.086 1.00 0.00 C ATOM 2809 O GLY B 64 5.259 -0.737 6.874 1.00 0.00 O ATOM 0 H GLY B 64 7.230 -1.117 9.472 1.00 0.00 H new ATOM 0 HA2 GLY B 64 7.140 0.771 7.592 1.00 0.00 H new ATOM 0 HA3 GLY B 64 8.343 -0.296 6.897 1.00 0.00 H new ATOM 2813 N GLY B 65 6.743 -2.467 6.945 1.00 0.00 N ATOM 2814 CA GLY B 65 5.859 -3.451 6.324 1.00 0.00 C ATOM 2815 C GLY B 65 5.719 -3.183 4.832 1.00 0.00 C ATOM 2816 O GLY B 65 6.717 -3.250 4.101 1.00 0.00 O ATOM 0 H GLY B 65 7.636 -2.849 7.257 1.00 0.00 H new ATOM 0 HA2 GLY B 65 6.255 -4.454 6.483 1.00 0.00 H new ATOM 0 HA3 GLY B 65 4.878 -3.417 6.798 1.00 0.00 H new ATOM 2820 N GLY B 66 4.487 -2.871 4.386 1.00 0.00 N ATOM 2821 CA GLY B 66 4.235 -2.458 3.003 1.00 0.00 C ATOM 2822 C GLY B 66 4.691 -1.017 2.744 1.00 0.00 C ATOM 2823 O GLY B 66 4.679 -0.184 3.665 1.00 0.00 O ATOM 0 H GLY B 66 3.652 -2.899 4.970 1.00 0.00 H new ATOM 0 HA2 GLY B 66 4.756 -3.131 2.322 1.00 0.00 H new ATOM 0 HA3 GLY B 66 3.170 -2.546 2.786 1.00 0.00 H new ATOM 2827 N GLU B 67 5.082 -0.718 1.488 1.00 0.00 N ATOM 2828 CA GLU B 67 5.541 0.627 1.077 1.00 0.00 C ATOM 2829 C GLU B 67 4.472 1.387 0.284 1.00 0.00 C ATOM 2830 O GLU B 67 3.508 0.809 -0.230 1.00 0.00 O ATOM 2831 CB GLU B 67 6.890 0.567 0.279 1.00 0.00 C ATOM 2832 CG GLU B 67 7.038 -0.596 -0.710 1.00 0.00 C ATOM 2833 CD GLU B 67 8.349 -0.565 -1.519 1.00 0.00 C ATOM 2834 OE1 GLU B 67 9.409 -0.202 -0.955 1.00 0.00 O ATOM 2835 OE2 GLU B 67 8.325 -0.920 -2.718 1.00 0.00 O ATOM 0 H GLU B 67 5.089 -1.401 0.730 1.00 0.00 H new ATOM 0 HA GLU B 67 5.723 1.182 1.997 1.00 0.00 H new ATOM 0 HB2 GLU B 67 7.005 1.501 -0.270 1.00 0.00 H new ATOM 0 HB3 GLU B 67 7.710 0.515 0.995 1.00 0.00 H new ATOM 0 HG2 GLU B 67 6.984 -1.536 -0.161 1.00 0.00 H new ATOM 0 HG3 GLU B 67 6.195 -0.581 -1.401 1.00 0.00 H new ATOM 2842 N LEU B 68 4.685 2.706 0.202 1.00 0.00 N ATOM 2843 CA LEU B 68 3.792 3.651 -0.455 1.00 0.00 C ATOM 2844 C LEU B 68 4.579 4.329 -1.582 1.00 0.00 C ATOM 2845 O LEU B 68 5.425 5.176 -1.296 1.00 0.00 O ATOM 2846 CB LEU B 68 3.275 4.681 0.587 1.00 0.00 C ATOM 2847 CG LEU B 68 2.288 5.771 0.072 1.00 0.00 C ATOM 2848 CD1 LEU B 68 0.994 5.151 -0.500 1.00 0.00 C ATOM 2849 CD2 LEU B 68 1.987 6.804 1.186 1.00 0.00 C ATOM 0 H LEU B 68 5.509 3.152 0.605 1.00 0.00 H new ATOM 0 HA LEU B 68 2.921 3.150 -0.879 1.00 0.00 H new ATOM 0 HB2 LEU B 68 2.785 4.133 1.391 1.00 0.00 H new ATOM 0 HB3 LEU B 68 4.138 5.184 1.024 1.00 0.00 H new ATOM 0 HG LEU B 68 2.771 6.297 -0.752 1.00 0.00 H new ATOM 0 HD11 LEU B 68 0.333 5.945 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.243 4.494 -1.334 1.00 0.00 H new ATOM 0 HD13 LEU B 68 0.492 4.576 0.278 1.00 0.00 H new ATOM 0 HD21 LEU B 68 1.296 7.557 0.807 1.00 0.00 H new ATOM 0 HD22 LEU B 68 1.539 6.297 2.041 1.00 0.00 H new ATOM 0 HD23 LEU B 68 2.914 7.286 1.496 1.00 0.00 H new ATOM 2861 N ALA B 69 4.378 3.917 -2.836 1.00 0.00 N ATOM 2862 CA ALA B 69 5.231 4.364 -3.959 1.00 0.00 C ATOM 2863 C ALA B 69 4.744 5.707 -4.560 1.00 0.00 C ATOM 2864 O ALA B 69 3.646 5.792 -5.121 1.00 0.00 O ATOM 2865 CB ALA B 69 5.323 3.263 -5.028 1.00 0.00 C ATOM 0 H ALA B 69 3.634 3.274 -3.107 1.00 0.00 H new ATOM 0 HA ALA B 69 6.232 4.547 -3.569 1.00 0.00 H new ATOM 0 HB1 ALA B 69 5.954 3.605 -5.849 1.00 0.00 H new ATOM 0 HB2 ALA B 69 5.755 2.364 -4.588 1.00 0.00 H new ATOM 0 HB3 ALA B 69 4.326 3.038 -5.406 1.00 0.00 H new ATOM 2871 N PHE B 70 5.594 6.746 -4.432 1.00 0.00 N ATOM 2872 CA PHE B 70 5.377 8.100 -4.967 1.00 0.00 C ATOM 2873 C PHE B 70 5.996 8.164 -6.374 1.00 0.00 C ATOM 2874 O PHE B 70 7.222 8.153 -6.525 1.00 0.00 O ATOM 2875 CB PHE B 70 6.066 9.150 -4.039 1.00 0.00 C ATOM 2876 CG PHE B 70 5.496 9.265 -2.626 1.00 0.00 C ATOM 2877 CD1 PHE B 70 5.595 8.212 -1.724 1.00 0.00 C ATOM 2878 CD2 PHE B 70 4.872 10.435 -2.199 1.00 0.00 C ATOM 2879 CE1 PHE B 70 5.093 8.319 -0.444 1.00 0.00 C ATOM 2880 CE2 PHE B 70 4.373 10.538 -0.915 1.00 0.00 C ATOM 2881 CZ PHE B 70 4.481 9.481 -0.037 1.00 0.00 C ATOM 0 H PHE B 70 6.481 6.659 -3.935 1.00 0.00 H new ATOM 0 HA PHE B 70 4.311 8.321 -5.013 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.125 8.901 -3.964 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.001 10.127 -4.517 1.00 0.00 H new ATOM 0 HD1 PHE B 70 6.074 7.294 -2.031 1.00 0.00 H new ATOM 0 HD2 PHE B 70 4.777 11.269 -2.878 1.00 0.00 H new ATOM 0 HE1 PHE B 70 5.181 7.488 0.240 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.895 11.453 -0.597 1.00 0.00 H new ATOM 0 HZ PHE B 70 4.087 9.565 0.965 1.00 0.00 H new ATOM 2891 N ARG B 71 5.143 8.186 -7.397 1.00 0.00 N ATOM 2892 CA ARG B 71 5.582 8.133 -8.802 1.00 0.00 C ATOM 2893 C ARG B 71 5.827 9.535 -9.386 1.00 0.00 C ATOM 2894 O ARG B 71 5.025 10.457 -9.196 1.00 0.00 O ATOM 2895 CB ARG B 71 4.518 7.414 -9.672 1.00 0.00 C ATOM 2896 CG ARG B 71 4.085 6.021 -9.171 1.00 0.00 C ATOM 2897 CD ARG B 71 3.330 5.233 -10.252 1.00 0.00 C ATOM 2898 NE ARG B 71 2.041 5.846 -10.623 1.00 0.00 N ATOM 2899 CZ ARG B 71 1.621 6.113 -11.879 1.00 0.00 C ATOM 2900 NH1 ARG B 71 2.419 5.955 -12.927 1.00 0.00 N ATOM 2901 NH2 ARG B 71 0.401 6.582 -12.065 1.00 0.00 N ATOM 0 H ARG B 71 4.131 8.241 -7.282 1.00 0.00 H new ATOM 0 HA ARG B 71 6.522 7.582 -8.817 1.00 0.00 H new ATOM 0 HB2 ARG B 71 3.635 8.050 -9.735 1.00 0.00 H new ATOM 0 HB3 ARG B 71 4.910 7.312 -10.684 1.00 0.00 H new ATOM 0 HG2 ARG B 71 4.965 5.458 -8.859 1.00 0.00 H new ATOM 0 HG3 ARG B 71 3.450 6.132 -8.292 1.00 0.00 H new ATOM 0 HD2 ARG B 71 3.957 5.155 -11.140 1.00 0.00 H new ATOM 0 HD3 ARG B 71 3.153 4.218 -9.896 1.00 0.00 H new ATOM 0 HE ARG B 71 1.408 6.091 -9.861 1.00 0.00 H new ATOM 0 HH11 ARG B 71 3.375 5.625 -12.795 1.00 0.00 H new ATOM 0 HH12 ARG B 71 2.077 6.164 -13.865 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -0.213 6.739 -11.265 1.00 0.00 H new ATOM 0 HH22 ARG B 71 0.072 6.788 -13.008 1.00 0.00 H new ATOM 2915 N VAL B 72 6.978 9.673 -10.074 1.00 0.00 N ATOM 2916 CA VAL B 72 7.391 10.910 -10.777 1.00 0.00 C ATOM 2917 C VAL B 72 7.991 10.574 -12.163 1.00 0.00 C ATOM 2918 O VAL B 72 8.394 9.424 -12.422 1.00 0.00 O ATOM 2919 CB VAL B 72 8.452 11.745 -9.962 1.00 0.00 C ATOM 2920 CG1 VAL B 72 7.882 12.326 -8.649 1.00 0.00 C ATOM 2921 CG2 VAL B 72 9.732 10.925 -9.693 1.00 0.00 C ATOM 0 H VAL B 72 7.659 8.918 -10.160 1.00 0.00 H new ATOM 0 HA VAL B 72 6.489 11.513 -10.887 1.00 0.00 H new ATOM 0 HB VAL B 72 8.716 12.595 -10.592 1.00 0.00 H new ATOM 0 HG11 VAL B 72 8.659 12.890 -8.133 1.00 0.00 H new ATOM 0 HG12 VAL B 72 7.045 12.986 -8.876 1.00 0.00 H new ATOM 0 HG13 VAL B 72 7.539 11.512 -8.010 1.00 0.00 H new ATOM 0 HG21 VAL B 72 10.441 11.532 -9.129 1.00 0.00 H new ATOM 0 HG22 VAL B 72 9.479 10.034 -9.118 1.00 0.00 H new ATOM 0 HG23 VAL B 72 10.181 10.630 -10.641 1.00 0.00 H new ATOM 2931 N GLU B 73 8.057 11.603 -13.030 1.00 0.00 N ATOM 2932 CA GLU B 73 8.436 11.463 -14.453 1.00 0.00 C ATOM 2933 C GLU B 73 9.903 11.005 -14.665 1.00 0.00 C ATOM 2934 O GLU B 73 10.151 10.137 -15.515 1.00 0.00 O ATOM 2935 CB GLU B 73 8.164 12.798 -15.217 1.00 0.00 C ATOM 2936 CG GLU B 73 8.935 14.009 -14.664 1.00 0.00 C ATOM 2937 CD GLU B 73 8.679 15.336 -15.406 1.00 0.00 C ATOM 2938 OE1 GLU B 73 9.007 15.426 -16.609 1.00 0.00 O ATOM 2939 OE2 GLU B 73 8.163 16.296 -14.788 1.00 0.00 O ATOM 0 H GLU B 73 7.847 12.564 -12.762 1.00 0.00 H new ATOM 0 HA GLU B 73 7.811 10.669 -14.861 1.00 0.00 H new ATOM 0 HB2 GLU B 73 8.426 12.663 -16.266 1.00 0.00 H new ATOM 0 HB3 GLU B 73 7.096 13.014 -15.180 1.00 0.00 H new ATOM 0 HG2 GLU B 73 8.672 14.140 -13.614 1.00 0.00 H new ATOM 0 HG3 GLU B 73 10.002 13.789 -14.700 1.00 0.00 H new ATOM 2946 N ASN B 74 10.869 11.558 -13.887 1.00 0.00 N ATOM 2947 CA ASN B 74 12.297 11.205 -14.046 1.00 0.00 C ATOM 2948 C ASN B 74 13.119 11.512 -12.785 1.00 0.00 C ATOM 2949 O ASN B 74 12.589 11.999 -11.777 1.00 0.00 O ATOM 2950 CB ASN B 74 12.933 11.914 -15.281 1.00 0.00 C ATOM 2951 CG ASN B 74 13.085 13.426 -15.113 1.00 0.00 C ATOM 2952 OD1 ASN B 74 14.106 13.913 -14.617 1.00 0.00 O ATOM 2953 ND2 ASN B 74 12.088 14.177 -15.531 1.00 0.00 N ATOM 0 H ASN B 74 10.685 12.242 -13.153 1.00 0.00 H new ATOM 0 HA ASN B 74 12.324 10.128 -14.211 1.00 0.00 H new ATOM 0 HB2 ASN B 74 13.914 11.479 -15.473 1.00 0.00 H new ATOM 0 HB3 ASN B 74 12.318 11.715 -16.159 1.00 0.00 H new ATOM 0 HD21 ASN B 74 12.145 15.192 -15.450 1.00 0.00 H new ATOM 0 HD22 ASN B 74 11.258 13.744 -15.936 1.00 0.00 H new ATOM 2960 N ASP B 75 14.426 11.199 -12.891 1.00 0.00 N ATOM 2961 CA ASP B 75 15.387 11.121 -11.770 1.00 0.00 C ATOM 2962 C ASP B 75 15.447 12.410 -10.953 1.00 0.00 C ATOM 2963 O ASP B 75 15.632 12.376 -9.729 1.00 0.00 O ATOM 2964 CB ASP B 75 16.801 10.744 -12.302 1.00 0.00 C ATOM 2965 CG ASP B 75 17.359 11.752 -13.331 1.00 0.00 C ATOM 2966 OD1 ASP B 75 17.063 11.610 -14.536 1.00 0.00 O ATOM 2967 OD2 ASP B 75 18.081 12.699 -12.943 1.00 0.00 O ATOM 0 H ASP B 75 14.858 10.986 -13.790 1.00 0.00 H new ATOM 0 HA ASP B 75 15.032 10.341 -11.097 1.00 0.00 H new ATOM 0 HB2 ASP B 75 17.491 10.675 -11.461 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.757 9.756 -12.760 1.00 0.00 H new ATOM 2972 N ALA B 76 15.291 13.541 -11.654 1.00 0.00 N ATOM 2973 CA ALA B 76 15.406 14.869 -11.054 1.00 0.00 C ATOM 2974 C ALA B 76 14.282 15.085 -10.039 1.00 0.00 C ATOM 2975 O ALA B 76 14.524 15.484 -8.907 1.00 0.00 O ATOM 2976 CB ALA B 76 15.380 15.950 -12.146 1.00 0.00 C ATOM 0 H ALA B 76 15.082 13.557 -12.652 1.00 0.00 H new ATOM 0 HA ALA B 76 16.358 14.942 -10.529 1.00 0.00 H new ATOM 0 HB1 ALA B 76 15.466 16.934 -11.686 1.00 0.00 H new ATOM 0 HB2 ALA B 76 16.214 15.795 -12.831 1.00 0.00 H new ATOM 0 HB3 ALA B 76 14.441 15.888 -12.697 1.00 0.00 H new ATOM 2982 N GLN B 77 13.055 14.720 -10.460 1.00 0.00 N ATOM 2983 CA GLN B 77 11.830 14.872 -9.658 1.00 0.00 C ATOM 2984 C GLN B 77 11.844 14.004 -8.370 1.00 0.00 C ATOM 2985 O GLN B 77 11.177 14.336 -7.385 1.00 0.00 O ATOM 2986 CB GLN B 77 10.604 14.504 -10.538 1.00 0.00 C ATOM 2987 CG GLN B 77 10.351 15.418 -11.753 1.00 0.00 C ATOM 2988 CD GLN B 77 9.762 16.792 -11.413 1.00 0.00 C ATOM 2989 OE1 GLN B 77 9.005 16.942 -10.451 1.00 0.00 O ATOM 2990 NE2 GLN B 77 10.077 17.798 -12.220 1.00 0.00 N ATOM 0 H GLN B 77 12.887 14.307 -11.377 1.00 0.00 H new ATOM 0 HA GLN B 77 11.770 15.910 -9.332 1.00 0.00 H new ATOM 0 HB2 GLN B 77 10.731 13.482 -10.896 1.00 0.00 H new ATOM 0 HB3 GLN B 77 9.714 14.513 -9.909 1.00 0.00 H new ATOM 0 HG2 GLN B 77 11.292 15.563 -12.283 1.00 0.00 H new ATOM 0 HG3 GLN B 77 9.674 14.908 -12.439 1.00 0.00 H new ATOM 0 HE21 GLN B 77 10.706 17.642 -13.008 1.00 0.00 H new ATOM 0 HE22 GLN B 77 9.690 18.727 -12.052 1.00 0.00 H new ATOM 2999 N VAL B 78 12.641 12.908 -8.387 1.00 0.00 N ATOM 3000 CA VAL B 78 12.890 12.059 -7.194 1.00 0.00 C ATOM 3001 C VAL B 78 13.710 12.834 -6.148 1.00 0.00 C ATOM 3002 O VAL B 78 13.407 12.830 -4.953 1.00 0.00 O ATOM 3003 CB VAL B 78 13.680 10.734 -7.558 1.00 0.00 C ATOM 3004 CG1 VAL B 78 13.986 9.859 -6.309 1.00 0.00 C ATOM 3005 CG2 VAL B 78 12.927 9.913 -8.616 1.00 0.00 C ATOM 0 H VAL B 78 13.128 12.588 -9.224 1.00 0.00 H new ATOM 0 HA VAL B 78 11.913 11.788 -6.795 1.00 0.00 H new ATOM 0 HB VAL B 78 14.637 11.049 -7.974 1.00 0.00 H new ATOM 0 HG11 VAL B 78 14.528 8.964 -6.615 1.00 0.00 H new ATOM 0 HG12 VAL B 78 14.594 10.429 -5.606 1.00 0.00 H new ATOM 0 HG13 VAL B 78 13.051 9.570 -5.829 1.00 0.00 H new ATOM 0 HG21 VAL B 78 13.492 9.010 -8.846 1.00 0.00 H new ATOM 0 HG22 VAL B 78 11.945 9.638 -8.232 1.00 0.00 H new ATOM 0 HG23 VAL B 78 12.809 10.508 -9.522 1.00 0.00 H new ATOM 3015 N ASP B 79 14.737 13.533 -6.666 1.00 0.00 N ATOM 3016 CA ASP B 79 15.744 14.249 -5.874 1.00 0.00 C ATOM 3017 C ASP B 79 15.171 15.574 -5.325 1.00 0.00 C ATOM 3018 O ASP B 79 15.594 16.052 -4.268 1.00 0.00 O ATOM 3019 CB ASP B 79 16.995 14.480 -6.765 1.00 0.00 C ATOM 3020 CG ASP B 79 18.153 15.187 -6.047 1.00 0.00 C ATOM 3021 OD1 ASP B 79 18.876 14.529 -5.272 1.00 0.00 O ATOM 3022 OD2 ASP B 79 18.349 16.401 -6.253 1.00 0.00 O ATOM 0 H ASP B 79 14.890 13.615 -7.671 1.00 0.00 H new ATOM 0 HA ASP B 79 16.032 13.655 -5.007 1.00 0.00 H new ATOM 0 HB2 ASP B 79 17.346 13.517 -7.137 1.00 0.00 H new ATOM 0 HB3 ASP B 79 16.705 15.071 -7.634 1.00 0.00 H new ATOM 3027 N GLU B 80 14.197 16.149 -6.053 1.00 0.00 N ATOM 3028 CA GLU B 80 13.466 17.348 -5.604 1.00 0.00 C ATOM 3029 C GLU B 80 12.574 16.992 -4.401 1.00 0.00 C ATOM 3030 O GLU B 80 12.539 17.706 -3.389 1.00 0.00 O ATOM 3031 CB GLU B 80 12.629 17.946 -6.756 1.00 0.00 C ATOM 3032 CG GLU B 80 13.443 18.285 -8.012 1.00 0.00 C ATOM 3033 CD GLU B 80 12.645 19.124 -9.017 1.00 0.00 C ATOM 3034 OE1 GLU B 80 12.590 20.365 -8.863 1.00 0.00 O ATOM 3035 OE2 GLU B 80 12.055 18.554 -9.952 1.00 0.00 O ATOM 0 H GLU B 80 13.896 15.799 -6.963 1.00 0.00 H new ATOM 0 HA GLU B 80 14.186 18.105 -5.294 1.00 0.00 H new ATOM 0 HB2 GLU B 80 11.844 17.239 -7.025 1.00 0.00 H new ATOM 0 HB3 GLU B 80 12.136 18.851 -6.401 1.00 0.00 H new ATOM 0 HG2 GLU B 80 14.343 18.828 -7.723 1.00 0.00 H new ATOM 0 HG3 GLU B 80 13.768 17.362 -8.491 1.00 0.00 H new ATOM 3042 N THR B 81 11.864 15.853 -4.551 1.00 0.00 N ATOM 3043 CA THR B 81 11.015 15.269 -3.501 1.00 0.00 C ATOM 3044 C THR B 81 11.861 14.879 -2.267 1.00 0.00 C ATOM 3045 O THR B 81 11.419 15.061 -1.129 1.00 0.00 O ATOM 3046 CB THR B 81 10.229 14.036 -4.068 1.00 0.00 C ATOM 3047 OG1 THR B 81 9.398 14.467 -5.160 1.00 0.00 O ATOM 3048 CG2 THR B 81 9.350 13.340 -3.016 1.00 0.00 C ATOM 0 H THR B 81 11.867 15.311 -5.415 1.00 0.00 H new ATOM 0 HA THR B 81 10.290 16.016 -3.178 1.00 0.00 H new ATOM 0 HB THR B 81 10.973 13.310 -4.397 1.00 0.00 H new ATOM 0 HG1 THR B 81 9.919 14.461 -5.990 1.00 0.00 H new ATOM 0 HG21 THR B 81 8.834 12.496 -3.474 1.00 0.00 H new ATOM 0 HG22 THR B 81 9.976 12.983 -2.198 1.00 0.00 H new ATOM 0 HG23 THR B 81 8.616 14.047 -2.629 1.00 0.00 H new ATOM 3056 N PHE B 82 13.104 14.402 -2.524 1.00 0.00 N ATOM 3057 CA PHE B 82 14.094 14.066 -1.480 1.00 0.00 C ATOM 3058 C PHE B 82 14.340 15.295 -0.580 1.00 0.00 C ATOM 3059 O PHE B 82 14.141 15.255 0.628 1.00 0.00 O ATOM 3060 CB PHE B 82 15.424 13.576 -2.140 1.00 0.00 C ATOM 3061 CG PHE B 82 16.490 13.033 -1.171 1.00 0.00 C ATOM 3062 CD1 PHE B 82 17.307 13.890 -0.428 1.00 0.00 C ATOM 3063 CD2 PHE B 82 16.678 11.659 -1.007 1.00 0.00 C ATOM 3064 CE1 PHE B 82 18.261 13.394 0.436 1.00 0.00 C ATOM 3065 CE2 PHE B 82 17.636 11.166 -0.142 1.00 0.00 C ATOM 3066 CZ PHE B 82 18.424 12.033 0.581 1.00 0.00 C ATOM 0 H PHE B 82 13.447 14.240 -3.471 1.00 0.00 H new ATOM 0 HA PHE B 82 13.707 13.258 -0.859 1.00 0.00 H new ATOM 0 HB2 PHE B 82 15.184 12.795 -2.861 1.00 0.00 H new ATOM 0 HB3 PHE B 82 15.857 14.405 -2.700 1.00 0.00 H new ATOM 0 HD1 PHE B 82 17.189 14.958 -0.532 1.00 0.00 H new ATOM 0 HD2 PHE B 82 16.063 10.969 -1.566 1.00 0.00 H new ATOM 0 HE1 PHE B 82 18.882 14.074 1.000 1.00 0.00 H new ATOM 0 HE2 PHE B 82 17.767 10.100 -0.033 1.00 0.00 H new ATOM 0 HZ PHE B 82 19.169 11.647 1.261 1.00 0.00 H new ATOM 3076 N ALA B 83 14.731 16.400 -1.241 1.00 0.00 N ATOM 3077 CA ALA B 83 15.117 17.669 -0.592 1.00 0.00 C ATOM 3078 C ALA B 83 13.997 18.247 0.298 1.00 0.00 C ATOM 3079 O ALA B 83 14.245 18.649 1.441 1.00 0.00 O ATOM 3080 CB ALA B 83 15.503 18.691 -1.673 1.00 0.00 C ATOM 0 H ALA B 83 14.789 16.438 -2.259 1.00 0.00 H new ATOM 0 HA ALA B 83 15.965 17.461 0.060 1.00 0.00 H new ATOM 0 HB1 ALA B 83 15.789 19.630 -1.200 1.00 0.00 H new ATOM 0 HB2 ALA B 83 16.342 18.307 -2.254 1.00 0.00 H new ATOM 0 HB3 ALA B 83 14.652 18.861 -2.333 1.00 0.00 H new ATOM 3086 N GLY B 84 12.771 18.271 -0.255 1.00 0.00 N ATOM 3087 CA GLY B 84 11.602 18.813 0.443 1.00 0.00 C ATOM 3088 C GLY B 84 11.193 18.013 1.672 1.00 0.00 C ATOM 3089 O GLY B 84 10.863 18.592 2.715 1.00 0.00 O ATOM 0 H GLY B 84 12.568 17.918 -1.190 1.00 0.00 H new ATOM 0 HA2 GLY B 84 11.814 19.839 0.743 1.00 0.00 H new ATOM 0 HA3 GLY B 84 10.762 18.851 -0.250 1.00 0.00 H new ATOM 3093 N TRP B 85 11.256 16.679 1.553 1.00 0.00 N ATOM 3094 CA TRP B 85 11.002 15.745 2.669 1.00 0.00 C ATOM 3095 C TRP B 85 12.050 15.939 3.771 1.00 0.00 C ATOM 3096 O TRP B 85 11.711 15.958 4.956 1.00 0.00 O ATOM 3097 CB TRP B 85 11.023 14.302 2.133 1.00 0.00 C ATOM 3098 CG TRP B 85 9.793 13.912 1.363 1.00 0.00 C ATOM 3099 CD1 TRP B 85 8.812 14.729 0.854 1.00 0.00 C ATOM 3100 CD2 TRP B 85 9.416 12.585 1.024 1.00 0.00 C ATOM 3101 NE1 TRP B 85 7.851 13.976 0.240 1.00 0.00 N ATOM 3102 CE2 TRP B 85 8.203 12.662 0.328 1.00 0.00 C ATOM 3103 CE3 TRP B 85 9.992 11.341 1.245 1.00 0.00 C ATOM 3104 CZ2 TRP B 85 7.558 11.544 -0.142 1.00 0.00 C ATOM 3105 CZ3 TRP B 85 9.346 10.227 0.775 1.00 0.00 C ATOM 3106 CH2 TRP B 85 8.137 10.336 0.089 1.00 0.00 C ATOM 0 H TRP B 85 11.486 16.211 0.676 1.00 0.00 H new ATOM 0 HA TRP B 85 10.022 15.946 3.103 1.00 0.00 H new ATOM 0 HB2 TRP B 85 11.895 14.178 1.490 1.00 0.00 H new ATOM 0 HB3 TRP B 85 11.145 13.617 2.972 1.00 0.00 H new ATOM 0 HD1 TRP B 85 8.802 15.806 0.928 1.00 0.00 H new ATOM 0 HE1 TRP B 85 7.010 14.337 -0.210 1.00 0.00 H new ATOM 0 HE3 TRP B 85 10.929 11.253 1.776 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 6.623 11.622 -0.677 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.780 9.251 0.938 1.00 0.00 H new ATOM 0 HH2 TRP B 85 7.650 9.440 -0.267 1.00 0.00 H new ATOM 3117 N LYS B 86 13.316 16.050 3.359 1.00 0.00 N ATOM 3118 CA LYS B 86 14.454 16.220 4.275 1.00 0.00 C ATOM 3119 C LYS B 86 14.292 17.505 5.101 1.00 0.00 C ATOM 3120 O LYS B 86 14.537 17.520 6.309 1.00 0.00 O ATOM 3121 CB LYS B 86 15.756 16.232 3.450 1.00 0.00 C ATOM 3122 CG LYS B 86 17.035 16.501 4.260 1.00 0.00 C ATOM 3123 CD LYS B 86 18.321 16.360 3.413 1.00 0.00 C ATOM 3124 CE LYS B 86 18.195 16.984 2.011 1.00 0.00 C ATOM 3125 NZ LYS B 86 19.504 17.093 1.344 1.00 0.00 N ATOM 0 H LYS B 86 13.585 16.025 2.375 1.00 0.00 H new ATOM 0 HA LYS B 86 14.493 15.391 4.981 1.00 0.00 H new ATOM 0 HB2 LYS B 86 15.858 15.271 2.946 1.00 0.00 H new ATOM 0 HB3 LYS B 86 15.669 16.992 2.673 1.00 0.00 H new ATOM 0 HG2 LYS B 86 16.990 17.506 4.679 1.00 0.00 H new ATOM 0 HG3 LYS B 86 17.081 15.807 5.100 1.00 0.00 H new ATOM 0 HD2 LYS B 86 19.150 16.832 3.941 1.00 0.00 H new ATOM 0 HD3 LYS B 86 18.568 15.303 3.312 1.00 0.00 H new ATOM 0 HE2 LYS B 86 17.525 16.377 1.401 1.00 0.00 H new ATOM 0 HE3 LYS B 86 17.744 17.973 2.092 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 19.380 17.517 0.403 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 20.135 17.692 1.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 19.923 16.146 1.244 1.00 0.00 H new ATOM 3139 N ALA B 87 13.834 18.561 4.419 1.00 0.00 N ATOM 3140 CA ALA B 87 13.575 19.872 5.030 1.00 0.00 C ATOM 3141 C ALA B 87 12.357 19.833 5.973 1.00 0.00 C ATOM 3142 O ALA B 87 12.266 20.613 6.924 1.00 0.00 O ATOM 3143 CB ALA B 87 13.377 20.922 3.927 1.00 0.00 C ATOM 0 H ALA B 87 13.631 18.531 3.420 1.00 0.00 H new ATOM 0 HA ALA B 87 14.439 20.144 5.637 1.00 0.00 H new ATOM 0 HB1 ALA B 87 13.185 21.894 4.381 1.00 0.00 H new ATOM 0 HB2 ALA B 87 14.276 20.979 3.313 1.00 0.00 H new ATOM 0 HB3 ALA B 87 12.529 20.639 3.303 1.00 0.00 H new ATOM 3149 N SER B 88 11.429 18.896 5.687 1.00 0.00 N ATOM 3150 CA SER B 88 10.160 18.724 6.432 1.00 0.00 C ATOM 3151 C SER B 88 10.213 17.503 7.387 1.00 0.00 C ATOM 3152 O SER B 88 9.180 16.988 7.825 1.00 0.00 O ATOM 3153 CB SER B 88 9.010 18.577 5.412 1.00 0.00 C ATOM 3154 OG SER B 88 8.961 19.705 4.550 1.00 0.00 O ATOM 0 H SER B 88 11.539 18.229 4.923 1.00 0.00 H new ATOM 0 HA SER B 88 9.993 19.600 7.058 1.00 0.00 H new ATOM 0 HB2 SER B 88 9.151 17.669 4.825 1.00 0.00 H new ATOM 0 HB3 SER B 88 8.061 18.473 5.938 1.00 0.00 H new ATOM 0 HG SER B 88 9.567 19.564 3.792 1.00 0.00 H new ATOM 3160 N GLY B 89 11.445 17.046 7.675 1.00 0.00 N ATOM 3161 CA GLY B 89 11.723 16.156 8.810 1.00 0.00 C ATOM 3162 C GLY B 89 11.359 14.685 8.604 1.00 0.00 C ATOM 3163 O GLY B 89 10.734 14.067 9.481 1.00 0.00 O ATOM 0 H GLY B 89 12.272 17.284 7.127 1.00 0.00 H new ATOM 0 HA2 GLY B 89 12.785 16.219 9.045 1.00 0.00 H new ATOM 0 HA3 GLY B 89 11.181 16.527 9.680 1.00 0.00 H new ATOM 3167 N VAL B 90 11.755 14.115 7.456 1.00 0.00 N ATOM 3168 CA VAL B 90 11.673 12.655 7.210 1.00 0.00 C ATOM 3169 C VAL B 90 13.046 12.016 7.548 1.00 0.00 C ATOM 3170 O VAL B 90 14.086 12.623 7.271 1.00 0.00 O ATOM 3171 CB VAL B 90 11.271 12.347 5.714 1.00 0.00 C ATOM 3172 CG1 VAL B 90 11.167 10.833 5.443 1.00 0.00 C ATOM 3173 CG2 VAL B 90 9.955 13.047 5.318 1.00 0.00 C ATOM 0 H VAL B 90 12.140 14.643 6.673 1.00 0.00 H new ATOM 0 HA VAL B 90 10.898 12.228 7.847 1.00 0.00 H new ATOM 0 HB VAL B 90 12.073 12.748 5.094 1.00 0.00 H new ATOM 0 HG11 VAL B 90 10.888 10.668 4.402 1.00 0.00 H new ATOM 0 HG12 VAL B 90 12.130 10.361 5.640 1.00 0.00 H new ATOM 0 HG13 VAL B 90 10.409 10.398 6.095 1.00 0.00 H new ATOM 0 HG21 VAL B 90 9.714 12.809 4.282 1.00 0.00 H new ATOM 0 HG22 VAL B 90 9.150 12.701 5.966 1.00 0.00 H new ATOM 0 HG23 VAL B 90 10.070 14.126 5.426 1.00 0.00 H new ATOM 3183 N ALA B 91 13.038 10.808 8.163 1.00 0.00 N ATOM 3184 CA ALA B 91 14.276 10.101 8.587 1.00 0.00 C ATOM 3185 C ALA B 91 15.118 9.663 7.369 1.00 0.00 C ATOM 3186 O ALA B 91 16.353 9.780 7.394 1.00 0.00 O ATOM 3187 CB ALA B 91 13.928 8.896 9.480 1.00 0.00 C ATOM 0 H ALA B 91 12.181 10.298 8.379 1.00 0.00 H new ATOM 0 HA ALA B 91 14.880 10.797 9.169 1.00 0.00 H new ATOM 0 HB1 ALA B 91 14.845 8.390 9.781 1.00 0.00 H new ATOM 0 HB2 ALA B 91 13.396 9.242 10.366 1.00 0.00 H new ATOM 0 HB3 ALA B 91 13.296 8.202 8.925 1.00 0.00 H new ATOM 3193 N MET B 92 14.416 9.148 6.326 1.00 0.00 N ATOM 3194 CA MET B 92 14.953 8.880 4.961 1.00 0.00 C ATOM 3195 C MET B 92 16.299 8.115 4.945 1.00 0.00 C ATOM 3196 O MET B 92 17.380 8.705 4.861 1.00 0.00 O ATOM 3197 CB MET B 92 14.997 10.168 4.056 1.00 0.00 C ATOM 3198 CG MET B 92 15.788 11.378 4.579 1.00 0.00 C ATOM 3199 SD MET B 92 16.264 12.526 3.272 1.00 0.00 S ATOM 3200 CE MET B 92 14.708 12.817 2.438 1.00 0.00 C ATOM 0 H MET B 92 13.430 8.899 6.412 1.00 0.00 H new ATOM 0 HA MET B 92 14.227 8.200 4.515 1.00 0.00 H new ATOM 0 HB2 MET B 92 15.415 9.886 3.090 1.00 0.00 H new ATOM 0 HB3 MET B 92 13.971 10.489 3.878 1.00 0.00 H new ATOM 0 HG2 MET B 92 15.186 11.907 5.318 1.00 0.00 H new ATOM 0 HG3 MET B 92 16.684 11.026 5.090 1.00 0.00 H new ATOM 0 HE1 MET B 92 14.896 13.063 1.393 1.00 0.00 H new ATOM 0 HE2 MET B 92 14.092 11.920 2.494 1.00 0.00 H new ATOM 0 HE3 MET B 92 14.187 13.646 2.918 1.00 0.00 H new ATOM 3210 N LEU B 93 16.219 6.786 5.071 1.00 0.00 N ATOM 3211 CA LEU B 93 17.401 5.912 5.021 1.00 0.00 C ATOM 3212 C LEU B 93 17.421 5.141 3.690 1.00 0.00 C ATOM 3213 O LEU B 93 16.940 4.030 3.614 1.00 0.00 O ATOM 3214 CB LEU B 93 17.496 4.948 6.282 1.00 0.00 C ATOM 3215 CG LEU B 93 16.185 4.558 7.065 1.00 0.00 C ATOM 3216 CD1 LEU B 93 15.632 5.737 7.889 1.00 0.00 C ATOM 3217 CD2 LEU B 93 15.100 3.948 6.144 1.00 0.00 C ATOM 0 H LEU B 93 15.341 6.286 5.210 1.00 0.00 H new ATOM 0 HA LEU B 93 18.292 6.538 5.068 1.00 0.00 H new ATOM 0 HB2 LEU B 93 17.965 4.022 5.950 1.00 0.00 H new ATOM 0 HB3 LEU B 93 18.177 5.412 6.996 1.00 0.00 H new ATOM 0 HG LEU B 93 16.473 3.777 7.768 1.00 0.00 H new ATOM 0 HD11 LEU B 93 14.729 5.423 8.412 1.00 0.00 H new ATOM 0 HD12 LEU B 93 16.380 6.056 8.615 1.00 0.00 H new ATOM 0 HD13 LEU B 93 15.396 6.567 7.223 1.00 0.00 H new ATOM 0 HD21 LEU B 93 14.219 3.698 6.735 1.00 0.00 H new ATOM 0 HD22 LEU B 93 14.827 4.671 5.375 1.00 0.00 H new ATOM 0 HD23 LEU B 93 15.489 3.045 5.672 1.00 0.00 H new ATOM 3229 N GLN B 94 17.974 5.797 2.655 1.00 0.00 N ATOM 3230 CA GLN B 94 18.288 5.198 1.346 1.00 0.00 C ATOM 3231 C GLN B 94 18.943 6.265 0.465 1.00 0.00 C ATOM 3232 O GLN B 94 18.449 7.397 0.381 1.00 0.00 O ATOM 3233 CB GLN B 94 17.057 4.607 0.571 1.00 0.00 C ATOM 3234 CG GLN B 94 17.473 3.937 -0.767 1.00 0.00 C ATOM 3235 CD GLN B 94 16.347 3.279 -1.563 1.00 0.00 C ATOM 3236 OE1 GLN B 94 15.384 2.776 -1.006 1.00 0.00 O ATOM 3237 NE2 GLN B 94 16.473 3.269 -2.886 1.00 0.00 N ATOM 0 H GLN B 94 18.222 6.785 2.707 1.00 0.00 H new ATOM 0 HA GLN B 94 18.947 4.356 1.555 1.00 0.00 H new ATOM 0 HB2 GLN B 94 16.551 3.875 1.200 1.00 0.00 H new ATOM 0 HB3 GLN B 94 16.340 5.403 0.369 1.00 0.00 H new ATOM 0 HG2 GLN B 94 17.944 4.691 -1.397 1.00 0.00 H new ATOM 0 HG3 GLN B 94 18.230 3.182 -0.553 1.00 0.00 H new ATOM 0 HE21 GLN B 94 17.289 3.697 -3.324 1.00 0.00 H new ATOM 0 HE22 GLN B 94 15.754 2.833 -3.463 1.00 0.00 H new ATOM 3246 N GLN B 95 20.062 5.898 -0.166 1.00 0.00 N ATOM 3247 CA GLN B 95 20.660 6.679 -1.251 1.00 0.00 C ATOM 3248 C GLN B 95 19.922 6.311 -2.556 1.00 0.00 C ATOM 3249 O GLN B 95 19.960 5.138 -2.951 1.00 0.00 O ATOM 3250 CB GLN B 95 22.176 6.368 -1.353 1.00 0.00 C ATOM 3251 CG GLN B 95 22.975 6.690 -0.076 1.00 0.00 C ATOM 3252 CD GLN B 95 24.471 6.403 -0.215 1.00 0.00 C ATOM 3253 OE1 GLN B 95 24.933 5.301 0.083 1.00 0.00 O ATOM 3254 NE2 GLN B 95 25.234 7.388 -0.676 1.00 0.00 N ATOM 0 H GLN B 95 20.579 5.049 0.062 1.00 0.00 H new ATOM 0 HA GLN B 95 20.560 7.748 -1.064 1.00 0.00 H new ATOM 0 HB2 GLN B 95 22.303 5.312 -1.591 1.00 0.00 H new ATOM 0 HB3 GLN B 95 22.596 6.935 -2.184 1.00 0.00 H new ATOM 0 HG2 GLN B 95 22.835 7.741 0.178 1.00 0.00 H new ATOM 0 HG3 GLN B 95 22.575 6.106 0.753 1.00 0.00 H new ATOM 0 HE21 GLN B 95 24.817 8.288 -0.913 1.00 0.00 H new ATOM 0 HE22 GLN B 95 26.237 7.244 -0.793 1.00 0.00 H new ATOM 3263 N PRO B 96 19.168 7.278 -3.193 1.00 0.00 N ATOM 3264 CA PRO B 96 18.444 7.037 -4.464 1.00 0.00 C ATOM 3265 C PRO B 96 19.353 6.399 -5.536 1.00 0.00 C ATOM 3266 O PRO B 96 20.374 6.979 -5.915 1.00 0.00 O ATOM 3267 CB PRO B 96 17.938 8.450 -4.893 1.00 0.00 C ATOM 3268 CG PRO B 96 18.591 9.424 -3.955 1.00 0.00 C ATOM 3269 CD PRO B 96 18.925 8.657 -2.694 1.00 0.00 C ATOM 0 HA PRO B 96 17.626 6.327 -4.342 1.00 0.00 H new ATOM 0 HB2 PRO B 96 18.207 8.664 -5.927 1.00 0.00 H new ATOM 0 HB3 PRO B 96 16.852 8.512 -4.827 1.00 0.00 H new ATOM 0 HG2 PRO B 96 19.492 9.846 -4.401 1.00 0.00 H new ATOM 0 HG3 PRO B 96 17.923 10.257 -3.736 1.00 0.00 H new ATOM 0 HD2 PRO B 96 19.803 9.066 -2.194 1.00 0.00 H new ATOM 0 HD3 PRO B 96 18.106 8.687 -1.975 1.00 0.00 H new ATOM 3277 N ALA B 97 18.987 5.187 -5.974 1.00 0.00 N ATOM 3278 CA ALA B 97 19.797 4.376 -6.894 1.00 0.00 C ATOM 3279 C ALA B 97 18.932 3.849 -8.043 1.00 0.00 C ATOM 3280 O ALA B 97 17.731 3.606 -7.870 1.00 0.00 O ATOM 3281 CB ALA B 97 20.455 3.220 -6.123 1.00 0.00 C ATOM 0 H ALA B 97 18.114 4.738 -5.698 1.00 0.00 H new ATOM 0 HA ALA B 97 20.582 4.997 -7.325 1.00 0.00 H new ATOM 0 HB1 ALA B 97 21.055 2.621 -6.808 1.00 0.00 H new ATOM 0 HB2 ALA B 97 21.095 3.624 -5.338 1.00 0.00 H new ATOM 0 HB3 ALA B 97 19.682 2.595 -5.675 1.00 0.00 H new ATOM 3287 N LYS B 98 19.558 3.689 -9.218 1.00 0.00 N ATOM 3288 CA LYS B 98 18.904 3.166 -10.421 1.00 0.00 C ATOM 3289 C LYS B 98 18.598 1.656 -10.244 1.00 0.00 C ATOM 3290 O LYS B 98 19.497 0.858 -9.974 1.00 0.00 O ATOM 3291 CB LYS B 98 19.795 3.435 -11.690 1.00 0.00 C ATOM 3292 CG LYS B 98 19.172 4.375 -12.756 1.00 0.00 C ATOM 3293 CD LYS B 98 17.744 3.944 -13.166 1.00 0.00 C ATOM 3294 CE LYS B 98 17.223 4.688 -14.409 1.00 0.00 C ATOM 3295 NZ LYS B 98 17.213 6.171 -14.237 1.00 0.00 N ATOM 0 H LYS B 98 20.541 3.922 -9.359 1.00 0.00 H new ATOM 0 HA LYS B 98 17.957 3.684 -10.570 1.00 0.00 H new ATOM 0 HB2 LYS B 98 20.743 3.863 -11.363 1.00 0.00 H new ATOM 0 HB3 LYS B 98 20.023 2.479 -12.162 1.00 0.00 H new ATOM 0 HG2 LYS B 98 19.143 5.392 -12.366 1.00 0.00 H new ATOM 0 HG3 LYS B 98 19.811 4.391 -13.639 1.00 0.00 H new ATOM 0 HD2 LYS B 98 17.737 2.872 -13.362 1.00 0.00 H new ATOM 0 HD3 LYS B 98 17.064 4.121 -12.333 1.00 0.00 H new ATOM 0 HE2 LYS B 98 17.844 4.431 -15.267 1.00 0.00 H new ATOM 0 HE3 LYS B 98 16.213 4.347 -14.634 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 16.231 6.507 -14.174 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 17.721 6.423 -13.365 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 17.680 6.618 -15.052 1.00 0.00 H new ATOM 3309 N MET B 99 17.313 1.302 -10.391 1.00 0.00 N ATOM 3310 CA MET B 99 16.791 -0.075 -10.243 1.00 0.00 C ATOM 3311 C MET B 99 16.095 -0.494 -11.556 1.00 0.00 C ATOM 3312 O MET B 99 15.916 0.339 -12.456 1.00 0.00 O ATOM 3313 CB MET B 99 15.816 -0.103 -9.021 1.00 0.00 C ATOM 3314 CG MET B 99 15.202 -1.469 -8.663 1.00 0.00 C ATOM 3315 SD MET B 99 14.409 -1.477 -7.046 1.00 0.00 S ATOM 3316 CE MET B 99 15.840 -1.287 -5.974 1.00 0.00 C ATOM 0 H MET B 99 16.585 1.978 -10.622 1.00 0.00 H new ATOM 0 HA MET B 99 17.594 -0.788 -10.055 1.00 0.00 H new ATOM 0 HB2 MET B 99 16.352 0.269 -8.148 1.00 0.00 H new ATOM 0 HB3 MET B 99 15.003 0.596 -9.217 1.00 0.00 H new ATOM 0 HG2 MET B 99 14.470 -1.743 -9.423 1.00 0.00 H new ATOM 0 HG3 MET B 99 15.983 -2.229 -8.683 1.00 0.00 H new ATOM 0 HE1 MET B 99 15.911 -2.146 -5.306 1.00 0.00 H new ATOM 0 HE2 MET B 99 16.743 -1.223 -6.581 1.00 0.00 H new ATOM 0 HE3 MET B 99 15.734 -0.377 -5.384 1.00 0.00 H new ATOM 3326 N GLU B 100 15.731 -1.789 -11.657 1.00 0.00 N ATOM 3327 CA GLU B 100 14.994 -2.371 -12.802 1.00 0.00 C ATOM 3328 C GLU B 100 13.726 -1.555 -13.159 1.00 0.00 C ATOM 3329 O GLU B 100 13.477 -1.265 -14.328 1.00 0.00 O ATOM 3330 CB GLU B 100 14.613 -3.835 -12.439 1.00 0.00 C ATOM 3331 CG GLU B 100 13.954 -4.664 -13.557 1.00 0.00 C ATOM 3332 CD GLU B 100 14.881 -4.912 -14.760 1.00 0.00 C ATOM 3333 OE1 GLU B 100 15.827 -5.725 -14.630 1.00 0.00 O ATOM 3334 OE2 GLU B 100 14.677 -4.300 -15.835 1.00 0.00 O ATOM 0 H GLU B 100 15.944 -2.474 -10.932 1.00 0.00 H new ATOM 0 HA GLU B 100 15.636 -2.347 -13.683 1.00 0.00 H new ATOM 0 HB2 GLU B 100 15.515 -4.353 -12.115 1.00 0.00 H new ATOM 0 HB3 GLU B 100 13.935 -3.811 -11.586 1.00 0.00 H new ATOM 0 HG2 GLU B 100 13.636 -5.623 -13.149 1.00 0.00 H new ATOM 0 HG3 GLU B 100 13.056 -4.150 -13.899 1.00 0.00 H new ATOM 3341 N PHE B 101 12.968 -1.140 -12.124 1.00 0.00 N ATOM 3342 CA PHE B 101 11.703 -0.374 -12.294 1.00 0.00 C ATOM 3343 C PHE B 101 11.940 1.145 -12.296 1.00 0.00 C ATOM 3344 O PHE B 101 10.986 1.931 -12.403 1.00 0.00 O ATOM 3345 CB PHE B 101 10.673 -0.803 -11.210 1.00 0.00 C ATOM 3346 CG PHE B 101 10.099 -2.196 -11.479 1.00 0.00 C ATOM 3347 CD1 PHE B 101 10.844 -3.343 -11.203 1.00 0.00 C ATOM 3348 CD2 PHE B 101 8.835 -2.352 -12.054 1.00 0.00 C ATOM 3349 CE1 PHE B 101 10.343 -4.593 -11.486 1.00 0.00 C ATOM 3350 CE2 PHE B 101 8.338 -3.606 -12.340 1.00 0.00 C ATOM 3351 CZ PHE B 101 9.090 -4.727 -12.056 1.00 0.00 C ATOM 0 H PHE B 101 13.208 -1.322 -11.149 1.00 0.00 H new ATOM 0 HA PHE B 101 11.289 -0.613 -13.274 1.00 0.00 H new ATOM 0 HB2 PHE B 101 11.152 -0.792 -10.231 1.00 0.00 H new ATOM 0 HB3 PHE B 101 9.860 -0.077 -11.175 1.00 0.00 H new ATOM 0 HD1 PHE B 101 11.825 -3.249 -10.762 1.00 0.00 H new ATOM 0 HD2 PHE B 101 8.240 -1.479 -12.277 1.00 0.00 H new ATOM 0 HE1 PHE B 101 10.930 -5.472 -11.262 1.00 0.00 H new ATOM 0 HE2 PHE B 101 7.360 -3.710 -12.786 1.00 0.00 H new ATOM 0 HZ PHE B 101 8.700 -5.709 -12.279 1.00 0.00 H new ATOM 3361 N GLY B 102 13.215 1.549 -12.178 1.00 0.00 N ATOM 3362 CA GLY B 102 13.620 2.938 -12.385 1.00 0.00 C ATOM 3363 C GLY B 102 14.432 3.508 -11.233 1.00 0.00 C ATOM 3364 O GLY B 102 14.790 2.778 -10.302 1.00 0.00 O ATOM 0 H GLY B 102 13.984 0.924 -11.938 1.00 0.00 H new ATOM 0 HA2 GLY B 102 14.206 3.005 -13.301 1.00 0.00 H new ATOM 0 HA3 GLY B 102 12.730 3.550 -12.531 1.00 0.00 H new ATOM 3368 N TYR B 103 14.698 4.826 -11.283 1.00 0.00 N ATOM 3369 CA TYR B 103 15.546 5.500 -10.286 1.00 0.00 C ATOM 3370 C TYR B 103 14.746 5.659 -8.985 1.00 0.00 C ATOM 3371 O TYR B 103 13.913 6.558 -8.882 1.00 0.00 O ATOM 3372 CB TYR B 103 16.004 6.878 -10.827 1.00 0.00 C ATOM 3373 CG TYR B 103 17.144 7.479 -10.022 1.00 0.00 C ATOM 3374 CD1 TYR B 103 18.400 6.894 -10.077 1.00 0.00 C ATOM 3375 CD2 TYR B 103 16.975 8.603 -9.217 1.00 0.00 C ATOM 3376 CE1 TYR B 103 19.451 7.396 -9.370 1.00 0.00 C ATOM 3377 CE2 TYR B 103 18.029 9.117 -8.504 1.00 0.00 C ATOM 3378 CZ TYR B 103 19.268 8.513 -8.582 1.00 0.00 C ATOM 3379 OH TYR B 103 20.322 9.023 -7.866 1.00 0.00 O ATOM 0 H TYR B 103 14.336 5.447 -12.007 1.00 0.00 H new ATOM 0 HA TYR B 103 16.437 4.905 -10.087 1.00 0.00 H new ATOM 0 HB2 TYR B 103 16.317 6.769 -11.866 1.00 0.00 H new ATOM 0 HB3 TYR B 103 15.158 7.565 -10.819 1.00 0.00 H new ATOM 0 HD1 TYR B 103 18.549 6.020 -10.694 1.00 0.00 H new ATOM 0 HD2 TYR B 103 16.005 9.074 -9.153 1.00 0.00 H new ATOM 0 HE1 TYR B 103 20.420 6.923 -9.426 1.00 0.00 H new ATOM 0 HE2 TYR B 103 17.890 9.991 -7.884 1.00 0.00 H new ATOM 0 HH TYR B 103 20.504 8.445 -7.096 1.00 0.00 H new ATOM 3389 N THR B 104 15.012 4.793 -7.997 1.00 0.00 N ATOM 3390 CA THR B 104 14.137 4.627 -6.825 1.00 0.00 C ATOM 3391 C THR B 104 14.828 5.099 -5.539 1.00 0.00 C ATOM 3392 O THR B 104 16.059 5.083 -5.426 1.00 0.00 O ATOM 3393 CB THR B 104 13.673 3.134 -6.681 1.00 0.00 C ATOM 3394 OG1 THR B 104 12.654 3.021 -5.673 1.00 0.00 O ATOM 3395 CG2 THR B 104 14.829 2.186 -6.331 1.00 0.00 C ATOM 0 H THR B 104 15.835 4.190 -7.986 1.00 0.00 H new ATOM 0 HA THR B 104 13.257 5.250 -6.982 1.00 0.00 H new ATOM 0 HB THR B 104 13.279 2.838 -7.653 1.00 0.00 H new ATOM 0 HG1 THR B 104 12.802 2.207 -5.148 1.00 0.00 H new ATOM 0 HG21 THR B 104 14.451 1.168 -6.244 1.00 0.00 H new ATOM 0 HG22 THR B 104 15.584 2.227 -7.117 1.00 0.00 H new ATOM 0 HG23 THR B 104 15.275 2.490 -5.384 1.00 0.00 H new ATOM 3403 N PHE B 105 13.998 5.503 -4.585 1.00 0.00 N ATOM 3404 CA PHE B 105 14.403 5.987 -3.270 1.00 0.00 C ATOM 3405 C PHE B 105 13.304 5.643 -2.268 1.00 0.00 C ATOM 3406 O PHE B 105 12.139 5.774 -2.601 1.00 0.00 O ATOM 3407 CB PHE B 105 14.650 7.536 -3.340 1.00 0.00 C ATOM 3408 CG PHE B 105 14.464 8.321 -2.031 1.00 0.00 C ATOM 3409 CD1 PHE B 105 15.252 8.063 -0.906 1.00 0.00 C ATOM 3410 CD2 PHE B 105 13.473 9.303 -1.928 1.00 0.00 C ATOM 3411 CE1 PHE B 105 15.053 8.761 0.269 1.00 0.00 C ATOM 3412 CE2 PHE B 105 13.274 9.997 -0.755 1.00 0.00 C ATOM 3413 CZ PHE B 105 14.062 9.727 0.344 1.00 0.00 C ATOM 0 H PHE B 105 12.986 5.503 -4.710 1.00 0.00 H new ATOM 0 HA PHE B 105 15.331 5.513 -2.950 1.00 0.00 H new ATOM 0 HB2 PHE B 105 15.666 7.703 -3.697 1.00 0.00 H new ATOM 0 HB3 PHE B 105 13.977 7.955 -4.088 1.00 0.00 H new ATOM 0 HD1 PHE B 105 16.025 7.310 -0.956 1.00 0.00 H new ATOM 0 HD2 PHE B 105 12.852 9.521 -2.784 1.00 0.00 H new ATOM 0 HE1 PHE B 105 15.670 8.554 1.131 1.00 0.00 H new ATOM 0 HE2 PHE B 105 12.503 10.751 -0.696 1.00 0.00 H new ATOM 0 HZ PHE B 105 13.907 10.269 1.265 1.00 0.00 H new ATOM 3423 N THR B 106 13.661 5.191 -1.065 1.00 0.00 N ATOM 3424 CA THR B 106 12.668 4.836 -0.037 1.00 0.00 C ATOM 3425 C THR B 106 13.030 5.526 1.283 1.00 0.00 C ATOM 3426 O THR B 106 14.150 5.400 1.783 1.00 0.00 O ATOM 3427 CB THR B 106 12.532 3.291 0.165 1.00 0.00 C ATOM 3428 OG1 THR B 106 12.388 2.637 -1.112 1.00 0.00 O ATOM 3429 CG2 THR B 106 11.328 2.935 1.061 1.00 0.00 C ATOM 0 H THR B 106 14.630 5.060 -0.774 1.00 0.00 H new ATOM 0 HA THR B 106 11.695 5.186 -0.382 1.00 0.00 H new ATOM 0 HB THR B 106 13.439 2.944 0.661 1.00 0.00 H new ATOM 0 HG1 THR B 106 13.274 2.469 -1.495 1.00 0.00 H new ATOM 0 HG21 THR B 106 11.268 1.853 1.177 1.00 0.00 H new ATOM 0 HG22 THR B 106 11.453 3.398 2.040 1.00 0.00 H new ATOM 0 HG23 THR B 106 10.411 3.302 0.601 1.00 0.00 H new ATOM 3437 N ALA B 107 12.061 6.263 1.826 1.00 0.00 N ATOM 3438 CA ALA B 107 12.214 7.039 3.050 1.00 0.00 C ATOM 3439 C ALA B 107 11.485 6.369 4.218 1.00 0.00 C ATOM 3440 O ALA B 107 10.748 5.389 4.028 1.00 0.00 O ATOM 3441 CB ALA B 107 11.686 8.458 2.811 1.00 0.00 C ATOM 0 H ALA B 107 11.130 6.337 1.416 1.00 0.00 H new ATOM 0 HA ALA B 107 13.270 7.090 3.316 1.00 0.00 H new ATOM 0 HB1 ALA B 107 11.797 9.046 3.722 1.00 0.00 H new ATOM 0 HB2 ALA B 107 12.253 8.926 2.006 1.00 0.00 H new ATOM 0 HB3 ALA B 107 10.633 8.412 2.534 1.00 0.00 H new ATOM 3447 N ALA B 108 11.698 6.910 5.419 1.00 0.00 N ATOM 3448 CA ALA B 108 11.028 6.459 6.641 1.00 0.00 C ATOM 3449 C ALA B 108 10.530 7.672 7.417 1.00 0.00 C ATOM 3450 O ALA B 108 11.307 8.580 7.700 1.00 0.00 O ATOM 3451 CB ALA B 108 11.981 5.625 7.504 1.00 0.00 C ATOM 0 H ALA B 108 12.347 7.682 5.573 1.00 0.00 H new ATOM 0 HA ALA B 108 10.180 5.828 6.373 1.00 0.00 H new ATOM 0 HB1 ALA B 108 11.464 5.300 8.407 1.00 0.00 H new ATOM 0 HB2 ALA B 108 12.312 4.752 6.941 1.00 0.00 H new ATOM 0 HB3 ALA B 108 12.846 6.229 7.779 1.00 0.00 H new ATOM 3457 N ASP B 109 9.236 7.683 7.733 1.00 0.00 N ATOM 3458 CA ASP B 109 8.610 8.693 8.611 1.00 0.00 C ATOM 3459 C ASP B 109 9.163 8.590 10.054 1.00 0.00 C ATOM 3460 O ASP B 109 9.890 7.637 10.355 1.00 0.00 O ATOM 3461 CB ASP B 109 7.075 8.470 8.604 1.00 0.00 C ATOM 3462 CG ASP B 109 6.478 8.572 7.198 1.00 0.00 C ATOM 3463 OD1 ASP B 109 6.577 7.583 6.455 1.00 0.00 O ATOM 3464 OD2 ASP B 109 5.894 9.607 6.845 1.00 0.00 O ATOM 0 H ASP B 109 8.577 6.986 7.386 1.00 0.00 H new ATOM 0 HA ASP B 109 8.843 9.691 8.239 1.00 0.00 H new ATOM 0 HB2 ASP B 109 6.851 7.488 9.021 1.00 0.00 H new ATOM 0 HB3 ASP B 109 6.600 9.207 9.252 1.00 0.00 H new ATOM 3469 N PRO B 110 8.839 9.571 10.969 1.00 0.00 N ATOM 3470 CA PRO B 110 9.143 9.451 12.425 1.00 0.00 C ATOM 3471 C PRO B 110 8.575 8.155 13.049 1.00 0.00 C ATOM 3472 O PRO B 110 9.124 7.618 14.016 1.00 0.00 O ATOM 3473 CB PRO B 110 8.471 10.709 13.035 1.00 0.00 C ATOM 3474 CG PRO B 110 8.432 11.700 11.919 1.00 0.00 C ATOM 3475 CD PRO B 110 8.189 10.885 10.669 1.00 0.00 C ATOM 0 HA PRO B 110 10.215 9.394 12.616 1.00 0.00 H new ATOM 0 HB2 PRO B 110 7.469 10.484 13.400 1.00 0.00 H new ATOM 0 HB3 PRO B 110 9.041 11.090 13.883 1.00 0.00 H new ATOM 0 HG2 PRO B 110 7.639 12.432 12.071 1.00 0.00 H new ATOM 0 HG3 PRO B 110 9.369 12.253 11.852 1.00 0.00 H new ATOM 0 HD2 PRO B 110 7.124 10.768 10.468 1.00 0.00 H new ATOM 0 HD3 PRO B 110 8.629 11.358 9.791 1.00 0.00 H new ATOM 3483 N ASP B 111 7.475 7.660 12.456 1.00 0.00 N ATOM 3484 CA ASP B 111 6.770 6.441 12.906 1.00 0.00 C ATOM 3485 C ASP B 111 7.260 5.180 12.147 1.00 0.00 C ATOM 3486 O ASP B 111 6.616 4.125 12.214 1.00 0.00 O ATOM 3487 CB ASP B 111 5.239 6.639 12.715 1.00 0.00 C ATOM 3488 CG ASP B 111 4.713 7.920 13.399 1.00 0.00 C ATOM 3489 OD1 ASP B 111 4.938 9.024 12.847 1.00 0.00 O ATOM 3490 OD2 ASP B 111 4.102 7.831 14.491 1.00 0.00 O ATOM 0 H ASP B 111 7.044 8.098 11.642 1.00 0.00 H new ATOM 0 HA ASP B 111 6.990 6.281 13.961 1.00 0.00 H new ATOM 0 HB2 ASP B 111 5.013 6.682 11.650 1.00 0.00 H new ATOM 0 HB3 ASP B 111 4.712 5.774 13.118 1.00 0.00 H new ATOM 3495 N SER B 112 8.407 5.319 11.440 1.00 0.00 N ATOM 3496 CA SER B 112 9.087 4.235 10.690 1.00 0.00 C ATOM 3497 C SER B 112 8.155 3.551 9.663 1.00 0.00 C ATOM 3498 O SER B 112 7.560 2.501 9.944 1.00 0.00 O ATOM 3499 CB SER B 112 9.720 3.194 11.657 1.00 0.00 C ATOM 3500 OG SER B 112 10.655 3.796 12.540 1.00 0.00 O ATOM 0 H SER B 112 8.898 6.211 11.374 1.00 0.00 H new ATOM 0 HA SER B 112 9.891 4.703 10.121 1.00 0.00 H new ATOM 0 HB2 SER B 112 8.933 2.710 12.235 1.00 0.00 H new ATOM 0 HB3 SER B 112 10.216 2.415 11.078 1.00 0.00 H new ATOM 0 HG SER B 112 11.031 3.113 13.134 1.00 0.00 H new ATOM 3506 N HIS B 113 7.986 4.181 8.486 1.00 0.00 N ATOM 3507 CA HIS B 113 7.221 3.588 7.365 1.00 0.00 C ATOM 3508 C HIS B 113 8.152 3.402 6.160 1.00 0.00 C ATOM 3509 O HIS B 113 9.369 3.589 6.263 1.00 0.00 O ATOM 3510 CB HIS B 113 6.003 4.469 6.951 1.00 0.00 C ATOM 3511 CG HIS B 113 5.123 4.924 8.077 1.00 0.00 C ATOM 3512 ND1 HIS B 113 4.640 6.206 8.169 1.00 0.00 N ATOM 3513 CD2 HIS B 113 4.685 4.289 9.175 1.00 0.00 C ATOM 3514 CE1 HIS B 113 3.965 6.349 9.273 1.00 0.00 C ATOM 3515 NE2 HIS B 113 3.981 5.206 9.906 1.00 0.00 N ATOM 0 H HIS B 113 8.369 5.104 8.283 1.00 0.00 H new ATOM 0 HA HIS B 113 6.831 2.627 7.700 1.00 0.00 H new ATOM 0 HB2 HIS B 113 6.375 5.349 6.425 1.00 0.00 H new ATOM 0 HB3 HIS B 113 5.395 3.907 6.242 1.00 0.00 H new ATOM 0 HD2 HIS B 113 4.855 3.254 9.432 1.00 0.00 H new ATOM 0 HE1 HIS B 113 3.478 7.253 9.607 1.00 0.00 H new ATOM 0 HE2 HIS B 113 3.537 5.025 10.806 1.00 0.00 H new ATOM 3524 N ARG B 114 7.568 3.012 5.034 1.00 0.00 N ATOM 3525 CA ARG B 114 8.264 2.838 3.762 1.00 0.00 C ATOM 3526 C ARG B 114 7.598 3.766 2.720 1.00 0.00 C ATOM 3527 O ARG B 114 6.423 3.576 2.397 1.00 0.00 O ATOM 3528 CB ARG B 114 8.150 1.351 3.345 1.00 0.00 C ATOM 3529 CG ARG B 114 8.937 0.326 4.192 1.00 0.00 C ATOM 3530 CD ARG B 114 10.424 0.269 3.814 1.00 0.00 C ATOM 3531 NE ARG B 114 10.616 -0.066 2.379 1.00 0.00 N ATOM 3532 CZ ARG B 114 11.705 -0.637 1.862 1.00 0.00 C ATOM 3533 NH1 ARG B 114 12.642 -1.137 2.647 1.00 0.00 N ATOM 3534 NH2 ARG B 114 11.833 -0.740 0.543 1.00 0.00 N ATOM 0 H ARG B 114 6.571 2.802 4.977 1.00 0.00 H new ATOM 0 HA ARG B 114 9.320 3.097 3.840 1.00 0.00 H new ATOM 0 HB2 ARG B 114 7.097 1.072 3.367 1.00 0.00 H new ATOM 0 HB3 ARG B 114 8.481 1.262 2.310 1.00 0.00 H new ATOM 0 HG2 ARG B 114 8.843 0.583 5.247 1.00 0.00 H new ATOM 0 HG3 ARG B 114 8.495 -0.662 4.064 1.00 0.00 H new ATOM 0 HD2 ARG B 114 10.891 1.230 4.028 1.00 0.00 H new ATOM 0 HD3 ARG B 114 10.928 -0.475 4.431 1.00 0.00 H new ATOM 0 HE ARG B 114 9.855 0.159 1.739 1.00 0.00 H new ATOM 0 HH11 ARG B 114 12.537 -1.089 3.660 1.00 0.00 H new ATOM 0 HH12 ARG B 114 13.470 -1.571 2.240 1.00 0.00 H new ATOM 0 HH21 ARG B 114 11.100 -0.383 -0.070 1.00 0.00 H new ATOM 0 HH22 ARG B 114 12.664 -1.176 0.144 1.00 0.00 H new ATOM 3548 N LEU B 115 8.322 4.801 2.250 1.00 0.00 N ATOM 3549 CA LEU B 115 7.810 5.755 1.235 1.00 0.00 C ATOM 3550 C LEU B 115 8.724 5.711 -0.002 1.00 0.00 C ATOM 3551 O LEU B 115 9.793 6.326 0.003 1.00 0.00 O ATOM 3552 CB LEU B 115 7.802 7.203 1.806 1.00 0.00 C ATOM 3553 CG LEU B 115 7.040 7.477 3.138 1.00 0.00 C ATOM 3554 CD1 LEU B 115 7.190 8.962 3.551 1.00 0.00 C ATOM 3555 CD2 LEU B 115 5.551 7.071 3.050 1.00 0.00 C ATOM 0 H LEU B 115 9.273 5.002 2.558 1.00 0.00 H new ATOM 0 HA LEU B 115 6.792 5.473 0.966 1.00 0.00 H new ATOM 0 HB2 LEU B 115 8.839 7.508 1.949 1.00 0.00 H new ATOM 0 HB3 LEU B 115 7.380 7.857 1.043 1.00 0.00 H new ATOM 0 HG LEU B 115 7.492 6.854 3.910 1.00 0.00 H new ATOM 0 HD11 LEU B 115 6.652 9.137 4.483 1.00 0.00 H new ATOM 0 HD12 LEU B 115 8.245 9.196 3.692 1.00 0.00 H new ATOM 0 HD13 LEU B 115 6.778 9.600 2.769 1.00 0.00 H new ATOM 0 HD21 LEU B 115 5.060 7.280 4.001 1.00 0.00 H new ATOM 0 HD22 LEU B 115 5.065 7.640 2.258 1.00 0.00 H new ATOM 0 HD23 LEU B 115 5.477 6.006 2.830 1.00 0.00 H new ATOM 3567 N ARG B 116 8.296 5.017 -1.071 1.00 0.00 N ATOM 3568 CA ARG B 116 9.161 4.752 -2.233 1.00 0.00 C ATOM 3569 C ARG B 116 8.983 5.801 -3.359 1.00 0.00 C ATOM 3570 O ARG B 116 8.108 5.632 -4.204 1.00 0.00 O ATOM 3571 CB ARG B 116 8.917 3.316 -2.758 1.00 0.00 C ATOM 3572 CG ARG B 116 9.848 2.899 -3.922 1.00 0.00 C ATOM 3573 CD ARG B 116 9.463 1.553 -4.527 1.00 0.00 C ATOM 3574 NE ARG B 116 10.360 1.147 -5.620 1.00 0.00 N ATOM 3575 CZ ARG B 116 10.457 -0.098 -6.111 1.00 0.00 C ATOM 3576 NH1 ARG B 116 9.727 -1.087 -5.598 1.00 0.00 N ATOM 3577 NH2 ARG B 116 11.308 -0.353 -7.095 1.00 0.00 N ATOM 0 H ARG B 116 7.356 4.630 -1.154 1.00 0.00 H new ATOM 0 HA ARG B 116 10.195 4.837 -1.900 1.00 0.00 H new ATOM 0 HB2 ARG B 116 9.046 2.613 -1.935 1.00 0.00 H new ATOM 0 HB3 ARG B 116 7.882 3.233 -3.088 1.00 0.00 H new ATOM 0 HG2 ARG B 116 9.818 3.664 -4.698 1.00 0.00 H new ATOM 0 HG3 ARG B 116 10.875 2.851 -3.561 1.00 0.00 H new ATOM 0 HD2 ARG B 116 9.478 0.791 -3.748 1.00 0.00 H new ATOM 0 HD3 ARG B 116 8.441 1.606 -4.902 1.00 0.00 H new ATOM 0 HE ARG B 116 10.953 1.866 -6.036 1.00 0.00 H new ATOM 0 HH11 ARG B 116 9.088 -0.901 -4.825 1.00 0.00 H new ATOM 0 HH12 ARG B 116 9.807 -2.030 -5.978 1.00 0.00 H new ATOM 0 HH21 ARG B 116 11.886 0.396 -7.476 1.00 0.00 H new ATOM 0 HH22 ARG B 116 11.385 -1.298 -7.471 1.00 0.00 H new ATOM 3591 N VAL B 117 9.815 6.847 -3.420 1.00 0.00 N ATOM 3592 CA VAL B 117 9.792 7.801 -4.547 1.00 0.00 C ATOM 3593 C VAL B 117 10.646 7.227 -5.671 1.00 0.00 C ATOM 3594 O VAL B 117 11.854 7.073 -5.488 1.00 0.00 O ATOM 3595 CB VAL B 117 10.346 9.222 -4.165 1.00 0.00 C ATOM 3596 CG1 VAL B 117 10.087 10.251 -5.300 1.00 0.00 C ATOM 3597 CG2 VAL B 117 9.754 9.704 -2.833 1.00 0.00 C ATOM 0 H VAL B 117 10.513 7.058 -2.707 1.00 0.00 H new ATOM 0 HA VAL B 117 8.753 7.934 -4.848 1.00 0.00 H new ATOM 0 HB VAL B 117 11.425 9.136 -4.039 1.00 0.00 H new ATOM 0 HG11 VAL B 117 10.481 11.224 -5.006 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.583 9.919 -6.212 1.00 0.00 H new ATOM 0 HG13 VAL B 117 9.015 10.333 -5.479 1.00 0.00 H new ATOM 0 HG21 VAL B 117 10.154 10.689 -2.592 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.669 9.763 -2.917 1.00 0.00 H new ATOM 0 HG23 VAL B 117 10.018 9.002 -2.042 1.00 0.00 H new ATOM 3607 N TYR B 118 10.042 6.895 -6.828 1.00 0.00 N ATOM 3608 CA TYR B 118 10.801 6.307 -7.946 1.00 0.00 C ATOM 3609 C TYR B 118 10.557 7.070 -9.254 1.00 0.00 C ATOM 3610 O TYR B 118 9.539 7.764 -9.395 1.00 0.00 O ATOM 3611 CB TYR B 118 10.567 4.775 -8.090 1.00 0.00 C ATOM 3612 CG TYR B 118 9.289 4.344 -8.801 1.00 0.00 C ATOM 3613 CD1 TYR B 118 8.080 4.254 -8.123 1.00 0.00 C ATOM 3614 CD2 TYR B 118 9.307 4.001 -10.161 1.00 0.00 C ATOM 3615 CE1 TYR B 118 6.940 3.837 -8.769 1.00 0.00 C ATOM 3616 CE2 TYR B 118 8.168 3.592 -10.809 1.00 0.00 C ATOM 3617 CZ TYR B 118 6.984 3.507 -10.114 1.00 0.00 C ATOM 3618 OH TYR B 118 5.842 3.075 -10.762 1.00 0.00 O ATOM 0 H TYR B 118 9.047 7.022 -7.011 1.00 0.00 H new ATOM 0 HA TYR B 118 11.858 6.420 -7.707 1.00 0.00 H new ATOM 0 HB2 TYR B 118 11.415 4.350 -8.626 1.00 0.00 H new ATOM 0 HB3 TYR B 118 10.567 4.335 -7.093 1.00 0.00 H new ATOM 0 HD1 TYR B 118 8.035 4.515 -7.076 1.00 0.00 H new ATOM 0 HD2 TYR B 118 10.236 4.060 -10.709 1.00 0.00 H new ATOM 0 HE1 TYR B 118 6.009 3.767 -8.227 1.00 0.00 H new ATOM 0 HE2 TYR B 118 8.201 3.338 -11.858 1.00 0.00 H new ATOM 0 HH TYR B 118 5.212 2.710 -10.106 1.00 0.00 H new ATOM 3628 N ALA B 119 11.452 6.882 -10.222 1.00 0.00 N ATOM 3629 CA ALA B 119 11.368 7.506 -11.545 1.00 0.00 C ATOM 3630 C ALA B 119 11.250 6.414 -12.595 1.00 0.00 C ATOM 3631 O ALA B 119 12.158 5.598 -12.713 1.00 0.00 O ATOM 3632 CB ALA B 119 12.629 8.330 -11.794 1.00 0.00 C ATOM 0 H ALA B 119 12.270 6.283 -10.109 1.00 0.00 H new ATOM 0 HA ALA B 119 10.497 8.160 -11.598 1.00 0.00 H new ATOM 0 HB1 ALA B 119 12.571 8.796 -12.778 1.00 0.00 H new ATOM 0 HB2 ALA B 119 12.715 9.103 -11.031 1.00 0.00 H new ATOM 0 HB3 ALA B 119 13.503 7.680 -11.752 1.00 0.00 H new ATOM 3638 N PHE B 120 10.151 6.392 -13.361 1.00 0.00 N ATOM 3639 CA PHE B 120 9.914 5.322 -14.344 1.00 0.00 C ATOM 3640 C PHE B 120 10.704 5.614 -15.632 1.00 0.00 C ATOM 3641 O PHE B 120 10.599 6.710 -16.200 1.00 0.00 O ATOM 3642 CB PHE B 120 8.396 5.178 -14.648 1.00 0.00 C ATOM 3643 CG PHE B 120 8.005 3.832 -15.288 1.00 0.00 C ATOM 3644 CD1 PHE B 120 7.768 2.706 -14.494 1.00 0.00 C ATOM 3645 CD2 PHE B 120 7.874 3.693 -16.671 1.00 0.00 C ATOM 3646 CE1 PHE B 120 7.412 1.495 -15.059 1.00 0.00 C ATOM 3647 CE2 PHE B 120 7.522 2.481 -17.235 1.00 0.00 C ATOM 3648 CZ PHE B 120 7.290 1.383 -16.430 1.00 0.00 C ATOM 0 H PHE B 120 9.415 7.097 -13.321 1.00 0.00 H new ATOM 0 HA PHE B 120 10.260 4.377 -13.926 1.00 0.00 H new ATOM 0 HB2 PHE B 120 7.838 5.302 -13.720 1.00 0.00 H new ATOM 0 HB3 PHE B 120 8.092 5.986 -15.313 1.00 0.00 H new ATOM 0 HD1 PHE B 120 7.865 2.783 -13.421 1.00 0.00 H new ATOM 0 HD2 PHE B 120 8.050 4.546 -17.310 1.00 0.00 H new ATOM 0 HE1 PHE B 120 7.230 0.637 -14.428 1.00 0.00 H new ATOM 0 HE2 PHE B 120 7.428 2.393 -18.307 1.00 0.00 H new ATOM 0 HZ PHE B 120 7.013 0.437 -16.872 1.00 0.00 H new ATOM 3658 N ALA B 121 11.499 4.622 -16.067 1.00 0.00 N ATOM 3659 CA ALA B 121 12.247 4.663 -17.328 1.00 0.00 C ATOM 3660 C ALA B 121 11.776 3.499 -18.213 1.00 0.00 C ATOM 3661 O ALA B 121 12.243 2.364 -18.061 1.00 0.00 O ATOM 3662 CB ALA B 121 13.760 4.588 -17.050 1.00 0.00 C ATOM 0 H ALA B 121 11.640 3.758 -15.543 1.00 0.00 H new ATOM 0 HA ALA B 121 12.061 5.601 -17.850 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.305 4.619 -17.993 1.00 0.00 H new ATOM 0 HB2 ALA B 121 14.058 5.434 -16.430 1.00 0.00 H new ATOM 0 HB3 ALA B 121 13.989 3.658 -16.529 1.00 0.00 H new ATOM 3668 N GLY B 122 10.807 3.786 -19.096 1.00 0.00 N ATOM 3669 CA GLY B 122 10.249 2.780 -19.994 1.00 0.00 C ATOM 3670 C GLY B 122 9.326 3.414 -21.035 1.00 0.00 C ATOM 3671 O GLY B 122 9.818 3.814 -22.111 1.00 0.00 O ATOM 3672 OXT GLY B 122 8.113 3.540 -20.775 1.00 0.00 O ATOM 0 H GLY B 122 10.396 4.714 -19.202 1.00 0.00 H new ATOM 0 HA2 GLY B 122 11.058 2.250 -20.497 1.00 0.00 H new ATOM 0 HA3 GLY B 122 9.695 2.041 -19.416 1.00 0.00 H new TER 3676 GLY B 122