USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1033 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 89 ASN : amide:sc= -0.894! C(o=-0.34!,f=-3.6!) USER MOD Set 1.2: A 94 ASN : amide:sc= 0.554 K(o=-0.34,f=-2.5!) USER MOD Set 2.1: A 9 GLN : amide:sc= -0.0266 X(o=-0.0045,f=-0.096) USER MOD Set 2.2: A 11 GLN : amide:sc= 0.022 X(o=-0.0045,f=-0.45) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 HIS : no HD1:sc= -0.926 K(o=-0.93,f=-0.21) USER MOD Single : A 16 HIS : no HD1:sc= -0.0178 X(o=-0.018,f=-0.11) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 69:sc= 1.18 USER MOD Single : A 32 SER OG : rot -77:sc= 1.05 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -1:sc= 1.17 USER MOD Single : A 40 TYR OH : rot -110:sc= 1.2 USER MOD Single : A 41 THR OG1 : rot 147:sc= 0.701 USER MOD Single : A 47 SER OG : rot 73:sc= 1.28 USER MOD Single : A 51 ASN : amide:sc= -1.24 K(o=-1.2,f=-0.25) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.121 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0108 USER MOD Single : A 59 ASN : amide:sc= -0.185 X(o=-0.19,f=-0.23) USER MOD Single : A 60 THR OG1 : rot 81:sc= 0.595 USER MOD Single : A 67 SER OG : rot 37:sc= 0.0189 USER MOD Single : A 71 HIS : no HD1:sc= -0.0159 X(o=-0.016,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 150:sc= 0.926 (180deg=0.347) USER MOD Single : A 76 SER OG : rot -74:sc= 1.03 USER MOD Single : A 81 ASN : amide:sc= -0.0194 K(o=-0.019,f=-0.85) USER MOD Single : A 82 CYS SG : rot 87:sc= 0.327 USER MOD Single : A 85 THR OG1 : rot 88:sc= 1.19 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0.578 K(o=0.58,f=-0.18) USER MOD Single : A 91 GLN : amide:sc= 0.602 K(o=0.6,f=0) USER MOD Single : A 100 MET CE :methyl -170:sc= -0.552 (180deg=-0.666) USER MOD Single : A 102 THR OG1 : rot 86:sc= -1.06 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 36:sc= 0.106 USER MOD Single : A 109 SER OG : rot 150:sc= 0.139 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -1.34 K(o=-1.3,f=-0.61) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -1.86 K(o=-1.9,f=-0.67) USER MOD Single : A 116 TYR OH : rot -163:sc= 1.24 USER MOD Single : A 123 GLN : amide:sc= -0.884 X(o=-0.88,f=-0.59) USER MOD Single : A 125 GLN : amide:sc= -1.21! K(o=-1.2!,f=-0.12) USER MOD Single : A 129 THR OG1 : rot -100:sc= -0.489 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 175:sc= 1.02 (180deg=0.898) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.218 12.198 0.372 1.00 0.00 N ATOM 2 CA PRO A 1 4.102 11.089 0.058 1.00 0.00 C ATOM 3 C PRO A 1 5.479 11.489 0.455 1.00 0.00 C ATOM 4 O PRO A 1 5.648 12.596 0.919 1.00 0.00 O ATOM 5 CB PRO A 1 4.028 10.841 -1.428 1.00 0.00 C ATOM 6 CG PRO A 1 3.094 11.902 -1.928 1.00 0.00 C ATOM 7 CD PRO A 1 2.280 12.352 -0.730 1.00 0.00 C ATOM 0 H2 PRO A 1 3.755 13.055 0.506 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.718 12.020 1.243 1.00 0.00 H new ATOM 0 HA PRO A 1 3.821 10.178 0.585 1.00 0.00 H new ATOM 0 HB2 PRO A 1 5.010 10.921 -1.895 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.651 9.842 -1.647 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.648 12.737 -2.357 1.00 0.00 H new ATOM 0 HG3 PRO A 1 2.447 11.512 -2.713 1.00 0.00 H new ATOM 0 HD2 PRO A 1 1.943 13.384 -0.834 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.390 11.739 -0.592 1.00 0.00 H new ATOM 17 N VAL A 2 6.461 10.628 0.248 1.00 0.00 N ATOM 18 CA VAL A 2 7.838 10.918 0.621 1.00 0.00 C ATOM 19 C VAL A 2 8.499 11.656 -0.541 1.00 0.00 C ATOM 20 O VAL A 2 8.177 11.399 -1.694 1.00 0.00 O ATOM 21 CB VAL A 2 8.626 9.574 0.889 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.101 9.821 1.211 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.993 8.769 2.006 1.00 0.00 C ATOM 0 H VAL A 2 6.329 9.712 -0.181 1.00 0.00 H new ATOM 0 HA VAL A 2 7.854 11.523 1.527 1.00 0.00 H new ATOM 0 HB VAL A 2 8.569 9.002 -0.037 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.600 8.868 1.387 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.576 10.329 0.372 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.180 10.442 2.103 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.562 7.852 2.161 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.994 9.357 2.924 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.967 8.518 1.737 1.00 0.00 H new ATOM 33 N THR A 3 9.361 12.586 -0.255 1.00 0.00 N ATOM 34 CA THR A 3 10.098 13.209 -1.303 1.00 0.00 C ATOM 35 C THR A 3 11.538 12.693 -1.241 1.00 0.00 C ATOM 36 O THR A 3 12.095 12.521 -0.144 1.00 0.00 O ATOM 37 CB THR A 3 10.007 14.763 -1.252 1.00 0.00 C ATOM 38 OG1 THR A 3 10.825 15.361 -2.272 1.00 0.00 O ATOM 39 CG2 THR A 3 10.375 15.310 0.124 1.00 0.00 C ATOM 0 H THR A 3 9.567 12.924 0.685 1.00 0.00 H new ATOM 0 HA THR A 3 9.663 12.943 -2.267 1.00 0.00 H new ATOM 0 HB THR A 3 8.968 15.030 -1.443 1.00 0.00 H new ATOM 0 HG1 THR A 3 10.750 16.337 -2.221 1.00 0.00 H new ATOM 0 HG21 THR A 3 10.298 16.397 0.116 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.693 14.904 0.871 1.00 0.00 H new ATOM 0 HG23 THR A 3 11.397 15.020 0.369 1.00 0.00 H new ATOM 47 N GLU A 4 12.111 12.426 -2.402 1.00 0.00 N ATOM 48 CA GLU A 4 13.411 11.779 -2.521 1.00 0.00 C ATOM 49 C GLU A 4 14.360 12.500 -3.506 1.00 0.00 C ATOM 50 O GLU A 4 14.083 13.599 -3.993 1.00 0.00 O ATOM 51 CB GLU A 4 13.242 10.330 -2.995 1.00 0.00 C ATOM 52 CG GLU A 4 12.513 10.215 -4.328 1.00 0.00 C ATOM 53 CD GLU A 4 12.837 8.957 -5.103 1.00 0.00 C ATOM 54 OE1 GLU A 4 12.818 7.864 -4.553 1.00 0.00 O ATOM 55 OE2 GLU A 4 13.146 9.078 -6.325 1.00 0.00 O ATOM 0 H GLU A 4 11.684 12.654 -3.300 1.00 0.00 H new ATOM 0 HA GLU A 4 13.858 11.818 -1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 4 14.225 9.867 -3.085 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.693 9.769 -2.239 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.439 10.251 -4.147 1.00 0.00 H new ATOM 0 HG3 GLU A 4 12.761 11.081 -4.942 1.00 0.00 H new ATOM 62 N THR A 5 15.454 11.880 -3.700 1.00 0.00 N ATOM 63 CA THR A 5 16.466 12.245 -4.631 1.00 0.00 C ATOM 64 C THR A 5 17.330 11.022 -4.718 1.00 0.00 C ATOM 65 O THR A 5 17.158 10.111 -3.901 1.00 0.00 O ATOM 66 CB THR A 5 17.306 13.510 -4.184 1.00 0.00 C ATOM 67 OG1 THR A 5 18.168 13.940 -5.252 1.00 0.00 O ATOM 68 CG2 THR A 5 18.169 13.248 -2.950 1.00 0.00 C ATOM 0 H THR A 5 15.693 11.038 -3.177 1.00 0.00 H new ATOM 0 HA THR A 5 16.036 12.542 -5.587 1.00 0.00 H new ATOM 0 HB THR A 5 16.578 14.282 -3.934 1.00 0.00 H new ATOM 0 HG1 THR A 5 18.681 14.724 -4.963 1.00 0.00 H new ATOM 0 HG21 THR A 5 18.721 14.152 -2.693 1.00 0.00 H new ATOM 0 HG22 THR A 5 17.531 12.962 -2.114 1.00 0.00 H new ATOM 0 HG23 THR A 5 18.872 12.442 -3.162 1.00 0.00 H new ATOM 76 N VAL A 6 18.196 10.954 -5.653 1.00 0.00 N ATOM 77 CA VAL A 6 19.051 9.812 -5.767 1.00 0.00 C ATOM 78 C VAL A 6 20.485 10.239 -5.780 1.00 0.00 C ATOM 79 O VAL A 6 20.831 11.267 -6.355 1.00 0.00 O ATOM 80 CB VAL A 6 18.735 8.901 -6.996 1.00 0.00 C ATOM 81 CG1 VAL A 6 17.441 8.115 -6.787 1.00 0.00 C ATOM 82 CG2 VAL A 6 18.631 9.724 -8.263 1.00 0.00 C ATOM 0 H VAL A 6 18.342 11.674 -6.361 1.00 0.00 H new ATOM 0 HA VAL A 6 18.856 9.198 -4.888 1.00 0.00 H new ATOM 0 HB VAL A 6 19.558 8.194 -7.096 1.00 0.00 H new ATOM 0 HG11 VAL A 6 17.249 7.491 -7.660 1.00 0.00 H new ATOM 0 HG12 VAL A 6 17.537 7.484 -5.904 1.00 0.00 H new ATOM 0 HG13 VAL A 6 16.612 8.809 -6.648 1.00 0.00 H new ATOM 0 HG21 VAL A 6 18.411 9.069 -9.106 1.00 0.00 H new ATOM 0 HG22 VAL A 6 17.832 10.458 -8.156 1.00 0.00 H new ATOM 0 HG23 VAL A 6 19.575 10.239 -8.441 1.00 0.00 H new ATOM 92 N ASP A 7 21.302 9.495 -5.073 1.00 0.00 N ATOM 93 CA ASP A 7 22.733 9.738 -5.088 1.00 0.00 C ATOM 94 C ASP A 7 23.302 9.042 -6.318 1.00 0.00 C ATOM 95 O ASP A 7 22.649 8.115 -6.842 1.00 0.00 O ATOM 96 CB ASP A 7 23.396 9.182 -3.814 1.00 0.00 C ATOM 97 CG ASP A 7 24.872 9.522 -3.709 1.00 0.00 C ATOM 98 OD1 ASP A 7 25.716 8.764 -4.203 1.00 0.00 O ATOM 99 OD2 ASP A 7 25.211 10.568 -3.146 1.00 0.00 O ATOM 0 H ASP A 7 21.007 8.719 -4.481 1.00 0.00 H new ATOM 0 HA ASP A 7 22.931 10.809 -5.121 1.00 0.00 H new ATOM 0 HB2 ASP A 7 22.876 9.576 -2.941 1.00 0.00 H new ATOM 0 HB3 ASP A 7 23.277 8.099 -3.794 1.00 0.00 H new ATOM 104 N GLY A 8 24.464 9.470 -6.775 1.00 0.00 N ATOM 105 CA GLY A 8 25.101 8.900 -7.944 1.00 0.00 C ATOM 106 C GLY A 8 25.326 7.408 -7.843 1.00 0.00 C ATOM 107 O GLY A 8 25.382 6.722 -8.861 1.00 0.00 O ATOM 0 H GLY A 8 24.994 10.227 -6.342 1.00 0.00 H new ATOM 0 HA2 GLY A 8 24.487 9.108 -8.820 1.00 0.00 H new ATOM 0 HA3 GLY A 8 26.060 9.394 -8.102 1.00 0.00 H new ATOM 111 N GLN A 9 25.453 6.895 -6.606 1.00 0.00 N ATOM 112 CA GLN A 9 25.623 5.462 -6.377 1.00 0.00 C ATOM 113 C GLN A 9 24.307 4.694 -6.626 1.00 0.00 C ATOM 114 O GLN A 9 24.292 3.468 -6.670 1.00 0.00 O ATOM 115 CB GLN A 9 26.202 5.185 -4.976 1.00 0.00 C ATOM 116 CG GLN A 9 25.398 5.805 -3.857 1.00 0.00 C ATOM 117 CD GLN A 9 26.044 5.686 -2.500 1.00 0.00 C ATOM 118 OE1 GLN A 9 26.739 4.724 -2.200 1.00 0.00 O ATOM 119 NE2 GLN A 9 25.859 6.686 -1.698 1.00 0.00 N ATOM 0 H GLN A 9 25.440 7.457 -5.755 1.00 0.00 H new ATOM 0 HA GLN A 9 26.349 5.090 -7.100 1.00 0.00 H new ATOM 0 HB2 GLN A 9 26.255 4.107 -4.820 1.00 0.00 H new ATOM 0 HB3 GLN A 9 27.223 5.564 -4.932 1.00 0.00 H new ATOM 0 HG2 GLN A 9 25.237 6.860 -4.080 1.00 0.00 H new ATOM 0 HG3 GLN A 9 24.416 5.333 -3.824 1.00 0.00 H new ATOM 0 HE21 GLN A 9 25.272 7.469 -1.986 1.00 0.00 H new ATOM 0 HE22 GLN A 9 26.300 6.691 -0.778 1.00 0.00 H new ATOM 128 N GLY A 10 23.215 5.429 -6.809 1.00 0.00 N ATOM 129 CA GLY A 10 21.956 4.821 -7.133 1.00 0.00 C ATOM 130 C GLY A 10 21.111 4.476 -5.940 1.00 0.00 C ATOM 131 O GLY A 10 20.486 3.415 -5.910 1.00 0.00 O ATOM 0 H GLY A 10 23.190 6.446 -6.736 1.00 0.00 H new ATOM 0 HA2 GLY A 10 21.395 5.497 -7.778 1.00 0.00 H new ATOM 0 HA3 GLY A 10 22.141 3.913 -7.707 1.00 0.00 H new ATOM 135 N GLN A 11 21.057 5.342 -4.937 1.00 0.00 N ATOM 136 CA GLN A 11 20.240 5.134 -3.757 1.00 0.00 C ATOM 137 C GLN A 11 19.234 6.289 -3.678 1.00 0.00 C ATOM 138 O GLN A 11 19.555 7.403 -4.106 1.00 0.00 O ATOM 139 CB GLN A 11 21.076 5.111 -2.465 1.00 0.00 C ATOM 140 CG GLN A 11 21.756 6.427 -2.166 1.00 0.00 C ATOM 141 CD GLN A 11 22.205 6.527 -0.750 1.00 0.00 C ATOM 142 OE1 GLN A 11 23.316 6.165 -0.408 1.00 0.00 O ATOM 143 NE2 GLN A 11 21.341 7.027 0.087 1.00 0.00 N ATOM 0 H GLN A 11 21.585 6.215 -4.923 1.00 0.00 H new ATOM 0 HA GLN A 11 19.745 4.166 -3.842 1.00 0.00 H new ATOM 0 HB2 GLN A 11 20.430 4.846 -1.628 1.00 0.00 H new ATOM 0 HB3 GLN A 11 21.832 4.330 -2.544 1.00 0.00 H new ATOM 0 HG2 GLN A 11 22.615 6.547 -2.826 1.00 0.00 H new ATOM 0 HG3 GLN A 11 21.070 7.245 -2.385 1.00 0.00 H new ATOM 0 HE21 GLN A 11 20.421 7.318 -0.243 1.00 0.00 H new ATOM 0 HE22 GLN A 11 21.585 7.128 1.072 1.00 0.00 H new ATOM 152 N ALA A 12 18.073 6.037 -3.124 1.00 0.00 N ATOM 153 CA ALA A 12 16.987 7.008 -3.023 1.00 0.00 C ATOM 154 C ALA A 12 16.879 7.451 -1.595 1.00 0.00 C ATOM 155 O ALA A 12 16.846 6.622 -0.684 1.00 0.00 O ATOM 156 CB ALA A 12 15.673 6.388 -3.491 1.00 0.00 C ATOM 0 H ALA A 12 17.842 5.131 -2.718 1.00 0.00 H new ATOM 0 HA ALA A 12 17.196 7.866 -3.661 1.00 0.00 H new ATOM 0 HB1 ALA A 12 14.874 7.125 -3.409 1.00 0.00 H new ATOM 0 HB2 ALA A 12 15.770 6.071 -4.529 1.00 0.00 H new ATOM 0 HB3 ALA A 12 15.436 5.525 -2.869 1.00 0.00 H new ATOM 162 N TRP A 13 16.873 8.748 -1.376 1.00 0.00 N ATOM 163 CA TRP A 13 16.892 9.304 -0.045 1.00 0.00 C ATOM 164 C TRP A 13 16.494 10.744 -0.097 1.00 0.00 C ATOM 165 O TRP A 13 16.674 11.373 -1.125 1.00 0.00 O ATOM 166 CB TRP A 13 18.321 9.190 0.576 1.00 0.00 C ATOM 167 CG TRP A 13 19.460 9.779 -0.252 1.00 0.00 C ATOM 168 CD1 TRP A 13 19.554 9.821 -1.620 1.00 0.00 C ATOM 169 CD2 TRP A 13 20.684 10.343 0.240 1.00 0.00 C ATOM 170 NE1 TRP A 13 20.724 10.361 -2.009 1.00 0.00 N ATOM 171 CE2 TRP A 13 21.456 10.698 -0.887 1.00 0.00 C ATOM 172 CE3 TRP A 13 21.206 10.589 1.532 1.00 0.00 C ATOM 173 CZ2 TRP A 13 22.712 11.276 -0.768 1.00 0.00 C ATOM 174 CZ3 TRP A 13 22.454 11.166 1.640 1.00 0.00 C ATOM 175 CH2 TRP A 13 23.191 11.503 0.498 1.00 0.00 C ATOM 0 H TRP A 13 16.855 9.446 -2.119 1.00 0.00 H new ATOM 0 HA TRP A 13 16.190 8.746 0.574 1.00 0.00 H new ATOM 0 HB2 TRP A 13 18.313 9.682 1.548 1.00 0.00 H new ATOM 0 HB3 TRP A 13 18.535 8.136 0.754 1.00 0.00 H new ATOM 0 HD1 TRP A 13 18.790 9.467 -2.296 1.00 0.00 H new ATOM 0 HE1 TRP A 13 21.022 10.499 -2.975 1.00 0.00 H new ATOM 0 HE3 TRP A 13 20.639 10.331 2.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 23.292 11.538 -1.641 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 22.868 11.360 2.618 1.00 0.00 H new ATOM 0 HH2 TRP A 13 24.165 11.955 0.617 1.00 0.00 H new ATOM 186 N ARG A 14 15.930 11.236 0.982 1.00 0.00 N ATOM 187 CA ARG A 14 15.594 12.652 1.178 1.00 0.00 C ATOM 188 C ARG A 14 14.806 12.827 2.482 1.00 0.00 C ATOM 189 O ARG A 14 15.278 12.457 3.546 1.00 0.00 O ATOM 190 CB ARG A 14 14.932 13.384 -0.014 1.00 0.00 C ATOM 191 CG ARG A 14 14.912 14.903 0.150 1.00 0.00 C ATOM 192 CD ARG A 14 14.156 15.631 -0.939 1.00 0.00 C ATOM 193 NE ARG A 14 14.795 15.526 -2.240 1.00 0.00 N ATOM 194 CZ ARG A 14 15.316 16.562 -2.909 1.00 0.00 C ATOM 195 NH1 ARG A 14 15.672 17.658 -2.258 1.00 0.00 N ATOM 196 NH2 ARG A 14 15.535 16.460 -4.222 1.00 0.00 N ATOM 0 H ARG A 14 15.679 10.654 1.781 1.00 0.00 H new ATOM 0 HA ARG A 14 16.555 13.161 1.250 1.00 0.00 H new ATOM 0 HB2 ARG A 14 15.466 13.131 -0.930 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.910 13.024 -0.131 1.00 0.00 H new ATOM 0 HG2 ARG A 14 14.465 15.148 1.114 1.00 0.00 H new ATOM 0 HG3 ARG A 14 15.938 15.269 0.172 1.00 0.00 H new ATOM 0 HD2 ARG A 14 13.145 15.229 -1.003 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.064 16.683 -0.669 1.00 0.00 H new ATOM 0 HE ARG A 14 14.850 14.603 -2.671 1.00 0.00 H new ATOM 0 HH11 ARG A 14 15.549 17.713 -1.247 1.00 0.00 H new ATOM 0 HH12 ARG A 14 16.069 18.447 -2.767 1.00 0.00 H new ATOM 0 HH21 ARG A 14 15.306 15.595 -4.712 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.932 17.247 -4.736 1.00 0.00 H new ATOM 210 N HIS A 15 13.599 13.359 2.379 1.00 0.00 N ATOM 211 CA HIS A 15 12.794 13.715 3.526 1.00 0.00 C ATOM 212 C HIS A 15 11.565 12.863 3.584 1.00 0.00 C ATOM 213 O HIS A 15 10.869 12.683 2.559 1.00 0.00 O ATOM 214 CB HIS A 15 12.350 15.192 3.466 1.00 0.00 C ATOM 215 CG HIS A 15 13.427 16.203 3.711 1.00 0.00 C ATOM 216 ND1 HIS A 15 13.179 17.455 4.224 1.00 0.00 N ATOM 217 CD2 HIS A 15 14.751 16.165 3.459 1.00 0.00 C ATOM 218 CE1 HIS A 15 14.300 18.135 4.275 1.00 0.00 C ATOM 219 NE2 HIS A 15 15.270 17.377 3.820 1.00 0.00 N ATOM 0 H HIS A 15 13.150 13.556 1.485 1.00 0.00 H new ATOM 0 HA HIS A 15 13.410 13.557 4.411 1.00 0.00 H new ATOM 0 HB2 HIS A 15 11.915 15.382 2.485 1.00 0.00 H new ATOM 0 HB3 HIS A 15 11.559 15.345 4.201 1.00 0.00 H new ATOM 0 HD2 HIS A 15 15.300 15.331 3.048 1.00 0.00 H new ATOM 0 HE1 HIS A 15 14.407 19.149 4.632 1.00 0.00 H new ATOM 0 HE2 HIS A 15 16.251 17.648 3.748 1.00 0.00 H new ATOM 228 N HIS A 16 11.275 12.355 4.753 1.00 0.00 N ATOM 229 CA HIS A 16 10.063 11.634 4.970 1.00 0.00 C ATOM 230 C HIS A 16 9.009 12.678 5.036 1.00 0.00 C ATOM 231 O HIS A 16 9.216 13.712 5.680 1.00 0.00 O ATOM 232 CB HIS A 16 10.080 10.884 6.318 1.00 0.00 C ATOM 233 CG HIS A 16 11.145 9.870 6.473 1.00 0.00 C ATOM 234 ND1 HIS A 16 12.322 10.129 7.120 1.00 0.00 N ATOM 235 CD2 HIS A 16 11.206 8.594 6.071 1.00 0.00 C ATOM 236 CE1 HIS A 16 13.079 9.060 7.105 1.00 0.00 C ATOM 237 NE2 HIS A 16 12.427 8.102 6.474 1.00 0.00 N ATOM 0 H HIS A 16 11.874 12.433 5.575 1.00 0.00 H new ATOM 0 HA HIS A 16 9.909 10.894 4.185 1.00 0.00 H new ATOM 0 HB2 HIS A 16 10.181 11.616 7.119 1.00 0.00 H new ATOM 0 HB3 HIS A 16 9.115 10.395 6.453 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.442 8.053 5.532 1.00 0.00 H new ATOM 0 HE1 HIS A 16 14.066 8.977 7.535 1.00 0.00 H new ATOM 0 HE2 HIS A 16 12.770 7.155 6.312 1.00 0.00 H new ATOM 246 N ASN A 17 7.942 12.497 4.372 1.00 0.00 N ATOM 247 CA ASN A 17 6.907 13.479 4.385 1.00 0.00 C ATOM 248 C ASN A 17 5.604 12.772 4.545 1.00 0.00 C ATOM 249 O ASN A 17 5.501 11.586 4.186 1.00 0.00 O ATOM 250 CB ASN A 17 6.984 14.219 3.054 1.00 0.00 C ATOM 251 CG ASN A 17 6.228 15.502 2.992 1.00 0.00 C ATOM 252 OD1 ASN A 17 5.032 15.531 2.699 1.00 0.00 O ATOM 253 ND2 ASN A 17 6.936 16.575 3.202 1.00 0.00 N ATOM 0 H ASN A 17 7.747 11.674 3.802 1.00 0.00 H new ATOM 0 HA ASN A 17 7.010 14.193 5.202 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.031 14.423 2.831 1.00 0.00 H new ATOM 0 HB3 ASN A 17 6.613 13.560 2.269 1.00 0.00 H new ATOM 0 HD21 ASN A 17 6.502 17.495 3.126 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.924 16.495 3.442 1.00 0.00 H new ATOM 260 N GLY A 18 4.639 13.445 5.103 1.00 0.00 N ATOM 261 CA GLY A 18 3.367 12.843 5.369 1.00 0.00 C ATOM 262 C GLY A 18 2.459 12.764 4.154 1.00 0.00 C ATOM 263 O GLY A 18 2.905 12.675 3.000 1.00 0.00 O ATOM 0 H GLY A 18 4.712 14.423 5.385 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.526 11.837 5.758 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.863 13.411 6.151 1.00 0.00 H new ATOM 267 N PHE A 19 1.202 12.812 4.408 1.00 0.00 N ATOM 268 CA PHE A 19 0.215 12.650 3.388 1.00 0.00 C ATOM 269 C PHE A 19 -0.699 13.828 3.316 1.00 0.00 C ATOM 270 O PHE A 19 -0.836 14.580 4.277 1.00 0.00 O ATOM 271 CB PHE A 19 -0.571 11.359 3.614 1.00 0.00 C ATOM 272 CG PHE A 19 0.261 10.154 3.299 1.00 0.00 C ATOM 273 CD1 PHE A 19 1.110 9.630 4.254 1.00 0.00 C ATOM 274 CD2 PHE A 19 0.249 9.584 2.036 1.00 0.00 C ATOM 275 CE1 PHE A 19 1.922 8.569 3.970 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.073 8.520 1.750 1.00 0.00 C ATOM 277 CZ PHE A 19 1.905 8.016 2.716 1.00 0.00 C ATOM 0 H PHE A 19 0.818 12.967 5.340 1.00 0.00 H new ATOM 0 HA PHE A 19 0.729 12.582 2.429 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -0.906 11.311 4.650 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.464 11.360 2.989 1.00 0.00 H new ATOM 0 HD1 PHE A 19 1.132 10.066 5.242 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.409 9.976 1.274 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.575 8.167 4.731 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.064 8.081 0.763 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.550 7.180 2.488 1.00 0.00 H new ATOM 287 N ASP A 20 -1.285 14.010 2.168 1.00 0.00 N ATOM 288 CA ASP A 20 -2.228 15.059 1.963 1.00 0.00 C ATOM 289 C ASP A 20 -3.548 14.557 2.468 1.00 0.00 C ATOM 290 O ASP A 20 -3.934 13.415 2.157 1.00 0.00 O ATOM 291 CB ASP A 20 -2.341 15.369 0.493 1.00 0.00 C ATOM 292 CG ASP A 20 -3.031 16.660 0.269 1.00 0.00 C ATOM 293 OD1 ASP A 20 -2.357 17.699 0.247 1.00 0.00 O ATOM 294 OD2 ASP A 20 -4.264 16.678 0.129 1.00 0.00 O ATOM 0 H ASP A 20 -1.118 13.429 1.346 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.920 15.966 2.483 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.346 15.403 0.049 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.887 14.570 -0.009 1.00 0.00 H new ATOM 299 N PHE A 21 -4.241 15.341 3.243 1.00 0.00 N ATOM 300 CA PHE A 21 -5.436 14.853 3.846 1.00 0.00 C ATOM 301 C PHE A 21 -6.564 14.754 2.862 1.00 0.00 C ATOM 302 O PHE A 21 -7.335 13.840 2.954 1.00 0.00 O ATOM 303 CB PHE A 21 -5.848 15.650 5.097 1.00 0.00 C ATOM 304 CG PHE A 21 -6.896 14.941 5.912 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.619 13.705 6.476 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.159 15.480 6.089 1.00 0.00 C ATOM 307 CE1 PHE A 21 -7.580 13.030 7.206 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.126 14.800 6.815 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.833 13.574 7.375 1.00 0.00 C ATOM 0 H PHE A 21 -4.000 16.306 3.467 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.206 13.843 4.185 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.969 15.828 5.717 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -6.227 16.626 4.794 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.642 13.265 6.344 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.394 16.441 5.657 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -7.346 12.072 7.646 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.108 15.231 6.942 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.583 13.044 7.943 1.00 0.00 H new ATOM 319 N ALA A 22 -6.608 15.651 1.880 1.00 0.00 N ATOM 320 CA ALA A 22 -7.680 15.639 0.879 1.00 0.00 C ATOM 321 C ALA A 22 -7.654 14.350 0.071 1.00 0.00 C ATOM 322 O ALA A 22 -8.667 13.862 -0.354 1.00 0.00 O ATOM 323 CB ALA A 22 -7.615 16.867 -0.033 1.00 0.00 C ATOM 0 H ALA A 22 -5.920 16.393 1.753 1.00 0.00 H new ATOM 0 HA ALA A 22 -8.629 15.683 1.413 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.425 16.823 -0.761 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.716 17.771 0.567 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.658 16.882 -0.555 1.00 0.00 H new ATOM 329 N VAL A 23 -6.480 13.820 -0.081 1.00 0.00 N ATOM 330 CA VAL A 23 -6.247 12.549 -0.758 1.00 0.00 C ATOM 331 C VAL A 23 -6.886 11.396 0.037 1.00 0.00 C ATOM 332 O VAL A 23 -7.688 10.611 -0.502 1.00 0.00 O ATOM 333 CB VAL A 23 -4.709 12.323 -0.888 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.359 10.933 -1.403 1.00 0.00 C ATOM 335 CG2 VAL A 23 -4.115 13.363 -1.813 1.00 0.00 C ATOM 0 H VAL A 23 -5.626 14.257 0.265 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.701 12.574 -1.749 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.289 12.416 0.113 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.276 10.833 -1.473 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.749 10.182 -0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.801 10.788 -2.389 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.041 13.201 -1.901 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.576 13.280 -2.797 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.300 14.358 -1.408 1.00 0.00 H new ATOM 345 N ILE A 24 -6.541 11.336 1.326 1.00 0.00 N ATOM 346 CA ILE A 24 -7.057 10.312 2.248 1.00 0.00 C ATOM 347 C ILE A 24 -8.583 10.471 2.349 1.00 0.00 C ATOM 348 O ILE A 24 -9.357 9.510 2.283 1.00 0.00 O ATOM 349 CB ILE A 24 -6.454 10.515 3.684 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.917 10.668 3.650 1.00 0.00 C ATOM 351 CG2 ILE A 24 -6.867 9.398 4.627 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.196 9.531 2.985 1.00 0.00 C ATOM 0 H ILE A 24 -5.896 11.995 1.763 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.783 9.326 1.873 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.867 11.448 4.068 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.667 11.594 3.131 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.551 10.767 4.672 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.431 9.572 5.611 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.954 9.375 4.710 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.513 8.443 4.237 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.123 9.719 3.005 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.412 8.604 3.515 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.530 9.444 1.951 1.00 0.00 H new ATOM 364 N LYS A 25 -8.958 11.702 2.455 1.00 0.00 N ATOM 365 CA LYS A 25 -10.327 12.137 2.601 1.00 0.00 C ATOM 366 C LYS A 25 -11.184 11.764 1.392 1.00 0.00 C ATOM 367 O LYS A 25 -12.261 11.189 1.550 1.00 0.00 O ATOM 368 CB LYS A 25 -10.348 13.638 2.776 1.00 0.00 C ATOM 369 CG LYS A 25 -11.710 14.230 2.761 1.00 0.00 C ATOM 370 CD LYS A 25 -11.639 15.712 2.727 1.00 0.00 C ATOM 371 CE LYS A 25 -13.016 16.257 2.472 1.00 0.00 C ATOM 372 NZ LYS A 25 -13.031 17.733 2.337 1.00 0.00 N ATOM 0 H LYS A 25 -8.295 12.477 2.443 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.746 11.634 3.473 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.864 13.890 3.720 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.756 14.094 1.982 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.260 13.868 1.892 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.261 13.908 3.644 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.251 16.093 3.672 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.953 16.039 1.946 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -13.417 15.809 1.563 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.675 15.964 3.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.004 18.056 2.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.675 18.165 3.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.425 18.015 1.540 1.00 0.00 H new ATOM 386 N GLU A 26 -10.725 12.112 0.186 1.00 0.00 N ATOM 387 CA GLU A 26 -11.482 11.848 -1.023 1.00 0.00 C ATOM 388 C GLU A 26 -11.618 10.345 -1.241 1.00 0.00 C ATOM 389 O GLU A 26 -12.607 9.887 -1.803 1.00 0.00 O ATOM 390 CB GLU A 26 -10.862 12.526 -2.258 1.00 0.00 C ATOM 391 CG GLU A 26 -11.768 12.511 -3.484 1.00 0.00 C ATOM 392 CD GLU A 26 -11.181 13.217 -4.679 1.00 0.00 C ATOM 393 OE1 GLU A 26 -11.075 14.456 -4.662 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.829 12.554 -5.671 1.00 0.00 O ATOM 0 H GLU A 26 -9.831 12.577 0.030 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.474 12.279 -0.890 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.618 13.559 -2.010 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.925 12.027 -2.504 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.983 11.477 -3.753 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -12.719 12.978 -3.228 1.00 0.00 H new ATOM 401 N LEU A 27 -10.638 9.566 -0.785 1.00 0.00 N ATOM 402 CA LEU A 27 -10.762 8.122 -0.913 1.00 0.00 C ATOM 403 C LEU A 27 -11.893 7.618 -0.033 1.00 0.00 C ATOM 404 O LEU A 27 -12.663 6.774 -0.438 1.00 0.00 O ATOM 405 CB LEU A 27 -9.448 7.348 -0.649 1.00 0.00 C ATOM 406 CG LEU A 27 -9.489 5.838 -0.952 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.042 5.575 -2.331 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.105 5.247 -0.827 1.00 0.00 C ATOM 0 H LEU A 27 -9.782 9.897 -0.340 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.999 7.922 -1.958 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.656 7.798 -1.248 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.173 7.483 0.397 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.149 5.364 -0.226 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.059 4.501 -2.517 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.055 5.971 -2.398 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.412 6.062 -3.075 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.144 4.179 -1.043 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.435 5.736 -1.535 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.735 5.399 0.187 1.00 0.00 H new ATOM 420 N LYS A 28 -12.024 8.204 1.164 1.00 0.00 N ATOM 421 CA LYS A 28 -13.116 7.860 2.084 1.00 0.00 C ATOM 422 C LYS A 28 -14.438 8.384 1.525 1.00 0.00 C ATOM 423 O LYS A 28 -15.505 7.793 1.722 1.00 0.00 O ATOM 424 CB LYS A 28 -12.875 8.465 3.468 1.00 0.00 C ATOM 425 CG LYS A 28 -13.934 8.051 4.477 1.00 0.00 C ATOM 426 CD LYS A 28 -13.725 8.661 5.847 1.00 0.00 C ATOM 427 CE LYS A 28 -14.819 8.182 6.774 1.00 0.00 C ATOM 428 NZ LYS A 28 -14.665 8.666 8.159 1.00 0.00 N ATOM 0 H LYS A 28 -11.388 8.918 1.518 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.156 6.775 2.181 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.894 8.158 3.829 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.859 9.552 3.388 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.916 8.342 4.103 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.936 6.965 4.567 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.749 8.378 6.240 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -13.738 9.749 5.780 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.783 8.511 6.387 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.832 7.092 6.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -15.446 8.303 8.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.759 8.331 8.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -14.681 9.706 8.167 1.00 0.00 H new ATOM 442 N THR A 29 -14.354 9.486 0.843 1.00 0.00 N ATOM 443 CA THR A 29 -15.486 10.094 0.235 1.00 0.00 C ATOM 444 C THR A 29 -16.010 9.172 -0.872 1.00 0.00 C ATOM 445 O THR A 29 -17.190 8.832 -0.904 1.00 0.00 O ATOM 446 CB THR A 29 -15.124 11.479 -0.337 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.538 12.283 0.709 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.354 12.186 -0.858 1.00 0.00 C ATOM 0 H THR A 29 -13.481 9.992 0.694 1.00 0.00 H new ATOM 0 HA THR A 29 -16.263 10.241 0.985 1.00 0.00 H new ATOM 0 HB THR A 29 -14.421 11.341 -1.158 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.657 11.923 0.944 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.072 13.161 -1.256 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.809 11.589 -1.648 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.069 12.319 -0.046 1.00 0.00 H new ATOM 456 N ALA A 30 -15.120 8.747 -1.779 1.00 0.00 N ATOM 457 CA ALA A 30 -15.429 7.813 -2.794 1.00 0.00 C ATOM 458 C ALA A 30 -15.910 6.523 -2.201 1.00 0.00 C ATOM 459 O ALA A 30 -16.851 5.996 -2.637 1.00 0.00 O ATOM 460 CB ALA A 30 -14.227 7.574 -3.663 1.00 0.00 C ATOM 0 H ALA A 30 -14.152 9.069 -1.802 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.230 8.225 -3.408 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.478 6.853 -4.441 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.919 8.512 -4.124 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.411 7.183 -3.056 1.00 0.00 H new ATOM 466 N ALA A 31 -15.276 6.075 -1.162 1.00 0.00 N ATOM 467 CA ALA A 31 -15.664 4.873 -0.447 1.00 0.00 C ATOM 468 C ALA A 31 -17.128 4.911 0.025 1.00 0.00 C ATOM 469 O ALA A 31 -17.820 3.911 -0.019 1.00 0.00 O ATOM 470 CB ALA A 31 -14.782 4.721 0.741 1.00 0.00 C ATOM 0 H ALA A 31 -14.455 6.536 -0.770 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.562 4.032 -1.133 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.062 3.821 1.289 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.745 4.640 0.416 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.892 5.590 1.390 1.00 0.00 H new ATOM 476 N SER A 32 -17.582 6.044 0.476 1.00 0.00 N ATOM 477 CA SER A 32 -18.933 6.154 0.959 1.00 0.00 C ATOM 478 C SER A 32 -19.942 6.409 -0.158 1.00 0.00 C ATOM 479 O SER A 32 -21.005 5.787 -0.203 1.00 0.00 O ATOM 480 CB SER A 32 -18.999 7.209 2.063 1.00 0.00 C ATOM 481 OG SER A 32 -18.192 8.331 1.734 1.00 0.00 O ATOM 0 H SER A 32 -17.039 6.906 0.521 1.00 0.00 H new ATOM 0 HA SER A 32 -19.222 5.193 1.384 1.00 0.00 H new ATOM 0 HB2 SER A 32 -20.031 7.527 2.208 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.663 6.777 3.006 1.00 0.00 H new ATOM 0 HG SER A 32 -17.249 8.112 1.888 1.00 0.00 H new ATOM 487 N GLN A 33 -19.612 7.314 -1.074 1.00 0.00 N ATOM 488 CA GLN A 33 -20.505 7.727 -2.159 1.00 0.00 C ATOM 489 C GLN A 33 -20.498 6.719 -3.325 1.00 0.00 C ATOM 490 O GLN A 33 -21.547 6.321 -3.843 1.00 0.00 O ATOM 491 CB GLN A 33 -20.010 9.068 -2.697 1.00 0.00 C ATOM 492 CG GLN A 33 -19.955 10.212 -1.715 1.00 0.00 C ATOM 493 CD GLN A 33 -21.257 10.883 -1.597 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.081 10.536 -0.754 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.467 11.844 -2.443 1.00 0.00 N ATOM 0 H GLN A 33 -18.709 7.788 -1.087 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.518 7.790 -1.762 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.010 8.923 -3.107 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.654 9.361 -3.526 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.646 9.840 -0.738 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.201 10.932 -2.035 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.748 12.091 -3.123 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.351 12.352 -2.428 1.00 0.00 H new ATOM 504 N TYR A 34 -19.312 6.343 -3.714 1.00 0.00 N ATOM 505 CA TYR A 34 -19.023 5.506 -4.875 1.00 0.00 C ATOM 506 C TYR A 34 -18.854 4.056 -4.434 1.00 0.00 C ATOM 507 O TYR A 34 -19.352 3.138 -5.065 1.00 0.00 O ATOM 508 CB TYR A 34 -17.729 6.062 -5.554 1.00 0.00 C ATOM 509 CG TYR A 34 -17.877 7.442 -6.219 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.911 8.594 -5.454 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.977 7.589 -7.600 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.047 9.845 -6.017 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.109 8.847 -8.181 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.147 9.969 -7.382 1.00 0.00 C ATOM 515 OH TYR A 34 -18.293 11.217 -7.946 1.00 0.00 O ATOM 0 H TYR A 34 -18.468 6.620 -3.213 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.842 5.530 -5.594 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.941 6.121 -4.803 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.398 5.347 -6.308 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.828 8.511 -4.380 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.952 6.713 -8.231 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -18.075 10.723 -5.389 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.181 8.943 -9.254 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.348 11.131 -8.921 1.00 0.00 H new ATOM 525 N GLY A 35 -18.230 3.877 -3.301 1.00 0.00 N ATOM 526 CA GLY A 35 -17.946 2.575 -2.805 1.00 0.00 C ATOM 527 C GLY A 35 -16.757 1.993 -3.482 1.00 0.00 C ATOM 528 O GLY A 35 -16.178 2.596 -4.368 1.00 0.00 O ATOM 0 H GLY A 35 -17.907 4.637 -2.702 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.770 2.622 -1.730 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.809 1.927 -2.959 1.00 0.00 H new ATOM 532 N ALA A 36 -16.390 0.851 -3.089 1.00 0.00 N ATOM 533 CA ALA A 36 -15.311 0.177 -3.715 1.00 0.00 C ATOM 534 C ALA A 36 -15.841 -0.567 -4.871 1.00 0.00 C ATOM 535 O ALA A 36 -17.036 -0.700 -5.012 1.00 0.00 O ATOM 536 CB ALA A 36 -14.543 -0.682 -2.797 1.00 0.00 C ATOM 0 H ALA A 36 -16.823 0.341 -2.319 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.586 0.918 -4.053 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.734 -1.166 -3.343 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -14.126 -0.075 -1.994 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -15.200 -1.442 -2.374 1.00 0.00 H new ATOM 542 N THR A 37 -14.978 -0.907 -5.754 1.00 0.00 N ATOM 543 CA THR A 37 -15.292 -1.503 -7.026 1.00 0.00 C ATOM 544 C THR A 37 -15.791 -0.482 -8.053 1.00 0.00 C ATOM 545 O THR A 37 -15.671 -0.731 -9.248 1.00 0.00 O ATOM 546 CB THR A 37 -16.075 -2.876 -7.010 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.339 -2.814 -6.377 1.00 0.00 O ATOM 548 CG2 THR A 37 -15.250 -3.972 -6.375 1.00 0.00 C ATOM 0 H THR A 37 -13.976 -0.776 -5.615 1.00 0.00 H new ATOM 0 HA THR A 37 -14.321 -1.844 -7.386 1.00 0.00 H new ATOM 0 HB THR A 37 -16.256 -3.106 -8.060 1.00 0.00 H new ATOM 0 HG1 THR A 37 -17.490 -1.908 -6.035 1.00 0.00 H new ATOM 0 HG21 THR A 37 -15.817 -4.903 -6.379 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.327 -4.106 -6.939 1.00 0.00 H new ATOM 0 HG23 THR A 37 -15.010 -3.698 -5.348 1.00 0.00 H new ATOM 556 N ALA A 38 -16.291 0.688 -7.600 1.00 0.00 N ATOM 557 CA ALA A 38 -16.585 1.763 -8.513 1.00 0.00 C ATOM 558 C ALA A 38 -15.250 2.320 -8.979 1.00 0.00 C ATOM 559 O ALA A 38 -14.381 2.600 -8.143 1.00 0.00 O ATOM 560 CB ALA A 38 -17.419 2.838 -7.825 1.00 0.00 C ATOM 0 H ALA A 38 -16.490 0.890 -6.620 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.169 1.408 -9.362 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.631 3.641 -8.531 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.356 2.404 -7.477 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.867 3.238 -6.975 1.00 0.00 H new ATOM 566 N PRO A 39 -15.051 2.473 -10.315 1.00 0.00 N ATOM 567 CA PRO A 39 -13.748 2.833 -10.926 1.00 0.00 C ATOM 568 C PRO A 39 -13.056 4.039 -10.315 1.00 0.00 C ATOM 569 O PRO A 39 -11.830 4.130 -10.345 1.00 0.00 O ATOM 570 CB PRO A 39 -14.066 3.082 -12.401 1.00 0.00 C ATOM 571 CG PRO A 39 -15.557 3.101 -12.509 1.00 0.00 C ATOM 572 CD PRO A 39 -16.088 2.305 -11.348 1.00 0.00 C ATOM 0 HA PRO A 39 -13.035 2.026 -10.756 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.639 4.027 -12.737 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.640 2.299 -13.029 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.933 4.124 -12.481 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.881 2.668 -13.455 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.054 2.681 -11.012 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.228 1.256 -11.610 1.00 0.00 H new ATOM 580 N TYR A 40 -13.823 4.946 -9.780 1.00 0.00 N ATOM 581 CA TYR A 40 -13.309 6.138 -9.144 1.00 0.00 C ATOM 582 C TYR A 40 -12.422 5.768 -7.938 1.00 0.00 C ATOM 583 O TYR A 40 -11.205 6.004 -7.939 1.00 0.00 O ATOM 584 CB TYR A 40 -14.491 6.986 -8.673 1.00 0.00 C ATOM 585 CG TYR A 40 -14.126 8.381 -8.252 1.00 0.00 C ATOM 586 CD1 TYR A 40 -14.037 9.383 -9.186 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.858 8.692 -6.921 1.00 0.00 C ATOM 588 CE1 TYR A 40 -13.688 10.659 -8.817 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.511 9.965 -6.535 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.424 10.948 -7.491 1.00 0.00 C ATOM 591 OH TYR A 40 -13.072 12.232 -7.130 1.00 0.00 O ATOM 0 H TYR A 40 -14.841 4.882 -9.770 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.702 6.697 -9.857 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.225 7.043 -9.477 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.974 6.482 -7.836 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.244 9.165 -10.223 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.924 7.914 -6.174 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -13.620 11.437 -9.563 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.310 10.189 -5.498 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.128 12.251 -6.867 1.00 0.00 H new ATOM 601 N THR A 41 -13.051 5.162 -6.956 1.00 0.00 N ATOM 602 CA THR A 41 -12.479 4.795 -5.692 1.00 0.00 C ATOM 603 C THR A 41 -11.203 3.958 -5.841 1.00 0.00 C ATOM 604 O THR A 41 -10.183 4.293 -5.254 1.00 0.00 O ATOM 605 CB THR A 41 -13.546 4.024 -4.929 1.00 0.00 C ATOM 606 OG1 THR A 41 -14.794 4.687 -5.142 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.250 3.982 -3.442 1.00 0.00 C ATOM 0 H THR A 41 -14.034 4.899 -7.029 1.00 0.00 H new ATOM 0 HA THR A 41 -12.177 5.694 -5.155 1.00 0.00 H new ATOM 0 HB THR A 41 -13.571 2.995 -5.289 1.00 0.00 H new ATOM 0 HG1 THR A 41 -15.518 4.027 -5.148 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.034 3.423 -2.931 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.289 3.495 -3.276 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.214 4.998 -3.049 1.00 0.00 H new ATOM 615 N LEU A 42 -11.223 2.914 -6.648 1.00 0.00 N ATOM 616 CA LEU A 42 -10.005 2.113 -6.762 1.00 0.00 C ATOM 617 C LEU A 42 -8.895 2.768 -7.542 1.00 0.00 C ATOM 618 O LEU A 42 -7.739 2.459 -7.311 1.00 0.00 O ATOM 619 CB LEU A 42 -10.157 0.611 -7.082 1.00 0.00 C ATOM 620 CG LEU A 42 -11.104 0.148 -8.191 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.507 0.232 -7.708 1.00 0.00 C ATOM 622 CD2 LEU A 42 -10.923 0.926 -9.488 1.00 0.00 C ATOM 0 H LEU A 42 -12.018 2.607 -7.209 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.691 2.098 -5.718 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.165 0.232 -7.326 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.470 0.116 -6.163 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.858 -0.887 -8.427 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.184 -0.097 -8.497 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.630 -0.408 -6.834 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.738 1.263 -7.439 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.622 0.553 -10.237 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.115 1.984 -9.308 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.902 0.799 -9.849 1.00 0.00 H new ATOM 634 N ALA A 43 -9.251 3.707 -8.427 1.00 0.00 N ATOM 635 CA ALA A 43 -8.247 4.478 -9.164 1.00 0.00 C ATOM 636 C ALA A 43 -7.419 5.244 -8.167 1.00 0.00 C ATOM 637 O ALA A 43 -6.200 5.340 -8.271 1.00 0.00 O ATOM 638 CB ALA A 43 -8.892 5.452 -10.154 1.00 0.00 C ATOM 0 H ALA A 43 -10.217 3.948 -8.648 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.628 3.790 -9.741 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.114 6.005 -10.680 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.492 4.895 -10.874 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.530 6.151 -9.613 1.00 0.00 H new ATOM 644 N ILE A 44 -8.093 5.730 -7.153 1.00 0.00 N ATOM 645 CA ILE A 44 -7.460 6.445 -6.081 1.00 0.00 C ATOM 646 C ILE A 44 -6.604 5.475 -5.240 1.00 0.00 C ATOM 647 O ILE A 44 -5.471 5.787 -4.904 1.00 0.00 O ATOM 648 CB ILE A 44 -8.511 7.100 -5.192 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.401 8.029 -6.016 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.842 7.881 -4.071 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.659 8.436 -5.303 1.00 0.00 C ATOM 0 H ILE A 44 -9.104 5.638 -7.051 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.821 7.219 -6.505 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.130 6.316 -4.755 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.836 8.923 -6.279 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.666 7.533 -6.950 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.605 8.343 -3.444 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.237 7.205 -3.467 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.204 8.655 -4.497 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.244 9.095 -5.945 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.245 7.549 -5.064 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.402 8.960 -4.383 1.00 0.00 H new ATOM 663 N VAL A 45 -7.155 4.282 -4.950 1.00 0.00 N ATOM 664 CA VAL A 45 -6.447 3.227 -4.171 1.00 0.00 C ATOM 665 C VAL A 45 -5.096 2.918 -4.804 1.00 0.00 C ATOM 666 O VAL A 45 -4.043 2.966 -4.138 1.00 0.00 O ATOM 667 CB VAL A 45 -7.262 1.885 -4.073 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.509 0.839 -3.264 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.610 2.111 -3.434 1.00 0.00 C ATOM 0 H VAL A 45 -8.095 4.015 -5.242 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.325 3.627 -3.164 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.398 1.525 -5.093 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.098 -0.077 -3.215 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.552 0.629 -3.742 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.336 1.214 -2.255 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.150 1.166 -3.380 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.474 2.509 -2.428 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.181 2.822 -4.031 1.00 0.00 H new ATOM 679 N GLU A 46 -5.108 2.659 -6.103 1.00 0.00 N ATOM 680 CA GLU A 46 -3.900 2.329 -6.817 1.00 0.00 C ATOM 681 C GLU A 46 -2.976 3.520 -6.959 1.00 0.00 C ATOM 682 O GLU A 46 -1.770 3.332 -7.098 1.00 0.00 O ATOM 683 CB GLU A 46 -4.182 1.639 -8.150 1.00 0.00 C ATOM 684 CG GLU A 46 -5.200 2.342 -9.007 1.00 0.00 C ATOM 685 CD GLU A 46 -5.321 1.721 -10.372 1.00 0.00 C ATOM 686 OE1 GLU A 46 -5.462 0.492 -10.469 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.236 2.457 -11.384 1.00 0.00 O ATOM 0 H GLU A 46 -5.949 2.673 -6.680 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.367 1.600 -6.207 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.249 1.557 -8.708 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.527 0.624 -7.955 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.170 2.316 -8.511 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.923 3.391 -9.110 1.00 0.00 H new ATOM 694 N SER A 47 -3.521 4.742 -6.868 1.00 0.00 N ATOM 695 CA SER A 47 -2.717 5.938 -6.930 1.00 0.00 C ATOM 696 C SER A 47 -2.010 6.169 -5.591 1.00 0.00 C ATOM 697 O SER A 47 -0.862 6.585 -5.550 1.00 0.00 O ATOM 698 CB SER A 47 -3.573 7.161 -7.285 1.00 0.00 C ATOM 699 OG SER A 47 -4.203 6.996 -8.541 1.00 0.00 O ATOM 0 H SER A 47 -4.520 4.912 -6.751 1.00 0.00 H new ATOM 0 HA SER A 47 -1.971 5.802 -7.713 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.328 7.316 -6.514 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.947 8.053 -7.303 1.00 0.00 H new ATOM 0 HG SER A 47 -4.924 6.337 -8.461 1.00 0.00 H new ATOM 705 N VAL A 48 -2.699 5.882 -4.488 1.00 0.00 N ATOM 706 CA VAL A 48 -2.121 6.031 -3.154 1.00 0.00 C ATOM 707 C VAL A 48 -1.073 4.948 -2.925 1.00 0.00 C ATOM 708 O VAL A 48 -0.019 5.213 -2.400 1.00 0.00 O ATOM 709 CB VAL A 48 -3.211 6.006 -2.034 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.621 6.213 -0.645 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.304 7.031 -2.300 1.00 0.00 C ATOM 0 H VAL A 48 -3.661 5.544 -4.492 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.643 7.009 -3.100 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.653 5.010 -2.059 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.419 6.187 0.097 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.903 5.421 -0.433 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.118 7.179 -0.604 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.046 6.987 -1.502 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.867 8.029 -2.334 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.784 6.812 -3.254 1.00 0.00 H new ATOM 721 N ALA A 49 -1.337 3.734 -3.397 1.00 0.00 N ATOM 722 CA ALA A 49 -0.364 2.646 -3.261 1.00 0.00 C ATOM 723 C ALA A 49 0.763 2.806 -4.271 1.00 0.00 C ATOM 724 O ALA A 49 1.672 1.991 -4.319 1.00 0.00 O ATOM 725 CB ALA A 49 -1.021 1.287 -3.423 1.00 0.00 C ATOM 0 H ALA A 49 -2.203 3.477 -3.871 1.00 0.00 H new ATOM 0 HA ALA A 49 0.051 2.702 -2.255 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.270 0.505 -3.316 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.788 1.160 -2.659 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.478 1.219 -4.410 1.00 0.00 H new ATOM 731 N ASP A 50 0.664 3.851 -5.082 1.00 0.00 N ATOM 732 CA ASP A 50 1.656 4.208 -6.106 1.00 0.00 C ATOM 733 C ASP A 50 2.679 5.134 -5.486 1.00 0.00 C ATOM 734 O ASP A 50 3.747 5.436 -6.060 1.00 0.00 O ATOM 735 CB ASP A 50 0.939 4.877 -7.318 1.00 0.00 C ATOM 736 CG ASP A 50 1.836 5.572 -8.297 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.295 4.931 -9.271 1.00 0.00 O ATOM 738 OD2 ASP A 50 2.062 6.801 -8.142 1.00 0.00 O ATOM 0 H ASP A 50 -0.126 4.495 -5.051 1.00 0.00 H new ATOM 0 HA ASP A 50 2.167 3.318 -6.473 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.373 4.112 -7.850 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.218 5.600 -6.937 1.00 0.00 H new ATOM 743 N ASN A 51 2.366 5.545 -4.277 1.00 0.00 N ATOM 744 CA ASN A 51 3.208 6.439 -3.492 1.00 0.00 C ATOM 745 C ASN A 51 4.266 5.659 -2.773 1.00 0.00 C ATOM 746 O ASN A 51 4.233 4.420 -2.741 1.00 0.00 O ATOM 747 CB ASN A 51 2.396 7.168 -2.407 1.00 0.00 C ATOM 748 CG ASN A 51 1.464 8.267 -2.879 1.00 0.00 C ATOM 749 OD1 ASN A 51 1.215 9.210 -2.149 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.937 8.162 -4.053 1.00 0.00 N ATOM 0 H ASN A 51 1.509 5.267 -3.799 1.00 0.00 H new ATOM 0 HA ASN A 51 3.640 7.154 -4.192 1.00 0.00 H new ATOM 0 HB2 ASN A 51 1.804 6.427 -1.869 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.095 7.599 -1.690 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.295 8.879 -4.390 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.163 7.362 -4.644 1.00 0.00 H new ATOM 757 N TRP A 52 5.213 6.362 -2.202 1.00 0.00 N ATOM 758 CA TRP A 52 6.141 5.733 -1.307 1.00 0.00 C ATOM 759 C TRP A 52 5.543 5.851 0.085 1.00 0.00 C ATOM 760 O TRP A 52 5.554 6.927 0.698 1.00 0.00 O ATOM 761 CB TRP A 52 7.547 6.358 -1.385 1.00 0.00 C ATOM 762 CG TRP A 52 8.171 6.268 -2.755 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.503 5.133 -3.431 1.00 0.00 C ATOM 764 CD2 TRP A 52 8.545 7.362 -3.605 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.052 5.447 -4.656 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.088 6.815 -4.782 1.00 0.00 C ATOM 767 CE3 TRP A 52 8.472 8.759 -3.483 1.00 0.00 C ATOM 768 CZ2 TRP A 52 9.554 7.617 -5.828 1.00 0.00 C ATOM 769 CZ3 TRP A 52 8.925 9.537 -4.514 1.00 0.00 C ATOM 770 CH2 TRP A 52 9.461 8.971 -5.672 1.00 0.00 C ATOM 0 H TRP A 52 5.358 7.362 -2.342 1.00 0.00 H new ATOM 0 HA TRP A 52 6.286 4.688 -1.581 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.487 7.406 -1.090 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.197 5.861 -0.665 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.357 4.129 -3.060 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.377 4.776 -5.352 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.065 9.212 -2.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 9.971 7.183 -6.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.866 10.612 -4.430 1.00 0.00 H new ATOM 0 HH2 TRP A 52 9.810 9.618 -6.463 1.00 0.00 H new ATOM 781 N LEU A 53 4.914 4.776 0.526 1.00 0.00 N ATOM 782 CA LEU A 53 4.223 4.742 1.790 1.00 0.00 C ATOM 783 C LEU A 53 4.545 3.456 2.538 1.00 0.00 C ATOM 784 O LEU A 53 4.838 2.423 1.935 1.00 0.00 O ATOM 785 CB LEU A 53 2.686 4.963 1.614 1.00 0.00 C ATOM 786 CG LEU A 53 1.822 3.867 0.962 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.380 4.360 0.836 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.344 3.430 -0.414 1.00 0.00 C ATOM 0 H LEU A 53 4.872 3.898 0.008 1.00 0.00 H new ATOM 0 HA LEU A 53 4.580 5.573 2.399 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.271 5.158 2.603 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.554 5.872 1.028 1.00 0.00 H new ATOM 0 HG LEU A 53 1.871 2.992 1.610 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.231 3.584 0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.013 4.591 1.826 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.355 5.257 0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.693 2.656 -0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.355 4.287 -1.088 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.355 3.036 -0.311 1.00 0.00 H new ATOM 800 N THR A 54 4.494 3.528 3.835 1.00 0.00 N ATOM 801 CA THR A 54 4.898 2.438 4.686 1.00 0.00 C ATOM 802 C THR A 54 3.730 1.481 4.932 1.00 0.00 C ATOM 803 O THR A 54 2.564 1.884 4.818 1.00 0.00 O ATOM 804 CB THR A 54 5.375 3.009 6.043 1.00 0.00 C ATOM 805 OG1 THR A 54 4.289 3.705 6.674 1.00 0.00 O ATOM 806 CG2 THR A 54 6.518 3.985 5.834 1.00 0.00 C ATOM 0 H THR A 54 4.168 4.351 4.341 1.00 0.00 H new ATOM 0 HA THR A 54 5.704 1.890 4.197 1.00 0.00 H new ATOM 0 HB THR A 54 5.714 2.183 6.669 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.588 4.066 7.535 1.00 0.00 H new ATOM 0 HG21 THR A 54 6.842 4.378 6.798 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.351 3.472 5.353 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.183 4.807 5.201 1.00 0.00 H new ATOM 814 N PRO A 55 4.017 0.191 5.263 1.00 0.00 N ATOM 815 CA PRO A 55 2.972 -0.793 5.628 1.00 0.00 C ATOM 816 C PRO A 55 2.160 -0.336 6.849 1.00 0.00 C ATOM 817 O PRO A 55 0.984 -0.672 7.001 1.00 0.00 O ATOM 818 CB PRO A 55 3.755 -2.076 5.955 1.00 0.00 C ATOM 819 CG PRO A 55 5.182 -1.653 6.106 1.00 0.00 C ATOM 820 CD PRO A 55 5.359 -0.425 5.253 1.00 0.00 C ATOM 0 HA PRO A 55 2.248 -0.928 4.825 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.385 -2.538 6.870 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.647 -2.814 5.160 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.414 -1.437 7.149 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.857 -2.447 5.787 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.113 0.246 5.665 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.677 -0.680 4.242 1.00 0.00 H new ATOM 828 N THR A 56 2.793 0.465 7.679 1.00 0.00 N ATOM 829 CA THR A 56 2.173 1.020 8.855 1.00 0.00 C ATOM 830 C THR A 56 1.137 2.089 8.436 1.00 0.00 C ATOM 831 O THR A 56 -0.015 2.147 8.956 1.00 0.00 O ATOM 832 CB THR A 56 3.263 1.673 9.718 1.00 0.00 C ATOM 833 OG1 THR A 56 4.375 0.771 9.780 1.00 0.00 O ATOM 834 CG2 THR A 56 2.763 1.952 11.134 1.00 0.00 C ATOM 0 H THR A 56 3.764 0.750 7.551 1.00 0.00 H new ATOM 0 HA THR A 56 1.668 0.235 9.419 1.00 0.00 H new ATOM 0 HB THR A 56 3.548 2.626 9.272 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.087 1.166 10.325 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.560 2.414 11.717 1.00 0.00 H new ATOM 0 HG22 THR A 56 1.907 2.626 11.092 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.465 1.016 11.606 1.00 0.00 H new ATOM 842 N ASP A 57 1.529 2.919 7.470 1.00 0.00 N ATOM 843 CA ASP A 57 0.646 3.954 6.999 1.00 0.00 C ATOM 844 C ASP A 57 -0.467 3.320 6.180 1.00 0.00 C ATOM 845 O ASP A 57 -1.579 3.789 6.173 1.00 0.00 O ATOM 846 CB ASP A 57 1.388 5.017 6.203 1.00 0.00 C ATOM 847 CG ASP A 57 0.637 6.325 6.207 1.00 0.00 C ATOM 848 OD1 ASP A 57 -0.218 6.535 5.361 1.00 0.00 O ATOM 849 OD2 ASP A 57 0.901 7.166 7.115 1.00 0.00 O ATOM 0 H ASP A 57 2.440 2.887 7.012 1.00 0.00 H new ATOM 0 HA ASP A 57 0.214 4.466 7.859 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.382 5.164 6.626 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.525 4.677 5.177 1.00 0.00 H new ATOM 854 N TRP A 58 -0.144 2.185 5.539 1.00 0.00 N ATOM 855 CA TRP A 58 -1.130 1.337 4.847 1.00 0.00 C ATOM 856 C TRP A 58 -2.278 0.978 5.787 1.00 0.00 C ATOM 857 O TRP A 58 -3.443 1.239 5.486 1.00 0.00 O ATOM 858 CB TRP A 58 -0.488 0.027 4.365 1.00 0.00 C ATOM 859 CG TRP A 58 0.194 0.060 3.036 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.248 1.092 2.151 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.885 -1.034 2.417 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.929 0.701 1.024 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.331 -0.590 1.168 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.180 -2.352 2.806 1.00 0.00 C ATOM 865 CZ2 TRP A 58 2.040 -1.407 0.292 1.00 0.00 C ATOM 866 CZ3 TRP A 58 1.884 -3.162 1.934 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.305 -2.690 0.698 1.00 0.00 C ATOM 0 H TRP A 58 0.810 1.828 5.486 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.501 1.904 3.993 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.239 -0.290 5.112 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.263 -0.738 4.330 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.180 2.071 2.311 1.00 0.00 H new ATOM 0 HE1 TRP A 58 1.105 1.287 0.208 1.00 0.00 H new ATOM 0 HE3 TRP A 58 0.863 -2.725 3.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.369 -1.044 -0.671 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.110 -4.179 2.219 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.854 -3.348 0.041 1.00 0.00 H new ATOM 878 N ASN A 59 -1.940 0.378 6.920 1.00 0.00 N ATOM 879 CA ASN A 59 -2.925 0.011 7.958 1.00 0.00 C ATOM 880 C ASN A 59 -3.819 1.221 8.298 1.00 0.00 C ATOM 881 O ASN A 59 -5.053 1.122 8.307 1.00 0.00 O ATOM 882 CB ASN A 59 -2.178 -0.497 9.218 1.00 0.00 C ATOM 883 CG ASN A 59 -3.072 -0.946 10.386 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.694 -0.783 11.538 1.00 0.00 O ATOM 885 ND2 ASN A 59 -4.204 -1.578 10.113 1.00 0.00 N ATOM 0 H ASN A 59 -0.980 0.127 7.156 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.568 -0.786 7.585 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.542 -1.334 8.929 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.520 0.296 9.572 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.781 -1.941 10.872 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -4.498 -1.702 9.144 1.00 0.00 H new ATOM 892 N THR A 60 -3.167 2.358 8.411 1.00 0.00 N ATOM 893 CA THR A 60 -3.851 3.588 8.740 1.00 0.00 C ATOM 894 C THR A 60 -4.804 4.016 7.585 1.00 0.00 C ATOM 895 O THR A 60 -5.978 4.403 7.826 1.00 0.00 O ATOM 896 CB THR A 60 -2.802 4.677 9.033 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.893 4.144 10.025 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.442 5.963 9.578 1.00 0.00 C ATOM 0 H THR A 60 -2.160 2.455 8.279 1.00 0.00 H new ATOM 0 HA THR A 60 -4.468 3.439 9.626 1.00 0.00 H new ATOM 0 HB THR A 60 -2.290 4.937 8.106 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.229 3.573 9.586 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.665 6.703 9.770 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.146 6.358 8.845 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.970 5.742 10.506 1.00 0.00 H new ATOM 906 N LEU A 61 -4.318 3.862 6.367 1.00 0.00 N ATOM 907 CA LEU A 61 -5.013 4.235 5.151 1.00 0.00 C ATOM 908 C LEU A 61 -6.299 3.446 4.997 1.00 0.00 C ATOM 909 O LEU A 61 -7.376 4.046 4.968 1.00 0.00 O ATOM 910 CB LEU A 61 -4.052 4.049 3.928 1.00 0.00 C ATOM 911 CG LEU A 61 -4.473 4.601 2.523 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.574 3.787 1.837 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.885 6.043 2.641 1.00 0.00 C ATOM 0 H LEU A 61 -3.397 3.460 6.192 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.300 5.285 5.202 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.100 4.511 4.188 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.868 2.980 3.817 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.595 4.510 1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.808 4.234 0.871 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.231 2.763 1.690 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.467 3.784 2.462 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.176 6.420 1.660 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.728 6.126 3.327 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.049 6.630 3.022 1.00 0.00 H new ATOM 925 N VAL A 62 -6.195 2.116 4.958 1.00 0.00 N ATOM 926 CA VAL A 62 -7.368 1.256 4.733 1.00 0.00 C ATOM 927 C VAL A 62 -8.457 1.492 5.772 1.00 0.00 C ATOM 928 O VAL A 62 -9.626 1.712 5.431 1.00 0.00 O ATOM 929 CB VAL A 62 -7.008 -0.288 4.654 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.315 -0.806 5.902 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.240 -1.120 4.383 1.00 0.00 C ATOM 0 H VAL A 62 -5.318 1.610 5.078 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.753 1.547 3.755 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.307 -0.385 3.825 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.097 -1.867 5.783 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.385 -0.259 6.055 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.966 -0.664 6.765 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.964 -2.173 4.334 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.963 -0.971 5.185 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.683 -0.816 3.434 1.00 0.00 H new ATOM 941 N ARG A 63 -8.053 1.532 7.020 1.00 0.00 N ATOM 942 CA ARG A 63 -9.025 1.685 8.115 1.00 0.00 C ATOM 943 C ARG A 63 -9.691 3.080 8.168 1.00 0.00 C ATOM 944 O ARG A 63 -10.744 3.247 8.794 1.00 0.00 O ATOM 945 CB ARG A 63 -8.434 1.306 9.461 1.00 0.00 C ATOM 946 CG ARG A 63 -7.314 2.195 9.902 1.00 0.00 C ATOM 947 CD ARG A 63 -6.712 1.683 11.175 1.00 0.00 C ATOM 948 NE ARG A 63 -5.566 2.492 11.597 1.00 0.00 N ATOM 949 CZ ARG A 63 -4.540 2.048 12.356 1.00 0.00 C ATOM 950 NH1 ARG A 63 -4.637 0.896 13.006 1.00 0.00 N ATOM 951 NH2 ARG A 63 -3.442 2.787 12.490 1.00 0.00 N ATOM 0 H ARG A 63 -7.079 1.463 7.315 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.823 0.978 7.887 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -9.222 1.331 10.213 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -8.072 0.279 9.412 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.551 2.243 9.125 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.683 3.210 10.049 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.467 1.684 11.961 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.396 0.649 11.038 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.541 3.466 11.295 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.489 0.340 12.934 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.859 0.566 13.577 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.374 3.690 12.020 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.668 2.451 13.063 1.00 0.00 H new ATOM 965 N ALA A 64 -9.063 4.079 7.560 1.00 0.00 N ATOM 966 CA ALA A 64 -9.646 5.414 7.531 1.00 0.00 C ATOM 967 C ALA A 64 -10.550 5.565 6.315 1.00 0.00 C ATOM 968 O ALA A 64 -11.668 6.093 6.391 1.00 0.00 O ATOM 969 CB ALA A 64 -8.556 6.482 7.487 1.00 0.00 C ATOM 0 H ALA A 64 -8.163 3.993 7.087 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.232 5.546 8.440 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.015 7.470 7.466 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.925 6.394 8.371 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.948 6.345 6.592 1.00 0.00 H new ATOM 975 N VAL A 65 -10.036 5.113 5.239 1.00 0.00 N ATOM 976 CA VAL A 65 -10.761 5.254 3.989 1.00 0.00 C ATOM 977 C VAL A 65 -12.037 4.407 3.900 1.00 0.00 C ATOM 978 O VAL A 65 -13.094 4.917 3.506 1.00 0.00 O ATOM 979 CB VAL A 65 -9.888 5.170 2.723 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.817 6.239 2.779 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.274 3.806 2.531 1.00 0.00 C ATOM 0 H VAL A 65 -9.132 4.645 5.172 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.105 6.288 4.017 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.533 5.340 1.861 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.198 6.181 1.884 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.286 7.221 2.833 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.195 6.085 3.661 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.669 3.804 1.624 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.644 3.567 3.388 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.064 3.061 2.442 1.00 0.00 H new ATOM 991 N LEU A 66 -11.992 3.171 4.329 1.00 0.00 N ATOM 992 CA LEU A 66 -13.176 2.318 4.269 1.00 0.00 C ATOM 993 C LEU A 66 -13.569 1.889 5.678 1.00 0.00 C ATOM 994 O LEU A 66 -12.902 2.241 6.652 1.00 0.00 O ATOM 995 CB LEU A 66 -12.976 1.076 3.354 1.00 0.00 C ATOM 996 CG LEU A 66 -13.267 1.183 1.830 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.748 1.394 1.545 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.455 2.267 1.207 1.00 0.00 C ATOM 0 H LEU A 66 -11.162 2.726 4.722 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.980 2.903 3.824 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.941 0.754 3.465 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.603 0.277 3.749 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.980 0.232 1.382 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.905 1.463 0.469 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.318 0.554 1.942 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -15.082 2.316 2.020 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.677 2.321 0.141 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.698 3.220 1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.395 2.054 1.346 1.00 0.00 H new ATOM 1010 N SER A 67 -14.654 1.196 5.773 1.00 0.00 N ATOM 1011 CA SER A 67 -15.115 0.734 7.054 1.00 0.00 C ATOM 1012 C SER A 67 -15.860 -0.603 6.936 1.00 0.00 C ATOM 1013 O SER A 67 -16.862 -0.718 6.218 1.00 0.00 O ATOM 1014 CB SER A 67 -15.995 1.815 7.703 1.00 0.00 C ATOM 1015 OG SER A 67 -16.965 2.306 6.779 1.00 0.00 O ATOM 0 H SER A 67 -15.243 0.933 4.983 1.00 0.00 H new ATOM 0 HA SER A 67 -14.251 0.554 7.694 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.497 1.403 8.579 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.370 2.637 8.051 1.00 0.00 H new ATOM 0 HG SER A 67 -17.288 1.568 6.221 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.302 -1.624 7.533 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.971 -2.887 7.647 1.00 0.00 C ATOM 1023 C GLY A 68 -15.696 -3.808 6.493 1.00 0.00 C ATOM 1024 O GLY A 68 -15.112 -4.881 6.672 1.00 0.00 O ATOM 0 H GLY A 68 -14.372 -1.600 7.952 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.662 -3.372 8.573 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.045 -2.717 7.720 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.094 -3.394 5.314 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.944 -4.238 4.144 1.00 0.00 C ATOM 1030 C GLY A 69 -14.501 -4.371 3.695 1.00 0.00 C ATOM 1031 O GLY A 69 -14.090 -5.438 3.189 1.00 0.00 O ATOM 0 H GLY A 69 -16.522 -2.485 5.136 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.344 -5.228 4.362 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.537 -3.827 3.327 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.723 -3.282 3.896 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.306 -3.168 3.490 1.00 0.00 C ATOM 1037 C ASP A 70 -11.548 -4.366 3.902 1.00 0.00 C ATOM 1038 O ASP A 70 -10.851 -5.000 3.104 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.673 -1.911 4.117 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.778 -1.849 5.650 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.898 -1.655 6.171 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.772 -2.085 6.337 1.00 0.00 O ATOM 0 H ASP A 70 -14.072 -2.441 4.355 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.267 -3.086 2.404 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.621 -1.868 3.834 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.153 -1.028 3.695 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.792 -4.706 5.115 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.206 -5.791 5.783 1.00 0.00 C ATOM 1049 C HIS A 71 -11.333 -7.065 4.985 1.00 0.00 C ATOM 1050 O HIS A 71 -10.326 -7.657 4.553 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.880 -5.945 7.140 1.00 0.00 C ATOM 1052 CG HIS A 71 -11.515 -4.876 8.125 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.334 -4.868 8.838 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -12.166 -3.748 8.496 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.279 -3.788 9.589 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -11.378 -3.092 9.397 1.00 0.00 N ATOM 0 H HIS A 71 -12.452 -4.193 5.700 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.141 -5.597 5.912 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -12.961 -5.942 7.000 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.615 -6.916 7.558 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -13.134 -3.426 8.143 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.469 -3.519 10.251 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -11.605 -2.206 9.848 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.559 -7.436 4.718 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.845 -8.672 4.051 1.00 0.00 C ATOM 1067 C LEU A 72 -12.193 -8.782 2.652 1.00 0.00 C ATOM 1068 O LEU A 72 -11.384 -9.657 2.435 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.372 -9.078 4.126 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.461 -8.093 3.626 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.649 -8.143 2.107 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.787 -8.352 4.346 1.00 0.00 C ATOM 0 H LEU A 72 -13.384 -6.887 4.958 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.342 -9.452 4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.489 -10.004 3.563 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.596 -9.307 5.168 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.116 -7.087 3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.423 -7.434 1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.712 -7.882 1.616 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.947 -9.149 1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.540 -7.653 3.984 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.115 -9.373 4.149 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.651 -8.215 5.419 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.459 -7.879 1.748 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.848 -8.047 0.425 1.00 0.00 C ATOM 1086 C LEU A 73 -10.499 -7.434 0.264 1.00 0.00 C ATOM 1087 O LEU A 73 -9.563 -8.156 -0.038 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.793 -7.847 -0.743 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.745 -9.042 -0.971 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -14.828 -8.722 -1.964 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -12.967 -10.273 -1.434 1.00 0.00 C ATOM 0 H LEU A 73 -13.055 -7.061 1.872 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.629 -9.114 0.387 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.385 -6.948 -0.573 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.210 -7.678 -1.648 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.221 -9.254 -0.013 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -15.473 -9.592 -2.092 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -15.420 -7.882 -1.599 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.378 -8.460 -2.921 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.657 -11.103 -1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.454 -10.049 -2.369 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.234 -10.547 -0.675 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.359 -6.123 0.496 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.069 -5.471 0.412 1.00 0.00 C ATOM 1105 C TRP A 74 -8.019 -6.233 1.278 1.00 0.00 C ATOM 1106 O TRP A 74 -6.904 -6.526 0.869 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.149 -4.010 0.936 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.851 -2.906 0.111 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.797 -2.970 -0.900 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.549 -1.527 0.251 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.145 -1.693 -1.312 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.384 -0.788 -0.614 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.654 -0.873 1.048 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.344 0.606 -0.681 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.590 0.525 0.996 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.443 1.256 0.136 1.00 0.00 C ATOM 0 H TRP A 74 -11.130 -5.502 0.743 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.772 -5.472 -0.637 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.643 -4.046 1.907 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.126 -3.677 1.110 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.204 -3.883 -1.308 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.848 -1.464 -2.015 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.004 -1.426 1.710 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.994 1.154 -1.347 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.882 1.051 1.619 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.388 2.334 0.119 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.401 -6.544 2.448 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.483 -7.074 3.409 1.00 0.00 C ATOM 1129 C LYS A 75 -7.264 -8.563 3.419 1.00 0.00 C ATOM 1130 O LYS A 75 -6.124 -8.977 3.596 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.594 -6.406 4.747 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.406 -4.907 4.609 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.986 -4.536 4.119 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.967 -4.771 5.239 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.586 -4.302 4.930 1.00 0.00 N ATOM 0 H LYS A 75 -9.359 -6.444 2.784 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.509 -6.778 3.021 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.569 -6.617 5.186 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.844 -6.812 5.426 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.144 -4.513 3.910 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.592 -4.430 5.571 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.725 -5.136 3.247 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.961 -3.492 3.807 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.315 -4.266 6.140 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.933 -5.837 5.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.110 -4.019 5.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.051 -5.071 4.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.632 -3.488 4.284 1.00 0.00 H new ATOM 1149 N SER A 76 -8.303 -9.379 3.231 1.00 0.00 N ATOM 1150 CA SER A 76 -8.056 -10.818 3.170 1.00 0.00 C ATOM 1151 C SER A 76 -7.201 -11.089 1.967 1.00 0.00 C ATOM 1152 O SER A 76 -6.223 -11.837 2.034 1.00 0.00 O ATOM 1153 CB SER A 76 -9.349 -11.643 3.129 1.00 0.00 C ATOM 1154 OG SER A 76 -9.076 -13.042 3.114 1.00 0.00 O ATOM 0 H SER A 76 -9.275 -9.088 3.123 1.00 0.00 H new ATOM 0 HA SER A 76 -7.544 -11.127 4.081 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.964 -11.401 3.996 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.925 -11.374 2.244 1.00 0.00 H new ATOM 0 HG SER A 76 -8.748 -13.302 2.228 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.493 -10.386 0.896 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.715 -10.516 -0.306 1.00 0.00 C ATOM 1162 C GLU A 77 -5.320 -9.949 -0.095 1.00 0.00 C ATOM 1163 O GLU A 77 -4.411 -10.350 -0.777 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.371 -9.812 -1.481 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.666 -10.416 -2.015 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.438 -11.597 -2.917 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.949 -11.384 -4.045 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.809 -12.717 -2.571 1.00 0.00 O ATOM 0 H GLU A 77 -8.263 -9.720 0.837 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.651 -11.579 -0.537 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.573 -8.782 -1.189 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.651 -9.776 -2.299 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.290 -10.723 -1.176 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.219 -9.651 -2.560 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.146 -8.995 0.840 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.830 -8.487 1.133 1.00 0.00 C ATOM 1177 C PHE A 78 -2.950 -9.603 1.621 1.00 0.00 C ATOM 1178 O PHE A 78 -1.830 -9.754 1.164 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.893 -7.356 2.171 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.555 -6.835 2.551 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.875 -5.977 1.709 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.965 -7.203 3.747 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.635 -5.497 2.054 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.731 -6.725 4.094 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.059 -5.872 3.254 1.00 0.00 C ATOM 0 H PHE A 78 -5.899 -8.578 1.387 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.406 -8.074 0.217 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.494 -6.539 1.772 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.401 -7.719 3.064 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.322 -5.681 0.771 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.484 -7.875 4.414 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.110 -4.827 1.389 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.284 -7.020 5.032 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.915 -5.496 3.529 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.482 -10.402 2.509 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.758 -11.524 3.058 1.00 0.00 C ATOM 1197 C PHE A 79 -2.502 -12.576 1.995 1.00 0.00 C ATOM 1198 O PHE A 79 -1.353 -13.021 1.792 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.525 -12.103 4.243 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.525 -11.192 5.438 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.393 -11.070 6.228 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.641 -10.431 5.755 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.379 -10.213 7.303 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.638 -9.573 6.823 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.508 -9.459 7.601 1.00 0.00 C ATOM 0 H PHE A 79 -4.429 -10.295 2.873 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.786 -11.180 3.412 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.554 -12.300 3.942 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.085 -13.061 4.522 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.514 -11.653 5.997 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.530 -10.517 5.148 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.493 -10.126 7.914 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.517 -8.989 7.053 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.499 -8.783 8.443 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.549 -12.906 1.267 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.497 -13.919 0.252 1.00 0.00 C ATOM 1217 C GLU A 80 -2.506 -13.549 -0.843 1.00 0.00 C ATOM 1218 O GLU A 80 -1.641 -14.350 -1.179 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.890 -14.171 -0.297 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.858 -14.607 0.790 1.00 0.00 C ATOM 1221 CD GLU A 80 -7.232 -14.913 0.300 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -7.397 -15.852 -0.523 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -8.192 -14.288 0.786 1.00 0.00 O ATOM 0 H GLU A 80 -4.465 -12.470 1.370 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.138 -14.848 0.695 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.263 -13.263 -0.772 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.842 -14.938 -1.070 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.456 -15.491 1.285 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.920 -13.821 1.542 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.595 -12.324 -1.339 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.712 -11.853 -2.400 1.00 0.00 C ATOM 1232 C ASN A 81 -0.283 -11.783 -1.952 1.00 0.00 C ATOM 1233 O ASN A 81 0.584 -12.250 -2.659 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.119 -10.480 -2.975 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.415 -10.494 -3.748 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.802 -11.497 -4.338 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.091 -9.381 -3.767 1.00 0.00 N ATOM 0 H ASN A 81 -3.274 -11.632 -1.022 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.814 -12.596 -3.191 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.205 -9.766 -2.156 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.323 -10.121 -3.628 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -4.969 -9.326 -4.283 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -3.742 -8.564 -3.266 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.051 -11.245 -0.773 1.00 0.00 N ATOM 1245 CA CYS A 82 1.306 -11.069 -0.282 1.00 0.00 C ATOM 1246 C CYS A 82 2.018 -12.395 -0.093 1.00 0.00 C ATOM 1247 O CYS A 82 3.143 -12.551 -0.517 1.00 0.00 O ATOM 1248 CB CYS A 82 1.352 -10.247 1.000 1.00 0.00 C ATOM 1249 SG CYS A 82 0.799 -8.547 0.816 1.00 0.00 S ATOM 0 H CYS A 82 -0.779 -10.922 -0.136 1.00 0.00 H new ATOM 0 HA CYS A 82 1.838 -10.510 -1.052 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.735 -10.737 1.753 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.374 -10.244 1.378 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.491 -8.492 0.964 1.00 0.00 H new ATOM 1255 N ARG A 83 1.329 -13.368 0.476 1.00 0.00 N ATOM 1256 CA ARG A 83 1.944 -14.658 0.728 1.00 0.00 C ATOM 1257 C ARG A 83 2.034 -15.517 -0.526 1.00 0.00 C ATOM 1258 O ARG A 83 2.925 -16.361 -0.659 1.00 0.00 O ATOM 1259 CB ARG A 83 1.325 -15.355 1.934 1.00 0.00 C ATOM 1260 CG ARG A 83 1.766 -14.681 3.235 1.00 0.00 C ATOM 1261 CD ARG A 83 3.247 -14.998 3.531 1.00 0.00 C ATOM 1262 NE ARG A 83 3.924 -13.995 4.378 1.00 0.00 N ATOM 1263 CZ ARG A 83 4.219 -14.130 5.677 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.642 -15.064 6.416 1.00 0.00 N ATOM 1265 NH2 ARG A 83 5.087 -13.298 6.231 1.00 0.00 N ATOM 0 H ARG A 83 0.355 -13.291 0.769 1.00 0.00 H new ATOM 0 HA ARG A 83 2.983 -14.479 1.006 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.238 -15.330 1.856 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.620 -16.404 1.944 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.627 -13.603 3.158 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.142 -15.025 4.060 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.308 -15.970 4.020 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.785 -15.082 2.587 1.00 0.00 H new ATOM 0 HE ARG A 83 4.192 -13.118 3.932 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.960 -15.696 5.997 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.880 -15.152 7.404 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.522 -12.566 5.669 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.321 -13.389 7.220 1.00 0.00 H new ATOM 1279 N ASP A 84 1.144 -15.256 -1.477 1.00 0.00 N ATOM 1280 CA ASP A 84 1.208 -15.917 -2.784 1.00 0.00 C ATOM 1281 C ASP A 84 2.435 -15.413 -3.505 1.00 0.00 C ATOM 1282 O ASP A 84 3.287 -16.158 -3.958 1.00 0.00 O ATOM 1283 CB ASP A 84 0.023 -15.534 -3.640 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.012 -16.324 -4.940 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.414 -17.504 -4.943 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.411 -15.783 -5.990 1.00 0.00 O ATOM 0 H ASP A 84 0.373 -14.597 -1.373 1.00 0.00 H new ATOM 0 HA ASP A 84 1.224 -16.995 -2.626 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.898 -15.707 -3.084 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.065 -14.468 -3.863 1.00 0.00 H new ATOM 1291 N THR A 85 2.517 -14.134 -3.547 1.00 0.00 N ATOM 1292 CA THR A 85 3.550 -13.441 -4.217 1.00 0.00 C ATOM 1293 C THR A 85 4.915 -13.706 -3.518 1.00 0.00 C ATOM 1294 O THR A 85 5.955 -13.786 -4.174 1.00 0.00 O ATOM 1295 CB THR A 85 3.115 -11.953 -4.300 1.00 0.00 C ATOM 1296 OG1 THR A 85 1.831 -11.894 -5.004 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.107 -11.058 -5.010 1.00 0.00 C ATOM 0 H THR A 85 1.839 -13.519 -3.097 1.00 0.00 H new ATOM 0 HA THR A 85 3.707 -13.790 -5.237 1.00 0.00 H new ATOM 0 HB THR A 85 3.047 -11.580 -3.278 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.100 -12.005 -4.361 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.729 -10.036 -5.025 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.062 -11.084 -4.484 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.246 -11.409 -6.033 1.00 0.00 H new ATOM 1305 N ALA A 86 4.849 -13.963 -2.207 1.00 0.00 N ATOM 1306 CA ALA A 86 5.974 -14.397 -1.415 1.00 0.00 C ATOM 1307 C ALA A 86 6.583 -15.656 -1.971 1.00 0.00 C ATOM 1308 O ALA A 86 7.776 -15.675 -2.255 1.00 0.00 O ATOM 1309 CB ALA A 86 5.558 -14.610 0.018 1.00 0.00 C ATOM 0 H ALA A 86 3.988 -13.869 -1.668 1.00 0.00 H new ATOM 0 HA ALA A 86 6.729 -13.612 -1.452 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.418 -14.937 0.602 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.175 -13.676 0.428 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.779 -15.371 0.061 1.00 0.00 H new ATOM 1315 N LYS A 87 5.764 -16.698 -2.179 1.00 0.00 N ATOM 1316 CA LYS A 87 6.291 -17.948 -2.724 1.00 0.00 C ATOM 1317 C LYS A 87 6.827 -17.762 -4.144 1.00 0.00 C ATOM 1318 O LYS A 87 7.745 -18.461 -4.567 1.00 0.00 O ATOM 1319 CB LYS A 87 5.294 -19.122 -2.625 1.00 0.00 C ATOM 1320 CG LYS A 87 3.957 -18.931 -3.313 1.00 0.00 C ATOM 1321 CD LYS A 87 3.049 -20.147 -3.169 1.00 0.00 C ATOM 1322 CE LYS A 87 1.679 -19.875 -3.783 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.773 -21.056 -3.724 1.00 0.00 N ATOM 0 H LYS A 87 4.763 -16.699 -1.983 1.00 0.00 H new ATOM 0 HA LYS A 87 7.134 -18.226 -2.092 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.769 -20.010 -3.042 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.109 -19.325 -1.570 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.458 -18.057 -2.894 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.122 -18.728 -4.371 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.507 -21.008 -3.656 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.936 -20.400 -2.115 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.212 -19.039 -3.262 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.806 -19.572 -4.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.142 -20.813 -4.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.201 -21.848 -4.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.626 -21.332 -2.732 1.00 0.00 H new ATOM 1337 N ARG A 88 6.297 -16.776 -4.849 1.00 0.00 N ATOM 1338 CA ARG A 88 6.749 -16.453 -6.195 1.00 0.00 C ATOM 1339 C ARG A 88 8.173 -15.848 -6.156 1.00 0.00 C ATOM 1340 O ARG A 88 9.008 -16.160 -7.001 1.00 0.00 O ATOM 1341 CB ARG A 88 5.753 -15.510 -6.929 1.00 0.00 C ATOM 1342 CG ARG A 88 4.490 -16.169 -7.556 1.00 0.00 C ATOM 1343 CD ARG A 88 3.864 -17.216 -6.656 1.00 0.00 C ATOM 1344 NE ARG A 88 2.430 -17.479 -6.922 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.930 -18.622 -7.367 1.00 0.00 C ATOM 1346 NH1 ARG A 88 2.674 -19.445 -8.101 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.659 -18.899 -7.138 1.00 0.00 N ATOM 0 H ARG A 88 5.544 -16.178 -4.507 1.00 0.00 H new ATOM 0 HA ARG A 88 6.786 -17.380 -6.766 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.423 -14.749 -6.222 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.295 -14.995 -7.722 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.753 -15.396 -7.773 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.760 -16.629 -8.507 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.418 -18.149 -6.766 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.976 -16.899 -5.619 1.00 0.00 H new ATOM 0 HE ARG A 88 1.774 -16.717 -6.748 1.00 0.00 H new ATOM 0 HH11 ARG A 88 3.638 -19.198 -8.325 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.281 -20.323 -8.439 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.077 -18.237 -6.625 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.259 -19.775 -7.474 1.00 0.00 H new ATOM 1361 N ASN A 89 8.468 -15.011 -5.167 1.00 0.00 N ATOM 1362 CA ASN A 89 9.829 -14.487 -5.040 1.00 0.00 C ATOM 1363 C ASN A 89 10.763 -15.415 -4.260 1.00 0.00 C ATOM 1364 O ASN A 89 11.993 -15.301 -4.383 1.00 0.00 O ATOM 1365 CB ASN A 89 9.913 -13.014 -4.552 1.00 0.00 C ATOM 1366 CG ASN A 89 9.896 -11.996 -5.722 1.00 0.00 C ATOM 1367 OD1 ASN A 89 10.362 -12.302 -6.812 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.409 -10.805 -5.497 1.00 0.00 N ATOM 0 H ASN A 89 7.808 -14.687 -4.460 1.00 0.00 H new ATOM 0 HA ASN A 89 10.198 -14.464 -6.065 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.077 -12.808 -3.884 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.825 -12.879 -3.971 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.411 -10.105 -6.239 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.026 -10.575 -4.580 1.00 0.00 H new ATOM 1375 N GLN A 90 10.208 -16.341 -3.424 1.00 0.00 N ATOM 1376 CA GLN A 90 11.046 -17.364 -2.739 1.00 0.00 C ATOM 1377 C GLN A 90 11.649 -18.326 -3.752 1.00 0.00 C ATOM 1378 O GLN A 90 12.817 -18.669 -3.664 1.00 0.00 O ATOM 1379 CB GLN A 90 10.285 -18.209 -1.693 1.00 0.00 C ATOM 1380 CG GLN A 90 9.530 -17.454 -0.609 1.00 0.00 C ATOM 1381 CD GLN A 90 10.308 -16.313 0.008 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.056 -16.496 0.969 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.076 -15.115 -0.485 1.00 0.00 N ATOM 0 H GLN A 90 9.212 -16.398 -3.214 1.00 0.00 H new ATOM 0 HA GLN A 90 11.813 -16.791 -2.217 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.573 -18.842 -2.223 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.001 -18.872 -1.207 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.605 -17.062 -1.032 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.249 -18.154 0.177 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.450 -15.004 -1.282 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.523 -14.297 -0.070 1.00 0.00 H new ATOM 1392 N GLN A 91 10.856 -18.733 -4.749 1.00 0.00 N ATOM 1393 CA GLN A 91 11.339 -19.665 -5.774 1.00 0.00 C ATOM 1394 C GLN A 91 12.345 -19.007 -6.694 1.00 0.00 C ATOM 1395 O GLN A 91 13.133 -19.680 -7.358 1.00 0.00 O ATOM 1396 CB GLN A 91 10.177 -20.298 -6.549 1.00 0.00 C ATOM 1397 CG GLN A 91 9.229 -19.296 -7.181 1.00 0.00 C ATOM 1398 CD GLN A 91 7.986 -19.939 -7.720 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.901 -20.320 -8.886 1.00 0.00 O ATOM 1400 NE2 GLN A 91 7.016 -20.080 -6.876 1.00 0.00 N ATOM 0 H GLN A 91 9.888 -18.436 -4.868 1.00 0.00 H new ATOM 0 HA GLN A 91 11.860 -20.475 -5.263 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.584 -20.939 -7.331 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.611 -20.939 -5.873 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.953 -18.545 -6.441 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.743 -18.774 -7.988 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.123 -19.751 -5.916 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.144 -20.520 -7.170 1.00 0.00 H new ATOM 1409 N ALA A 92 12.340 -17.690 -6.719 1.00 0.00 N ATOM 1410 CA ALA A 92 13.319 -16.941 -7.484 1.00 0.00 C ATOM 1411 C ALA A 92 14.532 -16.668 -6.604 1.00 0.00 C ATOM 1412 O ALA A 92 15.568 -16.211 -7.067 1.00 0.00 O ATOM 1413 CB ALA A 92 12.708 -15.642 -7.990 1.00 0.00 C ATOM 0 H ALA A 92 11.666 -17.113 -6.216 1.00 0.00 H new ATOM 0 HA ALA A 92 13.633 -17.521 -8.352 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.452 -15.089 -8.563 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.853 -15.866 -8.628 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.381 -15.040 -7.143 1.00 0.00 H new ATOM 1419 N GLY A 93 14.379 -16.998 -5.317 1.00 0.00 N ATOM 1420 CA GLY A 93 15.410 -16.812 -4.305 1.00 0.00 C ATOM 1421 C GLY A 93 15.772 -15.361 -4.078 1.00 0.00 C ATOM 1422 O GLY A 93 16.918 -15.043 -3.756 1.00 0.00 O ATOM 0 H GLY A 93 13.520 -17.408 -4.949 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.069 -17.245 -3.365 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.304 -17.360 -4.602 1.00 0.00 H new ATOM 1426 N ASN A 94 14.820 -14.479 -4.231 1.00 0.00 N ATOM 1427 CA ASN A 94 15.092 -13.039 -4.065 1.00 0.00 C ATOM 1428 C ASN A 94 15.137 -12.611 -2.609 1.00 0.00 C ATOM 1429 O ASN A 94 15.766 -11.600 -2.259 1.00 0.00 O ATOM 1430 CB ASN A 94 14.092 -12.186 -4.835 1.00 0.00 C ATOM 1431 CG ASN A 94 14.285 -12.231 -6.323 1.00 0.00 C ATOM 1432 OD1 ASN A 94 15.398 -12.383 -6.803 1.00 0.00 O ATOM 1433 ND2 ASN A 94 13.205 -12.126 -7.055 1.00 0.00 N ATOM 0 H ASN A 94 13.855 -14.708 -4.467 1.00 0.00 H new ATOM 0 HA ASN A 94 16.085 -12.874 -4.482 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.082 -12.521 -4.598 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.173 -11.153 -4.498 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.272 -12.170 -8.072 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.297 -12.000 -6.609 1.00 0.00 H new ATOM 1440 N GLY A 95 14.486 -13.381 -1.767 1.00 0.00 N ATOM 1441 CA GLY A 95 14.434 -13.082 -0.334 1.00 0.00 C ATOM 1442 C GLY A 95 13.544 -11.890 -0.022 1.00 0.00 C ATOM 1443 O GLY A 95 13.709 -11.207 0.998 1.00 0.00 O ATOM 0 H GLY A 95 13.980 -14.224 -2.040 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.067 -13.956 0.204 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.442 -12.884 0.030 1.00 0.00 H new ATOM 1447 N TRP A 96 12.601 -11.639 -0.894 1.00 0.00 N ATOM 1448 CA TRP A 96 11.644 -10.585 -0.736 1.00 0.00 C ATOM 1449 C TRP A 96 10.306 -11.215 -0.622 1.00 0.00 C ATOM 1450 O TRP A 96 10.199 -12.436 -0.665 1.00 0.00 O ATOM 1451 CB TRP A 96 11.593 -9.639 -1.924 1.00 0.00 C ATOM 1452 CG TRP A 96 12.832 -8.869 -2.202 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.661 -8.281 -1.298 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.355 -8.549 -3.491 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.655 -7.626 -1.935 1.00 0.00 N ATOM 1456 CE2 TRP A 96 14.495 -7.766 -3.291 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.960 -8.847 -4.800 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 15.259 -7.274 -4.342 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.719 -8.362 -5.844 1.00 0.00 C ATOM 1460 CH2 TRP A 96 14.853 -7.575 -5.607 1.00 0.00 C ATOM 0 H TRP A 96 12.478 -12.177 -1.752 1.00 0.00 H new ATOM 0 HA TRP A 96 11.932 -10.006 0.141 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.343 -10.218 -2.813 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.779 -8.932 -1.765 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.541 -8.331 -0.226 1.00 0.00 H new ATOM 0 HE1 TRP A 96 15.407 -7.108 -1.480 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.080 -9.444 -4.988 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 16.140 -6.676 -4.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.435 -8.593 -6.860 1.00 0.00 H new ATOM 0 HH2 TRP A 96 15.419 -7.198 -6.446 1.00 0.00 H new ATOM 1471 N ASP A 97 9.317 -10.386 -0.405 1.00 0.00 N ATOM 1472 CA ASP A 97 7.891 -10.738 -0.463 1.00 0.00 C ATOM 1473 C ASP A 97 7.332 -11.480 0.739 1.00 0.00 C ATOM 1474 O ASP A 97 6.189 -11.256 1.144 1.00 0.00 O ATOM 1475 CB ASP A 97 7.531 -11.460 -1.750 1.00 0.00 C ATOM 1476 CG ASP A 97 7.662 -10.600 -2.950 1.00 0.00 C ATOM 1477 OD1 ASP A 97 8.708 -9.959 -3.127 1.00 0.00 O ATOM 1478 OD2 ASP A 97 6.763 -10.599 -3.771 1.00 0.00 O ATOM 0 H ASP A 97 9.472 -9.405 -0.173 1.00 0.00 H new ATOM 0 HA ASP A 97 7.400 -9.765 -0.441 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.174 -12.333 -1.863 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.506 -11.825 -1.681 1.00 0.00 H new ATOM 1483 N PHE A 98 8.095 -12.362 1.289 1.00 0.00 N ATOM 1484 CA PHE A 98 7.642 -13.125 2.422 1.00 0.00 C ATOM 1485 C PHE A 98 7.613 -12.251 3.683 1.00 0.00 C ATOM 1486 O PHE A 98 6.555 -12.067 4.308 1.00 0.00 O ATOM 1487 CB PHE A 98 8.496 -14.407 2.572 1.00 0.00 C ATOM 1488 CG PHE A 98 8.189 -15.266 3.767 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.916 -15.736 3.977 1.00 0.00 C ATOM 1490 CD2 PHE A 98 9.183 -15.614 4.664 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.627 -16.532 5.064 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.904 -16.408 5.750 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.625 -16.866 5.954 1.00 0.00 C ATOM 0 H PHE A 98 9.041 -12.580 0.977 1.00 0.00 H new ATOM 0 HA PHE A 98 6.615 -13.454 2.263 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.370 -15.011 1.673 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.546 -14.117 2.617 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.131 -15.478 3.281 1.00 0.00 H new ATOM 0 HD2 PHE A 98 10.190 -15.257 4.509 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.621 -16.893 5.218 1.00 0.00 H new ATOM 0 HE2 PHE A 98 9.689 -16.672 6.443 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.402 -17.486 6.810 1.00 0.00 H new ATOM 1503 N ASP A 99 8.746 -11.737 4.046 1.00 0.00 N ATOM 1504 CA ASP A 99 8.877 -10.829 5.183 1.00 0.00 C ATOM 1505 C ASP A 99 8.646 -9.395 4.725 1.00 0.00 C ATOM 1506 O ASP A 99 7.896 -8.637 5.377 1.00 0.00 O ATOM 1507 CB ASP A 99 10.293 -10.907 5.776 1.00 0.00 C ATOM 1508 CG ASP A 99 10.735 -12.266 6.295 1.00 0.00 C ATOM 1509 OD1 ASP A 99 11.070 -13.150 5.499 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.837 -12.430 7.513 1.00 0.00 O ATOM 0 H ASP A 99 9.626 -11.927 3.567 1.00 0.00 H new ATOM 0 HA ASP A 99 8.142 -11.120 5.933 1.00 0.00 H new ATOM 0 HB2 ASP A 99 11.001 -10.586 5.012 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.361 -10.190 6.594 1.00 0.00 H new ATOM 1515 N MET A 100 9.362 -9.008 3.627 1.00 0.00 N ATOM 1516 CA MET A 100 9.293 -7.626 3.047 1.00 0.00 C ATOM 1517 C MET A 100 7.861 -7.231 2.710 1.00 0.00 C ATOM 1518 O MET A 100 7.329 -6.296 3.278 1.00 0.00 O ATOM 1519 CB MET A 100 10.128 -7.504 1.762 1.00 0.00 C ATOM 1520 CG MET A 100 11.616 -7.722 1.911 1.00 0.00 C ATOM 1521 SD MET A 100 12.418 -6.493 2.939 1.00 0.00 S ATOM 1522 CE MET A 100 14.135 -6.957 2.735 1.00 0.00 C ATOM 0 H MET A 100 9.994 -9.632 3.125 1.00 0.00 H new ATOM 0 HA MET A 100 9.694 -6.961 3.812 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.747 -8.223 1.036 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.967 -6.511 1.342 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.790 -8.710 2.337 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.077 -7.715 0.923 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.748 -6.404 3.447 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.247 -8.027 2.913 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.457 -6.723 1.720 1.00 0.00 H new ATOM 1532 N LEU A 101 7.264 -7.960 1.776 1.00 0.00 N ATOM 1533 CA LEU A 101 5.844 -7.800 1.420 1.00 0.00 C ATOM 1534 C LEU A 101 5.124 -8.538 2.522 1.00 0.00 C ATOM 1535 O LEU A 101 5.788 -9.262 3.259 1.00 0.00 O ATOM 1536 CB LEU A 101 5.591 -8.480 0.065 1.00 0.00 C ATOM 1537 CG LEU A 101 4.208 -8.435 -0.542 1.00 0.00 C ATOM 1538 CD1 LEU A 101 3.783 -7.026 -0.860 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.179 -9.295 -1.784 1.00 0.00 C ATOM 0 H LEU A 101 7.744 -8.682 1.238 1.00 0.00 H new ATOM 0 HA LEU A 101 5.522 -6.762 1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.279 -8.038 -0.656 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.868 -9.529 0.169 1.00 0.00 H new ATOM 0 HG LEU A 101 3.498 -8.824 0.188 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.783 -7.037 -1.295 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.775 -6.433 0.055 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.483 -6.586 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.182 -9.265 -2.224 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.906 -8.919 -2.504 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.428 -10.323 -1.521 1.00 0.00 H new ATOM 1551 N THR A 102 3.820 -8.362 2.709 1.00 0.00 N ATOM 1552 CA THR A 102 3.086 -8.988 3.823 1.00 0.00 C ATOM 1553 C THR A 102 3.301 -8.126 5.082 1.00 0.00 C ATOM 1554 O THR A 102 2.342 -7.680 5.741 1.00 0.00 O ATOM 1555 CB THR A 102 3.505 -10.467 4.123 1.00 0.00 C ATOM 1556 OG1 THR A 102 3.562 -11.251 2.910 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.517 -11.087 5.058 1.00 0.00 C ATOM 0 H THR A 102 3.237 -7.786 2.101 1.00 0.00 H new ATOM 0 HA THR A 102 2.037 -9.034 3.530 1.00 0.00 H new ATOM 0 HB THR A 102 4.497 -10.453 4.575 1.00 0.00 H new ATOM 0 HG1 THR A 102 4.445 -11.151 2.497 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.809 -12.116 5.266 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.493 -10.521 5.989 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.527 -11.076 4.601 1.00 0.00 H new ATOM 1565 N GLY A 103 4.558 -7.846 5.337 1.00 0.00 N ATOM 1566 CA GLY A 103 4.933 -7.057 6.460 1.00 0.00 C ATOM 1567 C GLY A 103 4.877 -7.863 7.710 1.00 0.00 C ATOM 1568 O GLY A 103 4.189 -7.492 8.674 1.00 0.00 O ATOM 0 H GLY A 103 5.340 -8.164 4.765 1.00 0.00 H new ATOM 0 HA2 GLY A 103 5.941 -6.668 6.317 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.268 -6.197 6.545 1.00 0.00 H new ATOM 1572 N SER A 104 5.577 -8.968 7.713 1.00 0.00 N ATOM 1573 CA SER A 104 5.590 -9.864 8.839 1.00 0.00 C ATOM 1574 C SER A 104 6.799 -10.758 8.731 1.00 0.00 C ATOM 1575 O SER A 104 6.931 -11.516 7.759 1.00 0.00 O ATOM 1576 CB SER A 104 4.281 -10.715 8.910 1.00 0.00 C ATOM 1577 OG SER A 104 4.217 -11.506 10.098 1.00 0.00 O ATOM 0 H SER A 104 6.156 -9.272 6.931 1.00 0.00 H new ATOM 0 HA SER A 104 5.641 -9.279 9.757 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.416 -10.053 8.869 1.00 0.00 H new ATOM 0 HB3 SER A 104 4.225 -11.367 8.038 1.00 0.00 H new ATOM 0 HG SER A 104 3.383 -12.021 10.104 1.00 0.00 H new ATOM 1583 N GLY A 105 7.687 -10.649 9.680 1.00 0.00 N ATOM 1584 CA GLY A 105 8.826 -11.475 9.689 1.00 0.00 C ATOM 1585 C GLY A 105 9.995 -10.779 10.285 1.00 0.00 C ATOM 1586 O GLY A 105 9.863 -10.039 11.271 1.00 0.00 O ATOM 0 H GLY A 105 7.629 -9.987 10.454 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.614 -12.383 10.254 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.063 -11.781 8.670 1.00 0.00 H new ATOM 1590 N ASN A 106 11.116 -10.992 9.688 1.00 0.00 N ATOM 1591 CA ASN A 106 12.381 -10.429 10.128 1.00 0.00 C ATOM 1592 C ASN A 106 12.703 -9.177 9.340 1.00 0.00 C ATOM 1593 O ASN A 106 13.120 -8.153 9.890 1.00 0.00 O ATOM 1594 CB ASN A 106 13.513 -11.436 9.892 1.00 0.00 C ATOM 1595 CG ASN A 106 13.502 -12.678 10.769 1.00 0.00 C ATOM 1596 OD1 ASN A 106 12.465 -13.121 11.259 1.00 0.00 O ATOM 1597 ND2 ASN A 106 14.658 -13.289 10.919 1.00 0.00 N ATOM 0 H ASN A 106 11.199 -11.576 8.856 1.00 0.00 H new ATOM 0 HA ASN A 106 12.294 -10.193 11.189 1.00 0.00 H new ATOM 0 HB2 ASN A 106 13.478 -11.753 8.850 1.00 0.00 H new ATOM 0 HB3 ASN A 106 14.464 -10.923 10.037 1.00 0.00 H new ATOM 0 HD21 ASN A 106 14.711 -14.156 11.454 1.00 0.00 H new ATOM 0 HD22 ASN A 106 15.501 -12.896 10.500 1.00 0.00 H new ATOM 1604 N TYR A 107 12.479 -9.246 8.039 1.00 0.00 N ATOM 1605 CA TYR A 107 12.884 -8.165 7.142 1.00 0.00 C ATOM 1606 C TYR A 107 11.843 -7.065 7.084 1.00 0.00 C ATOM 1607 O TYR A 107 12.061 -6.034 6.448 1.00 0.00 O ATOM 1608 CB TYR A 107 13.152 -8.687 5.735 1.00 0.00 C ATOM 1609 CG TYR A 107 14.115 -9.851 5.676 1.00 0.00 C ATOM 1610 CD1 TYR A 107 15.369 -9.777 6.250 1.00 0.00 C ATOM 1611 CD2 TYR A 107 13.747 -11.036 5.065 1.00 0.00 C ATOM 1612 CE1 TYR A 107 16.236 -10.851 6.210 1.00 0.00 C ATOM 1613 CE2 TYR A 107 14.591 -12.106 5.019 1.00 0.00 C ATOM 1614 CZ TYR A 107 15.845 -12.019 5.591 1.00 0.00 C ATOM 1615 OH TYR A 107 16.707 -13.105 5.553 1.00 0.00 O ATOM 0 H TYR A 107 12.022 -10.032 7.577 1.00 0.00 H new ATOM 0 HA TYR A 107 13.806 -7.749 7.549 1.00 0.00 H new ATOM 0 HB2 TYR A 107 12.206 -8.990 5.286 1.00 0.00 H new ATOM 0 HB3 TYR A 107 13.547 -7.873 5.127 1.00 0.00 H new ATOM 0 HD1 TYR A 107 15.677 -8.864 6.738 1.00 0.00 H new ATOM 0 HD2 TYR A 107 12.769 -11.116 4.614 1.00 0.00 H new ATOM 0 HE1 TYR A 107 17.215 -10.776 6.661 1.00 0.00 H new ATOM 0 HE2 TYR A 107 14.279 -13.020 4.536 1.00 0.00 H new ATOM 0 HH TYR A 107 16.276 -13.848 5.081 1.00 0.00 H new ATOM 1625 N SER A 108 10.715 -7.295 7.738 1.00 0.00 N ATOM 1626 CA SER A 108 9.649 -6.325 7.808 1.00 0.00 C ATOM 1627 C SER A 108 10.188 -5.063 8.476 1.00 0.00 C ATOM 1628 O SER A 108 10.831 -5.154 9.537 1.00 0.00 O ATOM 1629 CB SER A 108 8.500 -6.948 8.597 1.00 0.00 C ATOM 1630 OG SER A 108 9.005 -7.528 9.790 1.00 0.00 O ATOM 0 H SER A 108 10.519 -8.164 8.234 1.00 0.00 H new ATOM 0 HA SER A 108 9.279 -6.049 6.821 1.00 0.00 H new ATOM 0 HB2 SER A 108 7.755 -6.189 8.836 1.00 0.00 H new ATOM 0 HB3 SER A 108 8.000 -7.706 7.995 1.00 0.00 H new ATOM 0 HG SER A 108 9.741 -6.980 10.134 1.00 0.00 H new ATOM 1636 N SER A 109 9.917 -3.905 7.893 1.00 0.00 N ATOM 1637 CA SER A 109 10.556 -2.699 8.302 1.00 0.00 C ATOM 1638 C SER A 109 10.118 -1.543 7.411 1.00 0.00 C ATOM 1639 O SER A 109 9.656 -1.748 6.283 1.00 0.00 O ATOM 1640 CB SER A 109 12.104 -2.849 8.233 1.00 0.00 C ATOM 1641 OG SER A 109 12.759 -1.691 8.675 1.00 0.00 O ATOM 0 H SER A 109 9.250 -3.792 7.130 1.00 0.00 H new ATOM 0 HA SER A 109 10.265 -2.492 9.332 1.00 0.00 H new ATOM 0 HB2 SER A 109 12.415 -3.698 8.843 1.00 0.00 H new ATOM 0 HB3 SER A 109 12.403 -3.067 7.208 1.00 0.00 H new ATOM 0 HG SER A 109 13.621 -1.934 9.072 1.00 0.00 H new ATOM 1647 N THR A 110 10.249 -0.351 7.936 1.00 0.00 N ATOM 1648 CA THR A 110 10.024 0.852 7.213 1.00 0.00 C ATOM 1649 C THR A 110 11.276 1.124 6.357 1.00 0.00 C ATOM 1650 O THR A 110 11.200 1.707 5.268 1.00 0.00 O ATOM 1651 CB THR A 110 9.808 2.010 8.213 1.00 0.00 C ATOM 1652 OG1 THR A 110 8.674 1.707 9.065 1.00 0.00 O ATOM 1653 CG2 THR A 110 9.588 3.331 7.496 1.00 0.00 C ATOM 0 H THR A 110 10.523 -0.198 8.906 1.00 0.00 H new ATOM 0 HA THR A 110 9.143 0.768 6.577 1.00 0.00 H new ATOM 0 HB THR A 110 10.707 2.111 8.821 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.537 2.440 9.701 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.440 4.123 8.230 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.460 3.562 6.884 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.707 3.257 6.859 1.00 0.00 H new ATOM 1661 N ASP A 111 12.407 0.604 6.832 1.00 0.00 N ATOM 1662 CA ASP A 111 13.720 0.756 6.187 1.00 0.00 C ATOM 1663 C ASP A 111 13.755 0.102 4.813 1.00 0.00 C ATOM 1664 O ASP A 111 14.318 0.638 3.866 1.00 0.00 O ATOM 1665 CB ASP A 111 14.815 0.148 7.067 1.00 0.00 C ATOM 1666 CG ASP A 111 16.181 0.179 6.401 1.00 0.00 C ATOM 1667 OD1 ASP A 111 16.889 1.188 6.536 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.564 -0.816 5.731 1.00 0.00 O ATOM 0 H ASP A 111 12.442 0.055 7.691 1.00 0.00 H new ATOM 0 HA ASP A 111 13.897 1.824 6.060 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.862 0.692 8.011 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.554 -0.883 7.306 1.00 0.00 H new ATOM 1673 N ALA A 112 13.102 -1.019 4.681 1.00 0.00 N ATOM 1674 CA ALA A 112 13.120 -1.758 3.431 1.00 0.00 C ATOM 1675 C ALA A 112 12.283 -1.061 2.379 1.00 0.00 C ATOM 1676 O ALA A 112 12.443 -1.281 1.195 1.00 0.00 O ATOM 1677 CB ALA A 112 12.619 -3.165 3.657 1.00 0.00 C ATOM 0 H ALA A 112 12.547 -1.449 5.421 1.00 0.00 H new ATOM 0 HA ALA A 112 14.147 -1.801 3.069 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.636 -3.713 2.715 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.261 -3.668 4.380 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.599 -3.131 4.039 1.00 0.00 H new ATOM 1683 N GLN A 113 11.377 -0.254 2.844 1.00 0.00 N ATOM 1684 CA GLN A 113 10.516 0.527 2.018 1.00 0.00 C ATOM 1685 C GLN A 113 11.200 1.834 1.659 1.00 0.00 C ATOM 1686 O GLN A 113 11.119 2.277 0.555 1.00 0.00 O ATOM 1687 CB GLN A 113 9.213 0.747 2.790 1.00 0.00 C ATOM 1688 CG GLN A 113 8.118 1.629 2.137 1.00 0.00 C ATOM 1689 CD GLN A 113 8.363 3.146 2.172 1.00 0.00 C ATOM 1690 OE1 GLN A 113 7.930 3.863 1.289 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.046 3.650 3.203 1.00 0.00 N ATOM 0 H GLN A 113 11.214 -0.119 3.842 1.00 0.00 H new ATOM 0 HA GLN A 113 10.291 0.021 1.079 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.776 -0.231 2.993 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.467 1.189 3.753 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.006 1.323 1.097 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.170 1.423 2.634 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.400 3.031 3.932 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.214 4.654 3.261 1.00 0.00 H new ATOM 1700 N MET A 114 11.859 2.452 2.637 1.00 0.00 N ATOM 1701 CA MET A 114 12.533 3.745 2.410 1.00 0.00 C ATOM 1702 C MET A 114 13.667 3.556 1.427 1.00 0.00 C ATOM 1703 O MET A 114 13.898 4.364 0.542 1.00 0.00 O ATOM 1704 CB MET A 114 13.092 4.284 3.722 1.00 0.00 C ATOM 1705 CG MET A 114 13.677 5.682 3.593 1.00 0.00 C ATOM 1706 SD MET A 114 12.401 6.923 3.279 1.00 0.00 S ATOM 1707 CE MET A 114 13.401 8.385 2.988 1.00 0.00 C ATOM 0 H MET A 114 11.945 2.090 3.587 1.00 0.00 H new ATOM 0 HA MET A 114 11.809 4.455 2.010 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.299 4.296 4.470 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.864 3.606 4.087 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.213 5.936 4.507 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.405 5.697 2.782 1.00 0.00 H new ATOM 0 HE1 MET A 114 12.751 9.235 2.780 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.003 8.596 3.872 1.00 0.00 H new ATOM 0 HE3 MET A 114 14.057 8.213 2.135 1.00 0.00 H new ATOM 1717 N GLN A 115 14.366 2.469 1.600 1.00 0.00 N ATOM 1718 CA GLN A 115 15.439 2.095 0.730 1.00 0.00 C ATOM 1719 C GLN A 115 14.947 0.942 -0.122 1.00 0.00 C ATOM 1720 O GLN A 115 15.654 -0.061 -0.325 1.00 0.00 O ATOM 1721 CB GLN A 115 16.709 1.706 1.533 1.00 0.00 C ATOM 1722 CG GLN A 115 17.435 2.888 2.209 1.00 0.00 C ATOM 1723 CD GLN A 115 16.727 3.499 3.405 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.847 4.692 3.658 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.030 2.709 4.159 1.00 0.00 N ATOM 0 H GLN A 115 14.202 1.810 2.361 1.00 0.00 H new ATOM 0 HA GLN A 115 15.726 2.936 0.099 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.430 0.983 2.300 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.407 1.205 0.862 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.421 2.550 2.528 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.590 3.669 1.464 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.948 1.720 3.923 1.00 0.00 H new ATOM 0 HE22 GLN A 115 15.563 3.076 4.988 1.00 0.00 H new ATOM 1734 N TYR A 116 13.696 1.095 -0.600 1.00 0.00 N ATOM 1735 CA TYR A 116 12.998 0.139 -1.399 1.00 0.00 C ATOM 1736 C TYR A 116 13.831 -0.304 -2.575 1.00 0.00 C ATOM 1737 O TYR A 116 14.574 0.484 -3.165 1.00 0.00 O ATOM 1738 CB TYR A 116 11.684 0.755 -1.975 1.00 0.00 C ATOM 1739 CG TYR A 116 11.852 2.017 -2.849 1.00 0.00 C ATOM 1740 CD1 TYR A 116 12.055 1.920 -4.223 1.00 0.00 C ATOM 1741 CD2 TYR A 116 11.797 3.295 -2.293 1.00 0.00 C ATOM 1742 CE1 TYR A 116 12.197 3.045 -5.001 1.00 0.00 C ATOM 1743 CE2 TYR A 116 11.941 4.429 -3.069 1.00 0.00 C ATOM 1744 CZ TYR A 116 12.144 4.292 -4.425 1.00 0.00 C ATOM 1745 OH TYR A 116 12.250 5.411 -5.231 1.00 0.00 O ATOM 0 H TYR A 116 13.144 1.933 -0.417 1.00 0.00 H new ATOM 0 HA TYR A 116 12.778 -0.709 -0.750 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.178 -0.008 -2.567 1.00 0.00 H new ATOM 0 HB3 TYR A 116 11.026 1.000 -1.142 1.00 0.00 H new ATOM 0 HD1 TYR A 116 12.102 0.945 -4.685 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.638 3.401 -1.230 1.00 0.00 H new ATOM 0 HE1 TYR A 116 12.350 2.949 -6.066 1.00 0.00 H new ATOM 0 HE2 TYR A 116 11.895 5.410 -2.619 1.00 0.00 H new ATOM 0 HH TYR A 116 12.460 6.193 -4.679 1.00 0.00 H new ATOM 1755 N ASP A 117 13.738 -1.528 -2.903 1.00 0.00 N ATOM 1756 CA ASP A 117 14.294 -1.958 -4.151 1.00 0.00 C ATOM 1757 C ASP A 117 13.262 -1.610 -5.203 1.00 0.00 C ATOM 1758 O ASP A 117 12.085 -1.751 -4.929 1.00 0.00 O ATOM 1759 CB ASP A 117 14.568 -3.461 -4.154 1.00 0.00 C ATOM 1760 CG ASP A 117 14.945 -3.962 -5.520 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.123 -3.861 -5.902 1.00 0.00 O ATOM 1762 OD2 ASP A 117 14.054 -4.424 -6.245 1.00 0.00 O ATOM 0 H ASP A 117 13.291 -2.255 -2.345 1.00 0.00 H new ATOM 0 HA ASP A 117 15.251 -1.470 -4.339 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.371 -3.684 -3.452 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.682 -3.992 -3.805 1.00 0.00 H new ATOM 1767 N PRO A 118 13.658 -1.088 -6.387 1.00 0.00 N ATOM 1768 CA PRO A 118 12.713 -0.738 -7.472 1.00 0.00 C ATOM 1769 C PRO A 118 11.734 -1.880 -7.850 1.00 0.00 C ATOM 1770 O PRO A 118 10.578 -1.608 -8.244 1.00 0.00 O ATOM 1771 CB PRO A 118 13.629 -0.371 -8.654 1.00 0.00 C ATOM 1772 CG PRO A 118 15.004 -0.775 -8.242 1.00 0.00 C ATOM 1773 CD PRO A 118 15.031 -0.720 -6.755 1.00 0.00 C ATOM 0 HA PRO A 118 12.050 0.071 -7.165 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.324 -0.892 -9.562 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.583 0.697 -8.868 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.237 -1.779 -8.598 1.00 0.00 H new ATOM 0 HG3 PRO A 118 15.750 -0.105 -8.669 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.761 -1.414 -6.338 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.294 0.274 -6.392 1.00 0.00 H new ATOM 1781 N GLY A 119 12.137 -3.130 -7.617 1.00 0.00 N ATOM 1782 CA GLY A 119 11.323 -4.254 -7.972 1.00 0.00 C ATOM 1783 C GLY A 119 10.381 -4.512 -6.841 1.00 0.00 C ATOM 1784 O GLY A 119 9.183 -4.641 -7.041 1.00 0.00 O ATOM 0 H GLY A 119 13.027 -3.372 -7.182 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.771 -4.051 -8.890 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.943 -5.130 -8.160 1.00 0.00 H new ATOM 1788 N LEU A 120 10.953 -4.575 -5.630 1.00 0.00 N ATOM 1789 CA LEU A 120 10.198 -4.663 -4.369 1.00 0.00 C ATOM 1790 C LEU A 120 9.118 -3.557 -4.302 1.00 0.00 C ATOM 1791 O LEU A 120 7.989 -3.821 -3.928 1.00 0.00 O ATOM 1792 CB LEU A 120 11.180 -4.532 -3.191 1.00 0.00 C ATOM 1793 CG LEU A 120 10.597 -4.458 -1.767 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.724 -5.672 -1.453 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.731 -4.359 -0.759 1.00 0.00 C ATOM 0 H LEU A 120 11.964 -4.566 -5.496 1.00 0.00 H new ATOM 0 HA LEU A 120 9.691 -5.626 -4.315 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.862 -5.382 -3.229 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.779 -3.636 -3.354 1.00 0.00 H new ATOM 0 HG LEU A 120 9.966 -3.571 -1.703 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.330 -5.585 -0.440 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.897 -5.718 -2.161 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.321 -6.580 -1.533 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.319 -4.307 0.249 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.371 -5.237 -0.844 1.00 0.00 H new ATOM 0 HD23 LEU A 120 12.317 -3.462 -0.958 1.00 0.00 H new ATOM 1807 N PHE A 121 9.519 -2.321 -4.610 1.00 0.00 N ATOM 1808 CA PHE A 121 8.548 -1.209 -4.705 1.00 0.00 C ATOM 1809 C PHE A 121 7.376 -1.578 -5.621 1.00 0.00 C ATOM 1810 O PHE A 121 6.217 -1.448 -5.228 1.00 0.00 O ATOM 1811 CB PHE A 121 9.205 0.104 -5.163 1.00 0.00 C ATOM 1812 CG PHE A 121 8.213 1.231 -5.356 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.512 1.754 -4.282 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.972 1.753 -6.618 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.594 2.765 -4.461 1.00 0.00 C ATOM 1816 CE2 PHE A 121 7.059 2.771 -6.802 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.366 3.277 -5.720 1.00 0.00 C ATOM 0 H PHE A 121 10.487 -2.060 -4.796 1.00 0.00 H new ATOM 0 HA PHE A 121 8.162 -1.041 -3.699 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.950 0.406 -4.427 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.735 -0.070 -6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.688 1.364 -3.290 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.507 1.357 -7.469 1.00 0.00 H new ATOM 0 HE1 PHE A 121 6.052 3.157 -3.613 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.887 3.171 -7.790 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.648 4.071 -5.860 1.00 0.00 H new ATOM 1827 N ALA A 122 7.670 -2.054 -6.825 1.00 0.00 N ATOM 1828 CA ALA A 122 6.612 -2.432 -7.772 1.00 0.00 C ATOM 1829 C ALA A 122 5.753 -3.616 -7.254 1.00 0.00 C ATOM 1830 O ALA A 122 4.546 -3.717 -7.544 1.00 0.00 O ATOM 1831 CB ALA A 122 7.223 -2.771 -9.129 1.00 0.00 C ATOM 0 H ALA A 122 8.620 -2.189 -7.172 1.00 0.00 H new ATOM 0 HA ALA A 122 5.945 -1.576 -7.877 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.432 -3.050 -9.825 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.756 -1.902 -9.515 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.918 -3.603 -9.017 1.00 0.00 H new ATOM 1837 N GLN A 123 6.383 -4.447 -6.457 1.00 0.00 N ATOM 1838 CA GLN A 123 5.840 -5.651 -5.891 1.00 0.00 C ATOM 1839 C GLN A 123 4.776 -5.262 -4.839 1.00 0.00 C ATOM 1840 O GLN A 123 3.604 -5.670 -4.940 1.00 0.00 O ATOM 1841 CB GLN A 123 7.019 -6.336 -5.209 1.00 0.00 C ATOM 1842 CG GLN A 123 6.989 -7.821 -5.079 1.00 0.00 C ATOM 1843 CD GLN A 123 6.931 -8.526 -6.423 1.00 0.00 C ATOM 1844 OE1 GLN A 123 7.357 -7.982 -7.467 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.568 -9.750 -6.403 1.00 0.00 N ATOM 0 H GLN A 123 7.349 -4.286 -6.171 1.00 0.00 H new ATOM 0 HA GLN A 123 5.372 -6.298 -6.633 1.00 0.00 H new ATOM 0 HB2 GLN A 123 7.923 -6.067 -5.756 1.00 0.00 H new ATOM 0 HB3 GLN A 123 7.115 -5.916 -4.208 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.875 -8.152 -4.538 1.00 0.00 H new ATOM 0 HG3 GLN A 123 6.124 -8.112 -4.483 1.00 0.00 H new ATOM 0 HE21 GLN A 123 6.225 -10.166 -5.537 1.00 0.00 H new ATOM 0 HE22 GLN A 123 6.621 -10.312 -7.253 1.00 0.00 H new ATOM 1854 N ILE A 124 5.199 -4.436 -3.846 1.00 0.00 N ATOM 1855 CA ILE A 124 4.306 -3.969 -2.774 1.00 0.00 C ATOM 1856 C ILE A 124 3.147 -3.137 -3.313 1.00 0.00 C ATOM 1857 O ILE A 124 2.013 -3.313 -2.892 1.00 0.00 O ATOM 1858 CB ILE A 124 5.052 -3.211 -1.602 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.960 -2.104 -2.134 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.851 -4.180 -0.739 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.584 -1.213 -1.058 1.00 0.00 C ATOM 0 H ILE A 124 6.154 -4.085 -3.774 1.00 0.00 H new ATOM 0 HA ILE A 124 3.896 -4.879 -2.335 1.00 0.00 H new ATOM 0 HB ILE A 124 4.284 -2.748 -0.982 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.760 -2.559 -2.718 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.385 -1.478 -2.816 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.352 -3.630 0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.178 -4.918 -0.302 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.595 -4.686 -1.354 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.212 -0.457 -1.530 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.794 -0.724 -0.488 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.191 -1.822 -0.388 1.00 0.00 H new ATOM 1873 N GLN A 125 3.465 -2.273 -4.264 1.00 0.00 N ATOM 1874 CA GLN A 125 2.531 -1.388 -4.960 1.00 0.00 C ATOM 1875 C GLN A 125 1.332 -2.214 -5.465 1.00 0.00 C ATOM 1876 O GLN A 125 0.169 -2.014 -5.035 1.00 0.00 O ATOM 1877 CB GLN A 125 3.315 -0.817 -6.168 1.00 0.00 C ATOM 1878 CG GLN A 125 2.872 0.474 -6.811 1.00 0.00 C ATOM 1879 CD GLN A 125 1.518 0.435 -7.420 1.00 0.00 C ATOM 1880 OE1 GLN A 125 1.347 0.055 -8.578 1.00 0.00 O ATOM 1881 NE2 GLN A 125 0.576 0.867 -6.677 1.00 0.00 N ATOM 0 H GLN A 125 4.425 -2.161 -4.590 1.00 0.00 H new ATOM 0 HA GLN A 125 2.155 -0.596 -4.312 1.00 0.00 H new ATOM 0 HB2 GLN A 125 4.349 -0.683 -5.850 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.317 -1.582 -6.944 1.00 0.00 H new ATOM 0 HG2 GLN A 125 2.894 1.264 -6.060 1.00 0.00 H new ATOM 0 HG3 GLN A 125 3.594 0.746 -7.581 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.776 1.169 -5.724 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -0.378 0.910 -7.036 1.00 0.00 H new ATOM 1890 N ALA A 126 1.657 -3.205 -6.288 1.00 0.00 N ATOM 1891 CA ALA A 126 0.678 -4.018 -6.962 1.00 0.00 C ATOM 1892 C ALA A 126 -0.104 -4.859 -5.998 1.00 0.00 C ATOM 1893 O ALA A 126 -1.329 -4.884 -6.057 1.00 0.00 O ATOM 1894 CB ALA A 126 1.328 -4.905 -8.008 1.00 0.00 C ATOM 0 H ALA A 126 2.621 -3.461 -6.501 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.012 -3.335 -7.458 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.564 -5.507 -8.500 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.833 -4.285 -8.748 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.054 -5.561 -7.528 1.00 0.00 H new ATOM 1900 N ALA A 127 0.594 -5.517 -5.073 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.059 -6.425 -4.149 1.00 0.00 C ATOM 1902 C ALA A 127 -1.047 -5.687 -3.260 1.00 0.00 C ATOM 1903 O ALA A 127 -2.156 -6.200 -2.986 1.00 0.00 O ATOM 1904 CB ALA A 127 0.957 -7.175 -3.319 1.00 0.00 C ATOM 0 H ALA A 127 1.603 -5.435 -4.949 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.618 -7.153 -4.737 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.442 -7.849 -2.635 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.608 -7.753 -3.975 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.555 -6.465 -2.748 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.674 -4.477 -2.831 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.524 -3.692 -1.989 1.00 0.00 C ATOM 1912 C ALA A 128 -2.815 -3.370 -2.686 1.00 0.00 C ATOM 1913 O ALA A 128 -3.822 -3.850 -2.285 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.830 -2.421 -1.547 1.00 0.00 C ATOM 0 H ALA A 128 0.216 -4.036 -3.064 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.749 -4.282 -1.101 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.499 -1.844 -0.909 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.073 -2.674 -0.992 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.564 -1.829 -2.422 1.00 0.00 H new ATOM 1920 N THR A 129 -2.760 -2.655 -3.766 1.00 0.00 N ATOM 1921 CA THR A 129 -4.022 -2.269 -4.437 1.00 0.00 C ATOM 1922 C THR A 129 -4.870 -3.507 -4.899 1.00 0.00 C ATOM 1923 O THR A 129 -6.141 -3.497 -4.816 1.00 0.00 O ATOM 1924 CB THR A 129 -3.786 -1.273 -5.621 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.032 -0.892 -6.250 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.835 -1.848 -6.667 1.00 0.00 C ATOM 0 H THR A 129 -1.904 -2.323 -4.210 1.00 0.00 H new ATOM 0 HA THR A 129 -4.608 -1.747 -3.681 1.00 0.00 H new ATOM 0 HB THR A 129 -3.325 -0.384 -5.190 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.157 -1.413 -7.071 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.698 -1.125 -7.471 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.872 -2.062 -6.204 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.255 -2.768 -7.074 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.177 -4.604 -5.227 1.00 0.00 N ATOM 1935 CA LYS A 130 -4.807 -5.793 -5.804 1.00 0.00 C ATOM 1936 C LYS A 130 -5.655 -6.453 -4.749 1.00 0.00 C ATOM 1937 O LYS A 130 -6.589 -7.173 -5.036 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.734 -6.759 -6.293 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.246 -7.889 -7.175 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.837 -7.358 -8.466 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.790 -6.622 -9.288 1.00 0.00 C ATOM 1942 NZ LYS A 130 -4.304 -6.187 -10.602 1.00 0.00 N ATOM 0 H LYS A 130 -3.169 -4.691 -5.100 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.432 -5.509 -6.651 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -2.983 -6.196 -6.848 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.233 -7.191 -5.427 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.429 -8.574 -7.402 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.001 -8.460 -6.635 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -5.246 -8.184 -9.048 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -5.665 -6.686 -8.241 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.442 -5.752 -8.732 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -2.927 -7.271 -9.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -3.552 -5.691 -11.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -4.612 -7.018 -11.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -5.111 -5.545 -10.464 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.262 -6.233 -3.547 1.00 0.00 N ATOM 1957 CA ALA A 131 -5.971 -6.608 -2.396 1.00 0.00 C ATOM 1958 C ALA A 131 -6.995 -5.554 -2.148 1.00 0.00 C ATOM 1959 O ALA A 131 -8.187 -5.824 -2.251 1.00 0.00 O ATOM 1960 CB ALA A 131 -4.951 -6.647 -1.314 1.00 0.00 C ATOM 0 H ALA A 131 -4.384 -5.758 -3.337 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.481 -7.568 -2.470 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.426 -6.934 -0.376 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.180 -7.375 -1.567 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.498 -5.661 -1.205 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.522 -4.328 -2.007 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.286 -3.148 -1.607 1.00 0.00 C ATOM 1968 C TRP A 132 -8.278 -2.645 -2.679 1.00 0.00 C ATOM 1969 O TRP A 132 -8.539 -1.462 -2.794 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.379 -1.993 -1.156 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.495 -2.325 0.003 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.998 -3.522 0.252 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.003 -1.475 1.060 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.143 -3.505 1.237 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.120 -2.280 1.797 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.163 -0.128 1.458 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.407 -1.809 2.858 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.449 0.300 2.529 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.586 -0.534 3.196 1.00 0.00 C ATOM 0 H TRP A 132 -5.540 -4.112 -2.177 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.879 -3.488 -0.758 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.757 -1.685 -1.996 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.002 -1.139 -0.890 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.268 -4.412 -0.296 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.578 -4.299 1.538 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.830 0.536 0.928 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.724 -2.444 3.403 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.562 1.320 2.865 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.028 -0.138 4.032 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.753 -3.509 -3.479 1.00 0.00 N ATOM 1991 CA ARG A 133 -9.798 -3.138 -4.401 1.00 0.00 C ATOM 1992 C ARG A 133 -11.235 -3.814 -4.209 1.00 0.00 C ATOM 1993 O ARG A 133 -12.256 -3.119 -4.287 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.263 -3.224 -5.843 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.231 -2.812 -6.952 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.261 -3.887 -7.264 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.410 -3.357 -8.018 1.00 0.00 N ATOM 1998 CZ ARG A 133 -12.671 -3.661 -9.316 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -11.797 -4.354 -10.007 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -13.778 -3.220 -9.925 1.00 0.00 N ATOM 0 H ARG A 133 -8.451 -4.482 -3.532 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.042 -2.105 -4.153 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.374 -2.598 -5.916 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -8.946 -4.250 -6.029 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -10.745 -1.897 -6.658 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -9.666 -2.584 -7.855 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.789 -4.684 -7.838 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.614 -4.331 -6.333 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.048 -2.724 -7.536 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -10.928 -4.661 -9.569 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -11.986 -4.586 -10.982 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -14.446 -2.643 -9.414 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -13.954 -3.461 -10.901 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.295 -5.122 -3.945 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.532 -5.941 -4.284 1.00 0.00 C ATOM 2016 C LYS A 134 -13.927 -5.779 -3.642 1.00 0.00 C ATOM 2017 O LYS A 134 -14.839 -6.450 -4.109 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.284 -7.422 -4.506 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.630 -7.748 -5.830 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.242 -7.237 -5.894 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.388 -7.948 -4.901 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.090 -9.328 -5.332 1.00 0.00 N ATOM 0 H LYS A 134 -10.541 -5.653 -3.510 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.665 -5.335 -5.180 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.654 -7.799 -3.700 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.234 -7.952 -4.442 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.628 -8.828 -5.979 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.215 -7.315 -6.642 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -9.840 -7.378 -6.897 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.231 -6.166 -5.694 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.456 -7.400 -4.763 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.892 -7.969 -3.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.426 -9.765 -4.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.970 -9.881 -5.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.663 -9.311 -6.280 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.161 -4.943 -2.681 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.527 -4.972 -2.076 1.00 0.00 C ATOM 2038 C LEU A 135 -16.574 -4.158 -2.843 1.00 0.00 C ATOM 2039 O LEU A 135 -16.236 -3.166 -3.434 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.630 -4.869 -0.499 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.696 -3.953 0.306 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.319 -4.505 0.317 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.679 -2.566 -0.210 1.00 0.00 C ATOM 0 H LEU A 135 -13.504 -4.265 -2.295 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.807 -6.014 -2.229 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -16.651 -4.564 -0.267 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.501 -5.878 -0.106 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.086 -3.916 1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.667 -3.846 0.891 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.327 -5.495 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.949 -4.580 -0.706 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.003 -1.961 0.395 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.337 -2.567 -1.245 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.684 -2.147 -0.160 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.849 -4.643 -2.876 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.976 -4.039 -3.641 1.00 0.00 C ATOM 2057 C PRO A 136 -19.164 -2.504 -3.573 1.00 0.00 C ATOM 2058 O PRO A 136 -18.670 -1.803 -2.652 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.222 -4.727 -3.050 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.733 -5.503 -1.883 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.326 -5.859 -2.199 1.00 0.00 C ATOM 0 HA PRO A 136 -18.780 -4.197 -4.702 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.969 -3.993 -2.748 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -20.695 -5.379 -3.784 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -19.792 -4.913 -0.968 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.337 -6.396 -1.726 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.749 -6.079 -1.301 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -18.262 -6.736 -2.842 1.00 0.00 H new ATOM 2069 N VAL A 137 -19.954 -2.019 -4.542 1.00 0.00 N ATOM 2070 CA VAL A 137 -20.292 -0.618 -4.727 1.00 0.00 C ATOM 2071 C VAL A 137 -21.274 -0.205 -3.634 1.00 0.00 C ATOM 2072 O VAL A 137 -21.960 -1.072 -3.050 1.00 0.00 O ATOM 2073 CB VAL A 137 -20.923 -0.396 -6.161 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -21.313 1.057 -6.431 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -19.969 -0.865 -7.232 1.00 0.00 C ATOM 0 H VAL A 137 -20.387 -2.623 -5.240 1.00 0.00 H new ATOM 0 HA VAL A 137 -19.394 -0.004 -4.657 1.00 0.00 H new ATOM 0 HB VAL A 137 -21.839 -0.986 -6.184 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -21.739 1.140 -7.431 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -22.050 1.379 -5.695 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -20.429 1.690 -6.360 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -20.417 -0.706 -8.213 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -19.038 -0.302 -7.162 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -19.762 -1.926 -7.095 1.00 0.00 H new ATOM 2085 N LYS A 138 -21.367 1.085 -3.340 1.00 0.00 N ATOM 2086 CA LYS A 138 -22.243 1.536 -2.290 1.00 0.00 C ATOM 2087 C LYS A 138 -23.696 1.662 -2.708 1.00 0.00 C ATOM 2088 O LYS A 138 -24.232 2.749 -2.949 1.00 0.00 O ATOM 2089 CB LYS A 138 -21.698 2.741 -1.524 1.00 0.00 C ATOM 2090 CG LYS A 138 -20.558 2.405 -0.607 1.00 0.00 C ATOM 2091 CD LYS A 138 -20.974 1.443 0.469 1.00 0.00 C ATOM 2092 CE LYS A 138 -19.791 1.012 1.258 1.00 0.00 C ATOM 2093 NZ LYS A 138 -20.146 -0.073 2.195 1.00 0.00 N ATOM 0 H LYS A 138 -20.848 1.824 -3.814 1.00 0.00 H new ATOM 0 HA LYS A 138 -22.254 0.727 -1.560 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -21.369 3.496 -2.238 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -22.504 3.185 -0.940 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -19.741 1.973 -1.185 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -20.177 3.319 -0.151 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -21.706 1.914 1.125 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -21.459 0.575 0.023 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -19.004 0.673 0.584 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -19.391 1.860 1.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.303 -0.356 2.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -20.880 0.261 2.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -20.505 -0.890 1.660 1.00 0.00 H new ATOM 2107 N GLY A 139 -24.268 0.515 -2.855 1.00 0.00 N ATOM 2108 CA GLY A 139 -25.649 0.312 -3.159 1.00 0.00 C ATOM 2109 C GLY A 139 -25.972 -1.103 -2.778 1.00 0.00 C ATOM 2110 O GLY A 139 -26.763 -1.796 -3.434 1.00 0.00 O ATOM 0 H GLY A 139 -23.754 -0.361 -2.761 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -26.274 1.014 -2.606 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -25.841 0.481 -4.219 1.00 0.00 H new ATOM 2114 N ASP A 140 -25.308 -1.550 -1.736 1.00 0.00 N ATOM 2115 CA ASP A 140 -25.428 -2.904 -1.262 1.00 0.00 C ATOM 2116 C ASP A 140 -25.451 -2.895 0.252 1.00 0.00 C ATOM 2117 O ASP A 140 -26.541 -2.958 0.841 1.00 0.00 O ATOM 2118 CB ASP A 140 -24.251 -3.744 -1.764 1.00 0.00 C ATOM 2119 CG ASP A 140 -24.373 -5.193 -1.374 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -25.151 -5.930 -2.021 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -23.683 -5.647 -0.436 1.00 0.00 O ATOM 2122 OXT ASP A 140 -24.380 -2.716 0.865 1.00 0.00 O ATOM 0 H ASP A 140 -24.664 -0.976 -1.191 1.00 0.00 H new ATOM 0 HA ASP A 140 -26.351 -3.343 -1.640 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -24.190 -3.667 -2.850 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -23.322 -3.339 -1.363 1.00 0.00 H new TER 2127 ASP A 140