USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=35 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 :FLIP amide:sc= -0.64! C(o=-2.2!,f=-1.1!) USER MOD Set 1.2: A 94 ASN :FLIP amide:sc= -1.41! F(o=-2.2,f=-1.1!) USER MOD Set 1.3: A 123 GLN :FLIP amide:sc= 0.982 F(o=-2.2!,f=-1.1) USER MOD Set 2.1: A 102 THR OG1 : rot -95:sc= 0.251 USER MOD Set 2.2: A 104 SER OG : rot 38:sc= 0.131 USER MOD Set 3.1: A 59 ASN : amide:sc= 0.994 K(o=3.5,f=-8.2) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 139:sc= 2.53 (180deg=-0.332) USER MOD Set 4.1: A 16 HIS : no HE2:sc= -1.31 K(o=-0.61,f=-4.5!) USER MOD Set 4.2: A 54 THR OG1 : rot 9:sc= 0.701 USER MOD Set 5.1: A 9 GLN : amide:sc= 0 X(o=0.0056,f=-0.23) USER MOD Set 5.2: A 11 GLN : amide:sc= 0.00563 X(o=0.0056,f=-0.23) 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= -0.18 X(o=-0.18,f=0) USER MOD Single : A 17 ASN : amide:sc= 0.516 K(o=0.52,f=-5.2!) 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 176:sc= 0.0604 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1.44! C(o=-1.4!,f=-1.8!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 1.02 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 88:sc= 1.22 USER MOD Single : A 51 ASN : amide:sc= -0.298 X(o=-0.3,f=-0.013) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0488 USER MOD Single : A 60 THR OG1 : rot 60:sc= 1.23 USER MOD Single : A 67 SER OG : rot 180:sc=-0.00916 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 83:sc= 1.3 USER MOD Single : A 81 ASN : amide:sc= 0.551 K(o=0.55,f=-0.014) USER MOD Single : A 82 CYS SG : rot 84:sc= 0.923 USER MOD Single : A 85 THR OG1 : rot 101:sc= 1.3 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0.954 K(o=0.95,f=-0.32) USER MOD Single : A 91 GLN : amide:sc= 0.419 X(o=0.42,f=0) USER MOD Single : A 100 MET CE :methyl -110:sc= 0 (180deg=-2.54!) USER MOD Single : A 106 ASN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 107 TYR OH : rot 130:sc= 0 USER MOD Single : A 108 SER OG : rot -169:sc= -2! USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -4.29! C(o=-4.3!,f=-3.8!) USER MOD Single : A 114 MET CE :methyl -163:sc= 0 (180deg=-0.578) USER MOD Single : A 115 GLN :FLIP amide:sc= -0.0313 F(o=-1.7!,f=-0.031) USER MOD Single : A 116 TYR OH : rot -101:sc= -0.193 USER MOD Single : A 125 GLN : amide:sc= -0.162 X(o=-0.16,f=-0.46) USER MOD Single : A 129 THR OG1 : rot -100:sc= -0.519 USER MOD Single : A 130 LYS NZ :NH3+ 169:sc= -0.0382 (180deg=-0.213) USER MOD Single : A 134 LYS NZ :NH3+ 169:sc= 0.81 (180deg=0.466) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.744 12.238 0.418 1.00 0.00 N ATOM 2 CA PRO A 1 4.042 11.234 1.420 1.00 0.00 C ATOM 3 C PRO A 1 5.553 11.171 1.656 1.00 0.00 C ATOM 4 O PRO A 1 6.031 11.663 2.645 1.00 0.00 O ATOM 5 CB PRO A 1 3.507 9.902 0.949 1.00 0.00 C ATOM 6 CG PRO A 1 2.698 10.259 -0.258 1.00 0.00 C ATOM 7 CD PRO A 1 3.263 11.568 -0.781 1.00 0.00 C ATOM 0 H2 PRO A 1 4.578 12.786 0.207 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.040 12.888 0.767 1.00 0.00 H new ATOM 0 HA PRO A 1 3.566 11.491 2.366 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.312 9.210 0.702 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.897 9.421 1.714 1.00 0.00 H new ATOM 0 HG2 PRO A 1 2.764 9.477 -1.015 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.644 10.366 -0.001 1.00 0.00 H new ATOM 0 HD2 PRO A 1 4.068 11.400 -1.496 1.00 0.00 H new ATOM 0 HD3 PRO A 1 2.501 12.158 -1.291 1.00 0.00 H new ATOM 17 N VAL A 2 6.285 10.572 0.745 1.00 0.00 N ATOM 18 CA VAL A 2 7.731 10.567 0.830 1.00 0.00 C ATOM 19 C VAL A 2 8.279 11.570 -0.171 1.00 0.00 C ATOM 20 O VAL A 2 7.760 11.682 -1.285 1.00 0.00 O ATOM 21 CB VAL A 2 8.340 9.138 0.549 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.869 9.133 0.558 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.815 8.121 1.543 1.00 0.00 C ATOM 0 H VAL A 2 5.905 10.081 -0.064 1.00 0.00 H new ATOM 0 HA VAL A 2 8.017 10.841 1.846 1.00 0.00 H new ATOM 0 HB VAL A 2 8.020 8.862 -0.455 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.231 8.124 0.359 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.240 9.810 -0.212 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.228 9.462 1.533 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.249 7.145 1.328 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.088 8.425 2.553 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.730 8.061 1.463 1.00 0.00 H new ATOM 33 N THR A 3 9.266 12.312 0.232 1.00 0.00 N ATOM 34 CA THR A 3 9.952 13.205 -0.638 1.00 0.00 C ATOM 35 C THR A 3 11.322 12.570 -0.823 1.00 0.00 C ATOM 36 O THR A 3 11.924 12.093 0.176 1.00 0.00 O ATOM 37 CB THR A 3 10.028 14.673 -0.043 1.00 0.00 C ATOM 38 OG1 THR A 3 10.698 15.572 -0.939 1.00 0.00 O ATOM 39 CG2 THR A 3 10.704 14.710 1.325 1.00 0.00 C ATOM 0 H THR A 3 9.619 12.311 1.189 1.00 0.00 H new ATOM 0 HA THR A 3 9.438 13.336 -1.590 1.00 0.00 H new ATOM 0 HB THR A 3 8.996 15.002 0.081 1.00 0.00 H new ATOM 0 HG1 THR A 3 10.726 16.468 -0.543 1.00 0.00 H new ATOM 0 HG21 THR A 3 10.731 15.737 1.690 1.00 0.00 H new ATOM 0 HG22 THR A 3 10.143 14.091 2.025 1.00 0.00 H new ATOM 0 HG23 THR A 3 11.721 14.328 1.239 1.00 0.00 H new ATOM 47 N GLU A 4 11.788 12.447 -2.060 1.00 0.00 N ATOM 48 CA GLU A 4 13.000 11.706 -2.292 1.00 0.00 C ATOM 49 C GLU A 4 13.920 12.247 -3.358 1.00 0.00 C ATOM 50 O GLU A 4 13.720 13.332 -3.897 1.00 0.00 O ATOM 51 CB GLU A 4 12.733 10.214 -2.466 1.00 0.00 C ATOM 52 CG GLU A 4 11.692 9.827 -3.506 1.00 0.00 C ATOM 53 CD GLU A 4 11.961 10.351 -4.890 1.00 0.00 C ATOM 54 OE1 GLU A 4 12.763 9.753 -5.623 1.00 0.00 O ATOM 55 OE2 GLU A 4 11.372 11.384 -5.264 1.00 0.00 O ATOM 0 H GLU A 4 11.351 12.843 -2.892 1.00 0.00 H new ATOM 0 HA GLU A 4 13.567 11.852 -1.373 1.00 0.00 H new ATOM 0 HB2 GLU A 4 13.673 9.727 -2.727 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.421 9.809 -1.504 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.629 8.740 -3.550 1.00 0.00 H new ATOM 0 HG3 GLU A 4 10.718 10.190 -3.178 1.00 0.00 H new ATOM 62 N THR A 5 14.950 11.499 -3.572 1.00 0.00 N ATOM 63 CA THR A 5 15.959 11.791 -4.514 1.00 0.00 C ATOM 64 C THR A 5 16.452 10.439 -5.039 1.00 0.00 C ATOM 65 O THR A 5 16.069 9.384 -4.489 1.00 0.00 O ATOM 66 CB THR A 5 17.128 12.596 -3.830 1.00 0.00 C ATOM 67 OG1 THR A 5 18.102 13.006 -4.793 1.00 0.00 O ATOM 68 CG2 THR A 5 17.817 11.765 -2.742 1.00 0.00 C ATOM 0 H THR A 5 15.112 10.628 -3.067 1.00 0.00 H new ATOM 0 HA THR A 5 15.585 12.412 -5.328 1.00 0.00 H new ATOM 0 HB THR A 5 16.680 13.478 -3.372 1.00 0.00 H new ATOM 0 HG1 THR A 5 18.816 13.505 -4.344 1.00 0.00 H new ATOM 0 HG21 THR A 5 18.618 12.350 -2.290 1.00 0.00 H new ATOM 0 HG22 THR A 5 17.090 11.494 -1.976 1.00 0.00 H new ATOM 0 HG23 THR A 5 18.233 10.860 -3.184 1.00 0.00 H new ATOM 76 N VAL A 6 17.302 10.459 -6.031 1.00 0.00 N ATOM 77 CA VAL A 6 17.896 9.264 -6.550 1.00 0.00 C ATOM 78 C VAL A 6 19.364 9.510 -6.673 1.00 0.00 C ATOM 79 O VAL A 6 19.775 10.475 -7.307 1.00 0.00 O ATOM 80 CB VAL A 6 17.296 8.822 -7.953 1.00 0.00 C ATOM 81 CG1 VAL A 6 18.014 7.589 -8.525 1.00 0.00 C ATOM 82 CG2 VAL A 6 15.792 8.555 -7.841 1.00 0.00 C ATOM 0 H VAL A 6 17.601 11.313 -6.502 1.00 0.00 H new ATOM 0 HA VAL A 6 17.680 8.445 -5.865 1.00 0.00 H new ATOM 0 HB VAL A 6 17.458 9.649 -8.645 1.00 0.00 H new ATOM 0 HG11 VAL A 6 17.571 7.322 -9.485 1.00 0.00 H new ATOM 0 HG12 VAL A 6 19.071 7.815 -8.664 1.00 0.00 H new ATOM 0 HG13 VAL A 6 17.910 6.754 -7.833 1.00 0.00 H new ATOM 0 HG21 VAL A 6 15.403 8.254 -8.813 1.00 0.00 H new ATOM 0 HG22 VAL A 6 15.617 7.759 -7.117 1.00 0.00 H new ATOM 0 HG23 VAL A 6 15.285 9.462 -7.512 1.00 0.00 H new ATOM 92 N ASP A 7 20.162 8.684 -6.021 1.00 0.00 N ATOM 93 CA ASP A 7 21.609 8.843 -6.071 1.00 0.00 C ATOM 94 C ASP A 7 22.084 8.579 -7.498 1.00 0.00 C ATOM 95 O ASP A 7 21.405 7.882 -8.237 1.00 0.00 O ATOM 96 CB ASP A 7 22.275 7.872 -5.110 1.00 0.00 C ATOM 97 CG ASP A 7 23.737 8.131 -4.950 1.00 0.00 C ATOM 98 OD1 ASP A 7 24.527 7.630 -5.761 1.00 0.00 O ATOM 99 OD2 ASP A 7 24.110 8.847 -4.013 1.00 0.00 O ATOM 0 H ASP A 7 19.838 7.901 -5.454 1.00 0.00 H new ATOM 0 HA ASP A 7 21.878 9.857 -5.776 1.00 0.00 H new ATOM 0 HB2 ASP A 7 21.789 7.940 -4.137 1.00 0.00 H new ATOM 0 HB3 ASP A 7 22.128 6.853 -5.469 1.00 0.00 H new ATOM 104 N GLY A 8 23.248 9.086 -7.862 1.00 0.00 N ATOM 105 CA GLY A 8 23.753 8.965 -9.218 1.00 0.00 C ATOM 106 C GLY A 8 24.060 7.536 -9.629 1.00 0.00 C ATOM 107 O GLY A 8 24.289 7.263 -10.801 1.00 0.00 O ATOM 0 H GLY A 8 23.868 9.591 -7.229 1.00 0.00 H new ATOM 0 HA2 GLY A 8 23.020 9.383 -9.908 1.00 0.00 H new ATOM 0 HA3 GLY A 8 24.659 9.564 -9.314 1.00 0.00 H new ATOM 111 N GLN A 9 24.117 6.637 -8.664 1.00 0.00 N ATOM 112 CA GLN A 9 24.292 5.214 -8.943 1.00 0.00 C ATOM 113 C GLN A 9 22.922 4.522 -9.137 1.00 0.00 C ATOM 114 O GLN A 9 22.844 3.316 -9.372 1.00 0.00 O ATOM 115 CB GLN A 9 25.098 4.546 -7.824 1.00 0.00 C ATOM 116 CG GLN A 9 24.439 4.594 -6.457 1.00 0.00 C ATOM 117 CD GLN A 9 25.354 4.142 -5.348 1.00 0.00 C ATOM 118 OE1 GLN A 9 26.231 3.301 -5.535 1.00 0.00 O ATOM 119 NE2 GLN A 9 25.184 4.719 -4.195 1.00 0.00 N ATOM 0 H GLN A 9 24.045 6.864 -7.672 1.00 0.00 H new ATOM 0 HA GLN A 9 24.852 5.108 -9.872 1.00 0.00 H new ATOM 0 HB2 GLN A 9 25.273 3.504 -8.092 1.00 0.00 H new ATOM 0 HB3 GLN A 9 26.074 5.027 -7.760 1.00 0.00 H new ATOM 0 HG2 GLN A 9 24.107 5.612 -6.255 1.00 0.00 H new ATOM 0 HG3 GLN A 9 23.549 3.965 -6.466 1.00 0.00 H new ATOM 0 HE21 GLN A 9 24.446 5.413 -4.076 1.00 0.00 H new ATOM 0 HE22 GLN A 9 25.789 4.478 -3.410 1.00 0.00 H new ATOM 128 N GLY A 10 21.863 5.305 -9.021 1.00 0.00 N ATOM 129 CA GLY A 10 20.511 4.835 -9.241 1.00 0.00 C ATOM 130 C GLY A 10 19.911 4.073 -8.070 1.00 0.00 C ATOM 131 O GLY A 10 19.769 2.846 -8.109 1.00 0.00 O ATOM 0 H GLY A 10 21.921 6.292 -8.769 1.00 0.00 H new ATOM 0 HA2 GLY A 10 19.874 5.691 -9.466 1.00 0.00 H new ATOM 0 HA3 GLY A 10 20.502 4.191 -10.120 1.00 0.00 H new ATOM 135 N GLN A 11 19.584 4.794 -7.028 1.00 0.00 N ATOM 136 CA GLN A 11 18.868 4.251 -5.886 1.00 0.00 C ATOM 137 C GLN A 11 17.930 5.336 -5.416 1.00 0.00 C ATOM 138 O GLN A 11 18.252 6.518 -5.550 1.00 0.00 O ATOM 139 CB GLN A 11 19.798 3.840 -4.731 1.00 0.00 C ATOM 140 CG GLN A 11 20.552 4.992 -4.116 1.00 0.00 C ATOM 141 CD GLN A 11 21.223 4.640 -2.830 1.00 0.00 C ATOM 142 OE1 GLN A 11 22.376 4.234 -2.804 1.00 0.00 O ATOM 143 NE2 GLN A 11 20.496 4.756 -1.755 1.00 0.00 N ATOM 0 H GLN A 11 19.807 5.786 -6.941 1.00 0.00 H new ATOM 0 HA GLN A 11 18.345 3.344 -6.189 1.00 0.00 H new ATOM 0 HB2 GLN A 11 19.206 3.351 -3.957 1.00 0.00 H new ATOM 0 HB3 GLN A 11 20.514 3.104 -5.098 1.00 0.00 H new ATOM 0 HG2 GLN A 11 21.302 5.346 -4.824 1.00 0.00 H new ATOM 0 HG3 GLN A 11 19.862 5.818 -3.943 1.00 0.00 H new ATOM 0 HE21 GLN A 11 19.538 5.099 -1.822 1.00 0.00 H new ATOM 0 HE22 GLN A 11 20.885 4.504 -0.847 1.00 0.00 H new ATOM 152 N ALA A 12 16.850 4.966 -4.838 1.00 0.00 N ATOM 153 CA ALA A 12 15.821 5.890 -4.463 1.00 0.00 C ATOM 154 C ALA A 12 15.726 5.906 -2.977 1.00 0.00 C ATOM 155 O ALA A 12 15.536 4.867 -2.351 1.00 0.00 O ATOM 156 CB ALA A 12 14.528 5.460 -5.064 1.00 0.00 C ATOM 0 H ALA A 12 16.642 3.996 -4.603 1.00 0.00 H new ATOM 0 HA ALA A 12 16.053 6.892 -4.824 1.00 0.00 H new ATOM 0 HB1 ALA A 12 13.744 6.162 -4.780 1.00 0.00 H new ATOM 0 HB2 ALA A 12 14.621 5.439 -6.150 1.00 0.00 H new ATOM 0 HB3 ALA A 12 14.272 4.464 -4.703 1.00 0.00 H new ATOM 162 N TRP A 13 15.873 7.056 -2.401 1.00 0.00 N ATOM 163 CA TRP A 13 15.971 7.153 -0.975 1.00 0.00 C ATOM 164 C TRP A 13 15.738 8.561 -0.523 1.00 0.00 C ATOM 165 O TRP A 13 16.003 9.502 -1.299 1.00 0.00 O ATOM 166 CB TRP A 13 17.390 6.688 -0.541 1.00 0.00 C ATOM 167 CG TRP A 13 18.531 7.519 -1.119 1.00 0.00 C ATOM 168 CD1 TRP A 13 18.706 7.878 -2.424 1.00 0.00 C ATOM 169 CD2 TRP A 13 19.649 8.056 -0.415 1.00 0.00 C ATOM 170 NE1 TRP A 13 19.839 8.595 -2.578 1.00 0.00 N ATOM 171 CE2 TRP A 13 20.448 8.728 -1.361 1.00 0.00 C ATOM 172 CE3 TRP A 13 20.053 8.039 0.917 1.00 0.00 C ATOM 173 CZ2 TRP A 13 21.626 9.373 -1.014 1.00 0.00 C ATOM 174 CZ3 TRP A 13 21.220 8.685 1.264 1.00 0.00 C ATOM 175 CH2 TRP A 13 21.996 9.343 0.307 1.00 0.00 C ATOM 0 H TRP A 13 15.928 7.946 -2.896 1.00 0.00 H new ATOM 0 HA TRP A 13 15.211 6.520 -0.518 1.00 0.00 H new ATOM 0 HB2 TRP A 13 17.451 6.717 0.547 1.00 0.00 H new ATOM 0 HB3 TRP A 13 17.526 5.649 -0.841 1.00 0.00 H new ATOM 0 HD1 TRP A 13 18.029 7.623 -3.226 1.00 0.00 H new ATOM 0 HE1 TRP A 13 20.185 8.976 -3.459 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.463 7.529 1.664 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 22.228 9.879 -1.754 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 21.540 8.682 2.295 1.00 0.00 H new ATOM 0 HH2 TRP A 13 22.906 9.838 0.613 1.00 0.00 H new ATOM 186 N ARG A 14 15.131 8.694 0.660 1.00 0.00 N ATOM 187 CA ARG A 14 15.055 9.932 1.418 1.00 0.00 C ATOM 188 C ARG A 14 14.162 9.784 2.662 1.00 0.00 C ATOM 189 O ARG A 14 14.368 8.869 3.436 1.00 0.00 O ATOM 190 CB ARG A 14 14.755 11.174 0.599 1.00 0.00 C ATOM 191 CG ARG A 14 15.027 12.458 1.324 1.00 0.00 C ATOM 192 CD ARG A 14 15.606 13.518 0.421 1.00 0.00 C ATOM 193 NE ARG A 14 14.801 13.853 -0.742 1.00 0.00 N ATOM 194 CZ ARG A 14 14.127 15.024 -0.883 1.00 0.00 C ATOM 195 NH1 ARG A 14 14.042 15.883 0.132 1.00 0.00 N ATOM 196 NH2 ARG A 14 13.536 15.320 -2.033 1.00 0.00 N ATOM 0 H ARG A 14 14.666 7.914 1.125 1.00 0.00 H new ATOM 0 HA ARG A 14 16.070 10.113 1.771 1.00 0.00 H new ATOM 0 HB2 ARG A 14 15.352 11.149 -0.313 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.708 11.154 0.296 1.00 0.00 H new ATOM 0 HG2 ARG A 14 14.100 12.826 1.764 1.00 0.00 H new ATOM 0 HG3 ARG A 14 15.717 12.268 2.146 1.00 0.00 H new ATOM 0 HD2 ARG A 14 15.763 14.424 1.006 1.00 0.00 H new ATOM 0 HD3 ARG A 14 16.586 13.185 0.080 1.00 0.00 H new ATOM 0 HE ARG A 14 14.739 13.169 -1.496 1.00 0.00 H new ATOM 0 HH11 ARG A 14 14.485 15.664 1.024 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.534 16.760 0.017 1.00 0.00 H new ATOM 0 HH21 ARG A 14 13.587 14.667 -2.815 1.00 0.00 H new ATOM 0 HH22 ARG A 14 13.031 16.200 -2.135 1.00 0.00 H new ATOM 210 N HIS A 15 13.144 10.625 2.841 1.00 0.00 N ATOM 211 CA HIS A 15 12.399 10.613 4.103 1.00 0.00 C ATOM 212 C HIS A 15 10.928 10.604 3.893 1.00 0.00 C ATOM 213 O HIS A 15 10.414 11.153 2.914 1.00 0.00 O ATOM 214 CB HIS A 15 12.784 11.812 4.994 1.00 0.00 C ATOM 215 CG HIS A 15 14.125 11.687 5.673 1.00 0.00 C ATOM 216 ND1 HIS A 15 14.285 11.397 7.015 1.00 0.00 N ATOM 217 CD2 HIS A 15 15.369 11.850 5.186 1.00 0.00 C ATOM 218 CE1 HIS A 15 15.572 11.393 7.307 1.00 0.00 C ATOM 219 NE2 HIS A 15 16.249 11.666 6.216 1.00 0.00 N ATOM 0 H HIS A 15 12.822 11.305 2.152 1.00 0.00 H new ATOM 0 HA HIS A 15 12.675 9.687 4.608 1.00 0.00 H new ATOM 0 HB2 HIS A 15 12.783 12.715 4.384 1.00 0.00 H new ATOM 0 HB3 HIS A 15 12.016 11.942 5.757 1.00 0.00 H new ATOM 0 HD2 HIS A 15 15.626 12.084 4.164 1.00 0.00 H new ATOM 0 HE1 HIS A 15 15.997 11.198 8.280 1.00 0.00 H new ATOM 0 HE2 HIS A 15 17.265 11.730 6.148 1.00 0.00 H new ATOM 228 N HIS A 16 10.254 9.973 4.811 1.00 0.00 N ATOM 229 CA HIS A 16 8.811 9.950 4.822 1.00 0.00 C ATOM 230 C HIS A 16 8.385 11.215 5.481 1.00 0.00 C ATOM 231 O HIS A 16 9.078 11.704 6.390 1.00 0.00 O ATOM 232 CB HIS A 16 8.249 8.735 5.596 1.00 0.00 C ATOM 233 CG HIS A 16 8.562 7.400 4.982 1.00 0.00 C ATOM 234 ND1 HIS A 16 7.613 6.442 4.702 1.00 0.00 N ATOM 235 CD2 HIS A 16 9.742 6.845 4.647 1.00 0.00 C ATOM 236 CE1 HIS A 16 8.199 5.367 4.233 1.00 0.00 C ATOM 237 NE2 HIS A 16 9.493 5.579 4.190 1.00 0.00 N ATOM 0 H HIS A 16 10.686 9.457 5.577 1.00 0.00 H new ATOM 0 HA HIS A 16 8.430 9.863 3.804 1.00 0.00 H new ATOM 0 HB2 HIS A 16 8.644 8.754 6.612 1.00 0.00 H new ATOM 0 HB3 HIS A 16 7.167 8.839 5.673 1.00 0.00 H new ATOM 0 HD1 HIS A 16 6.608 6.552 4.839 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.711 7.315 4.725 1.00 0.00 H new ATOM 0 HE1 HIS A 16 7.699 4.458 3.932 1.00 0.00 H new ATOM 246 N ASN A 17 7.339 11.770 5.036 1.00 0.00 N ATOM 247 CA ASN A 17 6.896 13.003 5.594 1.00 0.00 C ATOM 248 C ASN A 17 5.426 12.931 5.873 1.00 0.00 C ATOM 249 O ASN A 17 4.794 11.906 5.585 1.00 0.00 O ATOM 250 CB ASN A 17 7.243 14.103 4.595 1.00 0.00 C ATOM 251 CG ASN A 17 7.665 15.384 5.241 1.00 0.00 C ATOM 252 OD1 ASN A 17 7.120 15.802 6.265 1.00 0.00 O ATOM 253 ND2 ASN A 17 8.699 15.968 4.698 1.00 0.00 N ATOM 0 H ASN A 17 6.759 11.401 4.283 1.00 0.00 H new ATOM 0 HA ASN A 17 7.385 13.216 6.544 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.044 13.752 3.944 1.00 0.00 H new ATOM 0 HB3 ASN A 17 6.377 14.293 3.961 1.00 0.00 H new ATOM 0 HD21 ASN A 17 9.091 16.809 5.122 1.00 0.00 H new ATOM 0 HD22 ASN A 17 9.115 15.583 3.850 1.00 0.00 H new ATOM 260 N GLY A 18 4.900 13.994 6.430 1.00 0.00 N ATOM 261 CA GLY A 18 3.519 14.074 6.783 1.00 0.00 C ATOM 262 C GLY A 18 2.621 13.853 5.605 1.00 0.00 C ATOM 263 O GLY A 18 2.600 14.659 4.667 1.00 0.00 O ATOM 0 H GLY A 18 5.433 14.835 6.651 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.298 13.332 7.550 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.313 15.052 7.217 1.00 0.00 H new ATOM 267 N PHE A 19 1.925 12.749 5.628 1.00 0.00 N ATOM 268 CA PHE A 19 0.990 12.379 4.586 1.00 0.00 C ATOM 269 C PHE A 19 -0.119 13.399 4.533 1.00 0.00 C ATOM 270 O PHE A 19 -0.590 13.860 5.589 1.00 0.00 O ATOM 271 CB PHE A 19 0.417 10.979 4.874 1.00 0.00 C ATOM 272 CG PHE A 19 1.411 9.850 4.761 1.00 0.00 C ATOM 273 CD1 PHE A 19 2.427 9.675 5.702 1.00 0.00 C ATOM 274 CD2 PHE A 19 1.337 8.971 3.705 1.00 0.00 C ATOM 275 CE1 PHE A 19 3.336 8.646 5.580 1.00 0.00 C ATOM 276 CE2 PHE A 19 2.238 7.947 3.577 1.00 0.00 C ATOM 277 CZ PHE A 19 3.244 7.779 4.512 1.00 0.00 C ATOM 0 H PHE A 19 1.989 12.065 6.382 1.00 0.00 H new ATOM 0 HA PHE A 19 1.500 12.354 3.623 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -0.003 10.974 5.880 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -0.405 10.790 4.184 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.502 10.355 6.537 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.558 9.090 2.967 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.116 8.520 6.317 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.163 7.267 2.741 1.00 0.00 H new ATOM 0 HZ PHE A 19 3.954 6.972 4.406 1.00 0.00 H new ATOM 287 N ASP A 20 -0.531 13.771 3.339 1.00 0.00 N ATOM 288 CA ASP A 20 -1.593 14.731 3.192 1.00 0.00 C ATOM 289 C ASP A 20 -2.863 14.049 3.514 1.00 0.00 C ATOM 290 O ASP A 20 -3.229 13.057 2.846 1.00 0.00 O ATOM 291 CB ASP A 20 -1.667 15.321 1.773 1.00 0.00 C ATOM 292 CG ASP A 20 -0.515 16.222 1.454 1.00 0.00 C ATOM 293 OD1 ASP A 20 -0.595 17.430 1.769 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.495 15.736 0.876 1.00 0.00 O ATOM 0 H ASP A 20 -0.145 13.422 2.462 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.403 15.566 3.866 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.696 14.507 1.048 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.598 15.878 1.665 1.00 0.00 H new ATOM 299 N PHE A 21 -3.548 14.520 4.530 1.00 0.00 N ATOM 300 CA PHE A 21 -4.758 13.860 4.932 1.00 0.00 C ATOM 301 C PHE A 21 -5.820 14.024 3.876 1.00 0.00 C ATOM 302 O PHE A 21 -6.648 13.180 3.738 1.00 0.00 O ATOM 303 CB PHE A 21 -5.279 14.297 6.306 1.00 0.00 C ATOM 304 CG PHE A 21 -6.369 13.378 6.803 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.090 12.041 7.052 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.675 13.824 6.973 1.00 0.00 C ATOM 307 CE1 PHE A 21 -7.073 11.173 7.468 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.671 12.952 7.386 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.368 11.627 7.632 1.00 0.00 C ATOM 0 H PHE A 21 -3.292 15.340 5.080 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.508 12.804 5.037 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.457 14.308 7.021 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.661 15.316 6.244 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.083 11.676 6.917 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.916 14.859 6.782 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.833 10.139 7.666 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.682 13.308 7.515 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.143 10.946 7.952 1.00 0.00 H new ATOM 319 N ALA A 22 -5.723 15.098 3.093 1.00 0.00 N ATOM 320 CA ALA A 22 -6.642 15.381 1.989 1.00 0.00 C ATOM 321 C ALA A 22 -6.787 14.171 1.060 1.00 0.00 C ATOM 322 O ALA A 22 -7.886 13.866 0.606 1.00 0.00 O ATOM 323 CB ALA A 22 -6.144 16.584 1.199 1.00 0.00 C ATOM 0 H ALA A 22 -4.996 15.804 3.208 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.622 15.601 2.412 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.831 16.790 0.379 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.090 17.453 1.855 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.153 16.371 0.797 1.00 0.00 H new ATOM 329 N VAL A 23 -5.684 13.469 0.842 1.00 0.00 N ATOM 330 CA VAL A 23 -5.650 12.281 -0.015 1.00 0.00 C ATOM 331 C VAL A 23 -6.507 11.147 0.601 1.00 0.00 C ATOM 332 O VAL A 23 -7.461 10.665 -0.016 1.00 0.00 O ATOM 333 CB VAL A 23 -4.184 11.780 -0.220 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.144 10.557 -1.117 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.290 12.880 -0.795 1.00 0.00 C ATOM 0 H VAL A 23 -4.781 13.704 1.254 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.062 12.557 -0.986 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.799 11.505 0.762 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.111 10.231 -1.242 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.726 9.754 -0.664 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.566 10.806 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.278 12.496 -0.924 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.683 13.201 -1.760 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.271 13.728 -0.111 1.00 0.00 H new ATOM 345 N ILE A 24 -6.178 10.769 1.835 1.00 0.00 N ATOM 346 CA ILE A 24 -6.891 9.698 2.567 1.00 0.00 C ATOM 347 C ILE A 24 -8.360 10.097 2.817 1.00 0.00 C ATOM 348 O ILE A 24 -9.283 9.281 2.748 1.00 0.00 O ATOM 349 CB ILE A 24 -6.170 9.387 3.918 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.723 8.938 3.631 1.00 0.00 C ATOM 351 CG2 ILE A 24 -6.932 8.353 4.753 1.00 0.00 C ATOM 352 CD1 ILE A 24 -3.977 8.331 4.799 1.00 0.00 C ATOM 0 H ILE A 24 -5.413 11.189 2.363 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.880 8.796 1.954 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.146 10.297 4.518 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.743 8.211 2.820 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.160 9.800 3.273 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.394 8.168 5.683 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.929 8.732 4.980 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.016 7.423 4.191 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -2.972 8.052 4.483 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -3.915 9.058 5.608 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.507 7.445 5.148 1.00 0.00 H new ATOM 364 N LYS A 25 -8.536 11.366 3.030 1.00 0.00 N ATOM 365 CA LYS A 25 -9.821 11.963 3.279 1.00 0.00 C ATOM 366 C LYS A 25 -10.699 11.828 2.044 1.00 0.00 C ATOM 367 O LYS A 25 -11.872 11.494 2.150 1.00 0.00 O ATOM 368 CB LYS A 25 -9.629 13.444 3.584 1.00 0.00 C ATOM 369 CG LYS A 25 -10.887 14.186 3.945 1.00 0.00 C ATOM 370 CD LYS A 25 -10.742 15.690 3.759 1.00 0.00 C ATOM 371 CE LYS A 25 -10.755 16.046 2.270 1.00 0.00 C ATOM 372 NZ LYS A 25 -10.794 17.506 2.026 1.00 0.00 N ATOM 0 H LYS A 25 -7.769 12.038 3.036 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.296 11.461 4.122 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.919 13.542 4.405 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.179 13.923 2.715 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.710 13.823 3.329 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.147 13.973 4.982 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.555 16.206 4.270 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.812 16.031 4.213 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.869 15.627 1.794 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.620 15.581 1.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.801 17.687 1.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.653 17.907 2.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.955 17.951 2.450 1.00 0.00 H new ATOM 386 N GLU A 26 -10.120 12.065 0.875 1.00 0.00 N ATOM 387 CA GLU A 26 -10.871 12.045 -0.363 1.00 0.00 C ATOM 388 C GLU A 26 -11.279 10.618 -0.719 1.00 0.00 C ATOM 389 O GLU A 26 -12.362 10.380 -1.279 1.00 0.00 O ATOM 390 CB GLU A 26 -10.071 12.665 -1.503 1.00 0.00 C ATOM 391 CG GLU A 26 -10.946 13.307 -2.551 1.00 0.00 C ATOM 392 CD GLU A 26 -11.670 14.513 -1.986 1.00 0.00 C ATOM 393 OE1 GLU A 26 -12.743 14.354 -1.379 1.00 0.00 O ATOM 394 OE2 GLU A 26 -11.147 15.642 -2.124 1.00 0.00 O ATOM 0 H GLU A 26 -9.128 12.274 0.763 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.771 12.642 -0.217 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.390 13.413 -1.098 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.457 11.895 -1.971 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.337 13.609 -3.403 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.672 12.582 -2.919 1.00 0.00 H new ATOM 401 N LEU A 27 -10.405 9.668 -0.418 1.00 0.00 N ATOM 402 CA LEU A 27 -10.743 8.275 -0.646 1.00 0.00 C ATOM 403 C LEU A 27 -11.927 7.889 0.263 1.00 0.00 C ATOM 404 O LEU A 27 -12.781 7.091 -0.117 1.00 0.00 O ATOM 405 CB LEU A 27 -9.533 7.340 -0.420 1.00 0.00 C ATOM 406 CG LEU A 27 -9.723 5.895 -0.920 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.061 5.904 -2.383 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.467 5.074 -0.712 1.00 0.00 C ATOM 0 H LEU A 27 -9.478 9.832 -0.025 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.033 8.153 -1.690 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.664 7.769 -0.918 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.308 7.313 0.646 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.535 5.446 -0.348 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.194 4.880 -2.732 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.983 6.464 -2.540 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.251 6.375 -2.941 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.631 4.059 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.642 5.526 -1.262 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.223 5.045 0.350 1.00 0.00 H new ATOM 420 N LYS A 28 -11.996 8.523 1.435 1.00 0.00 N ATOM 421 CA LYS A 28 -13.096 8.310 2.367 1.00 0.00 C ATOM 422 C LYS A 28 -14.365 9.029 1.857 1.00 0.00 C ATOM 423 O LYS A 28 -15.493 8.576 2.089 1.00 0.00 O ATOM 424 CB LYS A 28 -12.726 8.811 3.766 1.00 0.00 C ATOM 425 CG LYS A 28 -13.671 8.331 4.861 1.00 0.00 C ATOM 426 CD LYS A 28 -13.278 8.872 6.216 1.00 0.00 C ATOM 427 CE LYS A 28 -14.155 8.276 7.289 1.00 0.00 C ATOM 428 NZ LYS A 28 -13.760 8.744 8.615 1.00 0.00 N ATOM 0 H LYS A 28 -11.297 9.191 1.759 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.296 7.240 2.431 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.714 8.483 4.003 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.715 9.901 3.760 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.689 8.643 4.626 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.670 7.241 4.890 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.233 8.639 6.419 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -13.370 9.958 6.223 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.195 8.542 7.102 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.093 7.188 7.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.380 8.318 9.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -12.775 8.468 8.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -13.843 9.780 8.657 1.00 0.00 H new ATOM 442 N THR A 29 -14.166 10.150 1.171 1.00 0.00 N ATOM 443 CA THR A 29 -15.246 10.874 0.535 1.00 0.00 C ATOM 444 C THR A 29 -15.968 9.924 -0.435 1.00 0.00 C ATOM 445 O THR A 29 -17.201 9.740 -0.382 1.00 0.00 O ATOM 446 CB THR A 29 -14.703 12.065 -0.288 1.00 0.00 C ATOM 447 OG1 THR A 29 -13.876 12.916 0.519 1.00 0.00 O ATOM 448 CG2 THR A 29 -15.836 12.884 -0.855 1.00 0.00 C ATOM 0 H THR A 29 -13.249 10.577 1.044 1.00 0.00 H new ATOM 0 HA THR A 29 -15.917 11.246 1.309 1.00 0.00 H new ATOM 0 HB THR A 29 -14.108 11.651 -1.102 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.497 13.628 -0.038 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.431 13.716 -1.430 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.448 12.258 -1.504 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.449 13.270 -0.041 1.00 0.00 H new ATOM 456 N ALA A 30 -15.186 9.267 -1.283 1.00 0.00 N ATOM 457 CA ALA A 30 -15.693 8.357 -2.240 1.00 0.00 C ATOM 458 C ALA A 30 -16.201 7.100 -1.571 1.00 0.00 C ATOM 459 O ALA A 30 -17.128 6.514 -2.037 1.00 0.00 O ATOM 460 CB ALA A 30 -14.631 8.023 -3.256 1.00 0.00 C ATOM 0 H ALA A 30 -14.171 9.369 -1.306 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.531 8.829 -2.753 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.034 7.322 -3.987 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -14.314 8.934 -3.764 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.776 7.571 -2.753 1.00 0.00 H new ATOM 466 N ALA A 31 -15.565 6.687 -0.510 1.00 0.00 N ATOM 467 CA ALA A 31 -16.026 5.516 0.259 1.00 0.00 C ATOM 468 C ALA A 31 -17.503 5.634 0.623 1.00 0.00 C ATOM 469 O ALA A 31 -18.239 4.645 0.616 1.00 0.00 O ATOM 470 CB ALA A 31 -15.260 5.425 1.535 1.00 0.00 C ATOM 0 H ALA A 31 -14.723 7.130 -0.141 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.872 4.635 -0.364 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.601 4.559 2.103 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.198 5.319 1.315 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.421 6.330 2.121 1.00 0.00 H new ATOM 476 N SER A 32 -17.927 6.840 0.936 1.00 0.00 N ATOM 477 CA SER A 32 -19.292 7.077 1.282 1.00 0.00 C ATOM 478 C SER A 32 -20.188 7.120 0.030 1.00 0.00 C ATOM 479 O SER A 32 -21.162 6.365 -0.065 1.00 0.00 O ATOM 480 CB SER A 32 -19.416 8.376 2.096 1.00 0.00 C ATOM 481 OG SER A 32 -20.740 8.571 2.564 1.00 0.00 O ATOM 0 H SER A 32 -17.333 7.669 0.955 1.00 0.00 H new ATOM 0 HA SER A 32 -19.637 6.247 1.899 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.731 8.343 2.943 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.119 9.224 1.478 1.00 0.00 H new ATOM 0 HG SER A 32 -20.786 9.404 3.079 1.00 0.00 H new ATOM 487 N GLN A 33 -19.843 7.976 -0.946 1.00 0.00 N ATOM 488 CA GLN A 33 -20.718 8.208 -2.109 1.00 0.00 C ATOM 489 C GLN A 33 -20.624 7.093 -3.144 1.00 0.00 C ATOM 490 O GLN A 33 -21.626 6.573 -3.636 1.00 0.00 O ATOM 491 CB GLN A 33 -20.308 9.480 -2.841 1.00 0.00 C ATOM 492 CG GLN A 33 -19.813 10.621 -1.989 1.00 0.00 C ATOM 493 CD GLN A 33 -19.563 11.892 -2.784 1.00 0.00 C ATOM 494 OE1 GLN A 33 -18.701 12.694 -2.432 1.00 0.00 O ATOM 495 NE2 GLN A 33 -20.286 12.085 -3.853 1.00 0.00 N ATOM 0 H GLN A 33 -18.976 8.513 -0.955 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.728 8.267 -1.704 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.526 9.224 -3.556 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -21.164 9.832 -3.417 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -20.544 10.826 -1.207 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.890 10.322 -1.492 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.994 11.401 -4.120 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -20.143 12.920 -4.422 1.00 0.00 H new ATOM 504 N TYR A 34 -19.417 6.736 -3.437 1.00 0.00 N ATOM 505 CA TYR A 34 -19.066 5.882 -4.529 1.00 0.00 C ATOM 506 C TYR A 34 -18.950 4.447 -4.082 1.00 0.00 C ATOM 507 O TYR A 34 -19.528 3.552 -4.702 1.00 0.00 O ATOM 508 CB TYR A 34 -17.721 6.381 -5.126 1.00 0.00 C ATOM 509 CG TYR A 34 -17.822 7.634 -5.968 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.845 8.893 -5.387 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.885 7.552 -7.351 1.00 0.00 C ATOM 512 CE1 TYR A 34 -17.927 10.036 -6.153 1.00 0.00 C ATOM 513 CE2 TYR A 34 -17.968 8.685 -8.132 1.00 0.00 C ATOM 514 CZ TYR A 34 -17.989 9.925 -7.532 1.00 0.00 C ATOM 515 OH TYR A 34 -18.043 11.060 -8.313 1.00 0.00 O ATOM 0 H TYR A 34 -18.609 7.045 -2.897 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.848 5.920 -5.287 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.024 6.566 -4.309 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.294 5.585 -5.736 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.798 8.980 -4.312 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.869 6.582 -7.825 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -17.943 11.008 -5.683 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.016 8.601 -9.208 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.081 10.805 -9.258 1.00 0.00 H new ATOM 525 N GLY A 35 -18.280 4.246 -2.970 1.00 0.00 N ATOM 526 CA GLY A 35 -17.989 2.920 -2.497 1.00 0.00 C ATOM 527 C GLY A 35 -16.971 2.242 -3.374 1.00 0.00 C ATOM 528 O GLY A 35 -16.632 2.736 -4.451 1.00 0.00 O ATOM 0 H GLY A 35 -17.925 4.994 -2.374 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.617 2.969 -1.474 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.905 2.330 -2.475 1.00 0.00 H new ATOM 532 N ALA A 36 -16.545 1.090 -2.975 1.00 0.00 N ATOM 533 CA ALA A 36 -15.523 0.426 -3.701 1.00 0.00 C ATOM 534 C ALA A 36 -16.136 -0.488 -4.697 1.00 0.00 C ATOM 535 O ALA A 36 -16.962 -1.317 -4.346 1.00 0.00 O ATOM 536 CB ALA A 36 -14.593 -0.307 -2.783 1.00 0.00 C ATOM 0 H ALA A 36 -16.889 0.593 -2.153 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.925 1.169 -4.230 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.821 -0.805 -3.369 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -14.127 0.400 -2.096 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -15.153 -1.050 -2.215 1.00 0.00 H new ATOM 542 N THR A 37 -15.801 -0.206 -5.938 1.00 0.00 N ATOM 543 CA THR A 37 -16.157 -0.921 -7.162 1.00 0.00 C ATOM 544 C THR A 37 -16.386 0.162 -8.217 1.00 0.00 C ATOM 545 O THR A 37 -16.212 -0.048 -9.410 1.00 0.00 O ATOM 546 CB THR A 37 -17.403 -1.886 -7.054 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.348 -2.863 -8.089 1.00 0.00 O ATOM 548 CG2 THR A 37 -18.714 -1.158 -7.174 1.00 0.00 C ATOM 0 H THR A 37 -15.217 0.605 -6.143 1.00 0.00 H new ATOM 0 HA THR A 37 -15.347 -1.605 -7.414 1.00 0.00 H new ATOM 0 HB THR A 37 -17.353 -2.347 -6.068 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.122 -3.460 -8.017 1.00 0.00 H new ATOM 0 HG21 THR A 37 -19.535 -1.871 -7.093 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.794 -0.419 -6.376 1.00 0.00 H new ATOM 0 HG23 THR A 37 -18.764 -0.656 -8.140 1.00 0.00 H new ATOM 556 N ALA A 38 -16.746 1.352 -7.723 1.00 0.00 N ATOM 557 CA ALA A 38 -16.915 2.515 -8.553 1.00 0.00 C ATOM 558 C ALA A 38 -15.548 3.023 -8.982 1.00 0.00 C ATOM 559 O ALA A 38 -14.689 3.295 -8.119 1.00 0.00 O ATOM 560 CB ALA A 38 -17.675 3.589 -7.798 1.00 0.00 C ATOM 0 H ALA A 38 -16.925 1.520 -6.733 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.492 2.253 -9.440 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.797 4.465 -8.436 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.656 3.208 -7.513 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.119 3.867 -6.903 1.00 0.00 H new ATOM 566 N PRO A 39 -15.342 3.183 -10.307 1.00 0.00 N ATOM 567 CA PRO A 39 -14.046 3.541 -10.936 1.00 0.00 C ATOM 568 C PRO A 39 -13.266 4.626 -10.213 1.00 0.00 C ATOM 569 O PRO A 39 -12.057 4.505 -10.021 1.00 0.00 O ATOM 570 CB PRO A 39 -14.470 4.026 -12.308 1.00 0.00 C ATOM 571 CG PRO A 39 -15.627 3.157 -12.627 1.00 0.00 C ATOM 572 CD PRO A 39 -16.390 3.030 -11.343 1.00 0.00 C ATOM 0 HA PRO A 39 -13.362 2.693 -10.930 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.748 5.080 -12.295 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.670 3.917 -13.040 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.245 3.596 -13.410 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.299 2.182 -12.988 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.159 3.798 -11.254 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.893 2.066 -11.267 1.00 0.00 H new ATOM 580 N TYR A 40 -13.973 5.652 -9.779 1.00 0.00 N ATOM 581 CA TYR A 40 -13.367 6.793 -9.117 1.00 0.00 C ATOM 582 C TYR A 40 -12.520 6.394 -7.891 1.00 0.00 C ATOM 583 O TYR A 40 -11.329 6.686 -7.839 1.00 0.00 O ATOM 584 CB TYR A 40 -14.455 7.814 -8.739 1.00 0.00 C ATOM 585 CG TYR A 40 -13.966 9.039 -7.975 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.194 10.014 -8.588 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.285 9.209 -6.640 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.753 11.122 -7.890 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.854 10.310 -5.932 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.090 11.267 -6.558 1.00 0.00 C ATOM 591 OH TYR A 40 -12.657 12.368 -5.845 1.00 0.00 O ATOM 0 H TYR A 40 -14.986 5.718 -9.876 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.674 7.253 -9.821 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.948 8.149 -9.652 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.210 7.309 -8.137 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -12.933 9.905 -9.630 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.885 8.462 -6.141 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.149 11.870 -8.382 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.115 10.421 -4.890 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.986 12.311 -4.924 1.00 0.00 H new ATOM 601 N THR A 41 -13.114 5.680 -6.923 1.00 0.00 N ATOM 602 CA THR A 41 -12.451 5.384 -5.670 1.00 0.00 C ATOM 603 C THR A 41 -11.259 4.424 -5.858 1.00 0.00 C ATOM 604 O THR A 41 -10.207 4.619 -5.253 1.00 0.00 O ATOM 605 CB THR A 41 -13.470 4.846 -4.606 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.930 4.922 -3.284 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.835 3.416 -4.889 1.00 0.00 C ATOM 0 H THR A 41 -14.058 5.300 -6.997 1.00 0.00 H new ATOM 0 HA THR A 41 -12.040 6.319 -5.291 1.00 0.00 H new ATOM 0 HB THR A 41 -14.358 5.475 -4.671 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.587 4.581 -2.642 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.543 3.066 -4.138 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.290 3.345 -5.877 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.937 2.798 -4.858 1.00 0.00 H new ATOM 615 N LEU A 42 -11.385 3.411 -6.712 1.00 0.00 N ATOM 616 CA LEU A 42 -10.263 2.521 -6.887 1.00 0.00 C ATOM 617 C LEU A 42 -9.186 3.089 -7.754 1.00 0.00 C ATOM 618 O LEU A 42 -8.052 2.696 -7.632 1.00 0.00 O ATOM 619 CB LEU A 42 -10.556 1.008 -7.113 1.00 0.00 C ATOM 620 CG LEU A 42 -11.645 0.565 -8.104 1.00 0.00 C ATOM 621 CD1 LEU A 42 -13.006 0.741 -7.492 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.548 1.277 -9.453 1.00 0.00 C ATOM 0 H LEU A 42 -12.215 3.199 -7.266 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.853 2.478 -5.878 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.623 0.543 -7.431 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.810 0.581 -6.143 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.482 -0.493 -8.310 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.769 0.424 -8.203 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -13.079 0.137 -6.588 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.159 1.790 -7.240 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.343 0.923 -10.109 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.652 2.352 -9.305 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.580 1.065 -9.908 1.00 0.00 H new ATOM 634 N ALA A 43 -9.539 4.056 -8.604 1.00 0.00 N ATOM 635 CA ALA A 43 -8.535 4.809 -9.342 1.00 0.00 C ATOM 636 C ALA A 43 -7.635 5.506 -8.354 1.00 0.00 C ATOM 637 O ALA A 43 -6.421 5.536 -8.509 1.00 0.00 O ATOM 638 CB ALA A 43 -9.173 5.812 -10.281 1.00 0.00 C ATOM 0 H ALA A 43 -10.503 4.330 -8.794 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.953 4.121 -9.956 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.394 6.356 -10.816 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.807 5.288 -10.997 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.778 6.514 -9.707 1.00 0.00 H new ATOM 644 N ILE A 44 -8.238 5.988 -7.296 1.00 0.00 N ATOM 645 CA ILE A 44 -7.518 6.632 -6.228 1.00 0.00 C ATOM 646 C ILE A 44 -6.688 5.583 -5.457 1.00 0.00 C ATOM 647 O ILE A 44 -5.541 5.845 -5.101 1.00 0.00 O ATOM 648 CB ILE A 44 -8.484 7.376 -5.294 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.307 8.368 -6.111 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.726 8.106 -4.177 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.496 8.901 -5.371 1.00 0.00 C ATOM 0 H ILE A 44 -9.247 5.944 -7.152 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.837 7.372 -6.649 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.146 6.649 -4.823 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.669 9.201 -6.408 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.645 7.882 -7.026 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.437 8.623 -3.533 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.161 7.383 -3.588 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.041 8.831 -4.616 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.037 9.600 -6.008 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.154 8.076 -5.097 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.163 9.415 -4.469 1.00 0.00 H new ATOM 663 N VAL A 45 -7.253 4.374 -5.264 1.00 0.00 N ATOM 664 CA VAL A 45 -6.527 3.248 -4.618 1.00 0.00 C ATOM 665 C VAL A 45 -5.245 2.953 -5.424 1.00 0.00 C ATOM 666 O VAL A 45 -4.149 2.825 -4.867 1.00 0.00 O ATOM 667 CB VAL A 45 -7.427 1.925 -4.509 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.643 0.708 -4.000 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.622 2.139 -3.590 1.00 0.00 C ATOM 0 H VAL A 45 -8.207 4.147 -5.544 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.277 3.545 -3.599 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.764 1.723 -5.526 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.306 -0.156 -3.948 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.820 0.494 -4.682 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.245 0.921 -3.008 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.210 1.223 -3.539 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.271 2.401 -2.592 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.241 2.947 -3.980 1.00 0.00 H new ATOM 679 N GLU A 46 -5.395 2.942 -6.745 1.00 0.00 N ATOM 680 CA GLU A 46 -4.294 2.677 -7.650 1.00 0.00 C ATOM 681 C GLU A 46 -3.292 3.845 -7.681 1.00 0.00 C ATOM 682 O GLU A 46 -2.077 3.630 -7.802 1.00 0.00 O ATOM 683 CB GLU A 46 -4.799 2.399 -9.064 1.00 0.00 C ATOM 684 CG GLU A 46 -5.844 1.306 -9.159 1.00 0.00 C ATOM 685 CD GLU A 46 -6.109 0.862 -10.579 1.00 0.00 C ATOM 686 OE1 GLU A 46 -6.886 1.515 -11.292 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.545 -0.169 -11.003 1.00 0.00 O ATOM 0 H GLU A 46 -6.284 3.117 -7.213 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.782 1.791 -7.275 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.217 3.319 -9.474 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.950 2.127 -9.692 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.518 0.448 -8.571 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.774 1.661 -8.716 1.00 0.00 H new ATOM 694 N SER A 47 -3.804 5.063 -7.557 1.00 0.00 N ATOM 695 CA SER A 47 -2.979 6.259 -7.566 1.00 0.00 C ATOM 696 C SER A 47 -2.139 6.360 -6.300 1.00 0.00 C ATOM 697 O SER A 47 -0.937 6.601 -6.358 1.00 0.00 O ATOM 698 CB SER A 47 -3.843 7.500 -7.704 1.00 0.00 C ATOM 699 OG SER A 47 -4.602 7.484 -8.905 1.00 0.00 O ATOM 0 H SER A 47 -4.801 5.247 -7.448 1.00 0.00 H new ATOM 0 HA SER A 47 -2.308 6.190 -8.422 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.516 7.571 -6.850 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.210 8.387 -7.686 1.00 0.00 H new ATOM 0 HG SER A 47 -5.450 7.017 -8.750 1.00 0.00 H new ATOM 705 N VAL A 48 -2.765 6.148 -5.149 1.00 0.00 N ATOM 706 CA VAL A 48 -2.062 6.244 -3.879 1.00 0.00 C ATOM 707 C VAL A 48 -1.066 5.088 -3.725 1.00 0.00 C ATOM 708 O VAL A 48 -0.092 5.183 -3.001 1.00 0.00 O ATOM 709 CB VAL A 48 -3.032 6.320 -2.671 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.274 6.536 -1.375 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.032 7.437 -2.866 1.00 0.00 C ATOM 0 H VAL A 48 -3.754 5.910 -5.070 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.504 7.180 -3.887 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.562 5.369 -2.610 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.979 6.585 -0.545 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.583 5.708 -1.215 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.715 7.470 -1.432 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.705 7.476 -2.010 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.504 8.386 -2.957 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.609 7.255 -3.773 1.00 0.00 H new ATOM 721 N ALA A 49 -1.299 4.014 -4.446 1.00 0.00 N ATOM 722 CA ALA A 49 -0.359 2.908 -4.464 1.00 0.00 C ATOM 723 C ALA A 49 0.926 3.319 -5.189 1.00 0.00 C ATOM 724 O ALA A 49 1.993 2.837 -4.869 1.00 0.00 O ATOM 725 CB ALA A 49 -0.977 1.670 -5.100 1.00 0.00 C ATOM 0 H ALA A 49 -2.127 3.880 -5.026 1.00 0.00 H new ATOM 0 HA ALA A 49 -0.108 2.653 -3.434 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.249 0.859 -5.099 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.857 1.369 -4.531 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.268 1.895 -6.126 1.00 0.00 H new ATOM 731 N ASP A 50 0.826 4.309 -6.092 1.00 0.00 N ATOM 732 CA ASP A 50 1.989 4.786 -6.906 1.00 0.00 C ATOM 733 C ASP A 50 2.792 5.790 -6.074 1.00 0.00 C ATOM 734 O ASP A 50 3.813 6.369 -6.493 1.00 0.00 O ATOM 735 CB ASP A 50 1.482 5.426 -8.241 1.00 0.00 C ATOM 736 CG ASP A 50 2.571 6.092 -9.100 1.00 0.00 C ATOM 737 OD1 ASP A 50 3.308 5.375 -9.835 1.00 0.00 O ATOM 738 OD2 ASP A 50 2.680 7.347 -9.083 1.00 0.00 O ATOM 0 H ASP A 50 -0.044 4.804 -6.287 1.00 0.00 H new ATOM 0 HA ASP A 50 2.636 3.949 -7.168 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.995 4.652 -8.835 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.722 6.171 -8.003 1.00 0.00 H new ATOM 743 N ASN A 51 2.363 5.915 -4.871 1.00 0.00 N ATOM 744 CA ASN A 51 2.933 6.808 -3.914 1.00 0.00 C ATOM 745 C ASN A 51 3.671 5.996 -2.904 1.00 0.00 C ATOM 746 O ASN A 51 3.328 4.836 -2.659 1.00 0.00 O ATOM 747 CB ASN A 51 1.851 7.627 -3.206 1.00 0.00 C ATOM 748 CG ASN A 51 1.354 8.806 -4.000 1.00 0.00 C ATOM 749 OD1 ASN A 51 1.871 9.917 -3.857 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.376 8.590 -4.837 1.00 0.00 N ATOM 0 H ASN A 51 1.575 5.380 -4.506 1.00 0.00 H new ATOM 0 HA ASN A 51 3.600 7.501 -4.426 1.00 0.00 H new ATOM 0 HB2 ASN A 51 1.008 6.975 -2.978 1.00 0.00 H new ATOM 0 HB3 ASN A 51 2.245 7.984 -2.254 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.011 9.356 -5.404 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -0.023 7.656 -4.925 1.00 0.00 H new ATOM 757 N TRP A 52 4.656 6.572 -2.308 1.00 0.00 N ATOM 758 CA TRP A 52 5.442 5.844 -1.357 1.00 0.00 C ATOM 759 C TRP A 52 4.827 6.013 0.014 1.00 0.00 C ATOM 760 O TRP A 52 4.906 7.082 0.625 1.00 0.00 O ATOM 761 CB TRP A 52 6.879 6.326 -1.378 1.00 0.00 C ATOM 762 CG TRP A 52 7.455 6.392 -2.757 1.00 0.00 C ATOM 763 CD1 TRP A 52 7.725 5.354 -3.595 1.00 0.00 C ATOM 764 CD2 TRP A 52 7.848 7.567 -3.441 1.00 0.00 C ATOM 765 NE1 TRP A 52 8.248 5.821 -4.769 1.00 0.00 N ATOM 766 CE2 TRP A 52 8.344 7.175 -4.692 1.00 0.00 C ATOM 767 CE3 TRP A 52 7.831 8.911 -3.120 1.00 0.00 C ATOM 768 CZ2 TRP A 52 8.820 8.088 -5.614 1.00 0.00 C ATOM 769 CZ3 TRP A 52 8.309 9.808 -4.031 1.00 0.00 C ATOM 770 CH2 TRP A 52 8.796 9.396 -5.260 1.00 0.00 C ATOM 0 H TRP A 52 4.941 7.540 -2.457 1.00 0.00 H new ATOM 0 HA TRP A 52 5.450 4.785 -1.616 1.00 0.00 H new ATOM 0 HB2 TRP A 52 6.931 7.314 -0.921 1.00 0.00 H new ATOM 0 HB3 TRP A 52 7.489 5.660 -0.767 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.551 4.313 -3.366 1.00 0.00 H new ATOM 0 HE1 TRP A 52 8.520 5.249 -5.569 1.00 0.00 H new ATOM 0 HE3 TRP A 52 7.447 9.245 -2.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 9.195 7.772 -6.576 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.307 10.860 -3.788 1.00 0.00 H new ATOM 0 HH2 TRP A 52 9.166 10.136 -5.954 1.00 0.00 H new ATOM 781 N LEU A 53 4.173 4.978 0.474 1.00 0.00 N ATOM 782 CA LEU A 53 3.503 5.003 1.755 1.00 0.00 C ATOM 783 C LEU A 53 4.377 4.485 2.897 1.00 0.00 C ATOM 784 O LEU A 53 5.397 5.082 3.191 1.00 0.00 O ATOM 785 CB LEU A 53 2.106 4.324 1.717 1.00 0.00 C ATOM 786 CG LEU A 53 0.907 5.191 1.257 1.00 0.00 C ATOM 787 CD1 LEU A 53 1.180 5.881 -0.049 1.00 0.00 C ATOM 788 CD2 LEU A 53 -0.331 4.342 1.119 1.00 0.00 C ATOM 0 H LEU A 53 4.088 4.093 -0.026 1.00 0.00 H new ATOM 0 HA LEU A 53 3.322 6.056 1.972 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.169 3.459 1.057 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.887 3.948 2.716 1.00 0.00 H new ATOM 0 HG LEU A 53 0.753 5.954 2.020 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.313 6.478 -0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.049 6.531 0.057 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.377 5.136 -0.820 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.165 4.965 0.795 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.155 3.559 0.381 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.569 3.887 2.081 1.00 0.00 H new ATOM 800 N THR A 54 4.027 3.299 3.379 1.00 0.00 N ATOM 801 CA THR A 54 4.566 2.606 4.577 1.00 0.00 C ATOM 802 C THR A 54 3.513 1.534 4.893 1.00 0.00 C ATOM 803 O THR A 54 2.345 1.826 4.772 1.00 0.00 O ATOM 804 CB THR A 54 4.684 3.512 5.900 1.00 0.00 C ATOM 805 OG1 THR A 54 5.512 4.650 5.733 1.00 0.00 O ATOM 806 CG2 THR A 54 5.269 2.725 7.060 1.00 0.00 C ATOM 0 H THR A 54 3.306 2.742 2.920 1.00 0.00 H new ATOM 0 HA THR A 54 5.575 2.263 4.347 1.00 0.00 H new ATOM 0 HB THR A 54 3.661 3.830 6.102 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.746 4.748 4.786 1.00 0.00 H new ATOM 0 HG21 THR A 54 5.335 3.367 7.939 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.627 1.872 7.281 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.265 2.371 6.794 1.00 0.00 H new ATOM 814 N PRO A 55 3.880 0.282 5.203 1.00 0.00 N ATOM 815 CA PRO A 55 2.912 -0.738 5.659 1.00 0.00 C ATOM 816 C PRO A 55 2.015 -0.226 6.812 1.00 0.00 C ATOM 817 O PRO A 55 0.800 -0.472 6.832 1.00 0.00 O ATOM 818 CB PRO A 55 3.820 -1.869 6.133 1.00 0.00 C ATOM 819 CG PRO A 55 4.997 -1.764 5.230 1.00 0.00 C ATOM 820 CD PRO A 55 5.225 -0.290 5.029 1.00 0.00 C ATOM 0 HA PRO A 55 2.211 -1.030 4.878 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.103 -1.746 7.178 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.332 -2.840 6.047 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.873 -2.239 5.672 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.808 -2.264 4.280 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.931 0.112 5.756 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.629 -0.076 4.040 1.00 0.00 H new ATOM 828 N THR A 56 2.620 0.503 7.740 1.00 0.00 N ATOM 829 CA THR A 56 1.913 1.143 8.839 1.00 0.00 C ATOM 830 C THR A 56 0.840 2.139 8.306 1.00 0.00 C ATOM 831 O THR A 56 -0.327 2.116 8.740 1.00 0.00 O ATOM 832 CB THR A 56 2.936 1.896 9.702 1.00 0.00 C ATOM 833 OG1 THR A 56 4.093 1.038 9.878 1.00 0.00 O ATOM 834 CG2 THR A 56 2.348 2.241 11.067 1.00 0.00 C ATOM 0 H THR A 56 3.627 0.668 7.750 1.00 0.00 H new ATOM 0 HA THR A 56 1.402 0.382 9.429 1.00 0.00 H new ATOM 0 HB THR A 56 3.213 2.827 9.208 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.762 1.499 10.426 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.092 2.774 11.659 1.00 0.00 H new ATOM 0 HG22 THR A 56 1.469 2.872 10.936 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.063 1.324 11.583 1.00 0.00 H new ATOM 842 N ASP A 57 1.212 2.961 7.311 1.00 0.00 N ATOM 843 CA ASP A 57 0.280 3.934 6.737 1.00 0.00 C ATOM 844 C ASP A 57 -0.719 3.289 5.839 1.00 0.00 C ATOM 845 O ASP A 57 -1.820 3.781 5.689 1.00 0.00 O ATOM 846 CB ASP A 57 0.957 5.115 6.063 1.00 0.00 C ATOM 847 CG ASP A 57 0.816 6.365 6.891 1.00 0.00 C ATOM 848 OD1 ASP A 57 1.584 6.545 7.861 1.00 0.00 O ATOM 849 OD2 ASP A 57 -0.069 7.168 6.618 1.00 0.00 O ATOM 0 H ASP A 57 2.143 2.969 6.894 1.00 0.00 H new ATOM 0 HA ASP A 57 -0.256 4.351 7.590 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.013 4.894 5.910 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.519 5.276 5.078 1.00 0.00 H new ATOM 854 N TRP A 58 -0.333 2.173 5.249 1.00 0.00 N ATOM 855 CA TRP A 58 -1.241 1.350 4.499 1.00 0.00 C ATOM 856 C TRP A 58 -2.415 0.963 5.388 1.00 0.00 C ATOM 857 O TRP A 58 -3.556 1.297 5.095 1.00 0.00 O ATOM 858 CB TRP A 58 -0.554 0.062 4.026 1.00 0.00 C ATOM 859 CG TRP A 58 0.028 0.064 2.646 1.00 0.00 C ATOM 860 CD1 TRP A 58 -0.157 0.976 1.643 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.831 -0.969 2.099 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.510 0.561 0.508 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.120 -0.626 0.769 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.343 -2.161 2.616 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.883 -1.421 -0.046 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.103 -2.958 1.801 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.367 -2.591 0.486 1.00 0.00 C ATOM 0 H TRP A 58 0.623 1.818 5.281 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.577 1.917 3.631 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.245 -0.173 4.729 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.279 -0.749 4.086 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.737 1.883 1.727 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.540 1.062 -0.380 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.144 -2.449 3.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.095 -1.138 -1.067 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.503 -3.885 2.185 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.967 -3.242 -0.132 1.00 0.00 H new ATOM 878 N ASN A 59 -2.122 0.279 6.489 1.00 0.00 N ATOM 879 CA ASN A 59 -3.167 -0.180 7.405 1.00 0.00 C ATOM 880 C ASN A 59 -3.966 0.996 7.942 1.00 0.00 C ATOM 881 O ASN A 59 -5.179 0.921 8.028 1.00 0.00 O ATOM 882 CB ASN A 59 -2.613 -1.081 8.531 1.00 0.00 C ATOM 883 CG ASN A 59 -2.104 -2.430 8.013 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.598 -2.961 6.990 1.00 0.00 O ATOM 885 ND2 ASN A 59 -1.132 -2.994 8.686 1.00 0.00 N ATOM 0 H ASN A 59 -1.174 0.030 6.770 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.850 -0.810 6.835 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.801 -0.562 9.039 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.395 -1.252 9.271 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.755 -3.892 8.382 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.752 -2.536 9.514 1.00 0.00 H new ATOM 892 N THR A 60 -3.270 2.111 8.160 1.00 0.00 N ATOM 893 CA THR A 60 -3.922 3.345 8.609 1.00 0.00 C ATOM 894 C THR A 60 -4.967 3.812 7.545 1.00 0.00 C ATOM 895 O THR A 60 -6.143 4.067 7.857 1.00 0.00 O ATOM 896 CB THR A 60 -2.870 4.493 8.831 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.880 4.109 9.822 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.548 5.785 9.278 1.00 0.00 C ATOM 0 H THR A 60 -2.261 2.188 8.035 1.00 0.00 H new ATOM 0 HA THR A 60 -4.420 3.136 9.556 1.00 0.00 H new ATOM 0 HB THR A 60 -2.375 4.662 7.875 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.409 3.305 9.519 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.795 6.560 9.423 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.257 6.107 8.515 1.00 0.00 H new ATOM 0 HG23 THR A 60 -4.077 5.613 10.215 1.00 0.00 H new ATOM 906 N LEU A 61 -4.527 3.836 6.298 1.00 0.00 N ATOM 907 CA LEU A 61 -5.300 4.317 5.182 1.00 0.00 C ATOM 908 C LEU A 61 -6.538 3.471 4.956 1.00 0.00 C ATOM 909 O LEU A 61 -7.626 3.989 5.065 1.00 0.00 O ATOM 910 CB LEU A 61 -4.382 4.449 3.933 1.00 0.00 C ATOM 911 CG LEU A 61 -4.944 5.149 2.691 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.802 5.665 1.864 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.695 4.185 1.838 1.00 0.00 C ATOM 0 H LEU A 61 -3.597 3.511 6.035 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.683 5.314 5.401 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.481 4.983 4.237 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.074 3.446 3.639 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.603 5.952 3.021 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.192 6.165 0.977 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.217 6.372 2.452 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.167 4.833 1.561 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -6.086 4.702 0.962 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.027 3.384 1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.522 3.762 2.408 1.00 0.00 H new ATOM 925 N VAL A 62 -6.364 2.163 4.726 1.00 0.00 N ATOM 926 CA VAL A 62 -7.512 1.251 4.470 1.00 0.00 C ATOM 927 C VAL A 62 -8.591 1.351 5.551 1.00 0.00 C ATOM 928 O VAL A 62 -9.771 1.562 5.260 1.00 0.00 O ATOM 929 CB VAL A 62 -7.066 -0.252 4.277 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.137 -0.717 5.382 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.279 -1.179 4.219 1.00 0.00 C ATOM 0 H VAL A 62 -5.453 1.705 4.710 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.946 1.591 3.530 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.526 -0.296 3.331 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.856 -1.756 5.208 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.242 -0.096 5.390 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.645 -0.634 6.343 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.945 -2.208 4.086 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.843 -1.098 5.148 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.916 -0.893 3.382 1.00 0.00 H new ATOM 941 N ARG A 63 -8.151 1.269 6.776 1.00 0.00 N ATOM 942 CA ARG A 63 -9.063 1.269 7.939 1.00 0.00 C ATOM 943 C ARG A 63 -9.761 2.612 8.153 1.00 0.00 C ATOM 944 O ARG A 63 -10.792 2.685 8.830 1.00 0.00 O ATOM 945 CB ARG A 63 -8.356 0.816 9.214 1.00 0.00 C ATOM 946 CG ARG A 63 -7.396 1.836 9.796 1.00 0.00 C ATOM 947 CD ARG A 63 -6.540 1.234 10.861 1.00 0.00 C ATOM 948 NE ARG A 63 -5.624 2.233 11.456 1.00 0.00 N ATOM 949 CZ ARG A 63 -4.384 1.967 11.914 1.00 0.00 C ATOM 950 NH1 ARG A 63 -3.948 0.713 12.015 1.00 0.00 N ATOM 951 NH2 ARG A 63 -3.605 2.961 12.322 1.00 0.00 N ATOM 0 H ARG A 63 -7.163 1.200 7.019 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.841 0.543 7.704 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -9.108 0.573 9.965 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.808 -0.102 9.004 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.765 2.237 9.003 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.959 2.673 10.209 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.173 0.811 11.641 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.960 0.413 10.441 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.956 3.195 11.525 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.554 -0.061 11.744 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.008 0.527 12.363 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.945 3.922 12.288 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.666 2.764 12.669 1.00 0.00 H new ATOM 965 N ALA A 64 -9.216 3.668 7.607 1.00 0.00 N ATOM 966 CA ALA A 64 -9.845 4.947 7.750 1.00 0.00 C ATOM 967 C ALA A 64 -10.728 5.264 6.553 1.00 0.00 C ATOM 968 O ALA A 64 -11.865 5.693 6.721 1.00 0.00 O ATOM 969 CB ALA A 64 -8.813 6.039 7.955 1.00 0.00 C ATOM 0 H ALA A 64 -8.350 3.666 7.067 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.480 4.905 8.635 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.316 7.000 8.061 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.236 5.830 8.856 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.143 6.073 7.096 1.00 0.00 H new ATOM 975 N VAL A 65 -10.160 5.095 5.397 1.00 0.00 N ATOM 976 CA VAL A 65 -10.842 5.412 4.136 1.00 0.00 C ATOM 977 C VAL A 65 -12.196 4.729 3.971 1.00 0.00 C ATOM 978 O VAL A 65 -13.180 5.393 3.710 1.00 0.00 O ATOM 979 CB VAL A 65 -9.962 5.205 2.870 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.736 6.061 2.944 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.572 3.756 2.667 1.00 0.00 C ATOM 0 H VAL A 65 -9.213 4.735 5.280 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.033 6.482 4.221 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.564 5.502 2.011 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.130 5.906 2.052 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.028 7.109 3.007 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.157 5.792 3.827 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.959 3.666 1.770 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.005 3.407 3.530 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.471 3.150 2.554 1.00 0.00 H new ATOM 991 N LEU A 66 -12.257 3.440 4.152 1.00 0.00 N ATOM 992 CA LEU A 66 -13.498 2.739 3.963 1.00 0.00 C ATOM 993 C LEU A 66 -13.925 2.051 5.239 1.00 0.00 C ATOM 994 O LEU A 66 -13.177 2.004 6.219 1.00 0.00 O ATOM 995 CB LEU A 66 -13.449 1.742 2.774 1.00 0.00 C ATOM 996 CG LEU A 66 -13.764 2.261 1.347 1.00 0.00 C ATOM 997 CD1 LEU A 66 -12.741 3.255 0.801 1.00 0.00 C ATOM 998 CD2 LEU A 66 -13.904 1.089 0.421 1.00 0.00 C ATOM 0 H LEU A 66 -11.468 2.855 4.428 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.248 3.487 3.706 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.451 1.304 2.752 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -14.147 0.934 2.992 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.698 2.818 1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.036 3.568 -0.201 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.696 4.126 1.454 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.760 2.781 0.759 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -14.126 1.445 -0.585 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.973 0.522 0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -14.715 0.448 0.766 1.00 0.00 H new ATOM 1010 N SER A 67 -15.127 1.553 5.244 1.00 0.00 N ATOM 1011 CA SER A 67 -15.673 0.884 6.392 1.00 0.00 C ATOM 1012 C SER A 67 -16.613 -0.243 5.947 1.00 0.00 C ATOM 1013 O SER A 67 -17.475 -0.051 5.077 1.00 0.00 O ATOM 1014 CB SER A 67 -16.415 1.897 7.294 1.00 0.00 C ATOM 1015 OG SER A 67 -15.554 2.989 7.666 1.00 0.00 O ATOM 0 H SER A 67 -15.762 1.599 4.447 1.00 0.00 H new ATOM 0 HA SER A 67 -14.860 0.444 6.969 1.00 0.00 H new ATOM 0 HB2 SER A 67 -17.290 2.282 6.770 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.776 1.393 8.191 1.00 0.00 H new ATOM 0 HG SER A 67 -16.048 3.616 8.235 1.00 0.00 H new ATOM 1021 N GLY A 68 -16.389 -1.413 6.492 1.00 0.00 N ATOM 1022 CA GLY A 68 -17.244 -2.536 6.232 1.00 0.00 C ATOM 1023 C GLY A 68 -16.565 -3.579 5.392 1.00 0.00 C ATOM 1024 O GLY A 68 -15.880 -4.472 5.923 1.00 0.00 O ATOM 0 H GLY A 68 -15.613 -1.610 7.124 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -17.557 -2.979 7.177 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -18.147 -2.194 5.726 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.691 -3.431 4.087 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.185 -4.415 3.157 1.00 0.00 C ATOM 1030 C GLY A 69 -14.699 -4.345 2.953 1.00 0.00 C ATOM 1031 O GLY A 69 -14.086 -5.328 2.518 1.00 0.00 O ATOM 0 H GLY A 69 -17.144 -2.630 3.647 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.447 -5.410 3.516 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.681 -4.282 2.196 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.124 -3.190 3.254 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.700 -2.903 3.019 1.00 0.00 C ATOM 1037 C ASP A 70 -11.793 -4.028 3.513 1.00 0.00 C ATOM 1038 O ASP A 70 -11.074 -4.625 2.725 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.287 -1.555 3.659 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.478 -1.519 5.168 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.625 -1.557 5.630 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.495 -1.527 5.916 1.00 0.00 O ATOM 0 H ASP A 70 -14.631 -2.411 3.674 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.571 -2.829 1.939 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.240 -1.357 3.428 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.870 -0.753 3.207 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.905 -4.380 4.779 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.027 -5.362 5.372 1.00 0.00 C ATOM 1049 C HIS A 71 -11.227 -6.723 4.725 1.00 0.00 C ATOM 1050 O HIS A 71 -10.258 -7.379 4.358 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.237 -5.444 6.895 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.179 -6.214 7.632 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.421 -7.369 8.333 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -8.868 -5.950 7.807 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.306 -7.782 8.902 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.355 -6.935 8.597 1.00 0.00 N ATOM 0 H HIS A 71 -12.601 -3.996 5.418 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.999 -5.047 5.192 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.278 -4.432 7.298 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.205 -5.904 7.091 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.324 -5.112 7.396 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.196 -8.665 9.513 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -7.384 -7.002 8.902 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.467 -7.095 4.525 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.754 -8.398 3.993 1.00 0.00 C ATOM 1067 C LEU A 72 -12.139 -8.665 2.619 1.00 0.00 C ATOM 1068 O LEU A 72 -11.317 -9.556 2.496 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.224 -8.865 4.209 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.382 -7.942 3.785 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.691 -8.055 2.306 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.619 -8.223 4.623 1.00 0.00 C ATOM 0 H LEU A 72 -13.285 -6.518 4.721 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.202 -9.096 4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.348 -9.809 3.679 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.347 -9.077 5.271 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.064 -6.915 3.964 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.514 -7.386 2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.809 -7.779 1.728 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.973 -9.081 2.071 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.428 -7.562 4.311 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.924 -9.260 4.485 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.393 -8.048 5.675 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.427 -7.869 1.621 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.815 -8.146 0.324 1.00 0.00 C ATOM 1086 C LEU A 73 -10.455 -7.520 0.104 1.00 0.00 C ATOM 1087 O LEU A 73 -9.509 -8.244 -0.220 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.730 -7.968 -0.860 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.456 -9.251 -1.357 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -12.461 -10.326 -1.768 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.420 -9.801 -0.323 1.00 0.00 C ATOM 0 H LEU A 73 -13.048 -7.061 1.662 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.626 -9.218 0.388 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.484 -7.224 -0.603 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.148 -7.560 -1.686 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.037 -8.958 -2.232 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.000 -11.209 -2.110 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.832 -9.950 -2.575 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.837 -10.590 -0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.903 -10.696 -0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.874 -10.052 0.586 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.177 -9.050 -0.096 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.331 -6.189 0.302 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.045 -5.505 0.141 1.00 0.00 C ATOM 1105 C TRP A 74 -7.959 -6.222 0.976 1.00 0.00 C ATOM 1106 O TRP A 74 -6.861 -6.486 0.548 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.105 -4.041 0.665 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.877 -2.936 -0.092 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.838 -3.010 -1.071 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.641 -1.551 0.105 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.267 -1.728 -1.414 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.536 -0.820 -0.689 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.759 -0.890 0.909 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.567 0.585 -0.676 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.759 0.513 0.940 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.671 1.233 0.154 1.00 0.00 C ATOM 0 H TRP A 74 -11.103 -5.579 0.571 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.814 -5.516 -0.924 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.521 -4.083 1.672 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.075 -3.698 0.760 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.207 -3.925 -1.510 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.999 -1.504 -2.088 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.063 -1.445 1.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.263 1.137 -1.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -8.056 1.039 1.569 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.673 2.312 0.198 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.304 -6.526 2.161 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.353 -7.018 3.111 1.00 0.00 C ATOM 1129 C LYS A 75 -7.097 -8.503 3.126 1.00 0.00 C ATOM 1130 O LYS A 75 -5.940 -8.894 3.275 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.504 -6.378 4.458 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.487 -4.865 4.341 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.142 -4.320 3.838 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.111 -4.354 4.973 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.890 -3.574 4.689 1.00 0.00 N ATOM 0 H LYS A 75 -9.256 -6.446 2.518 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.397 -6.673 2.718 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.439 -6.701 4.916 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.697 -6.706 5.114 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.278 -4.549 3.661 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.709 -4.428 5.314 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.790 -4.916 2.996 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.265 -3.299 3.476 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.573 -3.971 5.883 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.833 -5.390 5.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.600 -3.059 5.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.127 -4.218 4.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.082 -2.895 3.925 1.00 0.00 H new ATOM 1149 N SER A 76 -8.121 -9.349 2.954 1.00 0.00 N ATOM 1150 CA SER A 76 -7.833 -10.783 2.918 1.00 0.00 C ATOM 1151 C SER A 76 -6.939 -11.068 1.714 1.00 0.00 C ATOM 1152 O SER A 76 -5.979 -11.851 1.792 1.00 0.00 O ATOM 1153 CB SER A 76 -9.108 -11.610 2.849 1.00 0.00 C ATOM 1154 OG SER A 76 -9.977 -11.269 3.923 1.00 0.00 O ATOM 0 H SER A 76 -9.100 -9.085 2.844 1.00 0.00 H new ATOM 0 HA SER A 76 -7.322 -11.067 3.838 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.610 -11.437 1.897 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.864 -12.671 2.893 1.00 0.00 H new ATOM 0 HG SER A 76 -10.489 -10.467 3.688 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.207 -10.338 0.639 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.422 -10.410 -0.558 1.00 0.00 C ATOM 1162 C GLU A 77 -5.052 -9.786 -0.358 1.00 0.00 C ATOM 1163 O GLU A 77 -4.112 -10.193 -1.018 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.146 -9.743 -1.712 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.236 -10.566 -2.367 1.00 0.00 C ATOM 1166 CD GLU A 77 -7.656 -11.573 -3.317 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.129 -11.145 -4.372 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -7.695 -12.777 -3.047 1.00 0.00 O ATOM 0 H GLU A 77 -7.983 -9.679 0.586 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.278 -11.463 -0.799 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.585 -8.813 -1.352 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.412 -9.476 -2.472 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.819 -11.078 -1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.920 -9.908 -2.903 1.00 0.00 H new ATOM 1175 N PHE A 78 -4.923 -8.810 0.546 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.628 -8.206 0.820 1.00 0.00 C ATOM 1177 C PHE A 78 -2.666 -9.264 1.286 1.00 0.00 C ATOM 1178 O PHE A 78 -1.561 -9.377 0.772 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.779 -7.094 1.884 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.491 -6.498 2.358 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.798 -5.606 1.571 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.980 -6.829 3.604 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.621 -5.050 2.010 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.800 -6.279 4.053 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.117 -5.386 3.254 1.00 0.00 C ATOM 0 H PHE A 78 -5.695 -8.428 1.093 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.236 -7.756 -0.092 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.401 -6.299 1.472 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.311 -7.503 2.743 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.184 -5.340 0.598 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.515 -7.527 4.231 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.088 -4.350 1.383 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.412 -6.545 5.025 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.809 -4.950 3.599 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.119 -10.060 2.211 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.332 -11.130 2.771 1.00 0.00 C ATOM 1197 C PHE A 79 -1.991 -12.188 1.727 1.00 0.00 C ATOM 1198 O PHE A 79 -0.836 -12.634 1.623 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.077 -11.733 3.947 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.133 -10.820 5.137 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.011 -10.613 5.926 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.292 -10.133 5.440 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.059 -9.742 7.000 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.345 -9.260 6.503 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.231 -9.063 7.286 1.00 0.00 C ATOM 0 H PHE A 79 -4.057 -9.987 2.605 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.383 -10.723 3.119 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.093 -11.981 3.638 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.595 -12.667 4.235 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.093 -11.136 5.700 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.172 -10.283 4.832 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.183 -9.592 7.614 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.260 -8.730 6.722 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.271 -8.380 8.122 1.00 0.00 H new ATOM 1215 N GLU A 80 -2.975 -12.529 0.919 1.00 0.00 N ATOM 1216 CA GLU A 80 -2.802 -13.538 -0.107 1.00 0.00 C ATOM 1217 C GLU A 80 -1.838 -13.093 -1.201 1.00 0.00 C ATOM 1218 O GLU A 80 -0.852 -13.787 -1.470 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.145 -13.951 -0.707 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.093 -14.535 0.315 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.510 -15.734 1.018 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.551 -16.839 0.456 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.008 -15.589 2.152 1.00 0.00 O ATOM 0 H GLU A 80 -3.908 -12.119 0.954 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.359 -14.407 0.380 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.611 -13.083 -1.173 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -3.974 -14.683 -1.496 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.345 -13.772 1.051 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.022 -14.822 -0.177 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.084 -11.918 -1.788 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.261 -11.422 -2.894 1.00 0.00 C ATOM 1232 C ASN A 81 0.176 -11.224 -2.475 1.00 0.00 C ATOM 1233 O ASN A 81 1.091 -11.553 -3.230 1.00 0.00 O ATOM 1234 CB ASN A 81 -1.800 -10.131 -3.552 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.093 -10.322 -4.336 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.068 -10.767 -5.486 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.205 -9.901 -3.785 1.00 0.00 N ATOM 0 H ASN A 81 -2.844 -11.294 -1.517 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.313 -12.205 -3.651 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.966 -9.383 -2.776 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.038 -9.732 -4.222 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.079 -9.937 -4.309 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.196 -9.538 -2.832 1.00 0.00 H new ATOM 1244 N CYS A 82 0.379 -10.727 -1.264 1.00 0.00 N ATOM 1245 CA CYS A 82 1.715 -10.496 -0.765 1.00 0.00 C ATOM 1246 C CYS A 82 2.492 -11.795 -0.610 1.00 0.00 C ATOM 1247 O CYS A 82 3.532 -11.959 -1.215 1.00 0.00 O ATOM 1248 CB CYS A 82 1.689 -9.721 0.542 1.00 0.00 C ATOM 1249 SG CYS A 82 0.994 -8.058 0.409 1.00 0.00 S ATOM 0 H CYS A 82 -0.367 -10.478 -0.614 1.00 0.00 H new ATOM 0 HA CYS A 82 2.234 -9.890 -1.507 1.00 0.00 H new ATOM 0 HB2 CYS A 82 1.111 -10.286 1.274 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.706 -9.647 0.927 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.301 -8.121 0.500 1.00 0.00 H new ATOM 1255 N ARG A 83 1.950 -12.744 0.135 1.00 0.00 N ATOM 1256 CA ARG A 83 2.669 -13.985 0.382 1.00 0.00 C ATOM 1257 C ARG A 83 2.754 -14.912 -0.814 1.00 0.00 C ATOM 1258 O ARG A 83 3.648 -15.737 -0.887 1.00 0.00 O ATOM 1259 CB ARG A 83 2.256 -14.695 1.660 1.00 0.00 C ATOM 1260 CG ARG A 83 3.058 -14.238 2.880 1.00 0.00 C ATOM 1261 CD ARG A 83 2.880 -12.765 3.198 1.00 0.00 C ATOM 1262 NE ARG A 83 3.949 -12.236 4.083 1.00 0.00 N ATOM 1263 CZ ARG A 83 4.004 -12.366 5.408 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.059 -13.024 6.068 1.00 0.00 N ATOM 1265 NH2 ARG A 83 5.014 -11.810 6.070 1.00 0.00 N ATOM 0 H ARG A 83 1.031 -12.683 0.573 1.00 0.00 H new ATOM 0 HA ARG A 83 3.695 -13.658 0.552 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.196 -14.519 1.841 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.383 -15.770 1.530 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.757 -14.828 3.746 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.115 -14.440 2.708 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.869 -12.196 2.269 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.912 -12.615 3.675 1.00 0.00 H new ATOM 0 HE ARG A 83 4.711 -11.726 3.636 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.277 -13.438 5.561 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.115 -13.115 7.082 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.733 -11.293 5.563 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.070 -11.901 7.084 1.00 0.00 H new ATOM 1279 N ASP A 84 1.830 -14.781 -1.736 1.00 0.00 N ATOM 1280 CA ASP A 84 1.879 -15.542 -3.001 1.00 0.00 C ATOM 1281 C ASP A 84 3.129 -15.142 -3.763 1.00 0.00 C ATOM 1282 O ASP A 84 3.988 -15.978 -4.159 1.00 0.00 O ATOM 1283 CB ASP A 84 0.698 -15.149 -3.865 1.00 0.00 C ATOM 1284 CG ASP A 84 0.539 -16.010 -5.094 1.00 0.00 C ATOM 1285 OD1 ASP A 84 1.201 -15.739 -6.093 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.266 -16.973 -5.067 1.00 0.00 O ATOM 0 H ASP A 84 1.027 -14.158 -1.651 1.00 0.00 H new ATOM 0 HA ASP A 84 1.868 -16.609 -2.779 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.213 -15.208 -3.270 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.812 -14.109 -4.172 1.00 0.00 H new ATOM 1291 N THR A 85 3.242 -13.859 -3.904 1.00 0.00 N ATOM 1292 CA THR A 85 4.299 -13.226 -4.592 1.00 0.00 C ATOM 1293 C THR A 85 5.606 -13.451 -3.806 1.00 0.00 C ATOM 1294 O THR A 85 6.701 -13.620 -4.397 1.00 0.00 O ATOM 1295 CB THR A 85 3.926 -11.740 -4.703 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.662 -11.638 -5.397 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.981 -10.916 -5.415 1.00 0.00 C ATOM 0 H THR A 85 2.562 -13.202 -3.521 1.00 0.00 H new ATOM 0 HA THR A 85 4.455 -13.629 -5.593 1.00 0.00 H new ATOM 0 HB THR A 85 3.852 -11.334 -3.694 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.942 -11.499 -4.747 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.660 -9.875 -5.462 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.923 -10.981 -4.870 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.120 -11.298 -6.426 1.00 0.00 H new ATOM 1305 N ALA A 86 5.466 -13.515 -2.476 1.00 0.00 N ATOM 1306 CA ALA A 86 6.548 -13.844 -1.593 1.00 0.00 C ATOM 1307 C ALA A 86 7.106 -15.218 -1.869 1.00 0.00 C ATOM 1308 O ALA A 86 8.322 -15.413 -1.902 1.00 0.00 O ATOM 1309 CB ALA A 86 6.132 -13.731 -0.141 1.00 0.00 C ATOM 0 H ALA A 86 4.584 -13.335 -1.997 1.00 0.00 H new ATOM 0 HA ALA A 86 7.337 -13.117 -1.785 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.975 -13.987 0.500 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.814 -12.709 0.068 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.306 -14.415 0.055 1.00 0.00 H new ATOM 1315 N LYS A 87 6.217 -16.185 -2.102 1.00 0.00 N ATOM 1316 CA LYS A 87 6.645 -17.540 -2.422 1.00 0.00 C ATOM 1317 C LYS A 87 7.467 -17.529 -3.684 1.00 0.00 C ATOM 1318 O LYS A 87 8.413 -18.289 -3.813 1.00 0.00 O ATOM 1319 CB LYS A 87 5.465 -18.507 -2.568 1.00 0.00 C ATOM 1320 CG LYS A 87 4.603 -18.594 -1.323 1.00 0.00 C ATOM 1321 CD LYS A 87 3.536 -19.680 -1.394 1.00 0.00 C ATOM 1322 CE LYS A 87 2.583 -19.471 -2.548 1.00 0.00 C ATOM 1323 NZ LYS A 87 1.457 -20.417 -2.496 1.00 0.00 N ATOM 0 H LYS A 87 5.206 -16.053 -2.075 1.00 0.00 H new ATOM 0 HA LYS A 87 7.250 -17.898 -1.589 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.847 -18.191 -3.408 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.845 -19.500 -2.808 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.243 -18.781 -0.461 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.119 -17.631 -1.158 1.00 0.00 H new ATOM 0 HD2 LYS A 87 4.017 -20.653 -1.494 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.974 -19.697 -0.460 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.203 -18.450 -2.527 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.118 -19.592 -3.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.822 -20.246 -3.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.819 -21.391 -2.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.932 -20.284 -1.608 1.00 0.00 H new ATOM 1337 N ARG A 88 7.127 -16.606 -4.588 1.00 0.00 N ATOM 1338 CA ARG A 88 7.873 -16.439 -5.839 1.00 0.00 C ATOM 1339 C ARG A 88 9.304 -15.969 -5.588 1.00 0.00 C ATOM 1340 O ARG A 88 10.241 -16.483 -6.202 1.00 0.00 O ATOM 1341 CB ARG A 88 7.187 -15.475 -6.816 1.00 0.00 C ATOM 1342 CG ARG A 88 6.233 -16.111 -7.807 1.00 0.00 C ATOM 1343 CD ARG A 88 5.089 -16.843 -7.148 1.00 0.00 C ATOM 1344 NE ARG A 88 4.216 -17.424 -8.161 1.00 0.00 N ATOM 1345 CZ ARG A 88 3.125 -18.151 -7.922 1.00 0.00 C ATOM 1346 NH1 ARG A 88 2.666 -18.284 -6.688 1.00 0.00 N ATOM 1347 NH2 ARG A 88 2.472 -18.714 -8.930 1.00 0.00 N ATOM 0 H ARG A 88 6.342 -15.964 -4.478 1.00 0.00 H new ATOM 0 HA ARG A 88 7.896 -17.428 -6.297 1.00 0.00 H new ATOM 0 HB2 ARG A 88 6.639 -14.731 -6.238 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.958 -14.942 -7.373 1.00 0.00 H new ATOM 0 HG2 ARG A 88 5.831 -15.338 -8.462 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.786 -16.807 -8.438 1.00 0.00 H new ATOM 0 HD2 ARG A 88 5.476 -17.627 -6.497 1.00 0.00 H new ATOM 0 HD3 ARG A 88 4.522 -16.157 -6.519 1.00 0.00 H new ATOM 0 HE ARG A 88 4.462 -17.260 -9.137 1.00 0.00 H new ATOM 0 HH11 ARG A 88 3.148 -17.829 -5.913 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.830 -18.842 -6.512 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.805 -18.590 -9.886 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.637 -19.271 -8.749 1.00 0.00 H new ATOM 1361 N ASN A 89 9.488 -15.029 -4.678 1.00 0.00 N ATOM 1362 CA ASN A 89 10.832 -14.493 -4.444 1.00 0.00 C ATOM 1363 C ASN A 89 11.640 -15.325 -3.495 1.00 0.00 C ATOM 1364 O ASN A 89 12.867 -15.347 -3.593 1.00 0.00 O ATOM 1365 CB ASN A 89 10.847 -13.037 -3.987 1.00 0.00 C ATOM 1366 CG ASN A 89 10.694 -12.039 -5.103 1.00 0.00 C ATOM 1367 OD1 ASN A 89 10.187 -10.894 -4.776 1.00 0.00 O flip ATOM 1368 ND2 ASN A 89 11.074 -12.288 -6.240 1.00 0.00 N flip ATOM 0 H ASN A 89 8.751 -14.625 -4.099 1.00 0.00 H new ATOM 0 HA ASN A 89 11.300 -14.535 -5.427 1.00 0.00 H new ATOM 0 HB2 ASN A 89 10.043 -12.886 -3.266 1.00 0.00 H new ATOM 0 HB3 ASN A 89 11.784 -12.841 -3.465 1.00 0.00 H new ATOM 0 HD21 ASN A 89 11.468 -13.203 -6.457 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.996 -11.580 -6.970 1.00 0.00 H new ATOM 1375 N GLN A 90 10.988 -15.981 -2.541 1.00 0.00 N ATOM 1376 CA GLN A 90 11.707 -16.847 -1.617 1.00 0.00 C ATOM 1377 C GLN A 90 12.316 -18.034 -2.339 1.00 0.00 C ATOM 1378 O GLN A 90 13.483 -18.345 -2.134 1.00 0.00 O ATOM 1379 CB GLN A 90 10.852 -17.335 -0.439 1.00 0.00 C ATOM 1380 CG GLN A 90 10.184 -16.248 0.415 1.00 0.00 C ATOM 1381 CD GLN A 90 11.097 -15.087 0.719 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.879 -15.117 1.682 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.933 -14.021 -0.016 1.00 0.00 N ATOM 0 H GLN A 90 9.981 -15.931 -2.389 1.00 0.00 H new ATOM 0 HA GLN A 90 12.501 -16.229 -1.198 1.00 0.00 H new ATOM 0 HB2 GLN A 90 10.073 -17.989 -0.830 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.481 -17.942 0.212 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.299 -15.880 -0.104 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.843 -16.689 1.352 1.00 0.00 H new ATOM 0 HE21 GLN A 90 10.280 -14.037 -0.799 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.458 -13.172 0.193 1.00 0.00 H new ATOM 1392 N GLN A 91 11.543 -18.675 -3.217 1.00 0.00 N ATOM 1393 CA GLN A 91 12.068 -19.808 -3.988 1.00 0.00 C ATOM 1394 C GLN A 91 13.090 -19.346 -5.029 1.00 0.00 C ATOM 1395 O GLN A 91 13.821 -20.149 -5.601 1.00 0.00 O ATOM 1396 CB GLN A 91 10.944 -20.609 -4.645 1.00 0.00 C ATOM 1397 CG GLN A 91 10.133 -19.840 -5.663 1.00 0.00 C ATOM 1398 CD GLN A 91 8.982 -20.651 -6.196 1.00 0.00 C ATOM 1399 OE1 GLN A 91 9.095 -21.329 -7.220 1.00 0.00 O ATOM 1400 NE2 GLN A 91 7.890 -20.634 -5.495 1.00 0.00 N ATOM 0 H GLN A 91 10.570 -18.437 -3.411 1.00 0.00 H new ATOM 0 HA GLN A 91 12.578 -20.468 -3.286 1.00 0.00 H new ATOM 0 HB2 GLN A 91 11.376 -21.484 -5.130 1.00 0.00 H new ATOM 0 HB3 GLN A 91 10.274 -20.974 -3.867 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.752 -18.926 -5.208 1.00 0.00 H new ATOM 0 HG3 GLN A 91 10.778 -19.540 -6.489 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.833 -20.061 -4.653 1.00 0.00 H new ATOM 0 HE22 GLN A 91 7.089 -21.194 -5.786 1.00 0.00 H new ATOM 1409 N ALA A 92 13.118 -18.052 -5.279 1.00 0.00 N ATOM 1410 CA ALA A 92 14.087 -17.480 -6.171 1.00 0.00 C ATOM 1411 C ALA A 92 15.354 -17.166 -5.383 1.00 0.00 C ATOM 1412 O ALA A 92 16.472 -17.330 -5.876 1.00 0.00 O ATOM 1413 CB ALA A 92 13.529 -16.227 -6.821 1.00 0.00 C ATOM 0 H ALA A 92 12.472 -17.378 -4.869 1.00 0.00 H new ATOM 0 HA ALA A 92 14.324 -18.188 -6.965 1.00 0.00 H new ATOM 0 HB1 ALA A 92 14.274 -15.804 -7.495 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.631 -16.479 -7.385 1.00 0.00 H new ATOM 0 HB3 ALA A 92 13.280 -15.497 -6.050 1.00 0.00 H new ATOM 1419 N GLY A 93 15.160 -16.772 -4.138 1.00 0.00 N ATOM 1420 CA GLY A 93 16.246 -16.436 -3.260 1.00 0.00 C ATOM 1421 C GLY A 93 16.725 -15.025 -3.507 1.00 0.00 C ATOM 1422 O GLY A 93 17.912 -14.790 -3.744 1.00 0.00 O ATOM 0 H GLY A 93 14.237 -16.678 -3.713 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.925 -16.539 -2.223 1.00 0.00 H new ATOM 0 HA3 GLY A 93 17.069 -17.135 -3.410 1.00 0.00 H new ATOM 1426 N ASN A 94 15.800 -14.088 -3.492 1.00 0.00 N ATOM 1427 CA ASN A 94 16.131 -12.684 -3.785 1.00 0.00 C ATOM 1428 C ASN A 94 16.464 -11.860 -2.546 1.00 0.00 C ATOM 1429 O ASN A 94 16.855 -10.701 -2.680 1.00 0.00 O ATOM 1430 CB ASN A 94 15.031 -11.997 -4.606 1.00 0.00 C ATOM 1431 CG ASN A 94 15.007 -12.454 -6.063 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.850 -12.483 -6.670 1.00 0.00 O flip ATOM 1433 ND2 ASN A 94 16.036 -12.779 -6.632 1.00 0.00 N flip ATOM 0 H ASN A 94 14.816 -14.258 -3.283 1.00 0.00 H new ATOM 0 HA ASN A 94 17.040 -12.727 -4.385 1.00 0.00 H new ATOM 0 HB2 ASN A 94 14.062 -12.201 -4.150 1.00 0.00 H new ATOM 0 HB3 ASN A 94 15.178 -10.918 -4.571 1.00 0.00 H new ATOM 0 HD21 ASN A 94 16.926 -12.747 -6.134 1.00 0.00 H new ATOM 0 HD22 ASN A 94 16.007 -13.083 -7.605 1.00 0.00 H new ATOM 1440 N GLY A 95 16.318 -12.449 -1.348 1.00 0.00 N ATOM 1441 CA GLY A 95 16.616 -11.727 -0.103 1.00 0.00 C ATOM 1442 C GLY A 95 15.761 -10.493 0.047 1.00 0.00 C ATOM 1443 O GLY A 95 16.254 -9.400 0.319 1.00 0.00 O ATOM 0 H GLY A 95 16.000 -13.409 -1.217 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.453 -12.388 0.748 1.00 0.00 H new ATOM 0 HA3 GLY A 95 17.668 -11.444 -0.090 1.00 0.00 H new ATOM 1447 N TRP A 96 14.492 -10.689 -0.121 1.00 0.00 N ATOM 1448 CA TRP A 96 13.504 -9.645 -0.146 1.00 0.00 C ATOM 1449 C TRP A 96 12.163 -10.247 0.027 1.00 0.00 C ATOM 1450 O TRP A 96 12.029 -11.483 0.152 1.00 0.00 O ATOM 1451 CB TRP A 96 13.414 -8.995 -1.532 1.00 0.00 C ATOM 1452 CG TRP A 96 14.253 -7.824 -1.832 1.00 0.00 C ATOM 1453 CD1 TRP A 96 14.573 -6.807 -1.010 1.00 0.00 C ATOM 1454 CD2 TRP A 96 14.775 -7.503 -3.101 1.00 0.00 C ATOM 1455 NE1 TRP A 96 15.288 -5.872 -1.685 1.00 0.00 N ATOM 1456 CE2 TRP A 96 15.434 -6.283 -2.981 1.00 0.00 C ATOM 1457 CE3 TRP A 96 14.758 -8.152 -4.333 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 16.073 -5.685 -4.055 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 15.387 -7.567 -5.397 1.00 0.00 C ATOM 1460 CH2 TRP A 96 16.039 -6.337 -5.256 1.00 0.00 C ATOM 0 H TRP A 96 14.094 -11.619 -0.251 1.00 0.00 H new ATOM 0 HA TRP A 96 13.783 -8.931 0.629 1.00 0.00 H new ATOM 0 HB2 TRP A 96 13.646 -9.763 -2.270 1.00 0.00 H new ATOM 0 HB3 TRP A 96 12.376 -8.704 -1.691 1.00 0.00 H new ATOM 0 HD1 TRP A 96 14.301 -6.745 0.033 1.00 0.00 H new ATOM 0 HE1 TRP A 96 15.656 -5.006 -1.291 1.00 0.00 H new ATOM 0 HE3 TRP A 96 14.256 -9.102 -4.446 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 16.580 -4.737 -3.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 15.380 -8.060 -6.358 1.00 0.00 H new ATOM 0 HH2 TRP A 96 16.525 -5.894 -6.113 1.00 0.00 H new ATOM 1471 N ASP A 97 11.181 -9.366 0.085 1.00 0.00 N ATOM 1472 CA ASP A 97 9.824 -9.726 -0.256 1.00 0.00 C ATOM 1473 C ASP A 97 8.904 -10.330 0.815 1.00 0.00 C ATOM 1474 O ASP A 97 8.003 -9.667 1.199 1.00 0.00 O ATOM 1475 CB ASP A 97 9.835 -10.411 -1.620 1.00 0.00 C ATOM 1476 CG ASP A 97 8.787 -11.394 -1.855 1.00 0.00 C ATOM 1477 OD1 ASP A 97 9.012 -12.546 -1.461 1.00 0.00 O ATOM 1478 OD2 ASP A 97 7.820 -11.068 -2.542 1.00 0.00 O ATOM 0 H ASP A 97 11.302 -8.393 0.367 1.00 0.00 H new ATOM 0 HA ASP A 97 9.274 -8.787 -0.319 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.763 -9.643 -2.390 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.800 -10.902 -1.749 1.00 0.00 H new ATOM 1483 N PHE A 98 9.121 -11.543 1.293 1.00 0.00 N ATOM 1484 CA PHE A 98 8.204 -12.162 2.294 1.00 0.00 C ATOM 1485 C PHE A 98 7.839 -11.230 3.474 1.00 0.00 C ATOM 1486 O PHE A 98 6.662 -11.074 3.829 1.00 0.00 O ATOM 1487 CB PHE A 98 8.764 -13.499 2.811 1.00 0.00 C ATOM 1488 CG PHE A 98 7.941 -14.098 3.915 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.745 -14.732 3.634 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.340 -13.987 5.239 1.00 0.00 C ATOM 1491 CE1 PHE A 98 5.971 -15.248 4.651 1.00 0.00 C ATOM 1492 CE2 PHE A 98 7.566 -14.497 6.252 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.379 -15.125 5.958 1.00 0.00 C ATOM 0 H PHE A 98 9.909 -12.131 1.022 1.00 0.00 H new ATOM 0 HA PHE A 98 7.273 -12.348 1.758 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.820 -14.206 1.984 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.782 -13.345 3.168 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.415 -14.824 2.610 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.271 -13.493 5.476 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.043 -15.750 4.421 1.00 0.00 H new ATOM 0 HE2 PHE A 98 7.889 -14.405 7.278 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.767 -15.522 6.754 1.00 0.00 H new ATOM 1503 N ASP A 99 8.825 -10.664 4.059 1.00 0.00 N ATOM 1504 CA ASP A 99 8.670 -9.779 5.182 1.00 0.00 C ATOM 1505 C ASP A 99 8.459 -8.351 4.748 1.00 0.00 C ATOM 1506 O ASP A 99 7.635 -7.646 5.314 1.00 0.00 O ATOM 1507 CB ASP A 99 9.839 -9.937 6.152 1.00 0.00 C ATOM 1508 CG ASP A 99 11.210 -9.646 5.603 1.00 0.00 C ATOM 1509 OD1 ASP A 99 11.396 -9.647 4.364 1.00 0.00 O ATOM 1510 OD2 ASP A 99 12.122 -9.447 6.437 1.00 0.00 O ATOM 0 H ASP A 99 9.795 -10.798 3.773 1.00 0.00 H new ATOM 0 HA ASP A 99 7.764 -10.061 5.718 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.666 -9.280 7.005 1.00 0.00 H new ATOM 0 HB3 ASP A 99 9.833 -10.959 6.531 1.00 0.00 H new ATOM 1515 N MET A 100 9.166 -7.948 3.726 1.00 0.00 N ATOM 1516 CA MET A 100 9.087 -6.587 3.195 1.00 0.00 C ATOM 1517 C MET A 100 7.732 -6.302 2.559 1.00 0.00 C ATOM 1518 O MET A 100 7.123 -5.253 2.781 1.00 0.00 O ATOM 1519 CB MET A 100 10.230 -6.335 2.217 1.00 0.00 C ATOM 1520 CG MET A 100 11.585 -6.473 2.860 1.00 0.00 C ATOM 1521 SD MET A 100 12.914 -6.355 1.670 1.00 0.00 S ATOM 1522 CE MET A 100 14.350 -6.486 2.740 1.00 0.00 C ATOM 0 H MET A 100 9.821 -8.549 3.226 1.00 0.00 H new ATOM 0 HA MET A 100 9.190 -5.894 4.030 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.153 -7.036 1.386 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.131 -5.333 1.799 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.707 -5.697 3.616 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.645 -7.432 3.375 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.861 -5.524 2.783 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.032 -6.773 3.742 1.00 0.00 H new ATOM 0 HE3 MET A 100 15.030 -7.241 2.345 1.00 0.00 H new ATOM 1532 N LEU A 101 7.248 -7.254 1.813 1.00 0.00 N ATOM 1533 CA LEU A 101 5.966 -7.165 1.188 1.00 0.00 C ATOM 1534 C LEU A 101 4.943 -7.755 2.119 1.00 0.00 C ATOM 1535 O LEU A 101 4.678 -8.952 2.105 1.00 0.00 O ATOM 1536 CB LEU A 101 5.968 -7.883 -0.159 1.00 0.00 C ATOM 1537 CG LEU A 101 4.630 -8.017 -0.860 1.00 0.00 C ATOM 1538 CD1 LEU A 101 4.050 -6.675 -1.172 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.782 -8.836 -2.102 1.00 0.00 C ATOM 0 H LEU A 101 7.743 -8.125 1.621 1.00 0.00 H new ATOM 0 HA LEU A 101 5.720 -6.121 0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.650 -7.355 -0.825 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.377 -8.883 -0.011 1.00 0.00 H new ATOM 0 HG LEU A 101 3.938 -8.526 -0.190 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.091 -6.801 -1.674 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.905 -6.117 -0.247 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.731 -6.127 -1.823 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.816 -8.927 -2.599 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.491 -8.351 -2.773 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.150 -9.828 -1.841 1.00 0.00 H new ATOM 1551 N THR A 102 4.515 -6.895 3.001 1.00 0.00 N ATOM 1552 CA THR A 102 3.502 -7.052 4.047 1.00 0.00 C ATOM 1553 C THR A 102 3.888 -6.060 5.107 1.00 0.00 C ATOM 1554 O THR A 102 3.056 -5.372 5.716 1.00 0.00 O ATOM 1555 CB THR A 102 3.447 -8.450 4.740 1.00 0.00 C ATOM 1556 OG1 THR A 102 4.764 -9.026 4.870 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.486 -9.399 4.043 1.00 0.00 C ATOM 0 H THR A 102 4.904 -5.952 3.019 1.00 0.00 H new ATOM 0 HA THR A 102 2.526 -6.915 3.582 1.00 0.00 H new ATOM 0 HB THR A 102 3.057 -8.292 5.745 1.00 0.00 H new ATOM 0 HG1 THR A 102 4.934 -9.627 4.115 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.482 -10.358 4.561 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.482 -8.975 4.057 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.804 -9.546 3.011 1.00 0.00 H new ATOM 1565 N GLY A 103 5.195 -6.030 5.326 1.00 0.00 N ATOM 1566 CA GLY A 103 5.798 -5.136 6.266 1.00 0.00 C ATOM 1567 C GLY A 103 5.853 -5.773 7.615 1.00 0.00 C ATOM 1568 O GLY A 103 5.389 -5.185 8.607 1.00 0.00 O ATOM 0 H GLY A 103 5.860 -6.636 4.845 1.00 0.00 H new ATOM 0 HA2 GLY A 103 6.804 -4.874 5.937 1.00 0.00 H new ATOM 0 HA3 GLY A 103 5.227 -4.209 6.316 1.00 0.00 H new ATOM 1572 N SER A 104 6.459 -6.969 7.677 1.00 0.00 N ATOM 1573 CA SER A 104 6.504 -7.774 8.881 1.00 0.00 C ATOM 1574 C SER A 104 7.358 -9.021 8.687 1.00 0.00 C ATOM 1575 O SER A 104 7.111 -9.791 7.762 1.00 0.00 O ATOM 1576 CB SER A 104 5.084 -8.162 9.263 1.00 0.00 C ATOM 1577 OG SER A 104 4.385 -8.709 8.138 1.00 0.00 O ATOM 0 H SER A 104 6.931 -7.397 6.881 1.00 0.00 H new ATOM 0 HA SER A 104 6.961 -7.189 9.679 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.107 -8.892 10.072 1.00 0.00 H new ATOM 0 HB3 SER A 104 4.552 -7.288 9.637 1.00 0.00 H new ATOM 0 HG SER A 104 5.000 -9.254 7.604 1.00 0.00 H new ATOM 1583 N GLY A 105 8.322 -9.235 9.560 1.00 0.00 N ATOM 1584 CA GLY A 105 9.168 -10.386 9.431 1.00 0.00 C ATOM 1585 C GLY A 105 10.494 -10.212 10.104 1.00 0.00 C ATOM 1586 O GLY A 105 10.546 -9.879 11.282 1.00 0.00 O ATOM 0 H GLY A 105 8.531 -8.630 10.354 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.661 -11.253 9.856 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.328 -10.597 8.374 1.00 0.00 H new ATOM 1590 N ASN A 106 11.564 -10.351 9.358 1.00 0.00 N ATOM 1591 CA ASN A 106 12.877 -10.410 9.976 1.00 0.00 C ATOM 1592 C ASN A 106 13.767 -9.223 9.643 1.00 0.00 C ATOM 1593 O ASN A 106 14.381 -8.639 10.545 1.00 0.00 O ATOM 1594 CB ASN A 106 13.588 -11.729 9.602 1.00 0.00 C ATOM 1595 CG ASN A 106 14.978 -11.898 10.248 1.00 0.00 C ATOM 1596 OD1 ASN A 106 16.027 -11.488 9.565 1.00 0.00 O flip ATOM 1597 ND2 ASN A 106 15.096 -12.431 11.354 1.00 0.00 N flip ATOM 0 H ASN A 106 11.559 -10.425 8.341 1.00 0.00 H new ATOM 0 HA ASN A 106 12.705 -10.370 11.052 1.00 0.00 H new ATOM 0 HB2 ASN A 106 12.957 -12.567 9.899 1.00 0.00 H new ATOM 0 HB3 ASN A 106 13.694 -11.778 8.518 1.00 0.00 H new ATOM 0 HD21 ASN A 106 14.267 -12.740 11.862 1.00 0.00 H new ATOM 0 HD22 ASN A 106 16.022 -12.563 11.760 1.00 0.00 H new ATOM 1604 N TYR A 107 13.814 -8.841 8.388 1.00 0.00 N ATOM 1605 CA TYR A 107 14.771 -7.839 7.933 1.00 0.00 C ATOM 1606 C TYR A 107 14.134 -6.739 7.102 1.00 0.00 C ATOM 1607 O TYR A 107 14.836 -5.983 6.408 1.00 0.00 O ATOM 1608 CB TYR A 107 15.936 -8.514 7.173 1.00 0.00 C ATOM 1609 CG TYR A 107 15.532 -9.421 6.009 1.00 0.00 C ATOM 1610 CD1 TYR A 107 15.061 -10.705 6.238 1.00 0.00 C ATOM 1611 CD2 TYR A 107 15.647 -9.006 4.692 1.00 0.00 C ATOM 1612 CE1 TYR A 107 14.699 -11.535 5.207 1.00 0.00 C ATOM 1613 CE2 TYR A 107 15.291 -9.841 3.651 1.00 0.00 C ATOM 1614 CZ TYR A 107 14.824 -11.103 3.916 1.00 0.00 C ATOM 1615 OH TYR A 107 14.476 -11.950 2.882 1.00 0.00 O ATOM 0 H TYR A 107 13.203 -9.205 7.657 1.00 0.00 H new ATOM 0 HA TYR A 107 15.166 -7.350 8.823 1.00 0.00 H new ATOM 0 HB2 TYR A 107 16.596 -7.735 6.790 1.00 0.00 H new ATOM 0 HB3 TYR A 107 16.516 -9.103 7.884 1.00 0.00 H new ATOM 0 HD1 TYR A 107 14.977 -11.061 7.254 1.00 0.00 H new ATOM 0 HD2 TYR A 107 16.020 -8.016 4.476 1.00 0.00 H new ATOM 0 HE1 TYR A 107 14.318 -12.524 5.414 1.00 0.00 H new ATOM 0 HE2 TYR A 107 15.380 -9.501 2.630 1.00 0.00 H new ATOM 0 HH TYR A 107 13.877 -11.482 2.263 1.00 0.00 H new ATOM 1625 N SER A 108 12.842 -6.607 7.205 1.00 0.00 N ATOM 1626 CA SER A 108 12.138 -5.572 6.484 1.00 0.00 C ATOM 1627 C SER A 108 12.341 -4.267 7.217 1.00 0.00 C ATOM 1628 O SER A 108 12.957 -3.320 6.698 1.00 0.00 O ATOM 1629 CB SER A 108 10.641 -5.904 6.392 1.00 0.00 C ATOM 1630 OG SER A 108 9.927 -4.891 5.694 1.00 0.00 O ATOM 0 H SER A 108 12.249 -7.203 7.782 1.00 0.00 H new ATOM 0 HA SER A 108 12.526 -5.497 5.468 1.00 0.00 H new ATOM 0 HB2 SER A 108 10.509 -6.860 5.885 1.00 0.00 H new ATOM 0 HB3 SER A 108 10.229 -6.016 7.395 1.00 0.00 H new ATOM 0 HG SER A 108 8.964 -5.038 5.800 1.00 0.00 H new ATOM 1636 N SER A 109 11.824 -4.240 8.436 1.00 0.00 N ATOM 1637 CA SER A 109 11.922 -3.120 9.333 1.00 0.00 C ATOM 1638 C SER A 109 11.373 -1.827 8.680 1.00 0.00 C ATOM 1639 O SER A 109 10.599 -1.869 7.704 1.00 0.00 O ATOM 1640 CB SER A 109 13.391 -2.950 9.722 1.00 0.00 C ATOM 1641 OG SER A 109 13.961 -4.186 10.141 1.00 0.00 O ATOM 0 H SER A 109 11.310 -5.027 8.832 1.00 0.00 H new ATOM 0 HA SER A 109 11.318 -3.308 10.221 1.00 0.00 H new ATOM 0 HB2 SER A 109 13.951 -2.558 8.873 1.00 0.00 H new ATOM 0 HB3 SER A 109 13.475 -2.218 10.525 1.00 0.00 H new ATOM 0 HG SER A 109 14.901 -4.048 10.382 1.00 0.00 H new ATOM 1647 N THR A 110 11.736 -0.708 9.241 1.00 0.00 N ATOM 1648 CA THR A 110 11.384 0.574 8.713 1.00 0.00 C ATOM 1649 C THR A 110 12.342 0.920 7.531 1.00 0.00 C ATOM 1650 O THR A 110 12.008 1.727 6.626 1.00 0.00 O ATOM 1651 CB THR A 110 11.448 1.605 9.880 1.00 0.00 C ATOM 1652 OG1 THR A 110 10.609 1.107 10.950 1.00 0.00 O ATOM 1653 CG2 THR A 110 10.950 2.983 9.469 1.00 0.00 C ATOM 0 H THR A 110 12.295 -0.664 10.093 1.00 0.00 H new ATOM 0 HA THR A 110 10.372 0.589 8.308 1.00 0.00 H new ATOM 0 HB THR A 110 12.488 1.715 10.187 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.630 1.735 11.702 1.00 0.00 H new ATOM 0 HG21 THR A 110 11.016 3.662 10.319 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.564 3.363 8.652 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.913 2.912 9.141 1.00 0.00 H new ATOM 1661 N ASP A 111 13.474 0.212 7.505 1.00 0.00 N ATOM 1662 CA ASP A 111 14.554 0.403 6.531 1.00 0.00 C ATOM 1663 C ASP A 111 14.138 0.118 5.113 1.00 0.00 C ATOM 1664 O ASP A 111 14.177 1.012 4.260 1.00 0.00 O ATOM 1665 CB ASP A 111 15.766 -0.469 6.859 1.00 0.00 C ATOM 1666 CG ASP A 111 16.426 -0.108 8.149 1.00 0.00 C ATOM 1667 OD1 ASP A 111 17.157 0.900 8.195 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.205 -0.813 9.155 1.00 0.00 O ATOM 0 H ASP A 111 13.671 -0.529 8.178 1.00 0.00 H new ATOM 0 HA ASP A 111 14.815 1.459 6.606 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.453 -1.512 6.899 1.00 0.00 H new ATOM 0 HB3 ASP A 111 16.493 -0.385 6.052 1.00 0.00 H new ATOM 1673 N ALA A 112 13.692 -1.103 4.852 1.00 0.00 N ATOM 1674 CA ALA A 112 13.395 -1.549 3.491 1.00 0.00 C ATOM 1675 C ALA A 112 12.274 -0.777 2.827 1.00 0.00 C ATOM 1676 O ALA A 112 12.118 -0.825 1.617 1.00 0.00 O ATOM 1677 CB ALA A 112 13.087 -3.026 3.478 1.00 0.00 C ATOM 0 H ALA A 112 13.526 -1.810 5.569 1.00 0.00 H new ATOM 0 HA ALA A 112 14.293 -1.350 2.906 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.868 -3.343 2.458 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.947 -3.580 3.854 1.00 0.00 H new ATOM 0 HB3 ALA A 112 12.223 -3.223 4.113 1.00 0.00 H new ATOM 1683 N GLN A 113 11.492 -0.081 3.612 1.00 0.00 N ATOM 1684 CA GLN A 113 10.421 0.702 3.046 1.00 0.00 C ATOM 1685 C GLN A 113 11.002 2.028 2.631 1.00 0.00 C ATOM 1686 O GLN A 113 10.830 2.478 1.521 1.00 0.00 O ATOM 1687 CB GLN A 113 9.413 1.054 4.066 1.00 0.00 C ATOM 1688 CG GLN A 113 9.098 0.016 5.133 1.00 0.00 C ATOM 1689 CD GLN A 113 8.457 0.674 6.348 1.00 0.00 C ATOM 1690 OE1 GLN A 113 7.614 0.084 7.003 1.00 0.00 O ATOM 1691 NE2 GLN A 113 8.945 1.847 6.734 1.00 0.00 N ATOM 0 H GLN A 113 11.573 -0.039 4.628 1.00 0.00 H new ATOM 0 HA GLN A 113 9.974 0.125 2.237 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.747 1.962 4.569 1.00 0.00 H new ATOM 0 HB3 GLN A 113 8.484 1.298 3.550 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.427 -0.740 4.726 1.00 0.00 H new ATOM 0 HG3 GLN A 113 10.013 -0.497 5.431 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.650 2.318 6.166 1.00 0.00 H new ATOM 0 HE22 GLN A 113 8.615 2.277 7.598 1.00 0.00 H new ATOM 1700 N MET A 114 11.673 2.676 3.602 1.00 0.00 N ATOM 1701 CA MET A 114 12.286 3.993 3.426 1.00 0.00 C ATOM 1702 C MET A 114 13.319 3.991 2.296 1.00 0.00 C ATOM 1703 O MET A 114 13.517 4.991 1.610 1.00 0.00 O ATOM 1704 CB MET A 114 12.895 4.452 4.764 1.00 0.00 C ATOM 1705 CG MET A 114 13.773 5.700 4.742 1.00 0.00 C ATOM 1706 SD MET A 114 14.355 6.112 6.418 1.00 0.00 S ATOM 1707 CE MET A 114 15.435 7.507 6.095 1.00 0.00 C ATOM 0 H MET A 114 11.802 2.291 4.537 1.00 0.00 H new ATOM 0 HA MET A 114 11.517 4.706 3.129 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.078 4.627 5.464 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.488 3.630 5.165 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.628 5.537 4.085 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.211 6.538 4.331 1.00 0.00 H new ATOM 0 HE1 MET A 114 16.084 7.671 6.955 1.00 0.00 H new ATOM 0 HE2 MET A 114 16.044 7.300 5.215 1.00 0.00 H new ATOM 0 HE3 MET A 114 14.834 8.399 5.919 1.00 0.00 H new ATOM 1717 N GLN A 115 13.941 2.855 2.114 1.00 0.00 N ATOM 1718 CA GLN A 115 14.887 2.639 1.046 1.00 0.00 C ATOM 1719 C GLN A 115 14.389 1.532 0.138 1.00 0.00 C ATOM 1720 O GLN A 115 15.130 0.598 -0.181 1.00 0.00 O ATOM 1721 CB GLN A 115 16.346 2.367 1.523 1.00 0.00 C ATOM 1722 CG GLN A 115 17.044 3.585 2.130 1.00 0.00 C ATOM 1723 CD GLN A 115 16.926 3.734 3.649 1.00 0.00 C ATOM 1724 OE1 GLN A 115 15.957 3.106 4.269 1.00 0.00 O flip ATOM 1725 NE2 GLN A 115 17.792 4.344 4.267 1.00 0.00 N flip ATOM 0 H GLN A 115 13.803 2.040 2.712 1.00 0.00 H new ATOM 0 HA GLN A 115 14.947 3.575 0.491 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.332 1.565 2.261 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.933 2.010 0.676 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.102 3.541 1.870 1.00 0.00 H new ATOM 0 HG3 GLN A 115 16.638 4.483 1.663 1.00 0.00 H new ATOM 0 HE21 GLN A 115 18.536 4.825 3.762 1.00 0.00 H new ATOM 0 HE22 GLN A 115 17.768 4.370 5.286 1.00 0.00 H new ATOM 1734 N TYR A 116 13.091 1.603 -0.182 1.00 0.00 N ATOM 1735 CA TYR A 116 12.415 0.727 -1.090 1.00 0.00 C ATOM 1736 C TYR A 116 13.234 0.528 -2.366 1.00 0.00 C ATOM 1737 O TYR A 116 13.801 1.484 -2.923 1.00 0.00 O ATOM 1738 CB TYR A 116 11.023 1.335 -1.444 1.00 0.00 C ATOM 1739 CG TYR A 116 11.094 2.721 -2.085 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.152 3.858 -1.298 1.00 0.00 C ATOM 1741 CD2 TYR A 116 11.139 2.882 -3.466 1.00 0.00 C ATOM 1742 CE1 TYR A 116 11.257 5.109 -1.850 1.00 0.00 C ATOM 1743 CE2 TYR A 116 11.254 4.131 -4.030 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.308 5.243 -3.212 1.00 0.00 C ATOM 1745 OH TYR A 116 11.445 6.488 -3.757 1.00 0.00 O ATOM 0 H TYR A 116 12.474 2.312 0.214 1.00 0.00 H new ATOM 0 HA TYR A 116 12.286 -0.245 -0.614 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.505 0.658 -2.123 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.423 1.396 -0.536 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.114 3.758 -0.223 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.083 2.013 -4.105 1.00 0.00 H new ATOM 0 HE1 TYR A 116 11.299 5.982 -1.215 1.00 0.00 H new ATOM 0 HE2 TYR A 116 11.302 4.242 -5.103 1.00 0.00 H new ATOM 0 HH TYR A 116 10.574 6.803 -4.077 1.00 0.00 H new ATOM 1755 N ASP A 117 13.349 -0.679 -2.789 1.00 0.00 N ATOM 1756 CA ASP A 117 13.992 -0.968 -4.046 1.00 0.00 C ATOM 1757 C ASP A 117 12.935 -0.850 -5.121 1.00 0.00 C ATOM 1758 O ASP A 117 11.801 -1.152 -4.846 1.00 0.00 O ATOM 1759 CB ASP A 117 14.579 -2.386 -4.019 1.00 0.00 C ATOM 1760 CG ASP A 117 15.077 -2.829 -5.364 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.233 -2.538 -5.708 1.00 0.00 O ATOM 1762 OD2 ASP A 117 14.303 -3.454 -6.114 1.00 0.00 O ATOM 0 H ASP A 117 13.007 -1.498 -2.287 1.00 0.00 H new ATOM 0 HA ASP A 117 14.811 -0.275 -4.238 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.399 -2.422 -3.302 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.818 -3.084 -3.669 1.00 0.00 H new ATOM 1767 N PRO A 118 13.263 -0.389 -6.340 1.00 0.00 N ATOM 1768 CA PRO A 118 12.291 -0.252 -7.443 1.00 0.00 C ATOM 1769 C PRO A 118 11.530 -1.562 -7.787 1.00 0.00 C ATOM 1770 O PRO A 118 10.402 -1.511 -8.274 1.00 0.00 O ATOM 1771 CB PRO A 118 13.141 0.216 -8.628 1.00 0.00 C ATOM 1772 CG PRO A 118 14.538 -0.101 -8.244 1.00 0.00 C ATOM 1773 CD PRO A 118 14.592 0.064 -6.759 1.00 0.00 C ATOM 0 HA PRO A 118 11.495 0.441 -7.170 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.857 -0.299 -9.546 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.013 1.283 -8.809 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.804 -1.117 -8.536 1.00 0.00 H new ATOM 0 HG3 PRO A 118 15.242 0.568 -8.739 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.385 -0.537 -6.313 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.777 1.099 -6.472 1.00 0.00 H new ATOM 1781 N GLY A 119 12.091 -2.715 -7.450 1.00 0.00 N ATOM 1782 CA GLY A 119 11.420 -3.969 -7.753 1.00 0.00 C ATOM 1783 C GLY A 119 10.555 -4.358 -6.576 1.00 0.00 C ATOM 1784 O GLY A 119 9.445 -4.884 -6.730 1.00 0.00 O ATOM 0 H GLY A 119 12.990 -2.808 -6.977 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.810 -3.863 -8.650 1.00 0.00 H new ATOM 0 HA3 GLY A 119 12.153 -4.749 -7.956 1.00 0.00 H new ATOM 1788 N LEU A 120 11.064 -4.052 -5.404 1.00 0.00 N ATOM 1789 CA LEU A 120 10.340 -4.255 -4.165 1.00 0.00 C ATOM 1790 C LEU A 120 9.111 -3.325 -4.151 1.00 0.00 C ATOM 1791 O LEU A 120 7.987 -3.770 -3.908 1.00 0.00 O ATOM 1792 CB LEU A 120 11.274 -3.983 -2.967 1.00 0.00 C ATOM 1793 CG LEU A 120 10.682 -4.117 -1.568 1.00 0.00 C ATOM 1794 CD1 LEU A 120 10.122 -5.520 -1.354 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.759 -3.819 -0.528 1.00 0.00 C ATOM 0 H LEU A 120 11.995 -3.654 -5.281 1.00 0.00 H new ATOM 0 HA LEU A 120 9.995 -5.286 -4.087 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.122 -4.664 -3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.668 -2.972 -3.070 1.00 0.00 H new ATOM 0 HG LEU A 120 9.866 -3.402 -1.460 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.704 -5.596 -0.350 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.340 -5.716 -2.088 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.921 -6.252 -1.471 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.336 -3.915 0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.581 -4.525 -0.643 1.00 0.00 H new ATOM 0 HD23 LEU A 120 12.130 -2.804 -0.669 1.00 0.00 H new ATOM 1807 N PHE A 121 9.365 -2.030 -4.404 1.00 0.00 N ATOM 1808 CA PHE A 121 8.300 -1.040 -4.553 1.00 0.00 C ATOM 1809 C PHE A 121 7.237 -1.507 -5.558 1.00 0.00 C ATOM 1810 O PHE A 121 6.050 -1.392 -5.298 1.00 0.00 O ATOM 1811 CB PHE A 121 8.844 0.337 -4.970 1.00 0.00 C ATOM 1812 CG PHE A 121 7.744 1.355 -5.198 1.00 0.00 C ATOM 1813 CD1 PHE A 121 6.970 1.809 -4.140 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.461 1.817 -6.468 1.00 0.00 C ATOM 1815 CE1 PHE A 121 5.938 2.705 -4.350 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.430 2.712 -6.688 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.669 3.157 -5.627 1.00 0.00 C ATOM 0 H PHE A 121 10.305 -1.649 -4.509 1.00 0.00 H new ATOM 0 HA PHE A 121 7.836 -0.937 -3.572 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.520 0.705 -4.198 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.430 0.231 -5.883 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.176 1.458 -3.140 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.054 1.474 -7.303 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.344 3.051 -3.517 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.221 3.062 -7.688 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.864 3.858 -5.795 1.00 0.00 H new ATOM 1827 N ALA A 122 7.684 -2.048 -6.690 1.00 0.00 N ATOM 1828 CA ALA A 122 6.780 -2.560 -7.712 1.00 0.00 C ATOM 1829 C ALA A 122 5.827 -3.603 -7.142 1.00 0.00 C ATOM 1830 O ALA A 122 4.613 -3.511 -7.327 1.00 0.00 O ATOM 1831 CB ALA A 122 7.557 -3.136 -8.875 1.00 0.00 C ATOM 0 H ALA A 122 8.673 -2.142 -6.921 1.00 0.00 H new ATOM 0 HA ALA A 122 6.183 -1.722 -8.072 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.862 -3.512 -9.626 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.182 -2.359 -9.316 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.188 -3.952 -8.523 1.00 0.00 H new ATOM 1837 N GLN A 123 6.369 -4.575 -6.409 1.00 0.00 N ATOM 1838 CA GLN A 123 5.551 -5.614 -5.824 1.00 0.00 C ATOM 1839 C GLN A 123 4.627 -5.076 -4.748 1.00 0.00 C ATOM 1840 O GLN A 123 3.445 -5.429 -4.725 1.00 0.00 O ATOM 1841 CB GLN A 123 6.402 -6.708 -5.238 1.00 0.00 C ATOM 1842 CG GLN A 123 7.213 -7.483 -6.254 1.00 0.00 C ATOM 1843 CD GLN A 123 8.034 -8.559 -5.607 1.00 0.00 C ATOM 1844 OE1 GLN A 123 7.542 -9.098 -4.502 1.00 0.00 O flip ATOM 1845 NE2 GLN A 123 9.093 -8.899 -6.089 1.00 0.00 N flip ATOM 0 H GLN A 123 7.366 -4.657 -6.212 1.00 0.00 H new ATOM 0 HA GLN A 123 4.942 -6.018 -6.633 1.00 0.00 H new ATOM 0 HB2 GLN A 123 7.081 -6.270 -4.507 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.758 -7.403 -4.699 1.00 0.00 H new ATOM 0 HG2 GLN A 123 6.544 -7.929 -6.990 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.869 -6.800 -6.793 1.00 0.00 H new ATOM 0 HE21 GLN A 123 9.431 -8.454 -6.942 1.00 0.00 H new ATOM 0 HE22 GLN A 123 9.646 -9.630 -5.641 1.00 0.00 H new ATOM 1854 N ILE A 124 5.162 -4.245 -3.841 1.00 0.00 N ATOM 1855 CA ILE A 124 4.341 -3.693 -2.759 1.00 0.00 C ATOM 1856 C ILE A 124 3.184 -2.879 -3.307 1.00 0.00 C ATOM 1857 O ILE A 124 2.075 -2.961 -2.792 1.00 0.00 O ATOM 1858 CB ILE A 124 5.143 -2.902 -1.654 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.822 -1.665 -2.207 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.172 -3.808 -0.985 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.552 -0.841 -1.156 1.00 0.00 C ATOM 0 H ILE A 124 6.137 -3.947 -3.835 1.00 0.00 H new ATOM 0 HA ILE A 124 3.940 -4.561 -2.235 1.00 0.00 H new ATOM 0 HB ILE A 124 4.416 -2.572 -0.912 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.533 -1.966 -2.977 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.074 -1.038 -2.691 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.715 -3.244 -0.226 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.664 -4.651 -0.517 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.873 -4.177 -1.734 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.012 0.027 -1.629 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.843 -0.508 -0.398 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.325 -1.451 -0.688 1.00 0.00 H new ATOM 1873 N GLN A 125 3.423 -2.161 -4.391 1.00 0.00 N ATOM 1874 CA GLN A 125 2.387 -1.387 -5.009 1.00 0.00 C ATOM 1875 C GLN A 125 1.326 -2.305 -5.623 1.00 0.00 C ATOM 1876 O GLN A 125 0.114 -2.166 -5.340 1.00 0.00 O ATOM 1877 CB GLN A 125 2.956 -0.495 -6.089 1.00 0.00 C ATOM 1878 CG GLN A 125 1.922 0.438 -6.614 1.00 0.00 C ATOM 1879 CD GLN A 125 2.366 1.292 -7.774 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.543 1.598 -7.940 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.427 1.728 -8.549 1.00 0.00 N ATOM 0 H GLN A 125 4.330 -2.105 -4.854 1.00 0.00 H new ATOM 0 HA GLN A 125 1.929 -0.768 -4.238 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.795 0.075 -5.690 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.345 -1.107 -6.903 1.00 0.00 H new ATOM 0 HG2 GLN A 125 1.052 -0.143 -6.922 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.599 1.091 -5.804 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.459 1.453 -8.382 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.654 2.347 -9.328 1.00 0.00 H new ATOM 1890 N ALA A 126 1.803 -3.248 -6.438 1.00 0.00 N ATOM 1891 CA ALA A 126 0.961 -4.198 -7.149 1.00 0.00 C ATOM 1892 C ALA A 126 0.074 -4.987 -6.219 1.00 0.00 C ATOM 1893 O ALA A 126 -1.150 -5.032 -6.397 1.00 0.00 O ATOM 1894 CB ALA A 126 1.818 -5.156 -7.958 1.00 0.00 C ATOM 0 H ALA A 126 2.799 -3.371 -6.622 1.00 0.00 H new ATOM 0 HA ALA A 126 0.319 -3.618 -7.812 1.00 0.00 H new ATOM 0 HB1 ALA A 126 1.176 -5.862 -8.485 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.409 -4.594 -8.681 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.484 -5.701 -7.290 1.00 0.00 H new ATOM 1900 N ALA A 127 0.679 -5.581 -5.212 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.045 -6.447 -4.302 1.00 0.00 C ATOM 1902 C ALA A 127 -1.076 -5.677 -3.491 1.00 0.00 C ATOM 1903 O ALA A 127 -2.191 -6.179 -3.255 1.00 0.00 O ATOM 1904 CB ALA A 127 0.904 -7.208 -3.395 1.00 0.00 C ATOM 0 H ALA A 127 1.672 -5.481 -5.002 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.584 -7.174 -4.910 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.331 -7.849 -2.724 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.572 -7.821 -4.000 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.491 -6.502 -2.808 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.738 -4.447 -3.110 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.641 -3.641 -2.321 1.00 0.00 C ATOM 1912 C ALA A 128 -2.918 -3.346 -3.074 1.00 0.00 C ATOM 1913 O ALA A 128 -3.932 -3.806 -2.693 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.985 -2.342 -1.888 1.00 0.00 C ATOM 0 H ALA A 128 0.149 -3.997 -3.337 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.890 -4.219 -1.431 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.690 -1.758 -1.296 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.102 -2.563 -1.287 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.691 -1.772 -2.769 1.00 0.00 H new ATOM 1920 N THR A 129 -2.839 -2.663 -4.169 1.00 0.00 N ATOM 1921 CA THR A 129 -4.072 -2.286 -4.893 1.00 0.00 C ATOM 1922 C THR A 129 -4.922 -3.543 -5.321 1.00 0.00 C ATOM 1923 O THR A 129 -6.222 -3.547 -5.219 1.00 0.00 O ATOM 1924 CB THR A 129 -3.745 -1.361 -6.114 1.00 0.00 C ATOM 1925 OG1 THR A 129 -4.942 -0.984 -6.825 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.754 -2.024 -7.073 1.00 0.00 C ATOM 0 H THR A 129 -1.969 -2.347 -4.598 1.00 0.00 H new ATOM 0 HA THR A 129 -4.693 -1.717 -4.201 1.00 0.00 H new ATOM 0 HB THR A 129 -3.283 -0.460 -5.712 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.039 -1.545 -7.623 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.551 -1.353 -7.908 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.825 -2.238 -6.545 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.179 -2.954 -7.450 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.188 -4.652 -5.631 1.00 0.00 N ATOM 1935 CA LYS A 130 -4.753 -5.894 -6.160 1.00 0.00 C ATOM 1936 C LYS A 130 -5.637 -6.498 -5.121 1.00 0.00 C ATOM 1937 O LYS A 130 -6.526 -7.241 -5.406 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.628 -6.877 -6.490 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.053 -8.070 -7.329 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.370 -7.673 -8.769 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.139 -7.130 -9.498 1.00 0.00 C ATOM 1942 NZ LYS A 130 -2.007 -8.109 -9.509 1.00 0.00 N ATOM 0 H LYS A 130 -3.176 -4.691 -5.513 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.321 -5.680 -7.065 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -2.839 -6.341 -7.018 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.197 -7.241 -5.557 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.259 -8.817 -7.325 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.930 -8.535 -6.880 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -4.757 -8.538 -9.307 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -5.156 -6.918 -8.772 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.409 -6.878 -10.524 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -2.813 -6.207 -9.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -1.270 -7.780 -10.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -1.608 -8.189 -8.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -2.355 -9.039 -9.818 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.301 -6.204 -3.917 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.029 -6.519 -2.767 1.00 0.00 C ATOM 1958 C ALA A 131 -7.092 -5.458 -2.542 1.00 0.00 C ATOM 1959 O ALA A 131 -8.292 -5.754 -2.624 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.014 -6.545 -1.676 1.00 0.00 C ATOM 0 H ALA A 131 -4.441 -5.697 -3.707 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.556 -7.471 -2.827 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.501 -6.786 -0.731 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.260 -7.300 -1.898 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.537 -5.568 -1.599 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.641 -4.210 -2.431 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.434 -3.048 -1.996 1.00 0.00 C ATOM 1968 C TRP A 132 -8.479 -2.555 -3.022 1.00 0.00 C ATOM 1969 O TRP A 132 -8.806 -1.374 -3.080 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.553 -1.857 -1.535 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.607 -2.179 -0.414 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.069 -3.369 -0.176 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.088 -1.314 0.611 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.172 -3.321 0.785 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.161 -2.088 1.321 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.267 0.031 0.998 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.420 -1.583 2.350 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.535 0.503 2.031 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.621 -0.296 2.677 1.00 0.00 C ATOM 0 H TRP A 132 -5.675 -3.964 -2.649 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.990 -3.432 -1.141 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.977 -1.496 -2.387 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.203 -1.040 -1.221 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.336 -4.270 -0.708 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.578 -4.097 1.077 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.971 0.667 0.482 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.702 -2.193 2.879 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.670 1.524 2.355 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.040 0.130 3.482 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.961 -3.421 -3.833 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.129 -3.092 -4.640 1.00 0.00 C ATOM 1992 C ARG A 133 -11.437 -3.898 -4.367 1.00 0.00 C ATOM 1993 O ARG A 133 -12.501 -3.288 -4.302 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.823 -2.953 -6.162 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.068 -2.658 -7.062 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.902 -3.910 -7.311 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.319 -3.659 -7.740 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.886 -4.307 -8.800 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.123 -4.992 -9.641 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.183 -4.224 -9.040 1.00 0.00 N ATOM 0 H ARG A 133 -8.587 -4.360 -3.972 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.372 -2.098 -4.263 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.096 -2.152 -6.300 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.353 -3.873 -6.508 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.688 -1.898 -6.586 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.737 -2.247 -8.016 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.409 -4.510 -8.076 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.916 -4.506 -6.398 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.877 -2.981 -7.222 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.114 -5.034 -9.496 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.545 -5.477 -10.433 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.780 -3.668 -8.428 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.587 -4.716 -9.837 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.346 -5.237 -4.179 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.520 -6.205 -4.415 1.00 0.00 C ATOM 2016 C LYS A 134 -13.851 -6.085 -3.678 1.00 0.00 C ATOM 2017 O LYS A 134 -14.476 -7.094 -3.377 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.141 -7.665 -4.477 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.572 -8.076 -5.802 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.264 -7.432 -6.039 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.250 -7.952 -5.079 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.786 -9.315 -5.469 1.00 0.00 N ATOM 0 H LYS A 134 -10.492 -5.699 -3.867 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.752 -5.779 -5.391 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.412 -7.877 -3.695 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.022 -8.271 -4.264 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.459 -9.160 -5.833 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.264 -7.805 -6.599 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -9.938 -7.622 -7.062 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.358 -6.352 -5.930 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.399 -7.272 -5.042 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.677 -7.983 -4.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.955 -9.575 -4.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.549 -10.002 -5.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.530 -9.319 -6.477 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.319 -4.945 -3.462 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.602 -4.791 -2.843 1.00 0.00 C ATOM 2038 C LEU A 135 -16.673 -4.687 -3.900 1.00 0.00 C ATOM 2039 O LEU A 135 -16.465 -4.045 -4.934 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.627 -3.561 -1.958 1.00 0.00 C ATOM 2041 CG LEU A 135 -15.064 -3.666 -0.536 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.782 -4.448 -0.506 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.777 -2.281 -0.053 1.00 0.00 C ATOM 0 H LEU A 135 -13.847 -4.072 -3.698 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.793 -5.666 -2.222 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.079 -2.772 -2.473 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.663 -3.231 -1.880 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.794 -4.176 0.093 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.412 -4.502 0.518 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.962 -5.456 -0.880 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.040 -3.955 -1.134 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.374 -2.325 0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.049 -1.809 -0.713 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.698 -1.698 -0.052 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.777 -5.398 -3.718 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.937 -5.244 -4.576 1.00 0.00 C ATOM 2057 C PRO A 136 -19.782 -4.029 -4.116 1.00 0.00 C ATOM 2058 O PRO A 136 -20.421 -3.336 -4.925 1.00 0.00 O ATOM 2059 CB PRO A 136 -19.701 -6.558 -4.362 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.320 -7.021 -2.992 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.946 -6.480 -2.718 1.00 0.00 C ATOM 0 HA PRO A 136 -18.689 -5.063 -5.622 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.777 -6.404 -4.439 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -19.430 -7.297 -5.116 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.032 -6.661 -2.250 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.325 -8.110 -2.936 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.863 -6.099 -1.700 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.184 -7.251 -2.832 1.00 0.00 H new ATOM 2069 N VAL A 137 -19.743 -3.777 -2.818 1.00 0.00 N ATOM 2070 CA VAL A 137 -20.451 -2.707 -2.152 1.00 0.00 C ATOM 2071 C VAL A 137 -19.545 -2.187 -1.053 1.00 0.00 C ATOM 2072 O VAL A 137 -18.577 -2.864 -0.688 1.00 0.00 O ATOM 2073 CB VAL A 137 -21.805 -3.171 -1.505 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -22.782 -3.673 -2.548 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -21.575 -4.230 -0.437 1.00 0.00 C ATOM 0 H VAL A 137 -19.190 -4.342 -2.174 1.00 0.00 H new ATOM 0 HA VAL A 137 -20.698 -1.947 -2.894 1.00 0.00 H new ATOM 0 HB VAL A 137 -22.245 -2.295 -1.028 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -23.706 -3.985 -2.061 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -22.998 -2.875 -3.259 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -22.346 -4.521 -3.076 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -22.532 -4.529 -0.009 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -21.090 -5.098 -0.884 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -20.938 -3.823 0.348 1.00 0.00 H new ATOM 2085 N LYS A 138 -19.844 -0.987 -0.572 1.00 0.00 N ATOM 2086 CA LYS A 138 -19.110 -0.331 0.529 1.00 0.00 C ATOM 2087 C LYS A 138 -18.871 -1.293 1.708 1.00 0.00 C ATOM 2088 O LYS A 138 -17.749 -1.454 2.194 1.00 0.00 O ATOM 2089 CB LYS A 138 -19.887 0.913 1.074 1.00 0.00 C ATOM 2090 CG LYS A 138 -20.145 2.095 0.109 1.00 0.00 C ATOM 2091 CD LYS A 138 -21.215 1.802 -0.935 1.00 0.00 C ATOM 2092 CE LYS A 138 -21.524 3.023 -1.791 1.00 0.00 C ATOM 2093 NZ LYS A 138 -22.597 2.749 -2.768 1.00 0.00 N ATOM 0 H LYS A 138 -20.614 -0.424 -0.934 1.00 0.00 H new ATOM 0 HA LYS A 138 -18.154 -0.019 0.109 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -20.853 0.567 1.442 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -19.338 1.298 1.933 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.443 2.969 0.688 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.214 2.351 -0.397 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -20.883 0.985 -1.575 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -22.125 1.468 -0.438 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -21.820 3.852 -1.148 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -20.623 3.335 -2.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -22.779 3.603 -3.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -22.304 1.975 -3.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -23.464 2.476 -2.263 1.00 0.00 H new ATOM 2107 N GLY A 139 -19.936 -1.905 2.157 1.00 0.00 N ATOM 2108 CA GLY A 139 -19.895 -2.770 3.306 1.00 0.00 C ATOM 2109 C GLY A 139 -20.692 -2.131 4.403 1.00 0.00 C ATOM 2110 O GLY A 139 -21.348 -2.805 5.205 1.00 0.00 O ATOM 0 H GLY A 139 -20.860 -1.817 1.734 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -20.305 -3.749 3.059 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -18.865 -2.927 3.627 1.00 0.00 H new ATOM 2114 N ASP A 140 -20.597 -0.816 4.439 1.00 0.00 N ATOM 2115 CA ASP A 140 -21.372 0.030 5.319 1.00 0.00 C ATOM 2116 C ASP A 140 -22.838 -0.085 4.982 1.00 0.00 C ATOM 2117 O ASP A 140 -23.230 0.297 3.856 1.00 0.00 O ATOM 2118 CB ASP A 140 -20.929 1.494 5.193 1.00 0.00 C ATOM 2119 CG ASP A 140 -21.775 2.425 6.038 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -21.546 2.500 7.264 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -22.656 3.128 5.491 1.00 0.00 O ATOM 2122 OXT ASP A 140 -23.613 -0.567 5.829 1.00 0.00 O ATOM 0 H ASP A 140 -19.959 -0.294 3.838 1.00 0.00 H new ATOM 0 HA ASP A 140 -21.207 -0.298 6.345 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -19.885 1.583 5.493 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -20.988 1.801 4.149 1.00 0.00 H new TER 2127 ASP A 140