USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=28 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 82 CYS SG : rot 91:sc= 1.6 USER MOD Set 1.2: A 102 THR OG1 : rot 144:sc= 1.33 USER MOD Set 2.1: A 59 ASN : amide:sc= 0.964 K(o=3.2,f=-7.6!) USER MOD Set 2.2: A 75 LYS NZ :NH3+ 147:sc= 2.19 (180deg=0.326) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.0144 USER MOD Single : A 9 GLN : amide:sc= -0.0176 K(o=-0.018,f=-1) USER MOD Single : A 11 GLN : amide:sc= -1.92! K(o=-1.9!,f=-0.24) USER MOD Single : A 15 HIS : no HD1:sc= -0.094 X(o=-0.094,f=-0.0081) USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 17 ASN : amide:sc= -2.53! K(o=-2.5!,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 139:sc= 1.21 (180deg=0.866) USER MOD Single : A 29 THR OG1 : rot 53:sc= 0.586 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1.6! K(o=-1.6!,f=-0.062) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 106:sc= 1.96 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 164:sc= 0.265 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 0.831 K(o=0.83,f=0) USER MOD Single : A 54 THR OG1 : rot -170:sc= 0.0889 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 100:sc= 1.23 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 102:sc= 1.21 USER MOD Single : A 81 ASN : amide:sc= 0.809 K(o=0.81,f=-0.0014) USER MOD Single : A 85 THR OG1 : rot 83:sc= 1.24 USER MOD Single : A 87 LYS NZ :NH3+ -162:sc= -0.101 (180deg=-0.466) USER MOD Single : A 89 ASN : amide:sc= -0.0187 K(o=-0.019,f=-0.7) USER MOD Single : A 90 GLN : amide:sc= -0.0116 X(o=-0.012,f=-0.32) USER MOD Single : A 91 GLN : amide:sc= 0.294 X(o=0.29,f=0) USER MOD Single : A 94 ASN : amide:sc= -1.5 K(o=-1.5,f=-0.58) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 52:sc= 0.17 USER MOD Single : A 106 ASN : amide:sc= 0.363 X(o=0.36,f=-0.062) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 66:sc= 1.26 USER MOD Single : A 109 SER OG : rot 180:sc= -0.0558 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -4.81! C(o=-4.8!,f=-5.5!) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -1.31 X(o=-1.3,f=-0.89) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.173 K(o=-0.17,f=-2.3!) USER MOD Single : A 125 GLN : amide:sc= -0.733 X(o=-0.73,f=-0.97) USER MOD Single : A 129 THR OG1 : rot -100:sc= -0.118 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -145:sc= 1.15 (180deg=0.0972) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0.513 (180deg=0.513) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 4.456 8.374 2.153 1.00 0.00 N ATOM 2 CA PRO A 1 5.248 8.688 3.303 1.00 0.00 C ATOM 3 C PRO A 1 6.734 8.987 2.994 1.00 0.00 C ATOM 4 O PRO A 1 7.339 9.739 3.697 1.00 0.00 O ATOM 5 CB PRO A 1 5.089 7.558 4.275 1.00 0.00 C ATOM 6 CG PRO A 1 3.717 7.045 3.959 1.00 0.00 C ATOM 7 CD PRO A 1 3.245 7.738 2.664 1.00 0.00 C ATOM 0 H2 PRO A 1 4.959 7.750 1.522 1.00 0.00 H new ATOM 0 H3 PRO A 1 4.231 9.216 1.623 1.00 0.00 H new ATOM 0 HA PRO A 1 4.887 9.624 3.729 1.00 0.00 H new ATOM 0 HB2 PRO A 1 5.851 6.791 4.133 1.00 0.00 H new ATOM 0 HB3 PRO A 1 5.167 7.898 5.308 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.734 5.963 3.830 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.031 7.258 4.779 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.838 7.021 1.951 1.00 0.00 H new ATOM 0 HD3 PRO A 1 2.462 8.469 2.863 1.00 0.00 H new ATOM 17 N VAL A 2 7.321 8.418 1.970 1.00 0.00 N ATOM 18 CA VAL A 2 8.723 8.725 1.699 1.00 0.00 C ATOM 19 C VAL A 2 8.902 9.319 0.331 1.00 0.00 C ATOM 20 O VAL A 2 8.298 8.861 -0.626 1.00 0.00 O ATOM 21 CB VAL A 2 9.658 7.491 1.923 1.00 0.00 C ATOM 22 CG1 VAL A 2 11.059 7.713 1.355 1.00 0.00 C ATOM 23 CG2 VAL A 2 9.766 7.207 3.411 1.00 0.00 C ATOM 0 H VAL A 2 6.879 7.762 1.326 1.00 0.00 H new ATOM 0 HA VAL A 2 9.026 9.479 2.426 1.00 0.00 H new ATOM 0 HB VAL A 2 9.216 6.645 1.397 1.00 0.00 H new ATOM 0 HG11 VAL A 2 11.669 6.828 1.536 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.992 7.895 0.282 1.00 0.00 H new ATOM 0 HG13 VAL A 2 11.516 8.575 1.841 1.00 0.00 H new ATOM 0 HG21 VAL A 2 10.417 6.347 3.571 1.00 0.00 H new ATOM 0 HG22 VAL A 2 10.183 8.077 3.918 1.00 0.00 H new ATOM 0 HG23 VAL A 2 8.776 6.992 3.813 1.00 0.00 H new ATOM 33 N THR A 3 9.673 10.361 0.268 1.00 0.00 N ATOM 34 CA THR A 3 9.987 11.004 -0.985 1.00 0.00 C ATOM 35 C THR A 3 11.502 11.211 -1.085 1.00 0.00 C ATOM 36 O THR A 3 12.189 11.313 -0.034 1.00 0.00 O ATOM 37 CB THR A 3 9.194 12.348 -1.130 1.00 0.00 C ATOM 38 OG1 THR A 3 9.612 13.075 -2.283 1.00 0.00 O ATOM 39 CG2 THR A 3 9.303 13.217 0.120 1.00 0.00 C ATOM 0 H THR A 3 10.107 10.796 1.082 1.00 0.00 H new ATOM 0 HA THR A 3 9.678 10.366 -1.813 1.00 0.00 H new ATOM 0 HB THR A 3 8.145 12.081 -1.254 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.099 13.908 -2.349 1.00 0.00 H new ATOM 0 HG21 THR A 3 8.738 14.138 -0.026 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.899 12.676 0.976 1.00 0.00 H new ATOM 0 HG23 THR A 3 10.350 13.459 0.305 1.00 0.00 H new ATOM 47 N GLU A 4 12.038 11.234 -2.314 1.00 0.00 N ATOM 48 CA GLU A 4 13.467 11.383 -2.530 1.00 0.00 C ATOM 49 C GLU A 4 13.795 12.309 -3.706 1.00 0.00 C ATOM 50 O GLU A 4 13.122 12.323 -4.711 1.00 0.00 O ATOM 51 CB GLU A 4 14.153 10.040 -2.704 1.00 0.00 C ATOM 52 CG GLU A 4 13.608 9.186 -3.820 1.00 0.00 C ATOM 53 CD GLU A 4 14.420 7.940 -4.006 1.00 0.00 C ATOM 54 OE1 GLU A 4 14.435 7.089 -3.093 1.00 0.00 O ATOM 55 OE2 GLU A 4 15.105 7.818 -5.037 1.00 0.00 O ATOM 0 H GLU A 4 11.492 11.150 -3.171 1.00 0.00 H new ATOM 0 HA GLU A 4 13.858 11.854 -1.628 1.00 0.00 H new ATOM 0 HB2 GLU A 4 15.214 10.212 -2.883 1.00 0.00 H new ATOM 0 HB3 GLU A 4 14.073 9.485 -1.770 1.00 0.00 H new ATOM 0 HG2 GLU A 4 12.574 8.918 -3.603 1.00 0.00 H new ATOM 0 HG3 GLU A 4 13.601 9.759 -4.747 1.00 0.00 H new ATOM 62 N THR A 5 14.753 13.138 -3.505 1.00 0.00 N ATOM 63 CA THR A 5 15.196 14.020 -4.575 1.00 0.00 C ATOM 64 C THR A 5 16.488 13.396 -5.119 1.00 0.00 C ATOM 65 O THR A 5 16.964 12.394 -4.557 1.00 0.00 O ATOM 66 CB THR A 5 15.477 15.488 -4.044 1.00 0.00 C ATOM 67 OG1 THR A 5 15.781 16.383 -5.134 1.00 0.00 O ATOM 68 CG2 THR A 5 16.642 15.521 -3.045 1.00 0.00 C ATOM 0 H THR A 5 15.256 13.241 -2.624 1.00 0.00 H new ATOM 0 HA THR A 5 14.428 14.113 -5.343 1.00 0.00 H new ATOM 0 HB THR A 5 14.567 15.814 -3.540 1.00 0.00 H new ATOM 0 HG1 THR A 5 15.949 17.282 -4.782 1.00 0.00 H new ATOM 0 HG21 THR A 5 16.802 16.545 -2.706 1.00 0.00 H new ATOM 0 HG22 THR A 5 16.406 14.888 -2.190 1.00 0.00 H new ATOM 0 HG23 THR A 5 17.547 15.154 -3.529 1.00 0.00 H new ATOM 76 N VAL A 6 17.104 13.986 -6.108 1.00 0.00 N ATOM 77 CA VAL A 6 18.366 13.521 -6.593 1.00 0.00 C ATOM 78 C VAL A 6 19.235 14.729 -6.751 1.00 0.00 C ATOM 79 O VAL A 6 18.890 15.645 -7.514 1.00 0.00 O ATOM 80 CB VAL A 6 18.276 12.777 -7.977 1.00 0.00 C ATOM 81 CG1 VAL A 6 19.612 12.168 -8.366 1.00 0.00 C ATOM 82 CG2 VAL A 6 17.184 11.715 -7.994 1.00 0.00 C ATOM 0 H VAL A 6 16.740 14.804 -6.598 1.00 0.00 H new ATOM 0 HA VAL A 6 18.761 12.795 -5.882 1.00 0.00 H new ATOM 0 HB VAL A 6 18.010 13.532 -8.716 1.00 0.00 H new ATOM 0 HG11 VAL A 6 19.515 11.662 -9.326 1.00 0.00 H new ATOM 0 HG12 VAL A 6 20.362 12.955 -8.445 1.00 0.00 H new ATOM 0 HG13 VAL A 6 19.919 11.449 -7.606 1.00 0.00 H new ATOM 0 HG21 VAL A 6 17.163 11.231 -8.970 1.00 0.00 H new ATOM 0 HG22 VAL A 6 17.388 10.971 -7.224 1.00 0.00 H new ATOM 0 HG23 VAL A 6 16.219 12.183 -7.800 1.00 0.00 H new ATOM 92 N ASP A 7 20.334 14.762 -6.030 1.00 0.00 N ATOM 93 CA ASP A 7 21.246 15.890 -6.110 1.00 0.00 C ATOM 94 C ASP A 7 22.050 15.807 -7.411 1.00 0.00 C ATOM 95 O ASP A 7 22.077 14.749 -8.040 1.00 0.00 O ATOM 96 CB ASP A 7 22.172 15.920 -4.886 1.00 0.00 C ATOM 97 CG ASP A 7 23.171 17.047 -4.946 1.00 0.00 C ATOM 98 OD1 ASP A 7 22.783 18.207 -4.796 1.00 0.00 O ATOM 99 OD2 ASP A 7 24.356 16.785 -5.184 1.00 0.00 O ATOM 0 H ASP A 7 20.620 14.027 -5.384 1.00 0.00 H new ATOM 0 HA ASP A 7 20.674 16.818 -6.113 1.00 0.00 H new ATOM 0 HB2 ASP A 7 21.571 16.019 -3.982 1.00 0.00 H new ATOM 0 HB3 ASP A 7 22.703 14.971 -4.813 1.00 0.00 H new ATOM 104 N GLY A 8 22.705 16.898 -7.802 1.00 0.00 N ATOM 105 CA GLY A 8 23.477 16.944 -9.039 1.00 0.00 C ATOM 106 C GLY A 8 24.598 15.905 -9.113 1.00 0.00 C ATOM 107 O GLY A 8 25.108 15.609 -10.198 1.00 0.00 O ATOM 0 H GLY A 8 22.715 17.770 -7.273 1.00 0.00 H new ATOM 0 HA2 GLY A 8 22.802 16.796 -9.882 1.00 0.00 H new ATOM 0 HA3 GLY A 8 23.910 17.938 -9.148 1.00 0.00 H new ATOM 111 N GLN A 9 24.991 15.357 -7.970 1.00 0.00 N ATOM 112 CA GLN A 9 26.006 14.306 -7.944 1.00 0.00 C ATOM 113 C GLN A 9 25.361 12.927 -8.138 1.00 0.00 C ATOM 114 O GLN A 9 26.015 11.885 -8.025 1.00 0.00 O ATOM 115 CB GLN A 9 26.857 14.383 -6.663 1.00 0.00 C ATOM 116 CG GLN A 9 26.107 14.137 -5.364 1.00 0.00 C ATOM 117 CD GLN A 9 26.925 14.526 -4.142 1.00 0.00 C ATOM 118 OE1 GLN A 9 27.729 15.453 -4.180 1.00 0.00 O ATOM 119 NE2 GLN A 9 26.781 13.797 -3.082 1.00 0.00 N ATOM 0 H GLN A 9 24.627 15.619 -7.054 1.00 0.00 H new ATOM 0 HA GLN A 9 26.689 14.463 -8.779 1.00 0.00 H new ATOM 0 HB2 GLN A 9 27.664 13.655 -6.740 1.00 0.00 H new ATOM 0 HB3 GLN A 9 27.320 15.368 -6.614 1.00 0.00 H new ATOM 0 HG2 GLN A 9 25.177 14.705 -5.371 1.00 0.00 H new ATOM 0 HG3 GLN A 9 25.837 13.083 -5.297 1.00 0.00 H new ATOM 0 HE21 GLN A 9 26.106 13.033 -3.077 1.00 0.00 H new ATOM 0 HE22 GLN A 9 27.343 13.987 -2.252 1.00 0.00 H new ATOM 128 N GLY A 10 24.066 12.943 -8.395 1.00 0.00 N ATOM 129 CA GLY A 10 23.319 11.760 -8.751 1.00 0.00 C ATOM 130 C GLY A 10 22.927 10.895 -7.588 1.00 0.00 C ATOM 131 O GLY A 10 22.662 9.708 -7.760 1.00 0.00 O ATOM 0 H GLY A 10 23.500 13.791 -8.361 1.00 0.00 H new ATOM 0 HA2 GLY A 10 22.417 12.062 -9.283 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.914 11.166 -9.445 1.00 0.00 H new ATOM 135 N GLN A 11 22.873 11.462 -6.413 1.00 0.00 N ATOM 136 CA GLN A 11 22.444 10.707 -5.251 1.00 0.00 C ATOM 137 C GLN A 11 20.972 10.948 -5.022 1.00 0.00 C ATOM 138 O GLN A 11 20.495 12.056 -5.224 1.00 0.00 O ATOM 139 CB GLN A 11 23.217 11.086 -4.010 1.00 0.00 C ATOM 140 CG GLN A 11 23.156 12.565 -3.681 1.00 0.00 C ATOM 141 CD GLN A 11 23.417 12.850 -2.242 1.00 0.00 C ATOM 142 OE1 GLN A 11 23.970 13.882 -1.898 1.00 0.00 O ATOM 143 NE2 GLN A 11 22.955 11.990 -1.388 1.00 0.00 N ATOM 0 H GLN A 11 23.117 12.435 -6.228 1.00 0.00 H new ATOM 0 HA GLN A 11 22.634 9.652 -5.446 1.00 0.00 H new ATOM 0 HB2 GLN A 11 22.829 10.518 -3.164 1.00 0.00 H new ATOM 0 HB3 GLN A 11 24.259 10.794 -4.139 1.00 0.00 H new ATOM 0 HG2 GLN A 11 23.886 13.098 -4.290 1.00 0.00 H new ATOM 0 HG3 GLN A 11 22.173 12.952 -3.950 1.00 0.00 H new ATOM 0 HE21 GLN A 11 22.499 11.139 -1.717 1.00 0.00 H new ATOM 0 HE22 GLN A 11 23.048 12.165 -0.387 1.00 0.00 H new ATOM 152 N ALA A 12 20.276 9.955 -4.569 1.00 0.00 N ATOM 153 CA ALA A 12 18.851 10.019 -4.426 1.00 0.00 C ATOM 154 C ALA A 12 18.494 9.832 -2.972 1.00 0.00 C ATOM 155 O ALA A 12 18.743 8.770 -2.382 1.00 0.00 O ATOM 156 CB ALA A 12 18.215 8.956 -5.271 1.00 0.00 C ATOM 0 H ALA A 12 20.683 9.064 -4.284 1.00 0.00 H new ATOM 0 HA ALA A 12 18.482 10.989 -4.758 1.00 0.00 H new ATOM 0 HB1 ALA A 12 17.132 9.005 -5.162 1.00 0.00 H new ATOM 0 HB2 ALA A 12 18.482 9.113 -6.316 1.00 0.00 H new ATOM 0 HB3 ALA A 12 18.568 7.976 -4.950 1.00 0.00 H new ATOM 162 N TRP A 13 17.960 10.864 -2.389 1.00 0.00 N ATOM 163 CA TRP A 13 17.672 10.903 -0.966 1.00 0.00 C ATOM 164 C TRP A 13 16.736 12.040 -0.685 1.00 0.00 C ATOM 165 O TRP A 13 16.643 12.941 -1.492 1.00 0.00 O ATOM 166 CB TRP A 13 18.976 11.137 -0.199 1.00 0.00 C ATOM 167 CG TRP A 13 19.645 12.473 -0.458 1.00 0.00 C ATOM 168 CD1 TRP A 13 19.907 13.054 -1.676 1.00 0.00 C ATOM 169 CD2 TRP A 13 20.164 13.362 0.523 1.00 0.00 C ATOM 170 NE1 TRP A 13 20.556 14.232 -1.500 1.00 0.00 N ATOM 171 CE2 TRP A 13 20.729 14.450 -0.163 1.00 0.00 C ATOM 172 CE3 TRP A 13 20.204 13.347 1.913 1.00 0.00 C ATOM 173 CZ2 TRP A 13 21.334 15.505 0.493 1.00 0.00 C ATOM 174 CZ3 TRP A 13 20.803 14.400 2.569 1.00 0.00 C ATOM 175 CH2 TRP A 13 21.362 15.468 1.858 1.00 0.00 C ATOM 0 H TRP A 13 17.705 11.718 -2.885 1.00 0.00 H new ATOM 0 HA TRP A 13 17.219 9.962 -0.656 1.00 0.00 H new ATOM 0 HB2 TRP A 13 18.772 11.052 0.868 1.00 0.00 H new ATOM 0 HB3 TRP A 13 19.677 10.342 -0.454 1.00 0.00 H new ATOM 0 HD1 TRP A 13 19.636 12.634 -2.633 1.00 0.00 H new ATOM 0 HE1 TRP A 13 20.865 14.855 -2.246 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.774 12.526 2.467 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 21.769 16.329 -0.054 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 20.842 14.401 3.648 1.00 0.00 H new ATOM 0 HH2 TRP A 13 21.825 16.280 2.400 1.00 0.00 H new ATOM 186 N ARG A 14 16.027 11.989 0.410 1.00 0.00 N ATOM 187 CA ARG A 14 15.232 13.119 0.863 1.00 0.00 C ATOM 188 C ARG A 14 14.716 12.856 2.271 1.00 0.00 C ATOM 189 O ARG A 14 15.512 12.604 3.177 1.00 0.00 O ATOM 190 CB ARG A 14 14.112 13.563 -0.109 1.00 0.00 C ATOM 191 CG ARG A 14 13.611 14.982 0.090 1.00 0.00 C ATOM 192 CD ARG A 14 12.385 15.271 -0.759 1.00 0.00 C ATOM 193 NE ARG A 14 12.567 14.956 -2.181 1.00 0.00 N ATOM 194 CZ ARG A 14 11.751 15.390 -3.172 1.00 0.00 C ATOM 195 NH1 ARG A 14 10.826 16.322 -2.932 1.00 0.00 N ATOM 196 NH2 ARG A 14 11.871 14.892 -4.395 1.00 0.00 N ATOM 0 H ARG A 14 15.978 11.171 1.017 1.00 0.00 H new ATOM 0 HA ARG A 14 15.901 13.979 0.882 1.00 0.00 H new ATOM 0 HB2 ARG A 14 14.479 13.464 -1.131 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.270 12.879 -0.005 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.370 15.138 1.141 1.00 0.00 H new ATOM 0 HG3 ARG A 14 14.403 15.686 -0.164 1.00 0.00 H new ATOM 0 HD2 ARG A 14 11.543 14.697 -0.373 1.00 0.00 H new ATOM 0 HD3 ARG A 14 12.125 16.325 -0.659 1.00 0.00 H new ATOM 0 HE ARG A 14 13.361 14.371 -2.441 1.00 0.00 H new ATOM 0 HH11 ARG A 14 10.728 16.714 -1.996 1.00 0.00 H new ATOM 0 HH12 ARG A 14 10.217 16.642 -3.685 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.577 14.182 -4.590 1.00 0.00 H new ATOM 0 HH22 ARG A 14 11.257 15.218 -5.141 1.00 0.00 H new ATOM 210 N HIS A 15 13.406 12.888 2.474 1.00 0.00 N ATOM 211 CA HIS A 15 12.873 12.865 3.824 1.00 0.00 C ATOM 212 C HIS A 15 11.680 11.947 3.991 1.00 0.00 C ATOM 213 O HIS A 15 11.042 11.498 3.004 1.00 0.00 O ATOM 214 CB HIS A 15 12.499 14.279 4.306 1.00 0.00 C ATOM 215 CG HIS A 15 13.661 15.183 4.624 1.00 0.00 C ATOM 216 ND1 HIS A 15 14.010 15.528 5.904 1.00 0.00 N ATOM 217 CD2 HIS A 15 14.550 15.806 3.818 1.00 0.00 C ATOM 218 CE1 HIS A 15 15.058 16.322 5.875 1.00 0.00 C ATOM 219 NE2 HIS A 15 15.405 16.506 4.620 1.00 0.00 N ATOM 0 H HIS A 15 12.705 12.929 1.734 1.00 0.00 H new ATOM 0 HA HIS A 15 13.679 12.466 4.440 1.00 0.00 H new ATOM 0 HB2 HIS A 15 11.889 14.756 3.539 1.00 0.00 H new ATOM 0 HB3 HIS A 15 11.877 14.188 5.197 1.00 0.00 H new ATOM 0 HD2 HIS A 15 14.579 15.759 2.739 1.00 0.00 H new ATOM 0 HE1 HIS A 15 15.550 16.750 6.736 1.00 0.00 H new ATOM 0 HE2 HIS A 15 16.186 17.078 4.298 1.00 0.00 H new ATOM 228 N HIS A 16 11.386 11.711 5.247 1.00 0.00 N ATOM 229 CA HIS A 16 10.287 10.899 5.687 1.00 0.00 C ATOM 230 C HIS A 16 9.123 11.790 6.046 1.00 0.00 C ATOM 231 O HIS A 16 9.280 12.795 6.735 1.00 0.00 O ATOM 232 CB HIS A 16 10.666 10.113 6.938 1.00 0.00 C ATOM 233 CG HIS A 16 11.682 9.034 6.772 1.00 0.00 C ATOM 234 ND1 HIS A 16 13.028 9.248 6.916 1.00 0.00 N ATOM 235 CD2 HIS A 16 11.540 7.705 6.544 1.00 0.00 C ATOM 236 CE1 HIS A 16 13.670 8.116 6.787 1.00 0.00 C ATOM 237 NE2 HIS A 16 12.796 7.156 6.563 1.00 0.00 N ATOM 0 H HIS A 16 11.931 12.097 6.018 1.00 0.00 H new ATOM 0 HA HIS A 16 10.027 10.212 4.881 1.00 0.00 H new ATOM 0 HB2 HIS A 16 11.037 10.817 7.682 1.00 0.00 H new ATOM 0 HB3 HIS A 16 9.759 9.666 7.346 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.612 7.178 6.379 1.00 0.00 H new ATOM 0 HE1 HIS A 16 14.740 7.989 6.853 1.00 0.00 H new ATOM 0 HE2 HIS A 16 13.017 6.170 6.427 1.00 0.00 H new ATOM 246 N ASN A 17 8.003 11.464 5.533 1.00 0.00 N ATOM 247 CA ASN A 17 6.748 12.116 5.829 1.00 0.00 C ATOM 248 C ASN A 17 5.872 11.091 6.507 1.00 0.00 C ATOM 249 O ASN A 17 6.223 9.898 6.551 1.00 0.00 O ATOM 250 CB ASN A 17 6.060 12.601 4.527 1.00 0.00 C ATOM 251 CG ASN A 17 6.693 13.833 3.862 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.020 14.568 3.139 1.00 0.00 O ATOM 253 ND2 ASN A 17 7.959 14.088 4.111 1.00 0.00 N ATOM 0 H ASN A 17 7.909 10.702 4.861 1.00 0.00 H new ATOM 0 HA ASN A 17 6.914 12.987 6.463 1.00 0.00 H new ATOM 0 HB2 ASN A 17 6.062 11.781 3.809 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.017 12.826 4.750 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.404 14.910 3.702 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.496 13.464 4.713 1.00 0.00 H new ATOM 260 N GLY A 18 4.768 11.518 7.030 1.00 0.00 N ATOM 261 CA GLY A 18 3.865 10.607 7.651 1.00 0.00 C ATOM 262 C GLY A 18 2.727 10.268 6.729 1.00 0.00 C ATOM 263 O GLY A 18 2.891 10.266 5.498 1.00 0.00 O ATOM 0 H GLY A 18 4.471 12.494 7.039 1.00 0.00 H new ATOM 0 HA2 GLY A 18 4.395 9.697 7.931 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.476 11.044 8.570 1.00 0.00 H new ATOM 267 N PHE A 19 1.590 10.007 7.310 1.00 0.00 N ATOM 268 CA PHE A 19 0.394 9.652 6.571 1.00 0.00 C ATOM 269 C PHE A 19 -0.232 10.958 6.087 1.00 0.00 C ATOM 270 O PHE A 19 -0.486 11.857 6.915 1.00 0.00 O ATOM 271 CB PHE A 19 -0.601 8.951 7.522 1.00 0.00 C ATOM 272 CG PHE A 19 0.033 7.972 8.496 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.664 6.831 8.059 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.018 8.212 9.862 1.00 0.00 C ATOM 275 CE1 PHE A 19 1.237 5.949 8.954 1.00 0.00 C ATOM 276 CE2 PHE A 19 0.552 7.329 10.759 1.00 0.00 C ATOM 277 CZ PHE A 19 1.179 6.199 10.300 1.00 0.00 C ATOM 0 H PHE A 19 1.458 10.033 8.321 1.00 0.00 H new ATOM 0 HA PHE A 19 0.630 8.987 5.740 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.137 9.712 8.090 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.341 8.419 6.924 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.712 6.622 7.001 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.510 9.101 10.229 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.732 5.060 8.592 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.504 7.528 11.819 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.626 5.507 10.998 1.00 0.00 H new ATOM 287 N ASP A 20 -0.457 11.114 4.791 1.00 0.00 N ATOM 288 CA ASP A 20 -1.044 12.352 4.286 1.00 0.00 C ATOM 289 C ASP A 20 -2.540 12.269 4.447 1.00 0.00 C ATOM 290 O ASP A 20 -3.201 11.517 3.719 1.00 0.00 O ATOM 291 CB ASP A 20 -0.728 12.554 2.796 1.00 0.00 C ATOM 292 CG ASP A 20 -1.090 13.953 2.308 1.00 0.00 C ATOM 293 OD1 ASP A 20 -2.264 14.219 1.997 1.00 0.00 O ATOM 294 OD2 ASP A 20 -0.174 14.820 2.208 1.00 0.00 O ATOM 0 H ASP A 20 -0.248 10.414 4.079 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.626 13.188 4.847 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.334 12.376 2.626 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.273 11.815 2.209 1.00 0.00 H new ATOM 299 N PHE A 21 -3.076 13.021 5.393 1.00 0.00 N ATOM 300 CA PHE A 21 -4.487 12.947 5.692 1.00 0.00 C ATOM 301 C PHE A 21 -5.341 13.325 4.505 1.00 0.00 C ATOM 302 O PHE A 21 -6.284 12.648 4.232 1.00 0.00 O ATOM 303 CB PHE A 21 -4.897 13.774 6.907 1.00 0.00 C ATOM 304 CG PHE A 21 -6.298 13.447 7.348 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.584 12.193 7.862 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.328 14.368 7.223 1.00 0.00 C ATOM 307 CE1 PHE A 21 -7.855 11.859 8.240 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.612 14.034 7.609 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.873 12.779 8.116 1.00 0.00 C ATOM 0 H PHE A 21 -2.554 13.686 5.963 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.664 11.900 5.936 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.203 13.587 7.727 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.828 14.835 6.667 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.791 11.468 7.966 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.125 15.350 6.822 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.061 10.875 8.635 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.410 14.755 7.514 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.877 12.517 8.416 1.00 0.00 H new ATOM 319 N ALA A 22 -4.996 14.402 3.808 1.00 0.00 N ATOM 320 CA ALA A 22 -5.755 14.848 2.629 1.00 0.00 C ATOM 321 C ALA A 22 -5.942 13.711 1.614 1.00 0.00 C ATOM 322 O ALA A 22 -7.043 13.502 1.115 1.00 0.00 O ATOM 323 CB ALA A 22 -5.086 16.042 1.975 1.00 0.00 C ATOM 0 H ALA A 22 -4.193 14.989 4.035 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.744 15.152 2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.666 16.353 1.106 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.032 16.864 2.688 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.079 15.768 1.660 1.00 0.00 H new ATOM 329 N VAL A 23 -4.874 12.972 1.351 1.00 0.00 N ATOM 330 CA VAL A 23 -4.926 11.805 0.462 1.00 0.00 C ATOM 331 C VAL A 23 -5.944 10.763 0.992 1.00 0.00 C ATOM 332 O VAL A 23 -6.890 10.381 0.286 1.00 0.00 O ATOM 333 CB VAL A 23 -3.515 11.163 0.302 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.572 9.863 -0.458 1.00 0.00 C ATOM 335 CG2 VAL A 23 -2.569 12.115 -0.408 1.00 0.00 C ATOM 0 H VAL A 23 -3.950 13.157 1.741 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.256 12.141 -0.521 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.145 10.959 1.307 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.568 9.449 -0.547 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.209 9.157 0.075 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.981 10.041 -1.453 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.590 11.647 -0.509 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -2.963 12.349 -1.397 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.474 13.033 0.172 1.00 0.00 H new ATOM 345 N ILE A 24 -5.728 10.331 2.232 1.00 0.00 N ATOM 346 CA ILE A 24 -6.612 9.367 2.933 1.00 0.00 C ATOM 347 C ILE A 24 -8.087 9.865 2.905 1.00 0.00 C ATOM 348 O ILE A 24 -9.031 9.114 2.675 1.00 0.00 O ATOM 349 CB ILE A 24 -6.178 9.226 4.437 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.671 8.931 4.590 1.00 0.00 C ATOM 351 CG2 ILE A 24 -6.996 8.162 5.160 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.180 7.689 3.883 1.00 0.00 C ATOM 0 H ILE A 24 -4.932 10.634 2.794 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.530 8.407 2.424 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.376 10.192 4.901 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.110 9.788 4.216 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.442 8.839 5.652 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.668 8.093 6.197 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.052 8.432 5.131 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.854 7.199 4.670 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.110 7.573 4.053 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.706 6.817 4.272 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.370 7.780 2.813 1.00 0.00 H new ATOM 364 N LYS A 25 -8.215 11.139 3.056 1.00 0.00 N ATOM 365 CA LYS A 25 -9.472 11.842 3.151 1.00 0.00 C ATOM 366 C LYS A 25 -10.199 11.834 1.806 1.00 0.00 C ATOM 367 O LYS A 25 -11.406 11.605 1.747 1.00 0.00 O ATOM 368 CB LYS A 25 -9.177 13.269 3.591 1.00 0.00 C ATOM 369 CG LYS A 25 -10.371 14.163 3.839 1.00 0.00 C ATOM 370 CD LYS A 25 -9.914 15.595 4.056 1.00 0.00 C ATOM 371 CE LYS A 25 -9.416 16.219 2.750 1.00 0.00 C ATOM 372 NZ LYS A 25 -8.902 17.579 2.950 1.00 0.00 N ATOM 0 H LYS A 25 -7.409 11.761 3.121 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.122 11.351 3.875 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.587 13.228 4.506 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.553 13.738 2.830 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.053 14.115 2.990 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.922 13.813 4.712 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.738 16.187 4.454 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.118 15.617 4.800 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -8.630 15.593 2.326 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.230 16.242 2.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.575 17.964 2.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.658 18.183 3.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.108 17.555 3.621 1.00 0.00 H new ATOM 386 N GLU A 26 -9.471 12.064 0.722 1.00 0.00 N ATOM 387 CA GLU A 26 -10.077 12.063 -0.600 1.00 0.00 C ATOM 388 C GLU A 26 -10.489 10.663 -1.022 1.00 0.00 C ATOM 389 O GLU A 26 -11.550 10.485 -1.639 1.00 0.00 O ATOM 390 CB GLU A 26 -9.188 12.731 -1.646 1.00 0.00 C ATOM 391 CG GLU A 26 -8.994 14.217 -1.407 1.00 0.00 C ATOM 392 CD GLU A 26 -8.187 14.879 -2.478 1.00 0.00 C ATOM 393 OE1 GLU A 26 -6.946 14.834 -2.422 1.00 0.00 O ATOM 394 OE2 GLU A 26 -8.780 15.478 -3.395 1.00 0.00 O ATOM 0 H GLU A 26 -8.469 12.252 0.732 1.00 0.00 H new ATOM 0 HA GLU A 26 -10.983 12.665 -0.533 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -8.214 12.241 -1.652 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.626 12.583 -2.633 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.969 14.700 -1.343 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.502 14.364 -0.445 1.00 0.00 H new ATOM 401 N LEU A 27 -9.675 9.661 -0.686 1.00 0.00 N ATOM 402 CA LEU A 27 -10.075 8.291 -0.966 1.00 0.00 C ATOM 403 C LEU A 27 -11.300 7.943 -0.138 1.00 0.00 C ATOM 404 O LEU A 27 -12.190 7.259 -0.608 1.00 0.00 O ATOM 405 CB LEU A 27 -8.941 7.264 -0.741 1.00 0.00 C ATOM 406 CG LEU A 27 -9.264 5.822 -1.161 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.773 5.791 -2.578 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.038 4.941 -1.029 1.00 0.00 C ATOM 0 H LEU A 27 -8.766 9.769 -0.235 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.318 8.232 -2.027 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.060 7.595 -1.290 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.677 7.266 0.317 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.041 5.438 -0.499 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.998 4.763 -2.862 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.678 6.394 -2.653 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.012 6.194 -3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.287 3.924 -1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.243 5.325 -1.668 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.701 4.940 0.008 1.00 0.00 H new ATOM 420 N LYS A 28 -11.357 8.472 1.081 1.00 0.00 N ATOM 421 CA LYS A 28 -12.507 8.284 1.958 1.00 0.00 C ATOM 422 C LYS A 28 -13.743 8.985 1.374 1.00 0.00 C ATOM 423 O LYS A 28 -14.871 8.539 1.571 1.00 0.00 O ATOM 424 CB LYS A 28 -12.182 8.801 3.366 1.00 0.00 C ATOM 425 CG LYS A 28 -13.237 8.516 4.431 1.00 0.00 C ATOM 426 CD LYS A 28 -12.723 8.928 5.806 1.00 0.00 C ATOM 427 CE LYS A 28 -13.694 8.572 6.930 1.00 0.00 C ATOM 428 NZ LYS A 28 -14.053 7.129 6.943 1.00 0.00 N ATOM 0 H LYS A 28 -10.612 9.039 1.486 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.733 7.220 2.032 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.238 8.360 3.687 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.028 9.879 3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.153 9.059 4.200 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.487 7.455 4.431 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.765 8.442 5.992 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.542 10.003 5.815 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -13.248 8.840 7.888 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.601 9.167 6.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.075 6.786 7.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -14.990 7.000 6.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -13.345 6.590 6.404 1.00 0.00 H new ATOM 442 N THR A 29 -13.507 10.068 0.638 1.00 0.00 N ATOM 443 CA THR A 29 -14.574 10.786 -0.029 1.00 0.00 C ATOM 444 C THR A 29 -15.211 9.864 -1.082 1.00 0.00 C ATOM 445 O THR A 29 -16.428 9.621 -1.064 1.00 0.00 O ATOM 446 CB THR A 29 -14.052 12.082 -0.711 1.00 0.00 C ATOM 447 OG1 THR A 29 -13.277 12.854 0.235 1.00 0.00 O ATOM 448 CG2 THR A 29 -15.214 12.942 -1.196 1.00 0.00 C ATOM 0 H THR A 29 -12.579 10.464 0.492 1.00 0.00 H new ATOM 0 HA THR A 29 -15.313 11.080 0.716 1.00 0.00 H new ATOM 0 HB THR A 29 -13.435 11.792 -1.562 1.00 0.00 H new ATOM 0 HG1 THR A 29 -12.585 12.285 0.633 1.00 0.00 H new ATOM 0 HG21 THR A 29 -14.826 13.844 -1.670 1.00 0.00 H new ATOM 0 HG22 THR A 29 -15.807 12.379 -1.917 1.00 0.00 H new ATOM 0 HG23 THR A 29 -15.841 13.219 -0.348 1.00 0.00 H new ATOM 456 N ALA A 30 -14.368 9.310 -1.975 1.00 0.00 N ATOM 457 CA ALA A 30 -14.778 8.400 -2.992 1.00 0.00 C ATOM 458 C ALA A 30 -15.391 7.161 -2.379 1.00 0.00 C ATOM 459 O ALA A 30 -16.398 6.731 -2.795 1.00 0.00 O ATOM 460 CB ALA A 30 -13.584 8.037 -3.844 1.00 0.00 C ATOM 0 H ALA A 30 -13.367 9.505 -1.986 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.535 8.874 -3.617 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -13.892 7.341 -4.624 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.176 8.938 -4.302 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -12.821 7.570 -3.221 1.00 0.00 H new ATOM 466 N ALA A 31 -14.784 6.635 -1.365 1.00 0.00 N ATOM 467 CA ALA A 31 -15.288 5.472 -0.652 1.00 0.00 C ATOM 468 C ALA A 31 -16.691 5.699 -0.071 1.00 0.00 C ATOM 469 O ALA A 31 -17.512 4.771 -0.019 1.00 0.00 O ATOM 470 CB ALA A 31 -14.351 5.149 0.451 1.00 0.00 C ATOM 0 H ALA A 31 -13.907 6.997 -0.990 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.361 4.650 -1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.716 4.278 0.995 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.365 4.933 0.039 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.282 5.999 1.130 1.00 0.00 H new ATOM 476 N SER A 32 -16.960 6.919 0.350 1.00 0.00 N ATOM 477 CA SER A 32 -18.234 7.270 0.905 1.00 0.00 C ATOM 478 C SER A 32 -19.292 7.315 -0.202 1.00 0.00 C ATOM 479 O SER A 32 -20.276 6.580 -0.165 1.00 0.00 O ATOM 480 CB SER A 32 -18.123 8.633 1.633 1.00 0.00 C ATOM 481 OG SER A 32 -19.364 9.048 2.192 1.00 0.00 O ATOM 0 H SER A 32 -16.294 7.690 0.313 1.00 0.00 H new ATOM 0 HA SER A 32 -18.540 6.517 1.631 1.00 0.00 H new ATOM 0 HB2 SER A 32 -17.377 8.560 2.424 1.00 0.00 H new ATOM 0 HB3 SER A 32 -17.772 9.390 0.932 1.00 0.00 H new ATOM 0 HG SER A 32 -19.248 9.910 2.643 1.00 0.00 H new ATOM 487 N GLN A 33 -19.030 8.121 -1.183 1.00 0.00 N ATOM 488 CA GLN A 33 -19.933 8.408 -2.289 1.00 0.00 C ATOM 489 C GLN A 33 -19.990 7.285 -3.338 1.00 0.00 C ATOM 490 O GLN A 33 -21.046 6.728 -3.638 1.00 0.00 O ATOM 491 CB GLN A 33 -19.400 9.676 -2.940 1.00 0.00 C ATOM 492 CG GLN A 33 -19.412 10.865 -2.014 1.00 0.00 C ATOM 493 CD GLN A 33 -20.783 11.442 -1.836 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.124 11.928 -0.756 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.546 11.477 -2.906 1.00 0.00 N ATOM 0 H GLN A 33 -18.147 8.626 -1.252 1.00 0.00 H new ATOM 0 HA GLN A 33 -20.949 8.510 -1.907 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.380 9.500 -3.283 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -19.998 9.904 -3.822 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.018 10.568 -1.042 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.746 11.634 -2.407 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.220 11.061 -3.778 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.464 11.920 -2.864 1.00 0.00 H new ATOM 504 N TYR A 34 -18.852 6.974 -3.841 1.00 0.00 N ATOM 505 CA TYR A 34 -18.611 6.076 -4.956 1.00 0.00 C ATOM 506 C TYR A 34 -18.462 4.638 -4.471 1.00 0.00 C ATOM 507 O TYR A 34 -19.082 3.715 -5.017 1.00 0.00 O ATOM 508 CB TYR A 34 -17.332 6.616 -5.685 1.00 0.00 C ATOM 509 CG TYR A 34 -17.599 7.892 -6.469 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.653 9.122 -5.830 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.872 7.853 -7.832 1.00 0.00 C ATOM 512 CE1 TYR A 34 -17.972 10.277 -6.521 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.173 9.008 -8.538 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.231 10.215 -7.877 1.00 0.00 C ATOM 515 OH TYR A 34 -18.564 11.368 -8.575 1.00 0.00 O ATOM 0 H TYR A 34 -17.985 7.361 -3.468 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.449 6.054 -5.653 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.551 6.804 -4.948 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -16.954 5.850 -6.363 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.442 9.179 -4.772 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.849 6.906 -8.350 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -18.018 11.223 -6.003 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.361 8.961 -9.600 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.713 11.148 -9.518 1.00 0.00 H new ATOM 525 N GLY A 35 -17.759 4.468 -3.384 1.00 0.00 N ATOM 526 CA GLY A 35 -17.495 3.158 -2.878 1.00 0.00 C ATOM 527 C GLY A 35 -16.509 2.421 -3.743 1.00 0.00 C ATOM 528 O GLY A 35 -15.779 3.028 -4.535 1.00 0.00 O ATOM 0 H GLY A 35 -17.359 5.227 -2.833 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.106 3.231 -1.862 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.426 2.593 -2.823 1.00 0.00 H new ATOM 532 N ALA A 36 -16.488 1.143 -3.601 1.00 0.00 N ATOM 533 CA ALA A 36 -15.625 0.299 -4.371 1.00 0.00 C ATOM 534 C ALA A 36 -16.232 0.001 -5.715 1.00 0.00 C ATOM 535 O ALA A 36 -17.423 0.201 -5.925 1.00 0.00 O ATOM 536 CB ALA A 36 -15.349 -0.961 -3.646 1.00 0.00 C ATOM 0 H ALA A 36 -17.077 0.640 -2.937 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.684 0.827 -4.525 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -14.692 -1.590 -4.246 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -14.866 -0.735 -2.695 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -16.286 -1.487 -3.462 1.00 0.00 H new ATOM 542 N THR A 37 -15.374 -0.359 -6.651 1.00 0.00 N ATOM 543 CA THR A 37 -15.755 -0.730 -8.017 1.00 0.00 C ATOM 544 C THR A 37 -16.278 0.492 -8.839 1.00 0.00 C ATOM 545 O THR A 37 -16.589 0.394 -10.038 1.00 0.00 O ATOM 546 CB THR A 37 -16.686 -1.975 -8.001 1.00 0.00 C ATOM 547 OG1 THR A 37 -15.968 -3.037 -7.332 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.087 -2.454 -9.391 1.00 0.00 C ATOM 0 H THR A 37 -14.368 -0.405 -6.487 1.00 0.00 H new ATOM 0 HA THR A 37 -14.866 -1.039 -8.566 1.00 0.00 H new ATOM 0 HB THR A 37 -17.609 -1.700 -7.491 1.00 0.00 H new ATOM 0 HG1 THR A 37 -16.341 -3.170 -6.436 1.00 0.00 H new ATOM 0 HG21 THR A 37 -17.736 -3.325 -9.302 1.00 0.00 H new ATOM 0 HG22 THR A 37 -17.618 -1.657 -9.911 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.194 -2.723 -9.955 1.00 0.00 H new ATOM 556 N ALA A 38 -16.308 1.655 -8.201 1.00 0.00 N ATOM 557 CA ALA A 38 -16.524 2.866 -8.894 1.00 0.00 C ATOM 558 C ALA A 38 -15.133 3.313 -9.297 1.00 0.00 C ATOM 559 O ALA A 38 -14.293 3.518 -8.412 1.00 0.00 O ATOM 560 CB ALA A 38 -17.187 3.879 -7.985 1.00 0.00 C ATOM 0 H ALA A 38 -16.181 1.759 -7.194 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.184 2.755 -9.755 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.348 4.808 -8.532 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.146 3.489 -7.643 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.546 4.071 -7.125 1.00 0.00 H new ATOM 566 N PRO A 39 -14.858 3.380 -10.629 1.00 0.00 N ATOM 567 CA PRO A 39 -13.528 3.661 -11.216 1.00 0.00 C ATOM 568 C PRO A 39 -12.634 4.603 -10.403 1.00 0.00 C ATOM 569 O PRO A 39 -11.462 4.288 -10.162 1.00 0.00 O ATOM 570 CB PRO A 39 -13.888 4.298 -12.549 1.00 0.00 C ATOM 571 CG PRO A 39 -15.151 3.621 -12.960 1.00 0.00 C ATOM 572 CD PRO A 39 -15.853 3.177 -11.698 1.00 0.00 C ATOM 0 HA PRO A 39 -12.932 2.750 -11.270 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.029 5.374 -12.449 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.099 4.147 -13.286 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.783 4.300 -13.533 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.938 2.767 -13.602 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -16.754 3.764 -11.518 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.160 2.133 -11.761 1.00 0.00 H new ATOM 580 N TYR A 40 -13.216 5.715 -9.951 1.00 0.00 N ATOM 581 CA TYR A 40 -12.503 6.752 -9.228 1.00 0.00 C ATOM 582 C TYR A 40 -11.714 6.184 -8.044 1.00 0.00 C ATOM 583 O TYR A 40 -10.479 6.193 -8.054 1.00 0.00 O ATOM 584 CB TYR A 40 -13.484 7.824 -8.723 1.00 0.00 C ATOM 585 CG TYR A 40 -12.794 9.081 -8.250 1.00 0.00 C ATOM 586 CD1 TYR A 40 -12.019 9.827 -9.125 1.00 0.00 C ATOM 587 CD2 TYR A 40 -12.904 9.513 -6.942 1.00 0.00 C ATOM 588 CE1 TYR A 40 -11.365 10.957 -8.712 1.00 0.00 C ATOM 589 CE2 TYR A 40 -12.256 10.653 -6.515 1.00 0.00 C ATOM 590 CZ TYR A 40 -11.483 11.373 -7.411 1.00 0.00 C ATOM 591 OH TYR A 40 -10.807 12.507 -7.000 1.00 0.00 O ATOM 0 H TYR A 40 -14.207 5.917 -10.082 1.00 0.00 H new ATOM 0 HA TYR A 40 -11.794 7.200 -9.924 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.180 8.077 -9.523 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.075 7.411 -7.905 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -11.929 9.510 -10.154 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.506 8.950 -6.244 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -10.759 11.518 -9.408 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.350 10.982 -5.491 1.00 0.00 H new ATOM 0 HH TYR A 40 -10.992 12.673 -6.052 1.00 0.00 H new ATOM 601 N THR A 41 -12.443 5.674 -7.046 1.00 0.00 N ATOM 602 CA THR A 41 -11.930 5.152 -5.804 1.00 0.00 C ATOM 603 C THR A 41 -10.731 4.188 -5.996 1.00 0.00 C ATOM 604 O THR A 41 -9.673 4.381 -5.403 1.00 0.00 O ATOM 605 CB THR A 41 -13.084 4.434 -5.110 1.00 0.00 C ATOM 606 OG1 THR A 41 -14.276 5.208 -5.289 1.00 0.00 O ATOM 607 CG2 THR A 41 -12.829 4.276 -3.639 1.00 0.00 C ATOM 0 H THR A 41 -13.460 5.618 -7.100 1.00 0.00 H new ATOM 0 HA THR A 41 -11.547 5.978 -5.204 1.00 0.00 H new ATOM 0 HB THR A 41 -13.187 3.441 -5.549 1.00 0.00 H new ATOM 0 HG1 THR A 41 -15.059 4.657 -5.080 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.671 3.761 -3.177 1.00 0.00 H new ATOM 0 HG22 THR A 41 -11.920 3.694 -3.488 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.710 5.259 -3.183 1.00 0.00 H new ATOM 615 N LEU A 42 -10.863 3.212 -6.871 1.00 0.00 N ATOM 616 CA LEU A 42 -9.786 2.239 -7.026 1.00 0.00 C ATOM 617 C LEU A 42 -8.611 2.719 -7.822 1.00 0.00 C ATOM 618 O LEU A 42 -7.507 2.195 -7.667 1.00 0.00 O ATOM 619 CB LEU A 42 -10.196 0.779 -7.346 1.00 0.00 C ATOM 620 CG LEU A 42 -11.313 0.478 -8.355 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.651 0.840 -7.782 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.072 1.141 -9.705 1.00 0.00 C ATOM 0 H LEU A 42 -11.675 3.067 -7.471 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.431 2.166 -5.998 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.301 0.265 -7.697 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.482 0.313 -6.403 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.305 -0.596 -8.543 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.431 0.620 -8.511 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.828 0.261 -6.876 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.668 1.903 -7.542 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.891 0.896 -10.382 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.019 2.222 -9.575 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.133 0.780 -10.125 1.00 0.00 H new ATOM 634 N ALA A 43 -8.825 3.722 -8.654 1.00 0.00 N ATOM 635 CA ALA A 43 -7.737 4.331 -9.384 1.00 0.00 C ATOM 636 C ALA A 43 -6.855 5.083 -8.411 1.00 0.00 C ATOM 637 O ALA A 43 -5.641 5.190 -8.576 1.00 0.00 O ATOM 638 CB ALA A 43 -8.262 5.248 -10.465 1.00 0.00 C ATOM 0 H ALA A 43 -9.742 4.129 -8.838 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.149 3.556 -9.876 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.425 5.695 -11.001 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.875 4.676 -11.161 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.865 6.035 -10.013 1.00 0.00 H new ATOM 644 N ILE A 44 -7.480 5.569 -7.381 1.00 0.00 N ATOM 645 CA ILE A 44 -6.800 6.245 -6.322 1.00 0.00 C ATOM 646 C ILE A 44 -5.983 5.224 -5.520 1.00 0.00 C ATOM 647 O ILE A 44 -4.816 5.446 -5.277 1.00 0.00 O ATOM 648 CB ILE A 44 -7.805 6.953 -5.402 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.659 7.930 -6.210 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.077 7.701 -4.283 1.00 0.00 C ATOM 651 CD1 ILE A 44 -9.873 8.410 -5.471 1.00 0.00 C ATOM 0 H ILE A 44 -8.490 5.505 -7.253 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.135 6.998 -6.745 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.452 6.199 -4.954 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.049 8.789 -6.489 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -8.973 7.447 -7.136 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -7.806 8.196 -3.642 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.495 6.994 -3.692 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.411 8.446 -4.717 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.434 9.100 -6.102 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.503 7.558 -5.215 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.565 8.921 -4.559 1.00 0.00 H new ATOM 663 N VAL A 45 -6.609 4.080 -5.173 1.00 0.00 N ATOM 664 CA VAL A 45 -5.941 2.978 -4.412 1.00 0.00 C ATOM 665 C VAL A 45 -4.592 2.614 -5.078 1.00 0.00 C ATOM 666 O VAL A 45 -3.513 2.647 -4.441 1.00 0.00 O ATOM 667 CB VAL A 45 -6.839 1.671 -4.358 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.186 0.564 -3.554 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.217 1.941 -3.789 1.00 0.00 C ATOM 0 H VAL A 45 -7.583 3.885 -5.405 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.783 3.340 -3.396 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.943 1.348 -5.394 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.836 -0.311 -3.544 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.230 0.301 -4.007 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.021 0.905 -2.532 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.792 1.015 -3.773 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.122 2.326 -2.774 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.729 2.676 -4.410 1.00 0.00 H new ATOM 679 N GLU A 46 -4.657 2.355 -6.370 1.00 0.00 N ATOM 680 CA GLU A 46 -3.495 1.944 -7.139 1.00 0.00 C ATOM 681 C GLU A 46 -2.509 3.096 -7.398 1.00 0.00 C ATOM 682 O GLU A 46 -1.325 2.854 -7.651 1.00 0.00 O ATOM 683 CB GLU A 46 -3.916 1.282 -8.448 1.00 0.00 C ATOM 684 CG GLU A 46 -4.852 2.113 -9.298 1.00 0.00 C ATOM 685 CD GLU A 46 -5.150 1.465 -10.610 1.00 0.00 C ATOM 686 OE1 GLU A 46 -4.206 1.210 -11.376 1.00 0.00 O ATOM 687 OE2 GLU A 46 -6.331 1.194 -10.910 1.00 0.00 O ATOM 0 H GLU A 46 -5.515 2.423 -6.917 1.00 0.00 H new ATOM 0 HA GLU A 46 -2.963 1.212 -6.531 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.022 1.055 -9.030 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.399 0.331 -8.221 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.783 2.276 -8.756 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.408 3.093 -9.472 1.00 0.00 H new ATOM 694 N SER A 47 -2.977 4.338 -7.322 1.00 0.00 N ATOM 695 CA SER A 47 -2.107 5.465 -7.543 1.00 0.00 C ATOM 696 C SER A 47 -1.379 5.827 -6.246 1.00 0.00 C ATOM 697 O SER A 47 -0.202 6.158 -6.264 1.00 0.00 O ATOM 698 CB SER A 47 -2.889 6.673 -8.094 1.00 0.00 C ATOM 699 OG SER A 47 -2.017 7.730 -8.527 1.00 0.00 O ATOM 0 H SER A 47 -3.946 4.578 -7.111 1.00 0.00 H new ATOM 0 HA SER A 47 -1.366 5.187 -8.293 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.511 6.351 -8.930 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.561 7.051 -7.324 1.00 0.00 H new ATOM 0 HG SER A 47 -2.552 8.476 -8.870 1.00 0.00 H new ATOM 705 N VAL A 48 -2.078 5.745 -5.117 1.00 0.00 N ATOM 706 CA VAL A 48 -1.482 6.057 -3.822 1.00 0.00 C ATOM 707 C VAL A 48 -0.351 5.087 -3.524 1.00 0.00 C ATOM 708 O VAL A 48 0.719 5.494 -3.065 1.00 0.00 O ATOM 709 CB VAL A 48 -2.523 6.041 -2.659 1.00 0.00 C ATOM 710 CG1 VAL A 48 -1.858 6.330 -1.318 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.621 7.060 -2.907 1.00 0.00 C ATOM 0 H VAL A 48 -3.058 5.465 -5.073 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.092 7.073 -3.885 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.959 5.042 -2.626 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.609 6.312 -0.528 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.101 5.572 -1.116 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.388 7.313 -1.349 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.336 7.032 -2.085 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.184 8.056 -2.975 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.132 6.824 -3.840 1.00 0.00 H new ATOM 721 N ALA A 49 -0.550 3.831 -3.886 1.00 0.00 N ATOM 722 CA ALA A 49 0.449 2.797 -3.642 1.00 0.00 C ATOM 723 C ALA A 49 1.683 2.936 -4.523 1.00 0.00 C ATOM 724 O ALA A 49 2.657 2.241 -4.317 1.00 0.00 O ATOM 725 CB ALA A 49 -0.156 1.403 -3.736 1.00 0.00 C ATOM 0 H ALA A 49 -1.395 3.499 -4.351 1.00 0.00 H new ATOM 0 HA ALA A 49 0.794 2.943 -2.618 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.617 0.658 -3.549 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.948 1.299 -2.994 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.571 1.253 -4.733 1.00 0.00 H new ATOM 731 N ASP A 50 1.665 3.883 -5.459 1.00 0.00 N ATOM 732 CA ASP A 50 2.807 4.114 -6.347 1.00 0.00 C ATOM 733 C ASP A 50 3.838 4.963 -5.619 1.00 0.00 C ATOM 734 O ASP A 50 4.995 5.113 -6.035 1.00 0.00 O ATOM 735 CB ASP A 50 2.344 4.833 -7.631 1.00 0.00 C ATOM 736 CG ASP A 50 3.488 5.217 -8.552 1.00 0.00 C ATOM 737 OD1 ASP A 50 3.943 4.364 -9.344 1.00 0.00 O ATOM 738 OD2 ASP A 50 3.952 6.393 -8.500 1.00 0.00 O ATOM 0 H ASP A 50 0.873 4.504 -5.624 1.00 0.00 H new ATOM 0 HA ASP A 50 3.250 3.158 -6.626 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.653 4.186 -8.172 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.791 5.731 -7.356 1.00 0.00 H new ATOM 743 N ASN A 51 3.437 5.455 -4.497 1.00 0.00 N ATOM 744 CA ASN A 51 4.250 6.331 -3.702 1.00 0.00 C ATOM 745 C ASN A 51 4.919 5.495 -2.664 1.00 0.00 C ATOM 746 O ASN A 51 4.429 4.439 -2.352 1.00 0.00 O ATOM 747 CB ASN A 51 3.366 7.379 -3.014 1.00 0.00 C ATOM 748 CG ASN A 51 2.649 8.276 -3.990 1.00 0.00 C ATOM 749 OD1 ASN A 51 3.178 9.296 -4.419 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.437 7.918 -4.336 1.00 0.00 N ATOM 0 H ASN A 51 2.521 5.261 -4.093 1.00 0.00 H new ATOM 0 HA ASN A 51 4.982 6.845 -4.325 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.632 6.872 -2.388 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.982 7.989 -2.353 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.900 8.495 -4.983 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.031 7.062 -3.958 1.00 0.00 H new ATOM 757 N TRP A 52 6.031 5.934 -2.136 1.00 0.00 N ATOM 758 CA TRP A 52 6.682 5.153 -1.112 1.00 0.00 C ATOM 759 C TRP A 52 5.930 5.257 0.204 1.00 0.00 C ATOM 760 O TRP A 52 5.861 6.336 0.825 1.00 0.00 O ATOM 761 CB TRP A 52 8.162 5.512 -0.969 1.00 0.00 C ATOM 762 CG TRP A 52 8.934 5.205 -2.215 1.00 0.00 C ATOM 763 CD1 TRP A 52 9.228 3.966 -2.698 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.514 6.137 -3.133 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.935 4.066 -3.863 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.131 5.384 -4.154 1.00 0.00 C ATOM 767 CE3 TRP A 52 9.569 7.531 -3.201 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.791 5.979 -5.224 1.00 0.00 C ATOM 769 CZ3 TRP A 52 10.224 8.115 -4.258 1.00 0.00 C ATOM 770 CH2 TRP A 52 10.828 7.345 -5.258 1.00 0.00 C ATOM 0 H TRP A 52 6.497 6.805 -2.388 1.00 0.00 H new ATOM 0 HA TRP A 52 6.655 4.108 -1.421 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.257 6.572 -0.735 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.590 4.961 -0.132 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.943 3.037 -2.227 1.00 0.00 H new ATOM 0 HE1 TRP A 52 10.264 3.281 -4.425 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.106 8.138 -2.437 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.256 5.385 -5.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 10.274 9.192 -4.318 1.00 0.00 H new ATOM 0 HH2 TRP A 52 11.334 7.840 -6.074 1.00 0.00 H new ATOM 781 N LEU A 53 5.348 4.152 0.605 1.00 0.00 N ATOM 782 CA LEU A 53 4.517 4.090 1.779 1.00 0.00 C ATOM 783 C LEU A 53 4.724 2.764 2.509 1.00 0.00 C ATOM 784 O LEU A 53 5.090 1.762 1.898 1.00 0.00 O ATOM 785 CB LEU A 53 3.023 4.348 1.404 1.00 0.00 C ATOM 786 CG LEU A 53 2.190 3.262 0.662 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.889 3.865 0.166 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.924 2.584 -0.492 1.00 0.00 C ATOM 0 H LEU A 53 5.441 3.261 0.118 1.00 0.00 H new ATOM 0 HA LEU A 53 4.809 4.880 2.471 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.496 4.580 2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.998 5.247 0.789 1.00 0.00 H new ATOM 0 HG LEU A 53 1.999 2.477 1.393 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.309 3.102 -0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.317 4.243 1.013 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.106 4.684 -0.519 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.271 1.842 -0.953 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.204 3.331 -1.234 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.821 2.093 -0.114 1.00 0.00 H new ATOM 800 N THR A 54 4.506 2.777 3.792 1.00 0.00 N ATOM 801 CA THR A 54 4.790 1.654 4.641 1.00 0.00 C ATOM 802 C THR A 54 3.547 0.810 4.909 1.00 0.00 C ATOM 803 O THR A 54 2.428 1.253 4.652 1.00 0.00 O ATOM 804 CB THR A 54 5.316 2.181 5.975 1.00 0.00 C ATOM 805 OG1 THR A 54 4.461 3.246 6.414 1.00 0.00 O ATOM 806 CG2 THR A 54 6.725 2.685 5.842 1.00 0.00 C ATOM 0 H THR A 54 4.120 3.581 4.287 1.00 0.00 H new ATOM 0 HA THR A 54 5.524 1.024 4.138 1.00 0.00 H new ATOM 0 HB THR A 54 5.319 1.369 6.702 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.869 3.698 7.182 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.072 3.054 6.807 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.372 1.873 5.510 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.755 3.494 5.113 1.00 0.00 H new ATOM 814 N PRO A 55 3.722 -0.430 5.434 1.00 0.00 N ATOM 815 CA PRO A 55 2.598 -1.265 5.856 1.00 0.00 C ATOM 816 C PRO A 55 1.769 -0.586 6.967 1.00 0.00 C ATOM 817 O PRO A 55 0.550 -0.787 7.056 1.00 0.00 O ATOM 818 CB PRO A 55 3.256 -2.549 6.374 1.00 0.00 C ATOM 819 CG PRO A 55 4.593 -2.583 5.721 1.00 0.00 C ATOM 820 CD PRO A 55 5.014 -1.148 5.576 1.00 0.00 C ATOM 0 HA PRO A 55 1.898 -1.449 5.041 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.347 -2.536 7.460 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.666 -3.428 6.114 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.309 -3.142 6.324 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.542 -3.076 4.750 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.574 -0.802 6.445 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.654 -1.002 4.706 1.00 0.00 H new ATOM 828 N THR A 56 2.428 0.221 7.808 1.00 0.00 N ATOM 829 CA THR A 56 1.722 0.962 8.842 1.00 0.00 C ATOM 830 C THR A 56 0.871 2.072 8.203 1.00 0.00 C ATOM 831 O THR A 56 -0.271 2.307 8.629 1.00 0.00 O ATOM 832 CB THR A 56 2.663 1.527 9.979 1.00 0.00 C ATOM 833 OG1 THR A 56 1.889 2.166 11.004 1.00 0.00 O ATOM 834 CG2 THR A 56 3.691 2.524 9.448 1.00 0.00 C ATOM 0 H THR A 56 3.437 0.372 7.788 1.00 0.00 H new ATOM 0 HA THR A 56 1.066 0.253 9.348 1.00 0.00 H new ATOM 0 HB THR A 56 3.198 0.669 10.387 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.488 2.508 11.700 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.311 2.880 10.271 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.321 2.036 8.704 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.176 3.368 8.990 1.00 0.00 H new ATOM 842 N ASP A 57 1.392 2.700 7.130 1.00 0.00 N ATOM 843 CA ASP A 57 0.644 3.724 6.381 1.00 0.00 C ATOM 844 C ASP A 57 -0.532 3.060 5.747 1.00 0.00 C ATOM 845 O ASP A 57 -1.659 3.500 5.914 1.00 0.00 O ATOM 846 CB ASP A 57 1.520 4.375 5.313 1.00 0.00 C ATOM 847 CG ASP A 57 0.791 5.439 4.490 1.00 0.00 C ATOM 848 OD1 ASP A 57 0.685 6.598 4.964 1.00 0.00 O ATOM 849 OD2 ASP A 57 0.393 5.139 3.363 1.00 0.00 O ATOM 0 H ASP A 57 2.326 2.515 6.765 1.00 0.00 H new ATOM 0 HA ASP A 57 0.320 4.512 7.061 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.387 4.829 5.793 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.896 3.602 4.642 1.00 0.00 H new ATOM 854 N TRP A 58 -0.248 1.942 5.084 1.00 0.00 N ATOM 855 CA TRP A 58 -1.255 1.076 4.491 1.00 0.00 C ATOM 856 C TRP A 58 -2.395 0.789 5.453 1.00 0.00 C ATOM 857 O TRP A 58 -3.556 1.095 5.164 1.00 0.00 O ATOM 858 CB TRP A 58 -0.634 -0.260 4.055 1.00 0.00 C ATOM 859 CG TRP A 58 -0.018 -0.278 2.691 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.001 0.726 1.772 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.632 -1.394 2.068 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.625 0.290 0.627 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.015 -0.985 0.784 1.00 0.00 C ATOM 864 CE3 TRP A 58 0.930 -2.693 2.471 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.670 -1.816 -0.102 1.00 0.00 C ATOM 866 CZ3 TRP A 58 1.585 -3.528 1.580 1.00 0.00 C ATOM 867 CH2 TRP A 58 1.945 -3.079 0.310 1.00 0.00 C ATOM 0 H TRP A 58 0.706 1.609 4.943 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.651 1.606 3.625 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.129 -0.538 4.781 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.406 -1.028 4.094 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.411 1.713 1.920 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.770 0.850 -0.213 1.00 0.00 H new ATOM 0 HE3 TRP A 58 0.657 -3.042 3.456 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 1.953 -1.474 -1.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 1.820 -4.541 1.873 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.455 -3.753 -0.362 1.00 0.00 H new ATOM 878 N ASN A 59 -2.081 0.224 6.598 1.00 0.00 N ATOM 879 CA ASN A 59 -3.110 -0.151 7.560 1.00 0.00 C ATOM 880 C ASN A 59 -3.898 1.035 8.041 1.00 0.00 C ATOM 881 O ASN A 59 -5.086 0.935 8.242 1.00 0.00 O ATOM 882 CB ASN A 59 -2.554 -0.978 8.721 1.00 0.00 C ATOM 883 CG ASN A 59 -2.123 -2.354 8.259 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.668 -2.885 7.287 1.00 0.00 O ATOM 885 ND2 ASN A 59 -1.160 -2.943 8.929 1.00 0.00 N ATOM 0 H ASN A 59 -1.127 0.012 6.891 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.806 -0.797 7.025 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.705 -0.459 9.166 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.312 -1.074 9.498 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.839 -3.870 8.651 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.733 -2.473 9.727 1.00 0.00 H new ATOM 892 N THR A 60 -3.234 2.161 8.100 1.00 0.00 N ATOM 893 CA THR A 60 -3.903 3.390 8.513 1.00 0.00 C ATOM 894 C THR A 60 -4.858 3.868 7.394 1.00 0.00 C ATOM 895 O THR A 60 -6.001 4.284 7.652 1.00 0.00 O ATOM 896 CB THR A 60 -2.863 4.479 8.844 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.963 3.958 9.841 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.527 5.737 9.384 1.00 0.00 C ATOM 0 H THR A 60 -2.245 2.263 7.873 1.00 0.00 H new ATOM 0 HA THR A 60 -4.488 3.194 9.411 1.00 0.00 H new ATOM 0 HB THR A 60 -2.330 4.744 7.931 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.136 3.657 9.410 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.765 6.484 9.607 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.216 6.133 8.638 1.00 0.00 H new ATOM 0 HG23 THR A 60 -4.076 5.496 10.294 1.00 0.00 H new ATOM 906 N LEU A 61 -4.402 3.703 6.163 1.00 0.00 N ATOM 907 CA LEU A 61 -5.107 4.116 4.976 1.00 0.00 C ATOM 908 C LEU A 61 -6.413 3.354 4.859 1.00 0.00 C ATOM 909 O LEU A 61 -7.480 3.953 4.935 1.00 0.00 O ATOM 910 CB LEU A 61 -4.171 3.900 3.745 1.00 0.00 C ATOM 911 CG LEU A 61 -4.565 4.450 2.349 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.380 4.327 1.413 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.730 3.699 1.740 1.00 0.00 C ATOM 0 H LEU A 61 -3.503 3.264 5.964 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.366 5.174 5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.202 4.330 3.998 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.024 2.825 3.637 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.863 5.490 2.483 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.651 4.712 0.430 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.542 4.901 1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.093 3.279 1.325 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.966 4.123 0.764 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.465 2.648 1.625 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.599 3.785 2.392 1.00 0.00 H new ATOM 925 N VAL A 62 -6.320 2.028 4.783 1.00 0.00 N ATOM 926 CA VAL A 62 -7.497 1.162 4.559 1.00 0.00 C ATOM 927 C VAL A 62 -8.504 1.334 5.684 1.00 0.00 C ATOM 928 O VAL A 62 -9.715 1.469 5.462 1.00 0.00 O ATOM 929 CB VAL A 62 -7.086 -0.351 4.394 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.262 -0.847 5.566 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.293 -1.235 4.210 1.00 0.00 C ATOM 0 H VAL A 62 -5.441 1.519 4.873 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.965 1.472 3.625 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.471 -0.406 3.496 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.001 -1.894 5.410 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.351 -0.254 5.647 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.841 -0.750 6.485 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.972 -2.271 4.099 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.944 -1.148 5.080 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.837 -0.927 3.317 1.00 0.00 H new ATOM 941 N ARG A 63 -7.951 1.399 6.857 1.00 0.00 N ATOM 942 CA ARG A 63 -8.683 1.570 8.108 1.00 0.00 C ATOM 943 C ARG A 63 -9.575 2.818 8.119 1.00 0.00 C ATOM 944 O ARG A 63 -10.672 2.811 8.699 1.00 0.00 O ATOM 945 CB ARG A 63 -7.679 1.685 9.206 1.00 0.00 C ATOM 946 CG ARG A 63 -8.223 1.945 10.553 1.00 0.00 C ATOM 947 CD ARG A 63 -7.097 2.212 11.495 1.00 0.00 C ATOM 948 NE ARG A 63 -7.614 2.605 12.802 1.00 0.00 N ATOM 949 CZ ARG A 63 -7.073 3.504 13.621 1.00 0.00 C ATOM 950 NH1 ARG A 63 -5.851 3.980 13.392 1.00 0.00 N ATOM 951 NH2 ARG A 63 -7.749 3.891 14.693 1.00 0.00 N ATOM 0 H ARG A 63 -6.942 1.334 6.991 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.342 0.711 8.235 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.100 0.762 9.241 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.985 2.487 8.955 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.900 2.799 10.526 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -8.804 1.088 10.895 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.477 1.321 11.594 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.459 3.001 11.096 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.470 2.148 13.117 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.321 3.656 12.583 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.445 4.669 14.025 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.672 3.501 14.882 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -7.346 4.579 15.329 1.00 0.00 H new ATOM 965 N ALA A 64 -9.106 3.872 7.517 1.00 0.00 N ATOM 966 CA ALA A 64 -9.833 5.120 7.518 1.00 0.00 C ATOM 967 C ALA A 64 -10.681 5.285 6.265 1.00 0.00 C ATOM 968 O ALA A 64 -11.837 5.701 6.344 1.00 0.00 O ATOM 969 CB ALA A 64 -8.850 6.277 7.638 1.00 0.00 C ATOM 0 H ALA A 64 -8.219 3.898 7.015 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.511 5.115 8.372 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.396 7.220 7.639 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.288 6.182 8.567 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.161 6.258 6.794 1.00 0.00 H new ATOM 975 N VAL A 65 -10.087 5.001 5.148 1.00 0.00 N ATOM 976 CA VAL A 65 -10.760 5.209 3.850 1.00 0.00 C ATOM 977 C VAL A 65 -12.094 4.463 3.706 1.00 0.00 C ATOM 978 O VAL A 65 -13.095 5.057 3.292 1.00 0.00 O ATOM 979 CB VAL A 65 -9.846 4.961 2.627 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.676 5.916 2.665 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.354 3.531 2.578 1.00 0.00 C ATOM 0 H VAL A 65 -9.141 4.625 5.081 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.000 6.272 3.857 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.432 5.137 1.725 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.034 5.739 1.802 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.043 6.942 2.640 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.106 5.757 3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.715 3.396 1.705 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.785 3.311 3.482 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.206 2.855 2.512 1.00 0.00 H new ATOM 991 N LEU A 66 -12.138 3.217 4.103 1.00 0.00 N ATOM 992 CA LEU A 66 -13.353 2.428 3.985 1.00 0.00 C ATOM 993 C LEU A 66 -13.787 1.971 5.351 1.00 0.00 C ATOM 994 O LEU A 66 -13.064 2.153 6.339 1.00 0.00 O ATOM 995 CB LEU A 66 -13.174 1.222 3.049 1.00 0.00 C ATOM 996 CG LEU A 66 -13.399 1.393 1.519 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.839 1.720 1.183 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.465 2.401 0.915 1.00 0.00 C ATOM 0 H LEU A 66 -11.348 2.719 4.513 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.123 3.061 3.544 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.159 0.849 3.189 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.851 0.440 3.392 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.170 0.426 1.072 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.945 1.830 0.104 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.486 0.915 1.531 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -15.124 2.651 1.672 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.661 2.484 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.620 3.370 1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.435 2.081 1.071 1.00 0.00 H new ATOM 1010 N SER A 67 -14.974 1.432 5.437 1.00 0.00 N ATOM 1011 CA SER A 67 -15.513 0.985 6.689 1.00 0.00 C ATOM 1012 C SER A 67 -16.257 -0.339 6.506 1.00 0.00 C ATOM 1013 O SER A 67 -17.214 -0.420 5.717 1.00 0.00 O ATOM 1014 CB SER A 67 -16.479 2.047 7.216 1.00 0.00 C ATOM 1015 OG SER A 67 -15.868 3.336 7.192 1.00 0.00 O ATOM 0 H SER A 67 -15.593 1.291 4.639 1.00 0.00 H new ATOM 0 HA SER A 67 -14.700 0.831 7.399 1.00 0.00 H new ATOM 0 HB2 SER A 67 -17.384 2.056 6.609 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.780 1.800 8.234 1.00 0.00 H new ATOM 0 HG SER A 67 -16.500 4.004 7.531 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.769 -1.380 7.148 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.470 -2.644 7.180 1.00 0.00 C ATOM 1023 C GLY A 68 -16.147 -3.539 6.011 1.00 0.00 C ATOM 1024 O GLY A 68 -15.715 -4.694 6.185 1.00 0.00 O ATOM 0 H GLY A 68 -14.885 -1.374 7.657 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.223 -3.164 8.105 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.543 -2.455 7.197 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.353 -3.019 4.823 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.130 -3.781 3.628 1.00 0.00 C ATOM 1030 C GLY A 69 -14.669 -3.984 3.348 1.00 0.00 C ATOM 1031 O GLY A 69 -14.258 -5.075 2.950 1.00 0.00 O ATOM 0 H GLY A 69 -16.677 -2.065 4.664 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.618 -4.751 3.722 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.593 -3.271 2.783 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.896 -2.948 3.592 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.457 -2.919 3.312 1.00 0.00 C ATOM 1037 C ASP A 70 -11.757 -4.172 3.760 1.00 0.00 C ATOM 1038 O ASP A 70 -11.165 -4.889 2.919 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.799 -1.687 3.953 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.942 -1.611 5.461 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.065 -1.391 5.941 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.947 -1.783 6.193 1.00 0.00 O ATOM 0 H ASP A 70 -14.246 -2.081 3.998 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.352 -2.857 2.229 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.739 -1.685 3.701 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.233 -0.789 3.514 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.905 -4.487 5.042 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.241 -5.601 5.646 1.00 0.00 C ATOM 1049 C HIS A 71 -11.555 -6.874 4.894 1.00 0.00 C ATOM 1050 O HIS A 71 -10.641 -7.561 4.440 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.621 -5.758 7.118 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.712 -6.696 7.870 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -11.061 -7.975 8.230 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.453 -6.518 8.330 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.068 -8.534 8.871 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.081 -7.674 8.947 1.00 0.00 N ATOM 0 H HIS A 71 -12.498 -3.962 5.684 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.170 -5.407 5.595 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.600 -4.780 7.598 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.646 -6.124 7.185 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.854 -5.625 8.227 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.062 -9.537 9.271 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -8.181 -7.843 9.395 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.841 -7.140 4.693 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.240 -8.363 4.056 1.00 0.00 C ATOM 1067 C LEU A 72 -12.615 -8.598 2.677 1.00 0.00 C ATOM 1068 O LEU A 72 -11.831 -9.534 2.539 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.764 -8.724 4.222 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.846 -7.632 3.983 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -16.109 -7.384 2.518 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -17.140 -7.985 4.690 1.00 0.00 C ATOM 0 H LEU A 72 -13.608 -6.525 4.963 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.768 -9.150 4.644 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.979 -9.549 3.543 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.901 -9.101 5.235 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.448 -6.709 4.404 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.872 -6.613 2.411 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.190 -7.054 2.034 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.455 -8.305 2.050 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.879 -7.205 4.507 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.514 -8.936 4.311 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.958 -8.068 5.762 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.814 -7.726 1.712 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.175 -8.001 0.420 1.00 0.00 C ATOM 1086 C LEU A 73 -10.778 -7.456 0.267 1.00 0.00 C ATOM 1087 O LEU A 73 -9.870 -8.240 0.055 1.00 0.00 O ATOM 1088 CB LEU A 73 -13.013 -7.725 -0.802 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.998 -8.836 -1.243 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.311 -10.190 -1.396 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -15.169 -8.938 -0.304 1.00 0.00 C ATOM 0 H LEU A 73 -13.371 -6.874 1.774 1.00 0.00 H new ATOM 0 HA LEU A 73 -12.079 -9.086 0.467 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.586 -6.816 -0.622 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.341 -7.518 -1.635 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.372 -8.547 -2.225 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.042 -10.936 -1.706 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.526 -10.117 -2.148 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.873 -10.486 -0.443 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.840 -9.727 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.812 -9.172 0.699 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.705 -7.989 -0.286 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.589 -6.124 0.374 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.271 -5.525 0.285 1.00 0.00 C ATOM 1105 C TRP A 74 -8.264 -6.263 1.181 1.00 0.00 C ATOM 1106 O TRP A 74 -7.153 -6.542 0.809 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.304 -4.065 0.756 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.954 -2.974 -0.105 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.838 -3.051 -1.167 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.640 -1.595 0.033 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.165 -1.750 -1.596 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.433 -0.854 -0.857 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.771 -0.942 0.863 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.378 0.540 -0.924 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.689 0.449 0.807 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.501 1.180 -0.078 1.00 0.00 C ATOM 0 H TRP A 74 -11.344 -5.454 0.522 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.969 -5.589 -0.760 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.808 -4.052 1.722 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.272 -3.762 0.931 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.218 -3.965 -1.599 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.832 -1.514 -2.331 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.155 -1.498 1.554 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.999 1.094 -1.612 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.995 0.970 1.450 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.436 2.258 -0.094 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.671 -6.549 2.345 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.774 -7.090 3.325 1.00 0.00 C ATOM 1129 C LYS A 75 -7.589 -8.585 3.362 1.00 0.00 C ATOM 1130 O LYS A 75 -6.455 -9.027 3.525 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.904 -6.427 4.660 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.775 -4.927 4.518 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.353 -4.494 4.162 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.491 -4.483 5.432 1.00 0.00 C ATOM 1135 NZ LYS A 75 -4.118 -3.989 5.239 1.00 0.00 N ATOM 0 H LYS A 75 -9.631 -6.423 2.667 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.796 -6.805 2.937 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.868 -6.675 5.104 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.136 -6.802 5.336 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.462 -4.578 3.747 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -8.074 -4.450 5.451 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.927 -5.176 3.426 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.365 -3.503 3.709 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.983 -3.865 6.183 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.445 -5.496 5.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.802 -3.496 6.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.484 -4.791 5.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.096 -3.330 4.434 1.00 0.00 H new ATOM 1149 N SER A 76 -8.644 -9.388 3.219 1.00 0.00 N ATOM 1150 CA SER A 76 -8.409 -10.838 3.209 1.00 0.00 C ATOM 1151 C SER A 76 -7.513 -11.182 2.020 1.00 0.00 C ATOM 1152 O SER A 76 -6.561 -11.968 2.133 1.00 0.00 O ATOM 1153 CB SER A 76 -9.713 -11.612 3.159 1.00 0.00 C ATOM 1154 OG SER A 76 -10.579 -11.183 4.204 1.00 0.00 O ATOM 0 H SER A 76 -9.613 -9.088 3.114 1.00 0.00 H new ATOM 0 HA SER A 76 -7.911 -11.128 4.134 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.196 -11.464 2.193 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.515 -12.679 3.256 1.00 0.00 H new ATOM 0 HG SER A 76 -11.265 -10.587 3.837 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.754 -10.477 0.940 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.999 -10.630 -0.269 1.00 0.00 C ATOM 1162 C GLU A 77 -5.624 -9.972 -0.134 1.00 0.00 C ATOM 1163 O GLU A 77 -4.711 -10.332 -0.860 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.760 -10.039 -1.434 1.00 0.00 C ATOM 1165 CG GLU A 77 -9.092 -10.702 -1.703 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.949 -12.069 -2.271 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -8.706 -12.173 -3.475 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -9.115 -13.047 -1.548 1.00 0.00 O ATOM 0 H GLU A 77 -8.490 -9.774 0.881 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.848 -11.694 -0.454 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.926 -8.978 -1.245 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.144 -10.110 -2.330 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.660 -10.757 -0.774 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.668 -10.085 -2.393 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.474 -8.993 0.778 1.00 0.00 N ATOM 1176 CA PHE A 78 -4.175 -8.366 1.034 1.00 0.00 C ATOM 1177 C PHE A 78 -3.200 -9.421 1.474 1.00 0.00 C ATOM 1178 O PHE A 78 -2.109 -9.563 0.911 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.339 -7.295 2.121 1.00 0.00 C ATOM 1180 CG PHE A 78 -3.073 -6.726 2.682 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -2.283 -5.877 1.935 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.689 -7.027 3.986 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -1.141 -5.337 2.471 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.540 -6.492 4.525 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.764 -5.645 3.771 1.00 0.00 C ATOM 0 H PHE A 78 -6.237 -8.624 1.345 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.797 -7.892 0.128 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.930 -6.477 1.710 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.915 -7.724 2.941 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.565 -5.636 0.921 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.300 -7.688 4.582 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.533 -4.669 1.879 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.250 -6.737 5.536 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.137 -5.220 4.189 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.640 -10.190 2.428 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.866 -11.254 2.986 1.00 0.00 C ATOM 1197 C PHE A 79 -2.607 -12.343 1.969 1.00 0.00 C ATOM 1198 O PHE A 79 -1.507 -12.877 1.889 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.569 -11.796 4.213 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.526 -10.828 5.359 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.362 -10.648 6.090 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.632 -10.080 5.686 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.311 -9.726 7.120 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.593 -9.162 6.713 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.433 -8.982 7.432 1.00 0.00 C ATOM 0 H PHE A 79 -4.565 -10.091 2.846 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.892 -10.865 3.281 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.607 -12.020 3.967 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.103 -12.734 4.513 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.486 -11.234 5.853 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.547 -10.214 5.128 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.397 -9.588 7.679 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.473 -8.584 6.954 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.400 -8.262 8.237 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.600 -12.636 1.171 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.480 -13.659 0.160 1.00 0.00 C ATOM 1217 C GLU A 80 -2.511 -13.281 -0.938 1.00 0.00 C ATOM 1218 O GLU A 80 -1.497 -13.938 -1.087 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.833 -14.026 -0.405 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.765 -14.605 0.640 1.00 0.00 C ATOM 1221 CD GLU A 80 -5.194 -15.832 1.291 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -5.265 -16.919 0.700 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.683 -15.746 2.424 1.00 0.00 O ATOM 0 H GLU A 80 -4.510 -12.177 1.201 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.065 -14.539 0.651 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.291 -13.140 -0.844 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.702 -14.749 -1.210 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.967 -13.852 1.402 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.720 -14.853 0.176 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.768 -12.168 -1.632 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.946 -11.770 -2.807 1.00 0.00 C ATOM 1232 C ASN A 81 -0.494 -11.584 -2.448 1.00 0.00 C ATOM 1233 O ASN A 81 0.406 -12.036 -3.169 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.445 -10.477 -3.499 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.745 -10.620 -4.244 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.772 -11.050 -5.389 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.816 -10.192 -3.648 1.00 0.00 N ATOM 0 H ASN A 81 -3.528 -11.524 -1.413 1.00 0.00 H new ATOM 0 HA ASN A 81 -2.053 -12.600 -3.505 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.559 -9.699 -2.744 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.679 -10.136 -4.196 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.712 -10.209 -4.135 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.761 -9.839 -2.693 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.257 -10.944 -1.325 1.00 0.00 N ATOM 1245 CA CYS A 82 1.084 -10.666 -0.897 1.00 0.00 C ATOM 1246 C CYS A 82 1.850 -11.943 -0.548 1.00 0.00 C ATOM 1247 O CYS A 82 2.913 -12.192 -1.103 1.00 0.00 O ATOM 1248 CB CYS A 82 1.077 -9.721 0.273 1.00 0.00 C ATOM 1249 SG CYS A 82 0.291 -8.125 -0.043 1.00 0.00 S ATOM 0 H CYS A 82 -0.983 -10.607 -0.693 1.00 0.00 H new ATOM 0 HA CYS A 82 1.601 -10.194 -1.732 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.566 -10.202 1.107 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.106 -9.547 0.587 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.969 -8.192 0.269 1.00 0.00 H new ATOM 1255 N ARG A 83 1.289 -12.782 0.326 1.00 0.00 N ATOM 1256 CA ARG A 83 1.981 -14.007 0.752 1.00 0.00 C ATOM 1257 C ARG A 83 2.124 -14.965 -0.405 1.00 0.00 C ATOM 1258 O ARG A 83 3.134 -15.616 -0.531 1.00 0.00 O ATOM 1259 CB ARG A 83 1.250 -14.692 1.916 1.00 0.00 C ATOM 1260 CG ARG A 83 1.172 -13.846 3.180 1.00 0.00 C ATOM 1261 CD ARG A 83 2.538 -13.588 3.773 1.00 0.00 C ATOM 1262 NE ARG A 83 2.483 -12.644 4.899 1.00 0.00 N ATOM 1263 CZ ARG A 83 2.300 -12.975 6.190 1.00 0.00 C ATOM 1264 NH1 ARG A 83 2.123 -14.248 6.550 1.00 0.00 N ATOM 1265 NH2 ARG A 83 2.286 -12.025 7.113 1.00 0.00 N ATOM 0 H ARG A 83 0.371 -12.642 0.749 1.00 0.00 H new ATOM 0 HA ARG A 83 2.973 -13.719 1.100 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.239 -14.946 1.598 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.756 -15.629 2.149 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.691 -12.895 2.951 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.546 -14.351 3.916 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.970 -14.530 4.111 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.199 -13.193 3.001 1.00 0.00 H new ATOM 0 HE ARG A 83 2.593 -11.653 4.683 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.125 -14.983 5.843 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.985 -14.486 7.532 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.413 -11.050 6.843 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.148 -12.269 8.094 1.00 0.00 H new ATOM 1279 N ASP A 84 1.114 -15.002 -1.260 1.00 0.00 N ATOM 1280 CA ASP A 84 1.085 -15.856 -2.468 1.00 0.00 C ATOM 1281 C ASP A 84 2.299 -15.589 -3.305 1.00 0.00 C ATOM 1282 O ASP A 84 3.037 -16.502 -3.700 1.00 0.00 O ATOM 1283 CB ASP A 84 -0.117 -15.490 -3.311 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.330 -16.407 -4.483 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.916 -17.509 -4.306 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.076 -16.039 -5.611 1.00 0.00 O ATOM 0 H ASP A 84 0.273 -14.437 -1.145 1.00 0.00 H new ATOM 0 HA ASP A 84 1.048 -16.899 -2.155 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.008 -15.503 -2.683 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.002 -14.470 -3.675 1.00 0.00 H new ATOM 1291 N THR A 85 2.504 -14.322 -3.528 1.00 0.00 N ATOM 1292 CA THR A 85 3.578 -13.813 -4.295 1.00 0.00 C ATOM 1293 C THR A 85 4.913 -14.048 -3.584 1.00 0.00 C ATOM 1294 O THR A 85 5.909 -14.370 -4.211 1.00 0.00 O ATOM 1295 CB THR A 85 3.322 -12.328 -4.516 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.099 -12.154 -5.285 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.488 -11.646 -5.189 1.00 0.00 C ATOM 0 H THR A 85 1.894 -13.593 -3.159 1.00 0.00 H new ATOM 0 HA THR A 85 3.639 -14.327 -5.254 1.00 0.00 H new ATOM 0 HB THR A 85 3.204 -11.854 -3.542 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.326 -12.201 -4.685 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.261 -10.589 -5.327 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.378 -11.748 -4.567 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.669 -12.108 -6.160 1.00 0.00 H new ATOM 1305 N ALA A 86 4.894 -13.964 -2.282 1.00 0.00 N ATOM 1306 CA ALA A 86 6.086 -14.203 -1.521 1.00 0.00 C ATOM 1307 C ALA A 86 6.511 -15.664 -1.653 1.00 0.00 C ATOM 1308 O ALA A 86 7.700 -15.957 -1.790 1.00 0.00 O ATOM 1309 CB ALA A 86 5.876 -13.828 -0.092 1.00 0.00 C ATOM 0 H ALA A 86 4.069 -13.733 -1.729 1.00 0.00 H new ATOM 0 HA ALA A 86 6.889 -13.580 -1.915 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.790 -14.016 0.471 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.620 -12.770 -0.027 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.064 -14.424 0.325 1.00 0.00 H new ATOM 1315 N LYS A 87 5.516 -16.568 -1.671 1.00 0.00 N ATOM 1316 CA LYS A 87 5.743 -18.011 -1.872 1.00 0.00 C ATOM 1317 C LYS A 87 6.393 -18.218 -3.232 1.00 0.00 C ATOM 1318 O LYS A 87 7.289 -19.048 -3.400 1.00 0.00 O ATOM 1319 CB LYS A 87 4.410 -18.784 -1.842 1.00 0.00 C ATOM 1320 CG LYS A 87 3.554 -18.553 -0.603 1.00 0.00 C ATOM 1321 CD LYS A 87 4.187 -19.078 0.674 1.00 0.00 C ATOM 1322 CE LYS A 87 4.265 -20.591 0.674 1.00 0.00 C ATOM 1323 NZ LYS A 87 2.936 -21.217 0.571 1.00 0.00 N ATOM 0 H LYS A 87 4.534 -16.320 -1.547 1.00 0.00 H new ATOM 0 HA LYS A 87 6.384 -18.381 -1.072 1.00 0.00 H new ATOM 0 HB2 LYS A 87 3.829 -18.509 -2.722 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.624 -19.850 -1.922 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.366 -17.485 -0.494 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.586 -19.034 -0.744 1.00 0.00 H new ATOM 0 HD2 LYS A 87 5.188 -18.661 0.783 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.607 -18.743 1.534 1.00 0.00 H new ATOM 0 HE2 LYS A 87 4.886 -20.921 -0.159 1.00 0.00 H new ATOM 0 HE3 LYS A 87 4.753 -20.928 1.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 2.995 -22.210 0.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 2.264 -20.708 1.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 2.609 -21.176 -0.415 1.00 0.00 H new ATOM 1337 N ARG A 88 5.947 -17.416 -4.203 1.00 0.00 N ATOM 1338 CA ARG A 88 6.489 -17.464 -5.548 1.00 0.00 C ATOM 1339 C ARG A 88 7.906 -16.934 -5.580 1.00 0.00 C ATOM 1340 O ARG A 88 8.761 -17.526 -6.202 1.00 0.00 O ATOM 1341 CB ARG A 88 5.590 -16.741 -6.571 1.00 0.00 C ATOM 1342 CG ARG A 88 4.523 -17.633 -7.209 1.00 0.00 C ATOM 1343 CD ARG A 88 3.587 -18.253 -6.191 1.00 0.00 C ATOM 1344 NE ARG A 88 2.694 -19.238 -6.801 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.610 -19.753 -6.220 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.252 -19.350 -4.999 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.880 -20.661 -6.861 1.00 0.00 N ATOM 0 H ARG A 88 5.208 -16.725 -4.073 1.00 0.00 H new ATOM 0 HA ARG A 88 6.514 -18.512 -5.846 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.099 -15.902 -6.077 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.218 -16.324 -7.359 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.941 -17.044 -7.919 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.011 -18.425 -7.776 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.171 -18.730 -5.404 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.995 -17.470 -5.718 1.00 0.00 H new ATOM 0 HE ARG A 88 2.918 -19.556 -7.744 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.808 -18.648 -4.510 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.423 -19.744 -4.555 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.149 -20.964 -7.797 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.051 -21.055 -6.417 1.00 0.00 H new ATOM 1361 N ASN A 89 8.162 -15.871 -4.842 1.00 0.00 N ATOM 1362 CA ASN A 89 9.502 -15.286 -4.761 1.00 0.00 C ATOM 1363 C ASN A 89 10.475 -16.248 -4.106 1.00 0.00 C ATOM 1364 O ASN A 89 11.660 -16.256 -4.426 1.00 0.00 O ATOM 1365 CB ASN A 89 9.496 -13.916 -4.015 1.00 0.00 C ATOM 1366 CG ASN A 89 8.949 -12.771 -4.857 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.113 -12.957 -5.727 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.442 -11.576 -4.613 1.00 0.00 N ATOM 0 H ASN A 89 7.459 -15.386 -4.283 1.00 0.00 H new ATOM 0 HA ASN A 89 9.834 -15.100 -5.783 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.899 -14.007 -3.108 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.513 -13.675 -3.705 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.127 -10.773 -5.158 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.140 -11.452 -3.879 1.00 0.00 H new ATOM 1375 N GLN A 90 9.984 -17.078 -3.196 1.00 0.00 N ATOM 1376 CA GLN A 90 10.858 -18.041 -2.536 1.00 0.00 C ATOM 1377 C GLN A 90 11.205 -19.186 -3.470 1.00 0.00 C ATOM 1378 O GLN A 90 12.365 -19.555 -3.592 1.00 0.00 O ATOM 1379 CB GLN A 90 10.256 -18.590 -1.236 1.00 0.00 C ATOM 1380 CG GLN A 90 9.778 -17.545 -0.228 1.00 0.00 C ATOM 1381 CD GLN A 90 10.750 -16.396 -0.044 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.658 -16.451 0.783 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.520 -15.328 -0.765 1.00 0.00 N ATOM 0 H GLN A 90 9.008 -17.106 -2.902 1.00 0.00 H new ATOM 0 HA GLN A 90 11.768 -17.502 -2.273 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.413 -19.232 -1.492 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.001 -19.220 -0.751 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.817 -17.149 -0.555 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.613 -18.029 0.735 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.756 -15.324 -1.441 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.105 -14.500 -0.651 1.00 0.00 H new ATOM 1392 N GLN A 91 10.211 -19.726 -4.167 1.00 0.00 N ATOM 1393 CA GLN A 91 10.454 -20.836 -5.103 1.00 0.00 C ATOM 1394 C GLN A 91 11.127 -20.350 -6.386 1.00 0.00 C ATOM 1395 O GLN A 91 11.599 -21.145 -7.195 1.00 0.00 O ATOM 1396 CB GLN A 91 9.163 -21.611 -5.398 1.00 0.00 C ATOM 1397 CG GLN A 91 8.056 -20.772 -5.991 1.00 0.00 C ATOM 1398 CD GLN A 91 6.730 -21.487 -5.993 1.00 0.00 C ATOM 1399 OE1 GLN A 91 6.377 -22.172 -6.948 1.00 0.00 O ATOM 1400 NE2 GLN A 91 5.994 -21.343 -4.921 1.00 0.00 N ATOM 0 H GLN A 91 9.239 -19.423 -4.109 1.00 0.00 H new ATOM 0 HA GLN A 91 11.144 -21.527 -4.620 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.392 -22.427 -6.084 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.805 -22.063 -4.473 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.964 -19.845 -5.426 1.00 0.00 H new ATOM 0 HG3 GLN A 91 8.319 -20.498 -7.013 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.325 -20.764 -4.149 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.089 -21.810 -4.857 1.00 0.00 H new ATOM 1409 N ALA A 92 11.139 -19.041 -6.575 1.00 0.00 N ATOM 1410 CA ALA A 92 11.860 -18.426 -7.674 1.00 0.00 C ATOM 1411 C ALA A 92 13.243 -17.998 -7.191 1.00 0.00 C ATOM 1412 O ALA A 92 14.039 -17.439 -7.956 1.00 0.00 O ATOM 1413 CB ALA A 92 11.086 -17.242 -8.237 1.00 0.00 C ATOM 0 H ALA A 92 10.651 -18.378 -5.973 1.00 0.00 H new ATOM 0 HA ALA A 92 11.973 -19.152 -8.479 1.00 0.00 H new ATOM 0 HB1 ALA A 92 11.647 -16.798 -9.059 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.116 -17.581 -8.601 1.00 0.00 H new ATOM 0 HB3 ALA A 92 10.940 -16.498 -7.454 1.00 0.00 H new ATOM 1419 N GLY A 93 13.488 -18.261 -5.899 1.00 0.00 N ATOM 1420 CA GLY A 93 14.752 -17.996 -5.229 1.00 0.00 C ATOM 1421 C GLY A 93 15.201 -16.565 -5.309 1.00 0.00 C ATOM 1422 O GLY A 93 16.340 -16.273 -5.685 1.00 0.00 O ATOM 0 H GLY A 93 12.789 -18.675 -5.282 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.661 -18.279 -4.180 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.522 -18.632 -5.665 1.00 0.00 H new ATOM 1426 N ASN A 94 14.311 -15.675 -4.971 1.00 0.00 N ATOM 1427 CA ASN A 94 14.604 -14.257 -4.949 1.00 0.00 C ATOM 1428 C ASN A 94 15.311 -13.915 -3.662 1.00 0.00 C ATOM 1429 O ASN A 94 15.330 -14.718 -2.723 1.00 0.00 O ATOM 1430 CB ASN A 94 13.308 -13.425 -5.036 1.00 0.00 C ATOM 1431 CG ASN A 94 12.611 -13.433 -6.399 1.00 0.00 C ATOM 1432 OD1 ASN A 94 11.872 -12.515 -6.726 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.853 -14.437 -7.197 1.00 0.00 N ATOM 0 H ASN A 94 13.355 -15.907 -4.701 1.00 0.00 H new ATOM 0 HA ASN A 94 15.234 -14.023 -5.807 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.608 -13.795 -4.287 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.541 -12.393 -4.772 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.421 -14.470 -8.121 1.00 0.00 H new ATOM 0 HD22 ASN A 94 13.474 -15.189 -6.897 1.00 0.00 H new ATOM 1440 N GLY A 95 15.849 -12.722 -3.599 1.00 0.00 N ATOM 1441 CA GLY A 95 16.506 -12.255 -2.398 1.00 0.00 C ATOM 1442 C GLY A 95 15.514 -11.654 -1.430 1.00 0.00 C ATOM 1443 O GLY A 95 15.884 -11.084 -0.399 1.00 0.00 O ATOM 0 H GLY A 95 15.846 -12.052 -4.368 1.00 0.00 H new ATOM 0 HA2 GLY A 95 17.028 -13.084 -1.920 1.00 0.00 H new ATOM 0 HA3 GLY A 95 17.260 -11.512 -2.658 1.00 0.00 H new ATOM 1447 N TRP A 96 14.256 -11.774 -1.774 1.00 0.00 N ATOM 1448 CA TRP A 96 13.187 -11.247 -0.986 1.00 0.00 C ATOM 1449 C TRP A 96 12.489 -12.331 -0.253 1.00 0.00 C ATOM 1450 O TRP A 96 12.615 -13.507 -0.591 1.00 0.00 O ATOM 1451 CB TRP A 96 12.210 -10.449 -1.832 1.00 0.00 C ATOM 1452 CG TRP A 96 12.865 -9.273 -2.427 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.360 -8.209 -1.753 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.126 -9.039 -3.807 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.909 -7.331 -2.620 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.783 -7.810 -3.890 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.873 -9.749 -4.980 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 14.192 -7.265 -5.092 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.280 -9.209 -6.177 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.936 -7.977 -6.224 1.00 0.00 C ATOM 0 H TRP A 96 13.949 -12.249 -2.623 1.00 0.00 H new ATOM 0 HA TRP A 96 13.622 -10.564 -0.256 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.805 -11.082 -2.621 1.00 0.00 H new ATOM 0 HB3 TRP A 96 11.369 -10.129 -1.217 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.322 -8.081 -0.681 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.349 -6.447 -2.364 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.368 -10.703 -4.949 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.696 -6.310 -5.132 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.090 -9.746 -7.095 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.247 -7.580 -7.179 1.00 0.00 H new ATOM 1471 N ASP A 97 11.696 -11.941 0.675 1.00 0.00 N ATOM 1472 CA ASP A 97 11.068 -12.864 1.584 1.00 0.00 C ATOM 1473 C ASP A 97 9.768 -12.289 2.026 1.00 0.00 C ATOM 1474 O ASP A 97 9.552 -11.101 1.868 1.00 0.00 O ATOM 1475 CB ASP A 97 11.973 -13.126 2.792 1.00 0.00 C ATOM 1476 CG ASP A 97 12.333 -11.867 3.547 1.00 0.00 C ATOM 1477 OD1 ASP A 97 11.593 -11.486 4.462 1.00 0.00 O ATOM 1478 OD2 ASP A 97 13.380 -11.259 3.244 1.00 0.00 O ATOM 0 H ASP A 97 11.453 -10.964 0.838 1.00 0.00 H new ATOM 0 HA ASP A 97 10.897 -13.815 1.080 1.00 0.00 H new ATOM 0 HB2 ASP A 97 11.473 -13.818 3.469 1.00 0.00 H new ATOM 0 HB3 ASP A 97 12.887 -13.614 2.454 1.00 0.00 H new ATOM 1483 N PHE A 98 8.911 -13.120 2.571 1.00 0.00 N ATOM 1484 CA PHE A 98 7.579 -12.715 2.974 1.00 0.00 C ATOM 1485 C PHE A 98 7.580 -11.842 4.244 1.00 0.00 C ATOM 1486 O PHE A 98 6.598 -11.199 4.557 1.00 0.00 O ATOM 1487 CB PHE A 98 6.640 -13.924 3.074 1.00 0.00 C ATOM 1488 CG PHE A 98 6.594 -14.606 4.381 1.00 0.00 C ATOM 1489 CD1 PHE A 98 7.605 -15.423 4.792 1.00 0.00 C ATOM 1490 CD2 PHE A 98 5.514 -14.417 5.190 1.00 0.00 C ATOM 1491 CE1 PHE A 98 7.535 -16.046 6.008 1.00 0.00 C ATOM 1492 CE2 PHE A 98 5.418 -15.025 6.400 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.433 -15.851 6.825 1.00 0.00 C ATOM 0 H PHE A 98 9.117 -14.103 2.750 1.00 0.00 H new ATOM 0 HA PHE A 98 7.184 -12.071 2.188 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.631 -13.596 2.823 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.936 -14.651 2.318 1.00 0.00 H new ATOM 0 HD1 PHE A 98 8.464 -15.579 4.156 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.716 -13.768 4.861 1.00 0.00 H new ATOM 0 HE1 PHE A 98 8.339 -16.690 6.331 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.552 -14.862 7.024 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.371 -16.342 7.785 1.00 0.00 H new ATOM 1503 N ASP A 99 8.657 -11.885 4.995 1.00 0.00 N ATOM 1504 CA ASP A 99 8.771 -11.070 6.208 1.00 0.00 C ATOM 1505 C ASP A 99 9.013 -9.654 5.842 1.00 0.00 C ATOM 1506 O ASP A 99 8.633 -8.763 6.589 1.00 0.00 O ATOM 1507 CB ASP A 99 9.899 -11.522 7.094 1.00 0.00 C ATOM 1508 CG ASP A 99 9.751 -12.932 7.590 1.00 0.00 C ATOM 1509 OD1 ASP A 99 9.000 -13.149 8.532 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.409 -13.839 7.062 1.00 0.00 O ATOM 0 H ASP A 99 9.469 -12.469 4.798 1.00 0.00 H new ATOM 0 HA ASP A 99 7.833 -11.181 6.753 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.837 -11.436 6.545 1.00 0.00 H new ATOM 0 HB3 ASP A 99 9.968 -10.851 7.950 1.00 0.00 H new ATOM 1515 N MET A 100 9.753 -9.451 4.770 1.00 0.00 N ATOM 1516 CA MET A 100 9.904 -8.126 4.170 1.00 0.00 C ATOM 1517 C MET A 100 8.700 -7.802 3.298 1.00 0.00 C ATOM 1518 O MET A 100 8.226 -6.668 3.257 1.00 0.00 O ATOM 1519 CB MET A 100 11.184 -8.015 3.316 1.00 0.00 C ATOM 1520 CG MET A 100 12.474 -7.966 4.107 1.00 0.00 C ATOM 1521 SD MET A 100 12.571 -6.503 5.153 1.00 0.00 S ATOM 1522 CE MET A 100 14.268 -6.616 5.724 1.00 0.00 C ATOM 0 H MET A 100 10.266 -10.189 4.288 1.00 0.00 H new ATOM 0 HA MET A 100 9.978 -7.414 4.992 1.00 0.00 H new ATOM 0 HB2 MET A 100 11.224 -8.865 2.635 1.00 0.00 H new ATOM 0 HB3 MET A 100 11.117 -7.117 2.701 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.554 -8.860 4.726 1.00 0.00 H new ATOM 0 HG3 MET A 100 13.321 -7.977 3.420 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.486 -5.778 6.386 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.408 -7.551 6.266 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.942 -6.588 4.868 1.00 0.00 H new ATOM 1532 N LEU A 101 8.206 -8.801 2.612 1.00 0.00 N ATOM 1533 CA LEU A 101 7.124 -8.611 1.691 1.00 0.00 C ATOM 1534 C LEU A 101 5.776 -8.806 2.377 1.00 0.00 C ATOM 1535 O LEU A 101 5.264 -9.921 2.451 1.00 0.00 O ATOM 1536 CB LEU A 101 7.312 -9.522 0.434 1.00 0.00 C ATOM 1537 CG LEU A 101 6.450 -9.253 -0.822 1.00 0.00 C ATOM 1538 CD1 LEU A 101 7.064 -9.954 -2.019 1.00 0.00 C ATOM 1539 CD2 LEU A 101 5.017 -9.741 -0.662 1.00 0.00 C ATOM 0 H LEU A 101 8.542 -9.762 2.678 1.00 0.00 H new ATOM 0 HA LEU A 101 7.135 -7.580 1.338 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.358 -9.459 0.135 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.131 -10.551 0.743 1.00 0.00 H new ATOM 0 HG LEU A 101 6.427 -8.173 -0.967 1.00 0.00 H new ATOM 0 HD11 LEU A 101 6.456 -9.764 -2.903 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.073 -9.576 -2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 101 7.105 -11.027 -1.831 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.456 -9.527 -1.572 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.017 -10.816 -0.479 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.550 -9.230 0.180 1.00 0.00 H new ATOM 1551 N THR A 102 5.283 -7.701 2.924 1.00 0.00 N ATOM 1552 CA THR A 102 3.939 -7.528 3.498 1.00 0.00 C ATOM 1553 C THR A 102 3.842 -7.728 5.015 1.00 0.00 C ATOM 1554 O THR A 102 4.563 -8.543 5.611 1.00 0.00 O ATOM 1555 CB THR A 102 2.804 -8.305 2.763 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.611 -7.504 2.773 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.463 -9.644 3.454 1.00 0.00 C ATOM 0 H THR A 102 5.838 -6.847 2.986 1.00 0.00 H new ATOM 0 HA THR A 102 3.765 -6.467 3.316 1.00 0.00 H new ATOM 0 HB THR A 102 3.157 -8.511 1.753 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.126 -7.628 1.930 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.667 -10.145 2.903 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.348 -10.280 3.472 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.133 -9.453 4.475 1.00 0.00 H new ATOM 1565 N GLY A 103 2.853 -7.028 5.600 1.00 0.00 N ATOM 1566 CA GLY A 103 2.604 -7.046 7.028 1.00 0.00 C ATOM 1567 C GLY A 103 3.855 -6.753 7.814 1.00 0.00 C ATOM 1568 O GLY A 103 4.320 -5.607 7.844 1.00 0.00 O ATOM 0 H GLY A 103 2.207 -6.434 5.080 1.00 0.00 H new ATOM 0 HA2 GLY A 103 1.839 -6.310 7.274 1.00 0.00 H new ATOM 0 HA3 GLY A 103 2.212 -8.021 7.317 1.00 0.00 H new ATOM 1572 N SER A 104 4.362 -7.800 8.436 1.00 0.00 N ATOM 1573 CA SER A 104 5.614 -7.891 9.153 1.00 0.00 C ATOM 1574 C SER A 104 5.711 -9.258 9.755 1.00 0.00 C ATOM 1575 O SER A 104 5.070 -9.543 10.768 1.00 0.00 O ATOM 1576 CB SER A 104 5.825 -6.858 10.276 1.00 0.00 C ATOM 1577 OG SER A 104 5.968 -5.534 9.786 1.00 0.00 O ATOM 0 H SER A 104 3.860 -8.688 8.452 1.00 0.00 H new ATOM 0 HA SER A 104 6.387 -7.682 8.414 1.00 0.00 H new ATOM 0 HB2 SER A 104 4.979 -6.897 10.963 1.00 0.00 H new ATOM 0 HB3 SER A 104 6.713 -7.127 10.848 1.00 0.00 H new ATOM 0 HG SER A 104 5.225 -5.327 9.181 1.00 0.00 H new ATOM 1583 N GLY A 105 6.408 -10.130 9.094 1.00 0.00 N ATOM 1584 CA GLY A 105 6.683 -11.395 9.698 1.00 0.00 C ATOM 1585 C GLY A 105 7.741 -11.180 10.730 1.00 0.00 C ATOM 1586 O GLY A 105 7.476 -11.157 11.925 1.00 0.00 O ATOM 0 H GLY A 105 6.789 -9.994 8.158 1.00 0.00 H new ATOM 0 HA2 GLY A 105 5.782 -11.807 10.153 1.00 0.00 H new ATOM 0 HA3 GLY A 105 7.018 -12.113 8.949 1.00 0.00 H new ATOM 1590 N ASN A 106 8.928 -10.996 10.254 1.00 0.00 N ATOM 1591 CA ASN A 106 10.061 -10.661 11.084 1.00 0.00 C ATOM 1592 C ASN A 106 10.503 -9.239 10.863 1.00 0.00 C ATOM 1593 O ASN A 106 11.005 -8.597 11.780 1.00 0.00 O ATOM 1594 CB ASN A 106 11.246 -11.602 10.833 1.00 0.00 C ATOM 1595 CG ASN A 106 11.053 -12.972 11.440 1.00 0.00 C ATOM 1596 OD1 ASN A 106 11.439 -13.216 12.582 1.00 0.00 O ATOM 1597 ND2 ASN A 106 10.458 -13.871 10.715 1.00 0.00 N ATOM 0 H ASN A 106 9.152 -11.073 9.262 1.00 0.00 H new ATOM 0 HA ASN A 106 9.733 -10.777 12.117 1.00 0.00 H new ATOM 0 HB2 ASN A 106 11.399 -11.705 9.759 1.00 0.00 H new ATOM 0 HB3 ASN A 106 12.151 -11.154 11.242 1.00 0.00 H new ATOM 0 HD21 ASN A 106 10.301 -14.806 11.090 1.00 0.00 H new ATOM 0 HD22 ASN A 106 10.148 -13.641 9.771 1.00 0.00 H new ATOM 1604 N TYR A 107 10.315 -8.715 9.657 1.00 0.00 N ATOM 1605 CA TYR A 107 10.843 -7.394 9.379 1.00 0.00 C ATOM 1606 C TYR A 107 9.793 -6.419 8.845 1.00 0.00 C ATOM 1607 O TYR A 107 9.015 -5.888 9.628 1.00 0.00 O ATOM 1608 CB TYR A 107 12.057 -7.449 8.442 1.00 0.00 C ATOM 1609 CG TYR A 107 13.136 -8.409 8.832 1.00 0.00 C ATOM 1610 CD1 TYR A 107 13.992 -8.147 9.886 1.00 0.00 C ATOM 1611 CD2 TYR A 107 13.293 -9.590 8.133 1.00 0.00 C ATOM 1612 CE1 TYR A 107 14.984 -9.039 10.228 1.00 0.00 C ATOM 1613 CE2 TYR A 107 14.271 -10.486 8.461 1.00 0.00 C ATOM 1614 CZ TYR A 107 15.119 -10.212 9.509 1.00 0.00 C ATOM 1615 OH TYR A 107 16.098 -11.115 9.848 1.00 0.00 O ATOM 0 H TYR A 107 9.821 -9.166 8.887 1.00 0.00 H new ATOM 0 HA TYR A 107 11.169 -7.005 10.344 1.00 0.00 H new ATOM 0 HB2 TYR A 107 11.709 -7.709 7.442 1.00 0.00 H new ATOM 0 HB3 TYR A 107 12.490 -6.451 8.380 1.00 0.00 H new ATOM 0 HD1 TYR A 107 13.881 -7.231 10.448 1.00 0.00 H new ATOM 0 HD2 TYR A 107 12.629 -9.810 7.310 1.00 0.00 H new ATOM 0 HE1 TYR A 107 15.650 -8.824 11.050 1.00 0.00 H new ATOM 0 HE2 TYR A 107 14.378 -11.403 7.901 1.00 0.00 H new ATOM 0 HH TYR A 107 16.056 -11.886 9.244 1.00 0.00 H new ATOM 1625 N SER A 108 9.751 -6.237 7.506 1.00 0.00 N ATOM 1626 CA SER A 108 8.913 -5.256 6.836 1.00 0.00 C ATOM 1627 C SER A 108 9.186 -3.845 7.358 1.00 0.00 C ATOM 1628 O SER A 108 10.199 -3.221 6.974 1.00 0.00 O ATOM 1629 CB SER A 108 7.421 -5.612 6.885 1.00 0.00 C ATOM 1630 OG SER A 108 7.101 -6.712 6.075 1.00 0.00 O ATOM 0 H SER A 108 10.317 -6.787 6.860 1.00 0.00 H new ATOM 0 HA SER A 108 9.188 -5.276 5.781 1.00 0.00 H new ATOM 0 HB2 SER A 108 7.137 -5.829 7.915 1.00 0.00 H new ATOM 0 HB3 SER A 108 6.835 -4.749 6.568 1.00 0.00 H new ATOM 0 HG SER A 108 7.528 -7.518 6.434 1.00 0.00 H new ATOM 1636 N SER A 109 8.391 -3.411 8.349 1.00 0.00 N ATOM 1637 CA SER A 109 8.440 -2.077 8.945 1.00 0.00 C ATOM 1638 C SER A 109 8.664 -0.937 7.898 1.00 0.00 C ATOM 1639 O SER A 109 8.310 -1.065 6.709 1.00 0.00 O ATOM 1640 CB SER A 109 9.531 -2.073 10.034 1.00 0.00 C ATOM 1641 OG SER A 109 10.823 -2.369 9.492 1.00 0.00 O ATOM 0 H SER A 109 7.674 -4.003 8.768 1.00 0.00 H new ATOM 0 HA SER A 109 7.467 -1.862 9.386 1.00 0.00 H new ATOM 0 HB2 SER A 109 9.555 -1.098 10.521 1.00 0.00 H new ATOM 0 HB3 SER A 109 9.282 -2.806 10.801 1.00 0.00 H new ATOM 0 HG SER A 109 11.490 -2.356 10.210 1.00 0.00 H new ATOM 1647 N THR A 110 9.225 0.166 8.359 1.00 0.00 N ATOM 1648 CA THR A 110 9.567 1.274 7.521 1.00 0.00 C ATOM 1649 C THR A 110 10.871 0.965 6.756 1.00 0.00 C ATOM 1650 O THR A 110 11.133 1.515 5.672 1.00 0.00 O ATOM 1651 CB THR A 110 9.756 2.524 8.409 1.00 0.00 C ATOM 1652 OG1 THR A 110 8.607 2.654 9.271 1.00 0.00 O ATOM 1653 CG2 THR A 110 9.889 3.793 7.570 1.00 0.00 C ATOM 0 H THR A 110 9.455 0.308 9.343 1.00 0.00 H new ATOM 0 HA THR A 110 8.773 1.455 6.796 1.00 0.00 H new ATOM 0 HB THR A 110 10.671 2.401 8.988 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.714 3.443 9.842 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.020 4.652 8.228 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.753 3.705 6.911 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.989 3.929 6.971 1.00 0.00 H new ATOM 1661 N ASP A 111 11.648 0.025 7.285 1.00 0.00 N ATOM 1662 CA ASP A 111 12.965 -0.293 6.724 1.00 0.00 C ATOM 1663 C ASP A 111 12.865 -0.940 5.350 1.00 0.00 C ATOM 1664 O ASP A 111 13.667 -0.659 4.467 1.00 0.00 O ATOM 1665 CB ASP A 111 13.776 -1.183 7.658 1.00 0.00 C ATOM 1666 CG ASP A 111 15.227 -1.283 7.220 1.00 0.00 C ATOM 1667 OD1 ASP A 111 15.999 -0.339 7.507 1.00 0.00 O ATOM 1668 OD2 ASP A 111 15.624 -2.297 6.598 1.00 0.00 O ATOM 0 H ASP A 111 11.393 -0.532 8.101 1.00 0.00 H new ATOM 0 HA ASP A 111 13.484 0.659 6.613 1.00 0.00 H new ATOM 0 HB2 ASP A 111 13.729 -0.785 8.672 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.335 -2.179 7.685 1.00 0.00 H new ATOM 1673 N ALA A 112 11.880 -1.787 5.143 1.00 0.00 N ATOM 1674 CA ALA A 112 11.720 -2.413 3.836 1.00 0.00 C ATOM 1675 C ALA A 112 11.208 -1.416 2.831 1.00 0.00 C ATOM 1676 O ALA A 112 11.387 -1.581 1.650 1.00 0.00 O ATOM 1677 CB ALA A 112 10.801 -3.619 3.894 1.00 0.00 C ATOM 0 H ALA A 112 11.188 -2.058 5.842 1.00 0.00 H new ATOM 0 HA ALA A 112 12.704 -2.762 3.522 1.00 0.00 H new ATOM 0 HB1 ALA A 112 10.710 -4.055 2.899 1.00 0.00 H new ATOM 0 HB2 ALA A 112 11.215 -4.360 4.578 1.00 0.00 H new ATOM 0 HB3 ALA A 112 9.817 -3.310 4.246 1.00 0.00 H new ATOM 1683 N GLN A 113 10.592 -0.372 3.314 1.00 0.00 N ATOM 1684 CA GLN A 113 10.048 0.616 2.441 1.00 0.00 C ATOM 1685 C GLN A 113 11.083 1.661 2.034 1.00 0.00 C ATOM 1686 O GLN A 113 11.101 2.096 0.892 1.00 0.00 O ATOM 1687 CB GLN A 113 8.772 1.239 3.029 1.00 0.00 C ATOM 1688 CG GLN A 113 8.155 2.356 2.185 1.00 0.00 C ATOM 1689 CD GLN A 113 8.569 3.764 2.601 1.00 0.00 C ATOM 1690 OE1 GLN A 113 7.900 4.412 3.404 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.685 4.223 2.119 1.00 0.00 N ATOM 0 H GLN A 113 10.457 -0.189 4.308 1.00 0.00 H new ATOM 0 HA GLN A 113 9.757 0.113 1.519 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.030 0.452 3.164 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.001 1.635 4.019 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.433 2.202 1.142 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.069 2.279 2.240 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.221 3.665 1.454 1.00 0.00 H new ATOM 0 HE22 GLN A 113 10.025 5.141 2.406 1.00 0.00 H new ATOM 1700 N MET A 114 11.905 2.136 2.969 1.00 0.00 N ATOM 1701 CA MET A 114 12.933 3.135 2.614 1.00 0.00 C ATOM 1702 C MET A 114 13.983 2.478 1.724 1.00 0.00 C ATOM 1703 O MET A 114 14.546 3.087 0.825 1.00 0.00 O ATOM 1704 CB MET A 114 13.577 3.746 3.874 1.00 0.00 C ATOM 1705 CG MET A 114 14.640 4.802 3.575 1.00 0.00 C ATOM 1706 SD MET A 114 15.409 5.471 5.061 1.00 0.00 S ATOM 1707 CE MET A 114 16.580 6.610 4.319 1.00 0.00 C ATOM 0 H MET A 114 11.889 1.861 3.951 1.00 0.00 H new ATOM 0 HA MET A 114 12.461 3.952 2.069 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.796 4.194 4.488 1.00 0.00 H new ATOM 0 HB3 MET A 114 14.028 2.948 4.464 1.00 0.00 H new ATOM 0 HG2 MET A 114 15.410 4.364 2.940 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.186 5.616 3.010 1.00 0.00 H new ATOM 0 HE1 MET A 114 17.145 7.114 5.104 1.00 0.00 H new ATOM 0 HE2 MET A 114 17.265 6.059 3.675 1.00 0.00 H new ATOM 0 HE3 MET A 114 16.042 7.350 3.727 1.00 0.00 H new ATOM 1717 N GLN A 115 14.179 1.214 1.966 1.00 0.00 N ATOM 1718 CA GLN A 115 15.058 0.374 1.194 1.00 0.00 C ATOM 1719 C GLN A 115 14.172 -0.513 0.327 1.00 0.00 C ATOM 1720 O GLN A 115 14.398 -1.710 0.198 1.00 0.00 O ATOM 1721 CB GLN A 115 15.995 -0.451 2.119 1.00 0.00 C ATOM 1722 CG GLN A 115 17.124 0.364 2.799 1.00 0.00 C ATOM 1723 CD GLN A 115 16.652 1.427 3.795 1.00 0.00 C ATOM 1724 OE1 GLN A 115 17.283 2.467 3.954 1.00 0.00 O ATOM 1725 NE2 GLN A 115 15.589 1.150 4.507 1.00 0.00 N ATOM 0 H GLN A 115 13.718 0.721 2.730 1.00 0.00 H new ATOM 0 HA GLN A 115 15.718 0.968 0.563 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.392 -0.925 2.894 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.447 -1.251 1.533 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.788 -0.328 3.318 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.715 0.852 2.024 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.085 0.277 4.352 1.00 0.00 H new ATOM 0 HE22 GLN A 115 15.265 1.807 5.217 1.00 0.00 H new ATOM 1734 N TYR A 116 13.162 0.156 -0.246 1.00 0.00 N ATOM 1735 CA TYR A 116 12.078 -0.370 -1.074 1.00 0.00 C ATOM 1736 C TYR A 116 12.449 -1.506 -1.981 1.00 0.00 C ATOM 1737 O TYR A 116 11.694 -2.446 -2.066 1.00 0.00 O ATOM 1738 CB TYR A 116 11.395 0.776 -1.869 1.00 0.00 C ATOM 1739 CG TYR A 116 12.330 1.657 -2.694 1.00 0.00 C ATOM 1740 CD1 TYR A 116 12.684 1.318 -3.996 1.00 0.00 C ATOM 1741 CD2 TYR A 116 12.844 2.835 -2.166 1.00 0.00 C ATOM 1742 CE1 TYR A 116 13.525 2.124 -4.741 1.00 0.00 C ATOM 1743 CE2 TYR A 116 13.682 3.644 -2.900 1.00 0.00 C ATOM 1744 CZ TYR A 116 14.022 3.287 -4.185 1.00 0.00 C ATOM 1745 OH TYR A 116 14.856 4.096 -4.918 1.00 0.00 O ATOM 0 H TYR A 116 13.079 1.166 -0.129 1.00 0.00 H new ATOM 0 HA TYR A 116 11.373 -0.807 -0.367 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.654 0.338 -2.538 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.855 1.410 -1.166 1.00 0.00 H new ATOM 0 HD1 TYR A 116 12.295 0.410 -4.432 1.00 0.00 H new ATOM 0 HD2 TYR A 116 12.581 3.122 -1.159 1.00 0.00 H new ATOM 0 HE1 TYR A 116 13.791 1.846 -5.750 1.00 0.00 H new ATOM 0 HE2 TYR A 116 14.071 4.555 -2.469 1.00 0.00 H new ATOM 0 HH TYR A 116 15.114 4.873 -4.380 1.00 0.00 H new ATOM 1755 N ASP A 117 13.602 -1.398 -2.646 1.00 0.00 N ATOM 1756 CA ASP A 117 14.117 -2.384 -3.586 1.00 0.00 C ATOM 1757 C ASP A 117 13.099 -2.629 -4.724 1.00 0.00 C ATOM 1758 O ASP A 117 12.073 -3.241 -4.505 1.00 0.00 O ATOM 1759 CB ASP A 117 14.460 -3.688 -2.853 1.00 0.00 C ATOM 1760 CG ASP A 117 15.422 -4.566 -3.596 1.00 0.00 C ATOM 1761 OD1 ASP A 117 15.569 -4.441 -4.825 1.00 0.00 O ATOM 1762 OD2 ASP A 117 16.069 -5.408 -2.951 1.00 0.00 O ATOM 0 H ASP A 117 14.220 -0.593 -2.538 1.00 0.00 H new ATOM 0 HA ASP A 117 15.033 -2.000 -4.036 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.883 -3.445 -1.878 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.540 -4.245 -2.672 1.00 0.00 H new ATOM 1767 N PRO A 118 13.388 -2.146 -5.956 1.00 0.00 N ATOM 1768 CA PRO A 118 12.475 -2.214 -7.137 1.00 0.00 C ATOM 1769 C PRO A 118 11.577 -3.487 -7.278 1.00 0.00 C ATOM 1770 O PRO A 118 10.439 -3.381 -7.716 1.00 0.00 O ATOM 1771 CB PRO A 118 13.434 -2.099 -8.311 1.00 0.00 C ATOM 1772 CG PRO A 118 14.524 -1.211 -7.810 1.00 0.00 C ATOM 1773 CD PRO A 118 14.650 -1.463 -6.318 1.00 0.00 C ATOM 0 HA PRO A 118 11.721 -1.431 -7.056 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.820 -3.075 -8.607 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.943 -1.672 -9.185 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.463 -1.428 -8.319 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.290 -0.165 -8.006 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.517 -2.083 -6.091 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.771 -0.531 -5.766 1.00 0.00 H new ATOM 1781 N GLY A 119 12.042 -4.640 -6.829 1.00 0.00 N ATOM 1782 CA GLY A 119 11.259 -5.870 -6.998 1.00 0.00 C ATOM 1783 C GLY A 119 10.412 -6.145 -5.767 1.00 0.00 C ATOM 1784 O GLY A 119 9.287 -6.651 -5.855 1.00 0.00 O ATOM 0 H GLY A 119 12.937 -4.759 -6.354 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.617 -5.780 -7.874 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.929 -6.711 -7.179 1.00 0.00 H new ATOM 1788 N LEU A 120 10.957 -5.764 -4.632 1.00 0.00 N ATOM 1789 CA LEU A 120 10.291 -5.891 -3.340 1.00 0.00 C ATOM 1790 C LEU A 120 9.081 -4.974 -3.353 1.00 0.00 C ATOM 1791 O LEU A 120 7.930 -5.420 -3.185 1.00 0.00 O ATOM 1792 CB LEU A 120 11.273 -5.446 -2.232 1.00 0.00 C ATOM 1793 CG LEU A 120 10.769 -5.360 -0.781 1.00 0.00 C ATOM 1794 CD1 LEU A 120 10.095 -6.653 -0.343 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.943 -5.051 0.143 1.00 0.00 C ATOM 0 H LEU A 120 11.888 -5.351 -4.573 1.00 0.00 H new ATOM 0 HA LEU A 120 9.981 -6.919 -3.154 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.119 -6.133 -2.247 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.656 -4.463 -2.506 1.00 0.00 H new ATOM 0 HG LEU A 120 10.027 -4.563 -0.725 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.752 -6.554 0.687 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.243 -6.857 -0.991 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.807 -7.476 -0.411 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.590 -4.989 1.172 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.688 -5.843 0.062 1.00 0.00 H new ATOM 0 HD23 LEU A 120 12.392 -4.100 -0.144 1.00 0.00 H new ATOM 1807 N PHE A 121 9.345 -3.697 -3.620 1.00 0.00 N ATOM 1808 CA PHE A 121 8.302 -2.695 -3.654 1.00 0.00 C ATOM 1809 C PHE A 121 7.277 -2.965 -4.777 1.00 0.00 C ATOM 1810 O PHE A 121 6.071 -2.808 -4.560 1.00 0.00 O ATOM 1811 CB PHE A 121 8.881 -1.286 -3.776 1.00 0.00 C ATOM 1812 CG PHE A 121 7.896 -0.208 -3.380 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.000 0.323 -4.292 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.857 0.251 -2.078 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.096 1.286 -3.910 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.951 1.214 -1.695 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.072 1.729 -2.611 1.00 0.00 C ATOM 0 H PHE A 121 10.280 -3.338 -3.816 1.00 0.00 H new ATOM 0 HA PHE A 121 7.773 -2.761 -2.703 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.769 -1.208 -3.149 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.202 -1.118 -4.804 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.011 -0.023 -5.315 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.547 -0.151 -1.351 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.405 1.694 -4.632 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.933 1.563 -0.673 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.360 2.484 -2.311 1.00 0.00 H new ATOM 1827 N ALA A 122 7.746 -3.395 -5.966 1.00 0.00 N ATOM 1828 CA ALA A 122 6.824 -3.673 -7.080 1.00 0.00 C ATOM 1829 C ALA A 122 5.777 -4.711 -6.698 1.00 0.00 C ATOM 1830 O ALA A 122 4.573 -4.507 -6.923 1.00 0.00 O ATOM 1831 CB ALA A 122 7.567 -4.136 -8.323 1.00 0.00 C ATOM 0 H ALA A 122 8.732 -3.553 -6.175 1.00 0.00 H new ATOM 0 HA ALA A 122 6.320 -2.733 -7.304 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.852 -4.331 -9.123 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.264 -3.360 -8.640 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.118 -5.049 -8.098 1.00 0.00 H new ATOM 1837 N GLN A 123 6.226 -5.802 -6.092 1.00 0.00 N ATOM 1838 CA GLN A 123 5.328 -6.879 -5.720 1.00 0.00 C ATOM 1839 C GLN A 123 4.346 -6.461 -4.646 1.00 0.00 C ATOM 1840 O GLN A 123 3.147 -6.736 -4.767 1.00 0.00 O ATOM 1841 CB GLN A 123 6.084 -8.137 -5.291 1.00 0.00 C ATOM 1842 CG GLN A 123 6.901 -8.805 -6.393 1.00 0.00 C ATOM 1843 CD GLN A 123 6.061 -9.208 -7.601 1.00 0.00 C ATOM 1844 OE1 GLN A 123 4.862 -9.490 -7.493 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.681 -9.255 -8.752 1.00 0.00 N ATOM 0 H GLN A 123 7.204 -5.961 -5.850 1.00 0.00 H new ATOM 0 HA GLN A 123 4.759 -7.119 -6.618 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.752 -7.879 -4.470 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.366 -8.860 -4.903 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.688 -8.124 -6.717 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.391 -9.690 -5.988 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.671 -9.016 -8.808 1.00 0.00 H new ATOM 0 HE22 GLN A 123 6.174 -9.530 -9.593 1.00 0.00 H new ATOM 1854 N ILE A 124 4.838 -5.780 -3.602 1.00 0.00 N ATOM 1855 CA ILE A 124 3.958 -5.366 -2.510 1.00 0.00 C ATOM 1856 C ILE A 124 2.890 -4.385 -2.993 1.00 0.00 C ATOM 1857 O ILE A 124 1.732 -4.494 -2.606 1.00 0.00 O ATOM 1858 CB ILE A 124 4.712 -4.806 -1.251 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.476 -3.517 -1.558 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.632 -5.856 -0.656 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.237 -2.944 -0.370 1.00 0.00 C ATOM 0 H ILE A 124 5.816 -5.511 -3.494 1.00 0.00 H new ATOM 0 HA ILE A 124 3.468 -6.281 -2.176 1.00 0.00 H new ATOM 0 HB ILE A 124 3.952 -4.556 -0.510 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.180 -3.709 -2.368 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.772 -2.768 -1.919 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.142 -5.442 0.214 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.046 -6.724 -0.354 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.370 -6.157 -1.400 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.751 -2.032 -0.673 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.538 -2.717 0.435 1.00 0.00 H new ATOM 0 HD13 ILE A 124 6.968 -3.673 -0.020 1.00 0.00 H new ATOM 1873 N GLN A 125 3.280 -3.472 -3.879 1.00 0.00 N ATOM 1874 CA GLN A 125 2.369 -2.484 -4.429 1.00 0.00 C ATOM 1875 C GLN A 125 1.249 -3.158 -5.225 1.00 0.00 C ATOM 1876 O GLN A 125 0.056 -2.861 -5.032 1.00 0.00 O ATOM 1877 CB GLN A 125 3.123 -1.514 -5.339 1.00 0.00 C ATOM 1878 CG GLN A 125 2.244 -0.418 -5.897 1.00 0.00 C ATOM 1879 CD GLN A 125 2.969 0.527 -6.828 1.00 0.00 C ATOM 1880 OE1 GLN A 125 4.173 0.746 -6.714 1.00 0.00 O ATOM 1881 NE2 GLN A 125 2.242 1.117 -7.725 1.00 0.00 N ATOM 0 H GLN A 125 4.234 -3.400 -4.232 1.00 0.00 H new ATOM 0 HA GLN A 125 1.930 -1.934 -3.597 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.943 -1.064 -4.780 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.567 -2.071 -6.164 1.00 0.00 H new ATOM 0 HG2 GLN A 125 1.409 -0.871 -6.431 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.822 0.153 -5.070 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.245 0.910 -7.790 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.667 1.788 -8.365 1.00 0.00 H new ATOM 1890 N ALA A 126 1.644 -4.081 -6.088 1.00 0.00 N ATOM 1891 CA ALA A 126 0.719 -4.780 -6.963 1.00 0.00 C ATOM 1892 C ALA A 126 -0.288 -5.581 -6.157 1.00 0.00 C ATOM 1893 O ALA A 126 -1.522 -5.408 -6.300 1.00 0.00 O ATOM 1894 CB ALA A 126 1.488 -5.701 -7.903 1.00 0.00 C ATOM 0 H ALA A 126 2.617 -4.366 -6.201 1.00 0.00 H new ATOM 0 HA ALA A 126 0.175 -4.040 -7.550 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.787 -6.222 -8.556 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.177 -5.111 -8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.050 -6.430 -7.319 1.00 0.00 H new ATOM 1900 N ALA A 127 0.238 -6.404 -5.268 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.567 -7.290 -4.459 1.00 0.00 C ATOM 1902 C ALA A 127 -1.534 -6.502 -3.574 1.00 0.00 C ATOM 1903 O ALA A 127 -2.701 -6.914 -3.363 1.00 0.00 O ATOM 1904 CB ALA A 127 0.341 -8.179 -3.624 1.00 0.00 C ATOM 0 H ALA A 127 1.240 -6.474 -5.089 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.170 -7.918 -5.115 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.266 -8.848 -3.013 1.00 0.00 H new ATOM 0 HB2 ALA A 127 0.979 -8.768 -4.283 1.00 0.00 H new ATOM 0 HB3 ALA A 127 0.961 -7.559 -2.977 1.00 0.00 H new ATOM 1910 N ALA A 128 -1.063 -5.359 -3.097 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.842 -4.508 -2.257 1.00 0.00 C ATOM 1912 C ALA A 128 -3.089 -4.027 -2.944 1.00 0.00 C ATOM 1913 O ALA A 128 -4.128 -4.387 -2.553 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.039 -3.320 -1.765 1.00 0.00 C ATOM 0 H ALA A 128 -0.125 -5.009 -3.291 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.135 -5.112 -1.398 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.666 -2.695 -1.129 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.180 -3.673 -1.194 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.693 -2.736 -2.618 1.00 0.00 H new ATOM 1920 N THR A 129 -2.961 -3.295 -4.011 1.00 0.00 N ATOM 1921 CA THR A 129 -4.166 -2.687 -4.627 1.00 0.00 C ATOM 1922 C THR A 129 -5.147 -3.756 -5.160 1.00 0.00 C ATOM 1923 O THR A 129 -6.401 -3.574 -5.127 1.00 0.00 O ATOM 1924 CB THR A 129 -3.819 -1.622 -5.721 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.016 -1.094 -6.319 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.900 -2.180 -6.806 1.00 0.00 C ATOM 0 H THR A 129 -2.079 -3.092 -4.481 1.00 0.00 H new ATOM 0 HA THR A 129 -4.675 -2.150 -3.826 1.00 0.00 H new ATOM 0 HB THR A 129 -3.284 -0.819 -5.215 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.173 -1.534 -7.180 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.690 -1.402 -7.540 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.966 -2.515 -6.355 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.388 -3.021 -7.298 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.590 -4.906 -5.503 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.355 -5.984 -6.089 1.00 0.00 C ATOM 1936 C LYS A 130 -6.232 -6.629 -5.042 1.00 0.00 C ATOM 1937 O LYS A 130 -7.229 -7.283 -5.334 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.435 -6.974 -6.782 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.397 -6.831 -8.309 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.854 -5.479 -8.758 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.869 -5.346 -10.274 1.00 0.00 C ATOM 1942 NZ LYS A 130 -3.239 -4.084 -10.736 1.00 0.00 N ATOM 0 H LYS A 130 -3.599 -5.114 -5.382 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.018 -5.585 -6.857 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.425 -6.850 -6.391 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -4.752 -7.986 -6.530 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.779 -7.624 -8.729 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.402 -6.965 -8.708 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -4.451 -4.681 -8.316 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -2.835 -5.355 -8.391 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.345 -6.194 -10.716 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.899 -5.387 -10.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -3.273 -4.039 -11.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -3.753 -3.273 -10.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -2.248 -4.055 -10.421 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.824 -6.457 -3.836 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.589 -6.738 -2.693 1.00 0.00 C ATOM 1958 C ALA A 131 -7.476 -5.546 -2.436 1.00 0.00 C ATOM 1959 O ALA A 131 -8.703 -5.652 -2.534 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.607 -6.919 -1.600 1.00 0.00 C ATOM 0 H ALA A 131 -4.895 -6.096 -3.617 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.220 -7.622 -2.789 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -6.133 -7.142 -0.672 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.938 -7.743 -1.845 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -5.027 -6.005 -1.477 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.842 -4.383 -2.275 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.463 -3.124 -1.865 1.00 0.00 C ATOM 1968 C TRP A 132 -8.382 -2.483 -2.925 1.00 0.00 C ATOM 1969 O TRP A 132 -8.522 -1.283 -2.989 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.451 -2.064 -1.409 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.619 -2.456 -0.259 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.191 -3.669 -0.022 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.115 -1.647 0.806 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.396 -3.716 1.001 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.325 -2.501 1.574 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.217 -0.301 1.190 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.639 -2.078 2.677 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.542 0.094 2.289 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.766 -0.791 3.008 1.00 0.00 C ATOM 0 H TRP A 132 -5.839 -4.290 -2.434 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.078 -3.433 -1.020 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.797 -1.823 -2.247 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.991 -1.152 -1.154 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.468 -4.531 -0.610 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.900 -4.547 1.322 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.817 0.396 0.624 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -3.023 -2.752 3.254 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.610 1.122 2.612 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.238 -0.427 3.877 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.945 -3.250 -3.764 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.015 -2.734 -4.639 1.00 0.00 C ATOM 1992 C ARG A 133 -11.401 -3.364 -4.435 1.00 0.00 C ATOM 1993 O ARG A 133 -12.442 -2.702 -4.514 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.575 -2.712 -6.121 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.705 -2.610 -7.183 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.392 -3.958 -7.441 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.794 -3.831 -7.894 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.295 -4.466 -8.975 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.491 -5.004 -9.868 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.593 -4.511 -9.166 1.00 0.00 N ATOM 0 H ARG A 133 -8.716 -4.235 -3.895 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.164 -1.703 -4.317 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.898 -1.870 -6.262 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.002 -3.618 -6.319 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.448 -1.885 -6.850 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.288 -2.233 -8.117 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.825 -4.508 -8.192 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.367 -4.550 -6.526 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.419 -3.228 -7.358 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.480 -4.943 -9.746 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -12.879 -5.482 -10.681 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.223 -4.066 -8.498 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -14.972 -4.991 -9.983 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.349 -4.569 -4.111 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.374 -5.563 -4.339 1.00 0.00 C ATOM 2016 C LYS A 134 -13.717 -5.518 -3.522 1.00 0.00 C ATOM 2017 O LYS A 134 -14.343 -6.557 -3.343 1.00 0.00 O ATOM 2018 CB LYS A 134 -11.624 -6.805 -4.097 1.00 0.00 C ATOM 2019 CG LYS A 134 -12.159 -8.082 -4.648 1.00 0.00 C ATOM 2020 CD LYS A 134 -11.191 -9.168 -4.304 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.779 -8.761 -4.698 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.885 -9.912 -4.954 1.00 0.00 N ATOM 0 H LYS A 134 -10.535 -4.958 -3.636 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.803 -5.412 -5.329 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -10.619 -6.668 -4.497 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -11.524 -6.926 -3.018 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -13.141 -8.298 -4.227 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.284 -8.009 -5.728 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -11.232 -9.376 -3.235 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.468 -10.088 -4.818 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.824 -8.140 -5.592 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.351 -8.148 -3.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.921 -9.680 -4.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.230 -10.742 -4.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.875 -10.124 -5.972 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.204 -4.386 -3.080 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.543 -4.425 -2.424 1.00 0.00 C ATOM 2038 C LEU A 135 -16.599 -4.250 -3.528 1.00 0.00 C ATOM 2039 O LEU A 135 -16.210 -3.935 -4.660 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.757 -3.340 -1.317 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.778 -3.233 -0.141 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.889 -4.447 0.012 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -13.995 -1.953 -0.219 1.00 0.00 C ATOM 0 H LEU A 135 -13.754 -3.473 -3.141 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.628 -5.381 -1.907 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.772 -2.370 -1.814 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.750 -3.498 -0.897 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.376 -3.207 0.770 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.222 -4.305 0.862 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -14.505 -5.331 0.178 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.298 -4.582 -0.894 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -13.306 -1.896 0.624 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.431 -1.928 -1.151 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -14.679 -1.105 -0.186 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.926 -4.486 -3.257 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.984 -4.298 -4.268 1.00 0.00 C ATOM 2057 C PRO A 136 -19.074 -2.854 -4.826 1.00 0.00 C ATOM 2058 O PRO A 136 -18.262 -2.494 -5.633 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.274 -4.745 -3.556 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.793 -5.631 -2.460 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.497 -5.023 -2.001 1.00 0.00 C ATOM 0 HA PRO A 136 -18.780 -4.883 -5.165 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.830 -3.893 -3.165 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -20.941 -5.276 -4.235 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.516 -5.678 -1.646 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.646 -6.651 -2.814 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.657 -4.239 -1.261 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.842 -5.764 -1.543 1.00 0.00 H new ATOM 2069 N VAL A 137 -20.042 -2.038 -4.374 1.00 0.00 N ATOM 2070 CA VAL A 137 -20.214 -0.627 -4.818 1.00 0.00 C ATOM 2071 C VAL A 137 -21.010 0.048 -3.731 1.00 0.00 C ATOM 2072 O VAL A 137 -21.757 -0.642 -3.022 1.00 0.00 O ATOM 2073 CB VAL A 137 -21.007 -0.463 -6.205 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -21.215 1.004 -6.587 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -20.309 -1.150 -7.347 1.00 0.00 C ATOM 0 H VAL A 137 -20.735 -2.332 -3.686 1.00 0.00 H new ATOM 0 HA VAL A 137 -19.228 -0.195 -4.988 1.00 0.00 H new ATOM 0 HB VAL A 137 -21.975 -0.934 -6.034 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -21.756 1.061 -7.532 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -21.791 1.504 -5.809 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -20.247 1.493 -6.693 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -20.884 -1.010 -8.262 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -19.314 -0.723 -7.475 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -20.222 -2.215 -7.132 1.00 0.00 H new ATOM 2085 N LYS A 138 -20.870 1.352 -3.553 1.00 0.00 N ATOM 2086 CA LYS A 138 -21.666 2.020 -2.562 1.00 0.00 C ATOM 2087 C LYS A 138 -23.024 2.381 -3.170 1.00 0.00 C ATOM 2088 O LYS A 138 -24.041 1.779 -2.841 1.00 0.00 O ATOM 2089 CB LYS A 138 -20.976 3.275 -2.008 1.00 0.00 C ATOM 2090 CG LYS A 138 -21.738 3.935 -0.856 1.00 0.00 C ATOM 2091 CD LYS A 138 -21.726 3.079 0.418 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.351 3.053 1.073 1.00 0.00 C ATOM 2093 NZ LYS A 138 -19.943 4.393 1.558 1.00 0.00 N ATOM 0 H LYS A 138 -20.226 1.949 -4.073 1.00 0.00 H new ATOM 0 HA LYS A 138 -21.801 1.340 -1.721 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -19.976 3.009 -1.666 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -20.855 3.999 -2.814 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -21.296 4.908 -0.641 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -22.769 4.114 -1.161 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -22.457 3.470 1.125 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -22.031 2.061 0.174 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.360 2.352 1.908 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -19.615 2.687 0.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.002 4.332 1.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -19.909 5.056 0.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -20.631 4.732 2.260 1.00 0.00 H new ATOM 2107 N GLY A 139 -23.015 3.313 -4.085 1.00 0.00 N ATOM 2108 CA GLY A 139 -24.236 3.741 -4.710 1.00 0.00 C ATOM 2109 C GLY A 139 -23.964 4.596 -5.908 1.00 0.00 C ATOM 2110 O GLY A 139 -24.180 5.813 -5.878 1.00 0.00 O ATOM 0 H GLY A 139 -22.175 3.790 -4.414 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -24.819 2.870 -5.008 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -24.838 4.298 -3.992 1.00 0.00 H new ATOM 2114 N ASP A 140 -23.449 3.984 -6.940 1.00 0.00 N ATOM 2115 CA ASP A 140 -23.138 4.683 -8.167 1.00 0.00 C ATOM 2116 C ASP A 140 -24.050 4.197 -9.248 1.00 0.00 C ATOM 2117 O ASP A 140 -23.938 3.009 -9.631 1.00 0.00 O ATOM 2118 CB ASP A 140 -21.683 4.474 -8.576 1.00 0.00 C ATOM 2119 CG ASP A 140 -21.334 5.202 -9.859 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -21.015 6.405 -9.808 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -21.338 4.577 -10.942 1.00 0.00 O ATOM 2122 OXT ASP A 140 -24.917 4.966 -9.704 1.00 0.00 O ATOM 0 H ASP A 140 -23.232 2.988 -6.958 1.00 0.00 H new ATOM 0 HA ASP A 140 -23.283 5.751 -8.006 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -21.030 4.821 -7.775 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -21.493 3.408 -8.703 1.00 0.00 H new TER 2127 ASP A 140