USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=30 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 114 MET CE :methyl 161:sc= -0.0677 (180deg=-0.474) USER MOD Set 1.2: A 115 GLN : amide:sc= 0.619 K(o=0.55,f=-0.3) USER MOD Set 2.1: A 89 ASN : amide:sc= -3.26! C(o=-3.2!,f=-7.7!) USER MOD Set 2.2: A 94 ASN : amide:sc= 0.0326 K(o=-3.2,f=-3.9) USER MOD Set 3.1: A 90 GLN : amide:sc= 0.992 K(o=0.99,f=-0.13) USER MOD Set 3.2: A 107 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 85 THR OG1 : rot 140:sc= 0.564 USER MOD Set 4.2: A 123 GLN : amide:sc= -0.669 K(o=-0.11,f=1.7) USER MOD Set 5.1: A 82 CYS SG : rot -91:sc= 0.746 USER MOD Set 5.2: A 102 THR OG1 : rot 178:sc= 1.2 USER MOD Set 6.1: A 59 ASN : amide:sc= 0.787 K(o=2.5,f=-8.8!) USER MOD Set 6.2: A 75 LYS NZ :NH3+ 162:sc= 1.67 (180deg=0.339) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 11 GLN : amide:sc= -6.1! C(o=-6.1!,f=-8.6!) USER MOD Single : A 15 HIS : no HD1:sc= -0.63 K(o=-0.63,f=0) USER MOD Single : A 16 HIS : no HD1:sc= -0.584 K(o=-0.58,f=-0.054) USER MOD Single : A 17 ASN : amide:sc= -1.51 K(o=-1.5,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 83:sc= 1.23 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -76:sc= 1.33 USER MOD Single : A 40 TYR OH : rot -109:sc= 1.21 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 103:sc= 1.22 USER MOD Single : A 51 ASN : amide:sc= -0.963 K(o=-0.96,f=-1.8!) USER MOD Single : A 54 THR OG1 : rot 23:sc= 1.28 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 157:sc= 1.26 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HE2:sc= 0.47 K(o=0.47,f=-5.4!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc=-0.00546 K(o=-0.0055,f=-0.76) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.229 X(o=-0.23,f=-0.0028) USER MOD Single : A 100 MET CE :methyl -170:sc=-0.00261 (180deg=-0.161) USER MOD Single : A 104 SER OG : rot -32:sc= 0.881 USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot -75:sc= -0.283 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -0.364 K(o=-0.36,f=-2.7!) USER MOD Single : A 116 TYR OH : rot 38:sc= 0.122 USER MOD Single : A 125 GLN : amide:sc= -1.75! X(o=-1.7!,f=-1.5) USER MOD Single : A 129 THR OG1 : rot 140:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -112:sc= 0.689 (180deg=-0.322) USER MOD Single : A 138 LYS NZ :NH3+ -156:sc= 0.162 (180deg=0.0478) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.308 9.235 2.314 1.00 0.00 N ATOM 2 CA PRO A 1 4.082 8.811 1.175 1.00 0.00 C ATOM 3 C PRO A 1 5.556 8.967 1.450 1.00 0.00 C ATOM 4 O PRO A 1 5.946 9.618 2.414 1.00 0.00 O ATOM 5 CB PRO A 1 3.674 9.652 -0.025 1.00 0.00 C ATOM 6 CG PRO A 1 2.641 10.578 0.530 1.00 0.00 C ATOM 7 CD PRO A 1 2.139 9.931 1.800 1.00 0.00 C ATOM 0 H2 PRO A 1 3.858 9.849 2.915 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.030 8.433 2.880 1.00 0.00 H new ATOM 0 HA PRO A 1 3.891 7.757 0.971 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.522 10.198 -0.438 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.270 9.035 -0.828 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.067 11.560 0.735 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.828 10.726 -0.180 1.00 0.00 H new ATOM 0 HD2 PRO A 1 1.770 10.672 2.509 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.317 9.243 1.602 1.00 0.00 H new ATOM 17 N VAL A 2 6.336 8.353 0.620 1.00 0.00 N ATOM 18 CA VAL A 2 7.771 8.383 0.667 1.00 0.00 C ATOM 19 C VAL A 2 8.296 9.225 -0.484 1.00 0.00 C ATOM 20 O VAL A 2 7.693 9.261 -1.548 1.00 0.00 O ATOM 21 CB VAL A 2 8.346 6.932 0.599 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.853 6.920 0.425 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.985 6.183 1.862 1.00 0.00 C ATOM 0 H VAL A 2 5.976 7.788 -0.149 1.00 0.00 H new ATOM 0 HA VAL A 2 8.093 8.829 1.608 1.00 0.00 H new ATOM 0 HB VAL A 2 7.905 6.447 -0.272 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.206 5.890 0.383 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.116 7.432 -0.501 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.321 7.430 1.267 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.387 5.171 1.812 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.407 6.699 2.724 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.900 6.138 1.961 1.00 0.00 H new ATOM 33 N THR A 3 9.357 9.946 -0.249 1.00 0.00 N ATOM 34 CA THR A 3 9.991 10.705 -1.270 1.00 0.00 C ATOM 35 C THR A 3 11.446 10.253 -1.343 1.00 0.00 C ATOM 36 O THR A 3 11.974 9.626 -0.398 1.00 0.00 O ATOM 37 CB THR A 3 9.886 12.257 -1.029 1.00 0.00 C ATOM 38 OG1 THR A 3 10.295 12.980 -2.205 1.00 0.00 O ATOM 39 CG2 THR A 3 10.743 12.711 0.139 1.00 0.00 C ATOM 0 H THR A 3 9.803 10.018 0.666 1.00 0.00 H new ATOM 0 HA THR A 3 9.483 10.526 -2.218 1.00 0.00 H new ATOM 0 HB THR A 3 8.841 12.468 -0.800 1.00 0.00 H new ATOM 0 HG1 THR A 3 10.222 13.943 -2.039 1.00 0.00 H new ATOM 0 HG21 THR A 3 10.640 13.788 0.269 1.00 0.00 H new ATOM 0 HG22 THR A 3 10.419 12.203 1.047 1.00 0.00 H new ATOM 0 HG23 THR A 3 11.787 12.468 -0.059 1.00 0.00 H new ATOM 47 N GLU A 4 12.070 10.553 -2.413 1.00 0.00 N ATOM 48 CA GLU A 4 13.409 10.156 -2.670 1.00 0.00 C ATOM 49 C GLU A 4 14.189 11.376 -3.073 1.00 0.00 C ATOM 50 O GLU A 4 13.721 12.200 -3.869 1.00 0.00 O ATOM 51 CB GLU A 4 13.382 8.995 -3.674 1.00 0.00 C ATOM 52 CG GLU A 4 14.452 8.949 -4.764 1.00 0.00 C ATOM 53 CD GLU A 4 15.865 8.868 -4.245 1.00 0.00 C ATOM 54 OE1 GLU A 4 16.195 7.889 -3.564 1.00 0.00 O ATOM 55 OE2 GLU A 4 16.655 9.781 -4.542 1.00 0.00 O ATOM 0 H GLU A 4 11.654 11.101 -3.166 1.00 0.00 H new ATOM 0 HA GLU A 4 13.929 9.761 -1.797 1.00 0.00 H new ATOM 0 HB2 GLU A 4 13.445 8.066 -3.108 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.409 9.004 -4.165 1.00 0.00 H new ATOM 0 HG2 GLU A 4 14.263 8.088 -5.405 1.00 0.00 H new ATOM 0 HG3 GLU A 4 14.357 9.838 -5.387 1.00 0.00 H new ATOM 62 N THR A 5 15.325 11.512 -2.471 1.00 0.00 N ATOM 63 CA THR A 5 16.081 12.701 -2.537 1.00 0.00 C ATOM 64 C THR A 5 17.568 12.388 -2.770 1.00 0.00 C ATOM 65 O THR A 5 18.177 11.661 -2.016 1.00 0.00 O ATOM 66 CB THR A 5 15.828 13.465 -1.192 1.00 0.00 C ATOM 67 OG1 THR A 5 16.544 14.697 -1.117 1.00 0.00 O ATOM 68 CG2 THR A 5 16.125 12.593 0.035 1.00 0.00 C ATOM 0 H THR A 5 15.756 10.778 -1.909 1.00 0.00 H new ATOM 0 HA THR A 5 15.780 13.325 -3.378 1.00 0.00 H new ATOM 0 HB THR A 5 14.765 13.704 -1.185 1.00 0.00 H new ATOM 0 HG1 THR A 5 16.352 15.135 -0.262 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.935 13.166 0.943 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.482 11.713 0.020 1.00 0.00 H new ATOM 0 HG23 THR A 5 17.169 12.280 0.015 1.00 0.00 H new ATOM 76 N VAL A 6 18.119 12.904 -3.841 1.00 0.00 N ATOM 77 CA VAL A 6 19.525 12.711 -4.141 1.00 0.00 C ATOM 78 C VAL A 6 20.321 13.949 -3.812 1.00 0.00 C ATOM 79 O VAL A 6 19.784 15.066 -3.779 1.00 0.00 O ATOM 80 CB VAL A 6 19.787 12.364 -5.632 1.00 0.00 C ATOM 81 CG1 VAL A 6 19.314 10.967 -5.951 1.00 0.00 C ATOM 82 CG2 VAL A 6 19.110 13.367 -6.553 1.00 0.00 C ATOM 0 H VAL A 6 17.615 13.466 -4.527 1.00 0.00 H new ATOM 0 HA VAL A 6 19.839 11.869 -3.524 1.00 0.00 H new ATOM 0 HB VAL A 6 20.863 12.414 -5.798 1.00 0.00 H new ATOM 0 HG11 VAL A 6 19.509 10.748 -7.001 1.00 0.00 H new ATOM 0 HG12 VAL A 6 19.847 10.251 -5.326 1.00 0.00 H new ATOM 0 HG13 VAL A 6 18.244 10.892 -5.757 1.00 0.00 H new ATOM 0 HG21 VAL A 6 19.310 13.100 -7.591 1.00 0.00 H new ATOM 0 HG22 VAL A 6 18.035 13.355 -6.376 1.00 0.00 H new ATOM 0 HG23 VAL A 6 19.500 14.365 -6.353 1.00 0.00 H new ATOM 92 N ASP A 7 21.571 13.746 -3.542 1.00 0.00 N ATOM 93 CA ASP A 7 22.512 14.829 -3.383 1.00 0.00 C ATOM 94 C ASP A 7 23.426 14.800 -4.552 1.00 0.00 C ATOM 95 O ASP A 7 23.504 13.773 -5.253 1.00 0.00 O ATOM 96 CB ASP A 7 23.350 14.689 -2.112 1.00 0.00 C ATOM 97 CG ASP A 7 22.746 15.319 -0.910 1.00 0.00 C ATOM 98 OD1 ASP A 7 21.971 14.661 -0.207 1.00 0.00 O ATOM 99 OD2 ASP A 7 23.095 16.470 -0.614 1.00 0.00 O ATOM 0 H ASP A 7 21.979 12.819 -3.423 1.00 0.00 H new ATOM 0 HA ASP A 7 21.956 15.764 -3.311 1.00 0.00 H new ATOM 0 HB2 ASP A 7 23.510 13.630 -1.911 1.00 0.00 H new ATOM 0 HB3 ASP A 7 24.330 15.132 -2.286 1.00 0.00 H new ATOM 104 N GLY A 8 24.198 15.843 -4.709 1.00 0.00 N ATOM 105 CA GLY A 8 25.115 15.950 -5.824 1.00 0.00 C ATOM 106 C GLY A 8 26.338 15.054 -5.673 1.00 0.00 C ATOM 107 O GLY A 8 27.315 15.214 -6.373 1.00 0.00 O ATOM 0 H GLY A 8 24.213 16.641 -4.074 1.00 0.00 H new ATOM 0 HA2 GLY A 8 24.592 15.690 -6.744 1.00 0.00 H new ATOM 0 HA3 GLY A 8 25.440 16.986 -5.923 1.00 0.00 H new ATOM 111 N GLN A 9 26.269 14.096 -4.758 1.00 0.00 N ATOM 112 CA GLN A 9 27.376 13.200 -4.525 1.00 0.00 C ATOM 113 C GLN A 9 27.087 11.870 -5.200 1.00 0.00 C ATOM 114 O GLN A 9 27.929 10.998 -5.240 1.00 0.00 O ATOM 115 CB GLN A 9 27.609 12.993 -3.025 1.00 0.00 C ATOM 116 CG GLN A 9 27.386 14.248 -2.167 1.00 0.00 C ATOM 117 CD GLN A 9 28.254 15.395 -2.564 1.00 0.00 C ATOM 118 OE1 GLN A 9 29.381 15.208 -3.013 1.00 0.00 O ATOM 119 NE2 GLN A 9 27.727 16.581 -2.467 1.00 0.00 N ATOM 0 H GLN A 9 25.454 13.926 -4.169 1.00 0.00 H new ATOM 0 HA GLN A 9 28.281 13.638 -4.945 1.00 0.00 H new ATOM 0 HB2 GLN A 9 26.944 12.204 -2.672 1.00 0.00 H new ATOM 0 HB3 GLN A 9 28.630 12.641 -2.874 1.00 0.00 H new ATOM 0 HG2 GLN A 9 26.341 14.549 -2.241 1.00 0.00 H new ATOM 0 HG3 GLN A 9 27.574 14.003 -1.122 1.00 0.00 H new ATOM 0 HE21 GLN A 9 26.787 16.692 -2.088 1.00 0.00 H new ATOM 0 HE22 GLN A 9 28.254 17.400 -2.770 1.00 0.00 H new ATOM 128 N GLY A 10 25.871 11.726 -5.692 1.00 0.00 N ATOM 129 CA GLY A 10 25.509 10.534 -6.417 1.00 0.00 C ATOM 130 C GLY A 10 24.617 9.597 -5.621 1.00 0.00 C ATOM 131 O GLY A 10 23.910 8.761 -6.197 1.00 0.00 O ATOM 0 H GLY A 10 25.126 12.417 -5.601 1.00 0.00 H new ATOM 0 HA2 GLY A 10 24.998 10.817 -7.337 1.00 0.00 H new ATOM 0 HA3 GLY A 10 26.416 10.003 -6.707 1.00 0.00 H new ATOM 135 N GLN A 11 24.632 9.725 -4.300 1.00 0.00 N ATOM 136 CA GLN A 11 23.851 8.815 -3.463 1.00 0.00 C ATOM 137 C GLN A 11 22.414 9.317 -3.294 1.00 0.00 C ATOM 138 O GLN A 11 22.155 10.551 -3.298 1.00 0.00 O ATOM 139 CB GLN A 11 24.506 8.536 -2.077 1.00 0.00 C ATOM 140 CG GLN A 11 24.414 9.653 -1.038 1.00 0.00 C ATOM 141 CD GLN A 11 25.126 10.892 -1.410 1.00 0.00 C ATOM 142 OE1 GLN A 11 26.289 11.071 -1.099 1.00 0.00 O ATOM 143 NE2 GLN A 11 24.454 11.749 -2.104 1.00 0.00 N ATOM 0 H GLN A 11 25.163 10.432 -3.791 1.00 0.00 H new ATOM 0 HA GLN A 11 23.831 7.862 -3.991 1.00 0.00 H new ATOM 0 HB2 GLN A 11 24.046 7.642 -1.657 1.00 0.00 H new ATOM 0 HB3 GLN A 11 25.559 8.307 -2.238 1.00 0.00 H new ATOM 0 HG2 GLN A 11 23.364 9.889 -0.868 1.00 0.00 H new ATOM 0 HG3 GLN A 11 24.815 9.287 -0.093 1.00 0.00 H new ATOM 0 HE21 GLN A 11 23.481 11.560 -2.343 1.00 0.00 H new ATOM 0 HE22 GLN A 11 24.897 12.615 -2.413 1.00 0.00 H new ATOM 152 N ALA A 12 21.524 8.384 -3.120 1.00 0.00 N ATOM 153 CA ALA A 12 20.124 8.641 -2.997 1.00 0.00 C ATOM 154 C ALA A 12 19.693 8.345 -1.591 1.00 0.00 C ATOM 155 O ALA A 12 20.221 7.413 -0.963 1.00 0.00 O ATOM 156 CB ALA A 12 19.376 7.748 -3.960 1.00 0.00 C ATOM 0 H ALA A 12 21.763 7.394 -3.058 1.00 0.00 H new ATOM 0 HA ALA A 12 19.911 9.685 -3.228 1.00 0.00 H new ATOM 0 HB1 ALA A 12 18.306 7.936 -3.874 1.00 0.00 H new ATOM 0 HB2 ALA A 12 19.701 7.959 -4.979 1.00 0.00 H new ATOM 0 HB3 ALA A 12 19.581 6.704 -3.722 1.00 0.00 H new ATOM 162 N TRP A 13 18.795 9.127 -1.071 1.00 0.00 N ATOM 163 CA TRP A 13 18.292 8.916 0.252 1.00 0.00 C ATOM 164 C TRP A 13 16.821 8.799 0.127 1.00 0.00 C ATOM 165 O TRP A 13 16.228 9.235 -0.871 1.00 0.00 O ATOM 166 CB TRP A 13 18.564 10.083 1.198 1.00 0.00 C ATOM 167 CG TRP A 13 19.904 10.703 1.084 1.00 0.00 C ATOM 168 CD1 TRP A 13 20.262 11.623 0.178 1.00 0.00 C ATOM 169 CD2 TRP A 13 21.040 10.480 1.918 1.00 0.00 C ATOM 170 NE1 TRP A 13 21.567 12.008 0.380 1.00 0.00 N ATOM 171 CE2 TRP A 13 22.069 11.319 1.449 1.00 0.00 C ATOM 172 CE3 TRP A 13 21.285 9.662 3.018 1.00 0.00 C ATOM 173 CZ2 TRP A 13 23.337 11.355 2.042 1.00 0.00 C ATOM 174 CZ3 TRP A 13 22.534 9.697 3.605 1.00 0.00 C ATOM 175 CH2 TRP A 13 23.543 10.540 3.120 1.00 0.00 C ATOM 0 H TRP A 13 18.390 9.930 -1.553 1.00 0.00 H new ATOM 0 HA TRP A 13 18.783 8.034 0.664 1.00 0.00 H new ATOM 0 HB2 TRP A 13 17.812 10.852 1.022 1.00 0.00 H new ATOM 0 HB3 TRP A 13 18.431 9.735 2.222 1.00 0.00 H new ATOM 0 HD1 TRP A 13 19.618 12.007 -0.599 1.00 0.00 H new ATOM 0 HE1 TRP A 13 22.076 12.695 -0.176 1.00 0.00 H new ATOM 0 HE3 TRP A 13 20.513 9.013 3.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 24.118 11.998 1.664 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 22.738 9.062 4.455 1.00 0.00 H new ATOM 0 HH2 TRP A 13 24.506 10.546 3.609 1.00 0.00 H new ATOM 186 N ARG A 14 16.210 8.315 1.124 1.00 0.00 N ATOM 187 CA ARG A 14 14.836 8.088 1.049 1.00 0.00 C ATOM 188 C ARG A 14 14.199 8.643 2.277 1.00 0.00 C ATOM 189 O ARG A 14 14.619 8.336 3.378 1.00 0.00 O ATOM 190 CB ARG A 14 14.647 6.626 0.937 1.00 0.00 C ATOM 191 CG ARG A 14 13.349 6.210 0.371 1.00 0.00 C ATOM 192 CD ARG A 14 13.210 6.667 -1.066 1.00 0.00 C ATOM 193 NE ARG A 14 14.415 6.404 -1.904 1.00 0.00 N ATOM 194 CZ ARG A 14 14.612 5.299 -2.674 1.00 0.00 C ATOM 195 NH1 ARG A 14 13.878 4.194 -2.492 1.00 0.00 N ATOM 196 NH2 ARG A 14 15.557 5.304 -3.601 1.00 0.00 N ATOM 0 H ARG A 14 16.646 8.066 2.012 1.00 0.00 H new ATOM 0 HA ARG A 14 14.375 8.574 0.189 1.00 0.00 H new ATOM 0 HB2 ARG A 14 15.445 6.217 0.317 1.00 0.00 H new ATOM 0 HB3 ARG A 14 14.754 6.183 1.927 1.00 0.00 H new ATOM 0 HG2 ARG A 14 13.258 5.125 0.421 1.00 0.00 H new ATOM 0 HG3 ARG A 14 12.538 6.626 0.968 1.00 0.00 H new ATOM 0 HD2 ARG A 14 12.352 6.167 -1.514 1.00 0.00 H new ATOM 0 HD3 ARG A 14 12.998 7.736 -1.078 1.00 0.00 H new ATOM 0 HE ARG A 14 15.152 7.110 -1.900 1.00 0.00 H new ATOM 0 HH11 ARG A 14 13.159 4.172 -1.768 1.00 0.00 H new ATOM 0 HH12 ARG A 14 14.037 3.374 -3.077 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.134 6.134 -3.736 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.708 4.478 -4.180 1.00 0.00 H new ATOM 210 N HIS A 15 13.218 9.485 2.103 1.00 0.00 N ATOM 211 CA HIS A 15 12.605 10.165 3.264 1.00 0.00 C ATOM 212 C HIS A 15 11.122 9.964 3.326 1.00 0.00 C ATOM 213 O HIS A 15 10.459 9.871 2.298 1.00 0.00 O ATOM 214 CB HIS A 15 12.920 11.679 3.305 1.00 0.00 C ATOM 215 CG HIS A 15 14.335 12.053 3.683 1.00 0.00 C ATOM 216 ND1 HIS A 15 14.656 13.209 4.347 1.00 0.00 N ATOM 217 CD2 HIS A 15 15.512 11.446 3.443 1.00 0.00 C ATOM 218 CE1 HIS A 15 15.949 13.291 4.495 1.00 0.00 C ATOM 219 NE2 HIS A 15 16.492 12.235 3.954 1.00 0.00 N ATOM 0 H HIS A 15 12.816 9.729 1.198 1.00 0.00 H new ATOM 0 HA HIS A 15 13.058 9.697 4.138 1.00 0.00 H new ATOM 0 HB2 HIS A 15 12.704 12.101 2.324 1.00 0.00 H new ATOM 0 HB3 HIS A 15 12.239 12.152 4.013 1.00 0.00 H new ATOM 0 HD2 HIS A 15 15.652 10.503 2.936 1.00 0.00 H new ATOM 0 HE1 HIS A 15 16.480 14.096 4.982 1.00 0.00 H new ATOM 0 HE2 HIS A 15 17.492 12.034 3.920 1.00 0.00 H new ATOM 228 N HIS A 16 10.603 9.896 4.529 1.00 0.00 N ATOM 229 CA HIS A 16 9.183 9.761 4.740 1.00 0.00 C ATOM 230 C HIS A 16 8.517 11.123 4.729 1.00 0.00 C ATOM 231 O HIS A 16 9.100 12.127 5.131 1.00 0.00 O ATOM 232 CB HIS A 16 8.858 9.083 6.089 1.00 0.00 C ATOM 233 CG HIS A 16 9.255 7.643 6.227 1.00 0.00 C ATOM 234 ND1 HIS A 16 10.259 7.211 7.054 1.00 0.00 N ATOM 235 CD2 HIS A 16 8.717 6.531 5.703 1.00 0.00 C ATOM 236 CE1 HIS A 16 10.319 5.911 7.041 1.00 0.00 C ATOM 237 NE2 HIS A 16 9.395 5.464 6.229 1.00 0.00 N ATOM 0 H HIS A 16 11.153 9.933 5.387 1.00 0.00 H new ATOM 0 HA HIS A 16 8.806 9.138 3.929 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.347 9.649 6.882 1.00 0.00 H new ATOM 0 HB3 HIS A 16 7.784 9.159 6.259 1.00 0.00 H new ATOM 0 HD2 HIS A 16 7.901 6.486 4.997 1.00 0.00 H new ATOM 0 HE1 HIS A 16 11.013 5.305 7.604 1.00 0.00 H new ATOM 0 HE2 HIS A 16 9.210 4.482 6.022 1.00 0.00 H new ATOM 246 N ASN A 17 7.359 11.165 4.179 1.00 0.00 N ATOM 247 CA ASN A 17 6.462 12.296 4.301 1.00 0.00 C ATOM 248 C ASN A 17 5.319 11.857 5.165 1.00 0.00 C ATOM 249 O ASN A 17 5.295 10.695 5.613 1.00 0.00 O ATOM 250 CB ASN A 17 5.948 12.744 2.917 1.00 0.00 C ATOM 251 CG ASN A 17 6.942 13.589 2.096 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.535 14.369 1.242 1.00 0.00 O ATOM 253 ND2 ASN A 17 8.223 13.477 2.377 1.00 0.00 N ATOM 0 H ASN A 17 6.983 10.404 3.614 1.00 0.00 H new ATOM 0 HA ASN A 17 6.980 13.148 4.741 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.684 11.858 2.340 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.032 13.319 3.055 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.906 14.048 1.879 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.533 12.819 3.093 1.00 0.00 H new ATOM 260 N GLY A 18 4.393 12.730 5.409 1.00 0.00 N ATOM 261 CA GLY A 18 3.252 12.375 6.198 1.00 0.00 C ATOM 262 C GLY A 18 2.205 11.729 5.342 1.00 0.00 C ATOM 263 O GLY A 18 2.463 10.715 4.690 1.00 0.00 O ATOM 0 H GLY A 18 4.403 13.693 5.074 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.551 11.694 6.995 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.842 13.264 6.676 1.00 0.00 H new ATOM 267 N PHE A 19 1.052 12.317 5.299 1.00 0.00 N ATOM 268 CA PHE A 19 -0.059 11.793 4.545 1.00 0.00 C ATOM 269 C PHE A 19 -0.730 12.944 3.887 1.00 0.00 C ATOM 270 O PHE A 19 -0.934 13.969 4.533 1.00 0.00 O ATOM 271 CB PHE A 19 -1.090 11.141 5.488 1.00 0.00 C ATOM 272 CG PHE A 19 -0.540 10.067 6.357 1.00 0.00 C ATOM 273 CD1 PHE A 19 -0.427 8.777 5.891 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.116 10.356 7.646 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.112 7.795 6.686 1.00 0.00 C ATOM 276 CE2 PHE A 19 0.417 9.373 8.446 1.00 0.00 C ATOM 277 CZ PHE A 19 0.535 8.094 7.966 1.00 0.00 C ATOM 0 H PHE A 19 0.846 13.187 5.791 1.00 0.00 H new ATOM 0 HA PHE A 19 0.302 11.054 3.830 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.525 11.915 6.120 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.900 10.726 4.888 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.764 8.535 4.894 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.206 11.363 8.025 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.205 6.787 6.309 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.742 9.607 9.449 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.959 7.320 8.589 1.00 0.00 H new ATOM 287 N ASP A 20 -1.056 12.841 2.627 1.00 0.00 N ATOM 288 CA ASP A 20 -1.818 13.890 2.007 1.00 0.00 C ATOM 289 C ASP A 20 -3.247 13.707 2.420 1.00 0.00 C ATOM 290 O ASP A 20 -3.863 12.691 2.085 1.00 0.00 O ATOM 291 CB ASP A 20 -1.702 13.825 0.484 1.00 0.00 C ATOM 292 CG ASP A 20 -2.484 14.925 -0.195 1.00 0.00 C ATOM 293 OD1 ASP A 20 -2.065 16.101 -0.110 1.00 0.00 O ATOM 294 OD2 ASP A 20 -3.527 14.647 -0.805 1.00 0.00 O ATOM 0 H ASP A 20 -0.812 12.058 2.020 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.440 14.863 2.322 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.653 13.897 0.198 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.062 12.857 0.135 1.00 0.00 H new ATOM 299 N PHE A 21 -3.769 14.648 3.171 1.00 0.00 N ATOM 300 CA PHE A 21 -5.088 14.498 3.705 1.00 0.00 C ATOM 301 C PHE A 21 -6.122 14.479 2.611 1.00 0.00 C ATOM 302 O PHE A 21 -7.076 13.750 2.701 1.00 0.00 O ATOM 303 CB PHE A 21 -5.429 15.571 4.741 1.00 0.00 C ATOM 304 CG PHE A 21 -6.704 15.260 5.484 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.756 14.172 6.336 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.840 16.038 5.327 1.00 0.00 C ATOM 307 CE1 PHE A 21 -7.902 13.862 7.017 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.002 15.734 6.011 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.034 14.642 6.856 1.00 0.00 C ATOM 0 H PHE A 21 -3.298 15.518 3.421 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.103 13.536 4.217 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.608 15.660 5.453 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.526 16.536 4.244 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.878 13.557 6.466 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.817 16.890 4.664 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -7.923 13.009 7.680 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.882 16.348 5.885 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.940 14.397 7.390 1.00 0.00 H new ATOM 319 N ALA A 22 -5.903 15.246 1.566 1.00 0.00 N ATOM 320 CA ALA A 22 -6.847 15.329 0.471 1.00 0.00 C ATOM 321 C ALA A 22 -7.059 13.985 -0.232 1.00 0.00 C ATOM 322 O ALA A 22 -8.186 13.650 -0.598 1.00 0.00 O ATOM 323 CB ALA A 22 -6.421 16.378 -0.514 1.00 0.00 C ATOM 0 H ALA A 22 -5.072 15.826 1.450 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.806 15.613 0.903 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.143 16.426 -1.330 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.372 17.346 -0.016 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.439 16.125 -0.913 1.00 0.00 H new ATOM 329 N VAL A 23 -6.006 13.211 -0.408 1.00 0.00 N ATOM 330 CA VAL A 23 -6.144 11.932 -1.079 1.00 0.00 C ATOM 331 C VAL A 23 -6.922 10.939 -0.198 1.00 0.00 C ATOM 332 O VAL A 23 -7.819 10.236 -0.675 1.00 0.00 O ATOM 333 CB VAL A 23 -4.771 11.362 -1.569 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.904 10.750 -0.466 1.00 0.00 C ATOM 335 CG2 VAL A 23 -4.949 10.418 -2.730 1.00 0.00 C ATOM 0 H VAL A 23 -5.060 13.439 -0.102 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.729 12.093 -1.984 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.209 12.230 -1.914 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.973 10.381 -0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.681 11.508 0.284 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.440 9.924 0.001 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.976 10.041 -3.045 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -5.581 9.583 -2.427 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.419 10.946 -3.560 1.00 0.00 H new ATOM 345 N ILE A 24 -6.608 10.936 1.094 1.00 0.00 N ATOM 346 CA ILE A 24 -7.332 10.122 2.078 1.00 0.00 C ATOM 347 C ILE A 24 -8.793 10.559 2.080 1.00 0.00 C ATOM 348 O ILE A 24 -9.703 9.753 2.027 1.00 0.00 O ATOM 349 CB ILE A 24 -6.777 10.349 3.517 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.276 10.031 3.604 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.572 9.544 4.568 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.906 8.591 3.299 1.00 0.00 C ATOM 0 H ILE A 24 -5.851 11.492 1.491 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.216 9.072 1.808 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.905 11.408 3.742 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.741 10.682 2.912 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.926 10.276 4.607 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.156 9.728 5.558 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.617 9.854 4.550 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.506 8.481 4.338 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.827 8.466 3.386 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.406 7.929 4.006 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.219 8.342 2.285 1.00 0.00 H new ATOM 364 N LYS A 25 -8.963 11.858 2.077 1.00 0.00 N ATOM 365 CA LYS A 25 -10.251 12.521 2.109 1.00 0.00 C ATOM 366 C LYS A 25 -11.117 12.153 0.928 1.00 0.00 C ATOM 367 O LYS A 25 -12.245 11.758 1.116 1.00 0.00 O ATOM 368 CB LYS A 25 -10.029 14.030 2.143 1.00 0.00 C ATOM 369 CG LYS A 25 -11.240 14.886 1.919 1.00 0.00 C ATOM 370 CD LYS A 25 -10.805 16.318 1.697 1.00 0.00 C ATOM 371 CE LYS A 25 -11.955 17.143 1.193 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.548 18.531 0.851 1.00 0.00 N ATOM 0 H LYS A 25 -8.180 12.511 2.051 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.779 12.192 3.004 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.600 14.291 3.111 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.286 14.283 1.386 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.800 14.526 1.056 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.907 14.825 2.779 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.428 16.739 2.629 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.985 16.349 0.979 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.383 16.665 0.312 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.737 17.173 1.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.375 19.061 0.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.164 18.998 1.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.820 18.506 0.108 1.00 0.00 H new ATOM 386 N GLU A 26 -10.602 12.285 -0.276 1.00 0.00 N ATOM 387 CA GLU A 26 -11.392 11.995 -1.455 1.00 0.00 C ATOM 388 C GLU A 26 -11.757 10.520 -1.496 1.00 0.00 C ATOM 389 O GLU A 26 -12.900 10.154 -1.823 1.00 0.00 O ATOM 390 CB GLU A 26 -10.662 12.409 -2.731 1.00 0.00 C ATOM 391 CG GLU A 26 -11.513 12.282 -3.978 1.00 0.00 C ATOM 392 CD GLU A 26 -10.807 12.769 -5.199 1.00 0.00 C ATOM 393 OE1 GLU A 26 -10.162 13.825 -5.139 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.914 12.136 -6.259 1.00 0.00 O ATOM 0 H GLU A 26 -9.647 12.589 -0.464 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.310 12.580 -1.398 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.328 13.442 -2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.769 11.795 -2.845 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.796 11.239 -4.117 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -12.435 12.848 -3.845 1.00 0.00 H new ATOM 401 N LEU A 27 -10.806 9.684 -1.120 1.00 0.00 N ATOM 402 CA LEU A 27 -11.036 8.231 -1.125 1.00 0.00 C ATOM 403 C LEU A 27 -12.108 7.878 -0.096 1.00 0.00 C ATOM 404 O LEU A 27 -12.953 7.032 -0.334 1.00 0.00 O ATOM 405 CB LEU A 27 -9.738 7.420 -0.874 1.00 0.00 C ATOM 406 CG LEU A 27 -9.831 5.910 -1.112 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.357 5.622 -2.491 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.470 5.270 -0.950 1.00 0.00 C ATOM 0 H LEU A 27 -9.877 9.970 -0.810 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.382 7.954 -2.121 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.953 7.821 -1.516 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.423 7.586 0.156 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.518 5.492 -0.376 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.416 4.544 -2.640 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.350 6.058 -2.600 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.687 6.055 -3.234 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.550 4.197 -1.122 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.776 5.702 -1.671 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.101 5.449 0.060 1.00 0.00 H new ATOM 420 N LYS A 28 -12.084 8.573 1.006 1.00 0.00 N ATOM 421 CA LYS A 28 -13.047 8.392 2.067 1.00 0.00 C ATOM 422 C LYS A 28 -14.407 8.956 1.638 1.00 0.00 C ATOM 423 O LYS A 28 -15.462 8.405 1.962 1.00 0.00 O ATOM 424 CB LYS A 28 -12.541 9.109 3.304 1.00 0.00 C ATOM 425 CG LYS A 28 -13.278 8.816 4.577 1.00 0.00 C ATOM 426 CD LYS A 28 -12.602 9.532 5.722 1.00 0.00 C ATOM 427 CE LYS A 28 -13.263 9.196 7.022 1.00 0.00 C ATOM 428 NZ LYS A 28 -12.664 9.905 8.169 1.00 0.00 N ATOM 0 H LYS A 28 -11.387 9.292 1.200 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.172 7.331 2.285 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.492 8.851 3.446 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.583 10.183 3.121 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.315 9.140 4.493 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.293 7.742 4.763 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.549 9.252 5.761 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.640 10.609 5.557 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -14.322 9.445 6.960 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -13.197 8.121 7.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -13.160 9.635 9.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.659 9.649 8.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -12.750 10.932 8.026 1.00 0.00 H new ATOM 442 N THR A 29 -14.370 10.034 0.888 1.00 0.00 N ATOM 443 CA THR A 29 -15.563 10.635 0.366 1.00 0.00 C ATOM 444 C THR A 29 -16.238 9.651 -0.599 1.00 0.00 C ATOM 445 O THR A 29 -17.452 9.450 -0.562 1.00 0.00 O ATOM 446 CB THR A 29 -15.238 11.974 -0.341 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.591 12.849 0.593 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.492 12.660 -0.872 1.00 0.00 C ATOM 0 H THR A 29 -13.509 10.514 0.626 1.00 0.00 H new ATOM 0 HA THR A 29 -16.247 10.857 1.185 1.00 0.00 H new ATOM 0 HB THR A 29 -14.589 11.756 -1.189 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.635 12.638 0.630 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.216 13.595 -1.360 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.987 12.007 -1.591 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.171 12.869 -0.045 1.00 0.00 H new ATOM 456 N ALA A 30 -15.444 8.984 -1.426 1.00 0.00 N ATOM 457 CA ALA A 30 -15.923 8.031 -2.341 1.00 0.00 C ATOM 458 C ALA A 30 -16.348 6.789 -1.611 1.00 0.00 C ATOM 459 O ALA A 30 -17.270 6.152 -2.009 1.00 0.00 O ATOM 460 CB ALA A 30 -14.845 7.715 -3.357 1.00 0.00 C ATOM 0 H ALA A 30 -14.433 9.114 -1.458 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.789 8.433 -2.866 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.218 6.976 -4.066 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -14.571 8.624 -3.892 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.969 7.317 -2.846 1.00 0.00 H new ATOM 466 N ALA A 31 -15.671 6.469 -0.543 1.00 0.00 N ATOM 467 CA ALA A 31 -16.015 5.347 0.289 1.00 0.00 C ATOM 468 C ALA A 31 -17.420 5.506 0.805 1.00 0.00 C ATOM 469 O ALA A 31 -18.158 4.552 0.901 1.00 0.00 O ATOM 470 CB ALA A 31 -15.077 5.278 1.450 1.00 0.00 C ATOM 0 H ALA A 31 -14.853 6.987 -0.221 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.943 4.433 -0.301 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.339 4.427 2.079 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.056 5.160 1.087 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.151 6.196 2.032 1.00 0.00 H new ATOM 476 N SER A 32 -17.770 6.723 1.125 1.00 0.00 N ATOM 477 CA SER A 32 -19.082 7.031 1.599 1.00 0.00 C ATOM 478 C SER A 32 -20.117 6.990 0.436 1.00 0.00 C ATOM 479 O SER A 32 -21.090 6.247 0.501 1.00 0.00 O ATOM 480 CB SER A 32 -19.070 8.398 2.307 1.00 0.00 C ATOM 481 OG SER A 32 -20.308 8.677 2.950 1.00 0.00 O ATOM 0 H SER A 32 -17.147 7.528 1.062 1.00 0.00 H new ATOM 0 HA SER A 32 -19.388 6.275 2.323 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.267 8.418 3.043 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.855 9.181 1.580 1.00 0.00 H new ATOM 0 HG SER A 32 -20.259 9.552 3.389 1.00 0.00 H new ATOM 487 N GLN A 33 -19.888 7.765 -0.649 1.00 0.00 N ATOM 488 CA GLN A 33 -20.852 7.868 -1.773 1.00 0.00 C ATOM 489 C GLN A 33 -20.909 6.597 -2.623 1.00 0.00 C ATOM 490 O GLN A 33 -21.968 5.998 -2.833 1.00 0.00 O ATOM 491 CB GLN A 33 -20.443 9.018 -2.730 1.00 0.00 C ATOM 492 CG GLN A 33 -20.071 10.302 -2.047 1.00 0.00 C ATOM 493 CD GLN A 33 -20.035 11.481 -2.976 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.040 12.170 -3.165 1.00 0.00 O ATOM 495 NE2 GLN A 33 -18.897 11.757 -3.532 1.00 0.00 N ATOM 0 H GLN A 33 -19.046 8.328 -0.771 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.824 8.044 -1.312 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.599 8.686 -3.334 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -21.268 9.213 -3.415 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -20.785 10.500 -1.248 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.093 10.187 -1.580 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -18.085 11.165 -3.354 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -18.813 12.566 -4.148 1.00 0.00 H new ATOM 504 N TYR A 34 -19.759 6.217 -3.076 1.00 0.00 N ATOM 505 CA TYR A 34 -19.542 5.238 -4.090 1.00 0.00 C ATOM 506 C TYR A 34 -19.366 3.880 -3.486 1.00 0.00 C ATOM 507 O TYR A 34 -19.917 2.896 -3.978 1.00 0.00 O ATOM 508 CB TYR A 34 -18.289 5.725 -4.864 1.00 0.00 C ATOM 509 CG TYR A 34 -18.521 7.074 -5.488 1.00 0.00 C ATOM 510 CD1 TYR A 34 -19.590 7.294 -6.328 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.700 8.145 -5.191 1.00 0.00 C ATOM 512 CE1 TYR A 34 -19.825 8.539 -6.846 1.00 0.00 C ATOM 513 CE2 TYR A 34 -17.923 9.390 -5.706 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.990 9.587 -6.530 1.00 0.00 C ATOM 515 OH TYR A 34 -19.221 10.838 -7.057 1.00 0.00 O ATOM 0 H TYR A 34 -18.887 6.610 -2.723 1.00 0.00 H new ATOM 0 HA TYR A 34 -20.391 5.136 -4.766 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.438 5.778 -4.185 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -18.034 5.002 -5.639 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -20.249 6.476 -6.580 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -16.858 7.993 -4.533 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -20.667 8.699 -7.504 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.262 10.208 -5.463 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.539 11.461 -6.731 1.00 0.00 H new ATOM 525 N GLY A 35 -18.674 3.835 -2.383 1.00 0.00 N ATOM 526 CA GLY A 35 -18.381 2.586 -1.781 1.00 0.00 C ATOM 527 C GLY A 35 -17.325 1.889 -2.567 1.00 0.00 C ATOM 528 O GLY A 35 -16.736 2.477 -3.462 1.00 0.00 O ATOM 0 H GLY A 35 -18.308 4.650 -1.892 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -18.046 2.735 -0.755 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -19.281 1.972 -1.737 1.00 0.00 H new ATOM 532 N ALA A 36 -17.077 0.677 -2.260 1.00 0.00 N ATOM 533 CA ALA A 36 -16.116 -0.072 -2.983 1.00 0.00 C ATOM 534 C ALA A 36 -16.721 -0.679 -4.215 1.00 0.00 C ATOM 535 O ALA A 36 -17.936 -0.728 -4.372 1.00 0.00 O ATOM 536 CB ALA A 36 -15.459 -1.093 -2.132 1.00 0.00 C ATOM 0 H ALA A 36 -17.532 0.170 -1.501 1.00 0.00 H new ATOM 0 HA ALA A 36 -15.336 0.618 -3.305 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -14.729 -1.645 -2.724 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -14.954 -0.603 -1.299 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -16.210 -1.783 -1.746 1.00 0.00 H new ATOM 542 N THR A 37 -15.849 -0.999 -5.127 1.00 0.00 N ATOM 543 CA THR A 37 -16.132 -1.595 -6.424 1.00 0.00 C ATOM 544 C THR A 37 -16.601 -0.593 -7.452 1.00 0.00 C ATOM 545 O THR A 37 -16.474 -0.850 -8.642 1.00 0.00 O ATOM 546 CB THR A 37 -16.962 -2.917 -6.446 1.00 0.00 C ATOM 547 OG1 THR A 37 -18.323 -2.727 -6.097 1.00 0.00 O ATOM 548 CG2 THR A 37 -16.329 -3.967 -5.546 1.00 0.00 C ATOM 0 H THR A 37 -14.851 -0.845 -4.986 1.00 0.00 H new ATOM 0 HA THR A 37 -15.143 -1.941 -6.724 1.00 0.00 H new ATOM 0 HB THR A 37 -16.947 -3.269 -7.478 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.399 -2.613 -5.127 1.00 0.00 H new ATOM 0 HG21 THR A 37 -16.924 -4.880 -5.577 1.00 0.00 H new ATOM 0 HG22 THR A 37 -15.318 -4.181 -5.892 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.290 -3.594 -4.523 1.00 0.00 H new ATOM 556 N ALA A 38 -17.085 0.559 -6.995 1.00 0.00 N ATOM 557 CA ALA A 38 -17.405 1.659 -7.875 1.00 0.00 C ATOM 558 C ALA A 38 -16.093 2.177 -8.474 1.00 0.00 C ATOM 559 O ALA A 38 -15.185 2.546 -7.715 1.00 0.00 O ATOM 560 CB ALA A 38 -18.097 2.751 -7.082 1.00 0.00 C ATOM 0 H ALA A 38 -17.263 0.747 -6.008 1.00 0.00 H new ATOM 0 HA ALA A 38 -18.075 1.339 -8.674 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -18.340 3.583 -7.743 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -19.014 2.357 -6.643 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.436 3.099 -6.289 1.00 0.00 H new ATOM 566 N PRO A 39 -15.971 2.174 -9.831 1.00 0.00 N ATOM 567 CA PRO A 39 -14.743 2.547 -10.590 1.00 0.00 C ATOM 568 C PRO A 39 -13.951 3.739 -10.046 1.00 0.00 C ATOM 569 O PRO A 39 -12.713 3.763 -10.129 1.00 0.00 O ATOM 570 CB PRO A 39 -15.288 2.878 -11.972 1.00 0.00 C ATOM 571 CG PRO A 39 -16.439 1.949 -12.135 1.00 0.00 C ATOM 572 CD PRO A 39 -17.048 1.770 -10.766 1.00 0.00 C ATOM 0 HA PRO A 39 -14.019 1.734 -10.542 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -15.603 3.919 -12.038 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.536 2.722 -12.746 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -17.170 2.357 -12.833 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -16.110 0.992 -12.540 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.936 2.390 -10.642 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -17.354 0.737 -10.598 1.00 0.00 H new ATOM 580 N TYR A 40 -14.655 4.700 -9.488 1.00 0.00 N ATOM 581 CA TYR A 40 -14.062 5.907 -8.972 1.00 0.00 C ATOM 582 C TYR A 40 -13.083 5.606 -7.821 1.00 0.00 C ATOM 583 O TYR A 40 -11.894 5.928 -7.916 1.00 0.00 O ATOM 584 CB TYR A 40 -15.171 6.858 -8.516 1.00 0.00 C ATOM 585 CG TYR A 40 -14.705 8.233 -8.143 1.00 0.00 C ATOM 586 CD1 TYR A 40 -14.517 9.198 -9.114 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.451 8.574 -6.825 1.00 0.00 C ATOM 588 CE1 TYR A 40 -14.079 10.460 -8.785 1.00 0.00 C ATOM 589 CE2 TYR A 40 -14.014 9.835 -6.489 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.833 10.773 -7.474 1.00 0.00 C ATOM 591 OH TYR A 40 -13.420 12.046 -7.144 1.00 0.00 O ATOM 0 H TYR A 40 -15.669 4.661 -9.380 1.00 0.00 H new ATOM 0 HA TYR A 40 -13.484 6.382 -9.764 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.908 6.943 -9.314 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.679 6.417 -7.659 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.717 8.958 -10.148 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.598 7.838 -6.048 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -13.930 11.201 -9.557 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.815 10.085 -5.457 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.479 12.024 -6.871 1.00 0.00 H new ATOM 601 N THR A 41 -13.562 4.931 -6.756 1.00 0.00 N ATOM 602 CA THR A 41 -12.779 4.676 -5.553 1.00 0.00 C ATOM 603 C THR A 41 -11.527 3.836 -5.841 1.00 0.00 C ATOM 604 O THR A 41 -10.442 4.170 -5.400 1.00 0.00 O ATOM 605 CB THR A 41 -13.656 4.010 -4.429 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.943 3.907 -3.203 1.00 0.00 O ATOM 607 CG2 THR A 41 -14.116 2.636 -4.819 1.00 0.00 C ATOM 0 H THR A 41 -14.508 4.551 -6.717 1.00 0.00 H new ATOM 0 HA THR A 41 -12.439 5.646 -5.189 1.00 0.00 H new ATOM 0 HB THR A 41 -14.521 4.660 -4.300 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.516 3.491 -2.525 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.718 2.212 -4.015 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.715 2.697 -5.728 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.250 1.999 -4.998 1.00 0.00 H new ATOM 615 N LEU A 42 -11.652 2.793 -6.629 1.00 0.00 N ATOM 616 CA LEU A 42 -10.502 1.967 -6.885 1.00 0.00 C ATOM 617 C LEU A 42 -9.517 2.580 -7.824 1.00 0.00 C ATOM 618 O LEU A 42 -8.343 2.213 -7.802 1.00 0.00 O ATOM 619 CB LEU A 42 -10.749 0.456 -7.099 1.00 0.00 C ATOM 620 CG LEU A 42 -11.872 -0.031 -8.027 1.00 0.00 C ATOM 621 CD1 LEU A 42 -13.215 0.168 -7.390 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.812 0.633 -9.385 1.00 0.00 C ATOM 0 H LEU A 42 -12.514 2.504 -7.091 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.009 1.955 -5.913 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.818 0.028 -7.470 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.932 0.019 -6.117 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.722 -1.099 -8.185 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.994 -0.184 -8.066 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -13.262 -0.394 -6.457 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.366 1.227 -7.183 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.624 0.259 -10.009 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.912 1.712 -9.267 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.857 0.407 -9.859 1.00 0.00 H new ATOM 634 N ALA A 43 -9.982 3.535 -8.637 1.00 0.00 N ATOM 635 CA ALA A 43 -9.098 4.309 -9.479 1.00 0.00 C ATOM 636 C ALA A 43 -8.165 5.095 -8.584 1.00 0.00 C ATOM 637 O ALA A 43 -6.962 5.231 -8.848 1.00 0.00 O ATOM 638 CB ALA A 43 -9.887 5.258 -10.368 1.00 0.00 C ATOM 0 H ALA A 43 -10.968 3.782 -8.721 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.533 3.640 -10.128 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -9.199 5.829 -10.992 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -10.562 4.685 -11.003 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -10.466 5.942 -9.747 1.00 0.00 H new ATOM 644 N ILE A 44 -8.720 5.567 -7.500 1.00 0.00 N ATOM 645 CA ILE A 44 -7.979 6.293 -6.533 1.00 0.00 C ATOM 646 C ILE A 44 -7.015 5.340 -5.803 1.00 0.00 C ATOM 647 O ILE A 44 -5.857 5.633 -5.708 1.00 0.00 O ATOM 648 CB ILE A 44 -8.923 6.964 -5.542 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.909 7.859 -6.283 1.00 0.00 C ATOM 650 CG2 ILE A 44 -8.140 7.773 -4.507 1.00 0.00 C ATOM 651 CD1 ILE A 44 -11.072 8.314 -5.451 1.00 0.00 C ATOM 0 H ILE A 44 -9.707 5.452 -7.272 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.399 7.070 -7.031 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.479 6.188 -5.015 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.378 8.735 -6.655 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -10.287 7.322 -7.153 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.835 8.243 -3.811 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.469 7.111 -3.959 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.557 8.543 -5.012 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.725 8.946 -6.053 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.630 7.446 -5.100 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.707 8.881 -4.595 1.00 0.00 H new ATOM 663 N VAL A 45 -7.524 4.168 -5.347 1.00 0.00 N ATOM 664 CA VAL A 45 -6.695 3.130 -4.650 1.00 0.00 C ATOM 665 C VAL A 45 -5.377 2.846 -5.434 1.00 0.00 C ATOM 666 O VAL A 45 -4.256 2.988 -4.894 1.00 0.00 O ATOM 667 CB VAL A 45 -7.515 1.787 -4.438 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.700 0.678 -3.748 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.786 2.044 -3.645 1.00 0.00 C ATOM 0 H VAL A 45 -8.506 3.910 -5.446 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.431 3.525 -3.669 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.766 1.435 -5.439 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.320 -0.211 -3.634 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.827 0.437 -4.355 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.375 1.022 -2.766 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.329 1.108 -3.514 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.529 2.454 -2.668 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.413 2.755 -4.183 1.00 0.00 H new ATOM 679 N GLU A 46 -5.517 2.532 -6.707 1.00 0.00 N ATOM 680 CA GLU A 46 -4.365 2.247 -7.557 1.00 0.00 C ATOM 681 C GLU A 46 -3.494 3.488 -7.783 1.00 0.00 C ATOM 682 O GLU A 46 -2.282 3.369 -7.979 1.00 0.00 O ATOM 683 CB GLU A 46 -4.778 1.599 -8.896 1.00 0.00 C ATOM 684 CG GLU A 46 -5.845 2.380 -9.652 1.00 0.00 C ATOM 685 CD GLU A 46 -6.056 1.917 -11.076 1.00 0.00 C ATOM 686 OE1 GLU A 46 -5.075 1.876 -11.849 1.00 0.00 O ATOM 687 OE2 GLU A 46 -7.208 1.582 -11.456 1.00 0.00 O ATOM 0 H GLU A 46 -6.417 2.466 -7.182 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.757 1.519 -7.019 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.896 1.500 -9.529 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.146 0.591 -8.703 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.789 2.301 -9.112 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.570 3.435 -9.661 1.00 0.00 H new ATOM 694 N SER A 47 -4.092 4.673 -7.726 1.00 0.00 N ATOM 695 CA SER A 47 -3.344 5.895 -7.905 1.00 0.00 C ATOM 696 C SER A 47 -2.590 6.305 -6.634 1.00 0.00 C ATOM 697 O SER A 47 -1.504 6.858 -6.716 1.00 0.00 O ATOM 698 CB SER A 47 -4.243 7.031 -8.399 1.00 0.00 C ATOM 699 OG SER A 47 -4.867 6.691 -9.641 1.00 0.00 O ATOM 0 H SER A 47 -5.089 4.805 -7.557 1.00 0.00 H new ATOM 0 HA SER A 47 -2.596 5.696 -8.673 1.00 0.00 H new ATOM 0 HB2 SER A 47 -5.007 7.246 -7.652 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.653 7.939 -8.522 1.00 0.00 H new ATOM 0 HG SER A 47 -5.799 6.433 -9.479 1.00 0.00 H new ATOM 705 N VAL A 48 -3.133 5.997 -5.461 1.00 0.00 N ATOM 706 CA VAL A 48 -2.447 6.351 -4.220 1.00 0.00 C ATOM 707 C VAL A 48 -1.244 5.425 -4.045 1.00 0.00 C ATOM 708 O VAL A 48 -0.262 5.782 -3.430 1.00 0.00 O ATOM 709 CB VAL A 48 -3.355 6.271 -2.948 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.666 6.905 -1.765 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.705 6.906 -3.170 1.00 0.00 C ATOM 0 H VAL A 48 -4.024 5.515 -5.341 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.143 7.394 -4.311 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.523 5.214 -2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.312 6.840 -0.890 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.731 6.382 -1.565 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.456 7.952 -1.984 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.299 6.826 -2.260 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.575 7.957 -3.427 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.218 6.395 -3.984 1.00 0.00 H new ATOM 721 N ALA A 49 -1.315 4.230 -4.627 1.00 0.00 N ATOM 722 CA ALA A 49 -0.181 3.333 -4.566 1.00 0.00 C ATOM 723 C ALA A 49 0.718 3.499 -5.778 1.00 0.00 C ATOM 724 O ALA A 49 1.645 2.749 -5.970 1.00 0.00 O ATOM 725 CB ALA A 49 -0.610 1.885 -4.375 1.00 0.00 C ATOM 0 H ALA A 49 -2.126 3.874 -5.132 1.00 0.00 H new ATOM 0 HA ALA A 49 0.401 3.606 -3.686 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.272 1.246 -4.335 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.169 1.791 -3.444 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.241 1.579 -5.209 1.00 0.00 H new ATOM 731 N ASP A 50 0.436 4.502 -6.575 1.00 0.00 N ATOM 732 CA ASP A 50 1.229 4.801 -7.760 1.00 0.00 C ATOM 733 C ASP A 50 2.484 5.565 -7.378 1.00 0.00 C ATOM 734 O ASP A 50 3.522 5.451 -8.033 1.00 0.00 O ATOM 735 CB ASP A 50 0.388 5.573 -8.800 1.00 0.00 C ATOM 736 CG ASP A 50 1.179 6.103 -9.997 1.00 0.00 C ATOM 737 OD1 ASP A 50 1.633 5.300 -10.861 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.324 7.340 -10.118 1.00 0.00 O ATOM 0 H ASP A 50 -0.348 5.138 -6.427 1.00 0.00 H new ATOM 0 HA ASP A 50 1.537 3.862 -8.221 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.403 4.918 -9.166 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.098 6.412 -8.303 1.00 0.00 H new ATOM 743 N ASN A 51 2.415 6.269 -6.278 1.00 0.00 N ATOM 744 CA ASN A 51 3.528 7.056 -5.810 1.00 0.00 C ATOM 745 C ASN A 51 4.356 6.217 -4.844 1.00 0.00 C ATOM 746 O ASN A 51 4.022 5.066 -4.599 1.00 0.00 O ATOM 747 CB ASN A 51 3.048 8.370 -5.158 1.00 0.00 C ATOM 748 CG ASN A 51 2.236 8.203 -3.889 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.766 8.076 -2.805 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.951 8.295 -4.020 1.00 0.00 N ATOM 0 H ASN A 51 1.588 6.314 -5.682 1.00 0.00 H new ATOM 0 HA ASN A 51 4.153 7.340 -6.657 1.00 0.00 H new ATOM 0 HB2 ASN A 51 3.920 8.985 -4.934 1.00 0.00 H new ATOM 0 HB3 ASN A 51 2.448 8.919 -5.884 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.351 8.261 -3.196 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.539 8.401 -4.947 1.00 0.00 H new ATOM 757 N TRP A 52 5.446 6.756 -4.345 1.00 0.00 N ATOM 758 CA TRP A 52 6.274 6.030 -3.399 1.00 0.00 C ATOM 759 C TRP A 52 5.660 6.104 -2.029 1.00 0.00 C ATOM 760 O TRP A 52 5.371 7.179 -1.537 1.00 0.00 O ATOM 761 CB TRP A 52 7.692 6.596 -3.317 1.00 0.00 C ATOM 762 CG TRP A 52 8.533 6.414 -4.530 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.749 5.254 -5.219 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.337 7.412 -5.156 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.605 5.484 -6.266 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.993 6.802 -6.245 1.00 0.00 C ATOM 767 CE3 TRP A 52 9.559 8.764 -4.906 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.856 7.511 -7.087 1.00 0.00 C ATOM 769 CZ3 TRP A 52 10.405 9.461 -5.732 1.00 0.00 C ATOM 770 CH2 TRP A 52 11.051 8.835 -6.812 1.00 0.00 C ATOM 0 H TRP A 52 5.782 7.691 -4.575 1.00 0.00 H new ATOM 0 HA TRP A 52 6.332 5.000 -3.750 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.625 7.662 -3.101 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.200 6.131 -2.472 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.311 4.298 -4.975 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.905 4.789 -6.950 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.074 9.256 -4.076 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.348 7.032 -7.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 10.578 10.511 -5.548 1.00 0.00 H new ATOM 0 HH2 TRP A 52 11.715 9.413 -7.438 1.00 0.00 H new ATOM 781 N LEU A 53 5.450 4.988 -1.436 1.00 0.00 N ATOM 782 CA LEU A 53 4.959 4.918 -0.099 1.00 0.00 C ATOM 783 C LEU A 53 5.297 3.560 0.468 1.00 0.00 C ATOM 784 O LEU A 53 5.874 2.729 -0.237 1.00 0.00 O ATOM 785 CB LEU A 53 3.445 5.247 -0.018 1.00 0.00 C ATOM 786 CG LEU A 53 2.400 4.248 -0.543 1.00 0.00 C ATOM 787 CD1 LEU A 53 1.013 4.838 -0.351 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.614 3.858 -2.007 1.00 0.00 C ATOM 0 H LEU A 53 5.615 4.079 -1.868 1.00 0.00 H new ATOM 0 HA LEU A 53 5.446 5.680 0.510 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.212 5.435 1.030 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.290 6.185 -0.552 1.00 0.00 H new ATOM 0 HG LEU A 53 2.510 3.328 0.032 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.265 4.137 -0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.841 5.027 0.709 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.936 5.775 -0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.842 3.151 -2.312 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.558 4.749 -2.633 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.594 3.396 -2.121 1.00 0.00 H new ATOM 800 N THR A 54 4.975 3.328 1.703 1.00 0.00 N ATOM 801 CA THR A 54 5.320 2.086 2.339 1.00 0.00 C ATOM 802 C THR A 54 4.098 1.460 3.039 1.00 0.00 C ATOM 803 O THR A 54 3.065 2.126 3.168 1.00 0.00 O ATOM 804 CB THR A 54 6.509 2.282 3.317 1.00 0.00 C ATOM 805 OG1 THR A 54 6.367 3.499 4.092 1.00 0.00 O ATOM 806 CG2 THR A 54 7.852 2.271 2.583 1.00 0.00 C ATOM 0 H THR A 54 4.470 3.985 2.298 1.00 0.00 H new ATOM 0 HA THR A 54 5.640 1.385 1.568 1.00 0.00 H new ATOM 0 HB THR A 54 6.493 1.437 4.005 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.423 3.759 4.122 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.660 2.411 3.301 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.980 1.316 2.074 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.873 3.078 1.851 1.00 0.00 H new ATOM 814 N PRO A 55 4.181 0.163 3.459 1.00 0.00 N ATOM 815 CA PRO A 55 3.083 -0.540 4.160 1.00 0.00 C ATOM 816 C PRO A 55 2.461 0.249 5.324 1.00 0.00 C ATOM 817 O PRO A 55 1.244 0.190 5.518 1.00 0.00 O ATOM 818 CB PRO A 55 3.747 -1.812 4.670 1.00 0.00 C ATOM 819 CG PRO A 55 4.779 -2.096 3.649 1.00 0.00 C ATOM 820 CD PRO A 55 5.325 -0.751 3.238 1.00 0.00 C ATOM 0 HA PRO A 55 2.242 -0.706 3.487 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.188 -1.667 5.656 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.033 -2.631 4.757 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.567 -2.731 4.054 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.352 -2.623 2.796 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.189 -0.467 3.839 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.647 -0.749 2.196 1.00 0.00 H new ATOM 828 N THR A 56 3.280 0.989 6.079 1.00 0.00 N ATOM 829 CA THR A 56 2.763 1.773 7.179 1.00 0.00 C ATOM 830 C THR A 56 1.774 2.841 6.668 1.00 0.00 C ATOM 831 O THR A 56 0.690 3.003 7.241 1.00 0.00 O ATOM 832 CB THR A 56 3.899 2.409 8.066 1.00 0.00 C ATOM 833 OG1 THR A 56 3.325 3.009 9.240 1.00 0.00 O ATOM 834 CG2 THR A 56 4.707 3.472 7.309 1.00 0.00 C ATOM 0 H THR A 56 4.289 1.054 5.943 1.00 0.00 H new ATOM 0 HA THR A 56 2.222 1.088 7.832 1.00 0.00 H new ATOM 0 HB THR A 56 4.578 1.602 8.340 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.036 3.401 9.788 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.477 3.879 7.965 1.00 0.00 H new ATOM 0 HG22 THR A 56 5.176 3.019 6.436 1.00 0.00 H new ATOM 0 HG23 THR A 56 4.042 4.274 6.988 1.00 0.00 H new ATOM 842 N ASP A 57 2.121 3.493 5.523 1.00 0.00 N ATOM 843 CA ASP A 57 1.276 4.511 4.885 1.00 0.00 C ATOM 844 C ASP A 57 -0.034 3.883 4.547 1.00 0.00 C ATOM 845 O ASP A 57 -1.113 4.409 4.872 1.00 0.00 O ATOM 846 CB ASP A 57 1.899 5.049 3.566 1.00 0.00 C ATOM 847 CG ASP A 57 3.229 5.730 3.710 1.00 0.00 C ATOM 848 OD1 ASP A 57 4.253 5.021 3.803 1.00 0.00 O ATOM 849 OD2 ASP A 57 3.289 6.990 3.685 1.00 0.00 O ATOM 0 H ASP A 57 2.995 3.319 5.027 1.00 0.00 H new ATOM 0 HA ASP A 57 1.170 5.344 5.580 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.010 4.217 2.871 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.198 5.751 3.113 1.00 0.00 H new ATOM 854 N TRP A 58 0.077 2.721 3.939 1.00 0.00 N ATOM 855 CA TRP A 58 -1.046 1.930 3.520 1.00 0.00 C ATOM 856 C TRP A 58 -1.999 1.614 4.672 1.00 0.00 C ATOM 857 O TRP A 58 -3.194 1.887 4.584 1.00 0.00 O ATOM 858 CB TRP A 58 -0.585 0.635 2.826 1.00 0.00 C ATOM 859 CG TRP A 58 -0.091 0.802 1.424 1.00 0.00 C ATOM 860 CD1 TRP A 58 -0.426 1.784 0.536 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.767 -0.093 0.710 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.223 1.571 -0.649 1.00 0.00 N ATOM 863 CE2 TRP A 58 0.943 0.448 -0.571 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.426 -1.291 1.027 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.724 -0.135 -1.525 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.210 -1.876 0.053 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.344 -1.275 -1.212 1.00 0.00 C ATOM 0 H TRP A 58 0.977 2.295 3.720 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.600 2.532 2.800 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.209 0.186 3.422 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.416 -0.070 2.819 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -1.100 2.603 0.738 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.166 2.177 -1.467 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.323 -1.741 2.003 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 1.837 0.311 -2.502 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.724 -2.802 0.264 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.968 -1.751 -1.953 1.00 0.00 H new ATOM 878 N ASN A 59 -1.491 1.054 5.734 1.00 0.00 N ATOM 879 CA ASN A 59 -2.342 0.644 6.874 1.00 0.00 C ATOM 880 C ASN A 59 -3.158 1.795 7.434 1.00 0.00 C ATOM 881 O ASN A 59 -4.357 1.651 7.707 1.00 0.00 O ATOM 882 CB ASN A 59 -1.537 -0.061 7.950 1.00 0.00 C ATOM 883 CG ASN A 59 -1.083 -1.413 7.480 1.00 0.00 C ATOM 884 OD1 ASN A 59 -1.746 -2.057 6.658 1.00 0.00 O ATOM 885 ND2 ASN A 59 0.030 -1.852 7.953 1.00 0.00 N ATOM 0 H ASN A 59 -0.497 0.861 5.857 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.060 -0.078 6.484 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.671 0.545 8.218 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.142 -0.169 8.850 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.391 -2.757 7.651 1.00 0.00 H new ATOM 0 HD22 ASN A 59 0.552 -1.295 8.630 1.00 0.00 H new ATOM 892 N THR A 60 -2.539 2.934 7.470 1.00 0.00 N ATOM 893 CA THR A 60 -3.271 4.097 7.932 1.00 0.00 C ATOM 894 C THR A 60 -4.327 4.554 6.916 1.00 0.00 C ATOM 895 O THR A 60 -5.443 4.988 7.288 1.00 0.00 O ATOM 896 CB THR A 60 -2.343 5.220 8.335 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.114 5.102 7.610 1.00 0.00 O ATOM 898 CG2 THR A 60 -2.073 5.162 9.815 1.00 0.00 C ATOM 0 H THR A 60 -1.569 3.094 7.200 1.00 0.00 H new ATOM 0 HA THR A 60 -3.813 3.797 8.829 1.00 0.00 H new ATOM 0 HB THR A 60 -2.812 6.176 8.103 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.669 5.975 7.575 1.00 0.00 H new ATOM 0 HG21 THR A 60 -1.403 5.975 10.095 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.012 5.261 10.360 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.608 4.208 10.063 1.00 0.00 H new ATOM 906 N LEU A 61 -3.991 4.369 5.653 1.00 0.00 N ATOM 907 CA LEU A 61 -4.840 4.717 4.541 1.00 0.00 C ATOM 908 C LEU A 61 -6.145 3.933 4.621 1.00 0.00 C ATOM 909 O LEU A 61 -7.194 4.534 4.777 1.00 0.00 O ATOM 910 CB LEU A 61 -4.066 4.461 3.213 1.00 0.00 C ATOM 911 CG LEU A 61 -4.644 4.954 1.861 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.643 4.712 0.758 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.928 4.266 1.486 1.00 0.00 C ATOM 0 H LEU A 61 -3.099 3.963 5.371 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.104 5.774 4.574 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.079 4.909 3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.920 3.384 3.128 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.851 6.017 1.984 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.054 5.060 -0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.723 5.255 0.976 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.427 3.646 0.690 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -6.283 4.653 0.531 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.754 3.193 1.401 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.678 4.452 2.254 1.00 0.00 H new ATOM 925 N VAL A 62 -6.052 2.594 4.612 1.00 0.00 N ATOM 926 CA VAL A 62 -7.249 1.721 4.562 1.00 0.00 C ATOM 927 C VAL A 62 -8.129 1.933 5.758 1.00 0.00 C ATOM 928 O VAL A 62 -9.334 2.154 5.629 1.00 0.00 O ATOM 929 CB VAL A 62 -6.902 0.178 4.414 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.967 -0.330 5.500 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.157 -0.690 4.387 1.00 0.00 C ATOM 0 H VAL A 62 -5.167 2.088 4.638 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.786 2.016 3.660 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.386 0.095 3.457 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.769 -1.390 5.343 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.029 0.224 5.461 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.432 -0.189 6.476 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.873 -1.737 4.285 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.714 -0.554 5.314 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.782 -0.400 3.543 1.00 0.00 H new ATOM 941 N ARG A 63 -7.501 1.938 6.908 1.00 0.00 N ATOM 942 CA ARG A 63 -8.236 2.035 8.162 1.00 0.00 C ATOM 943 C ARG A 63 -8.996 3.366 8.307 1.00 0.00 C ATOM 944 O ARG A 63 -9.983 3.459 9.052 1.00 0.00 O ATOM 945 CB ARG A 63 -7.348 1.744 9.380 1.00 0.00 C ATOM 946 CG ARG A 63 -6.309 2.798 9.698 1.00 0.00 C ATOM 947 CD ARG A 63 -5.351 2.317 10.781 1.00 0.00 C ATOM 948 NE ARG A 63 -6.058 2.005 12.033 1.00 0.00 N ATOM 949 CZ ARG A 63 -5.472 1.650 13.202 1.00 0.00 C ATOM 950 NH1 ARG A 63 -4.134 1.613 13.312 1.00 0.00 N ATOM 951 NH2 ARG A 63 -6.222 1.328 14.243 1.00 0.00 N ATOM 0 H ARG A 63 -6.488 1.877 7.010 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.994 1.252 8.128 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.989 1.616 10.252 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.838 0.794 9.217 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.749 3.044 8.796 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.803 3.713 10.026 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.822 1.431 10.431 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.599 3.084 10.969 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.076 2.061 12.020 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.550 1.853 12.511 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.702 1.345 14.196 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.239 1.347 14.164 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.784 1.060 15.124 1.00 0.00 H new ATOM 965 N ALA A 64 -8.563 4.384 7.597 1.00 0.00 N ATOM 966 CA ALA A 64 -9.282 5.641 7.653 1.00 0.00 C ATOM 967 C ALA A 64 -10.287 5.758 6.494 1.00 0.00 C ATOM 968 O ALA A 64 -11.469 6.059 6.710 1.00 0.00 O ATOM 969 CB ALA A 64 -8.320 6.821 7.639 1.00 0.00 C ATOM 0 H ALA A 64 -7.743 4.372 6.991 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.838 5.660 8.591 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.885 7.752 7.682 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.656 6.760 8.501 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.729 6.797 6.724 1.00 0.00 H new ATOM 975 N VAL A 65 -9.789 5.572 5.306 1.00 0.00 N ATOM 976 CA VAL A 65 -10.609 5.752 4.084 1.00 0.00 C ATOM 977 C VAL A 65 -11.927 4.929 4.047 1.00 0.00 C ATOM 978 O VAL A 65 -12.968 5.463 3.705 1.00 0.00 O ATOM 979 CB VAL A 65 -9.814 5.584 2.762 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.645 6.559 2.708 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.338 4.153 2.576 1.00 0.00 C ATOM 0 H VAL A 65 -8.823 5.296 5.129 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.908 6.798 4.155 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.489 5.814 1.938 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.101 6.424 1.773 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.020 7.581 2.765 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.975 6.371 3.547 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.785 4.072 1.640 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.689 3.875 3.406 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.198 3.484 2.548 1.00 0.00 H new ATOM 991 N LEU A 66 -11.889 3.668 4.430 1.00 0.00 N ATOM 992 CA LEU A 66 -13.078 2.846 4.393 1.00 0.00 C ATOM 993 C LEU A 66 -13.235 2.123 5.721 1.00 0.00 C ATOM 994 O LEU A 66 -12.386 2.272 6.613 1.00 0.00 O ATOM 995 CB LEU A 66 -13.072 1.881 3.158 1.00 0.00 C ATOM 996 CG LEU A 66 -14.196 2.141 2.112 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.035 1.341 0.830 1.00 0.00 C ATOM 998 CD2 LEU A 66 -15.583 1.904 2.713 1.00 0.00 C ATOM 0 H LEU A 66 -11.052 3.194 4.768 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.954 3.480 4.258 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.106 1.961 2.658 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.161 0.856 3.517 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.098 3.192 1.838 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.854 1.574 0.150 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.087 1.598 0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -14.048 0.276 1.062 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -16.345 2.094 1.957 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.660 0.872 3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.734 2.577 3.557 1.00 0.00 H new ATOM 1010 N SER A 67 -14.298 1.366 5.878 1.00 0.00 N ATOM 1011 CA SER A 67 -14.570 0.712 7.115 1.00 0.00 C ATOM 1012 C SER A 67 -15.570 -0.418 6.869 1.00 0.00 C ATOM 1013 O SER A 67 -16.266 -0.429 5.839 1.00 0.00 O ATOM 1014 CB SER A 67 -15.119 1.743 8.139 1.00 0.00 C ATOM 1015 OG SER A 67 -15.311 1.171 9.427 1.00 0.00 O ATOM 0 H SER A 67 -14.989 1.194 5.148 1.00 0.00 H new ATOM 0 HA SER A 67 -13.657 0.283 7.528 1.00 0.00 H new ATOM 0 HB2 SER A 67 -14.426 2.581 8.215 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.066 2.144 7.777 1.00 0.00 H new ATOM 0 HG SER A 67 -15.655 1.854 10.040 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.592 -1.385 7.767 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.530 -2.470 7.686 1.00 0.00 C ATOM 1023 C GLY A 68 -16.008 -3.608 6.867 1.00 0.00 C ATOM 1024 O GLY A 68 -15.188 -4.405 7.335 1.00 0.00 O ATOM 0 H GLY A 68 -14.960 -1.434 8.566 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.761 -2.824 8.691 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.463 -2.110 7.252 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.461 -3.671 5.641 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.071 -4.726 4.728 1.00 0.00 C ATOM 1030 C GLY A 69 -14.657 -4.566 4.226 1.00 0.00 C ATOM 1031 O GLY A 69 -14.050 -5.536 3.759 1.00 0.00 O ATOM 0 H GLY A 69 -17.112 -2.994 5.243 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.168 -5.689 5.229 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.755 -4.738 3.879 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.151 -3.338 4.326 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.812 -2.900 3.801 1.00 0.00 C ATOM 1037 C ASP A 70 -11.759 -3.929 4.148 1.00 0.00 C ATOM 1038 O ASP A 70 -11.050 -4.450 3.280 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.410 -1.501 4.392 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.055 -1.525 5.882 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.850 -2.071 6.690 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.966 -1.106 6.266 1.00 0.00 O ATOM 0 H ASP A 70 -14.658 -2.581 4.784 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.882 -2.808 2.717 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.557 -1.115 3.833 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.234 -0.804 4.238 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.775 -4.283 5.389 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.931 -5.236 5.986 1.00 0.00 C ATOM 1049 C HIS A 71 -11.033 -6.595 5.313 1.00 0.00 C ATOM 1050 O HIS A 71 -10.041 -7.138 4.857 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.305 -5.340 7.445 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.646 -4.346 8.350 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -11.022 -3.020 8.448 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.622 -4.506 9.221 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.264 -2.419 9.339 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.410 -3.299 9.821 1.00 0.00 N ATOM 0 H HIS A 71 -12.433 -3.876 6.054 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.896 -4.913 5.874 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -12.385 -5.227 7.534 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.060 -6.343 7.795 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -11.769 -2.577 7.914 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -9.075 -5.419 9.406 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.330 -1.380 9.627 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.228 -7.116 5.204 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.403 -8.445 4.684 1.00 0.00 C ATOM 1067 C LEU A 72 -11.908 -8.653 3.248 1.00 0.00 C ATOM 1068 O LEU A 72 -11.113 -9.556 3.020 1.00 0.00 O ATOM 1069 CB LEU A 72 -13.770 -9.102 5.055 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.074 -8.307 4.821 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.504 -8.328 3.376 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.193 -8.808 5.725 1.00 0.00 C ATOM 0 H LEU A 72 -13.091 -6.641 5.468 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.691 -9.053 5.242 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.849 -10.034 4.496 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -13.731 -9.366 6.112 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.861 -7.270 5.079 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.425 -7.756 3.262 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.723 -7.886 2.758 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.675 -9.358 3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.098 -8.230 5.538 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.385 -9.861 5.517 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -15.898 -8.692 6.768 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.279 -7.816 2.295 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.735 -8.042 0.949 1.00 0.00 C ATOM 1086 C LEU A 73 -10.402 -7.358 0.665 1.00 0.00 C ATOM 1087 O LEU A 73 -9.459 -8.044 0.305 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.723 -7.891 -0.200 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.487 -9.158 -0.650 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -12.538 -10.238 -1.129 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.396 -9.699 0.430 1.00 0.00 C ATOM 0 H LEU A 73 -12.911 -7.022 2.403 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.515 -9.109 0.986 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.457 -7.137 0.084 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.181 -7.500 -1.061 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.116 -8.853 -1.486 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.109 -11.114 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.960 -9.866 -1.975 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.861 -10.513 -0.320 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.908 -10.588 0.063 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.804 -9.958 1.308 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.132 -8.941 0.699 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.319 -6.027 0.833 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.065 -5.300 0.626 1.00 0.00 C ATOM 1105 C TRP A 74 -7.936 -5.976 1.440 1.00 0.00 C ATOM 1106 O TRP A 74 -6.872 -6.281 0.963 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.174 -3.807 1.104 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.932 -2.733 0.264 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.943 -2.842 -0.669 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.636 -1.351 0.324 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.340 -1.582 -1.101 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.547 -0.653 -0.493 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.700 -0.660 1.020 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.536 0.733 -0.606 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.662 0.731 0.914 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.596 1.414 0.112 1.00 0.00 C ATOM 0 H TRP A 74 -11.105 -5.439 1.111 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.849 -5.318 -0.442 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.639 -3.824 2.090 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.155 -3.443 1.238 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.366 -3.774 -1.014 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -12.094 -1.386 -1.759 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.992 -1.180 1.649 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.243 1.250 -1.237 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.909 1.288 1.452 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.568 2.493 0.064 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.225 -6.232 2.646 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.228 -6.673 3.587 1.00 0.00 C ATOM 1129 C LYS A 75 -6.961 -8.158 3.682 1.00 0.00 C ATOM 1130 O LYS A 75 -5.800 -8.546 3.770 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.310 -5.928 4.890 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.203 -4.437 4.651 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.792 -4.019 4.231 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.869 -3.942 5.482 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.510 -3.458 5.192 1.00 0.00 N ATOM 0 H LYS A 75 -9.164 -6.148 3.036 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.285 -6.374 3.130 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.252 -6.156 5.389 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.510 -6.255 5.554 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.913 -4.143 3.878 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.483 -3.904 5.560 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.389 -4.735 3.514 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.824 -3.051 3.731 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.328 -3.285 6.220 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.803 -4.932 5.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.057 -3.145 6.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.951 -4.226 4.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.560 -2.660 4.527 1.00 0.00 H new ATOM 1149 N SER A 76 -7.982 -9.007 3.634 1.00 0.00 N ATOM 1150 CA SER A 76 -7.687 -10.421 3.714 1.00 0.00 C ATOM 1151 C SER A 76 -7.025 -10.850 2.425 1.00 0.00 C ATOM 1152 O SER A 76 -6.121 -11.695 2.428 1.00 0.00 O ATOM 1153 CB SER A 76 -8.916 -11.237 4.024 1.00 0.00 C ATOM 1154 OG SER A 76 -9.546 -10.730 5.202 1.00 0.00 O ATOM 0 H SER A 76 -8.967 -8.756 3.545 1.00 0.00 H new ATOM 0 HA SER A 76 -7.002 -10.601 4.542 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.610 -11.200 3.184 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.644 -12.283 4.167 1.00 0.00 H new ATOM 0 HG SER A 76 -10.345 -11.261 5.400 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.400 -10.198 1.315 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.713 -10.452 0.087 1.00 0.00 C ATOM 1162 C GLU A 77 -5.333 -9.849 0.128 1.00 0.00 C ATOM 1163 O GLU A 77 -4.473 -10.295 -0.581 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.451 -9.954 -1.147 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.713 -10.718 -1.524 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.434 -12.169 -1.842 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.829 -12.450 -2.904 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.837 -13.049 -1.073 1.00 0.00 O ATOM 0 H GLU A 77 -8.155 -9.514 1.263 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.654 -11.537 -0.003 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.716 -8.909 -0.990 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.765 -9.985 -1.993 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.429 -10.660 -0.704 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.178 -10.242 -2.387 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.110 -8.803 0.953 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.763 -8.267 1.091 1.00 0.00 C ATOM 1177 C PHE A 78 -2.886 -9.307 1.681 1.00 0.00 C ATOM 1178 O PHE A 78 -1.798 -9.551 1.192 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.741 -6.992 1.956 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.387 -6.351 2.054 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.876 -5.650 0.982 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.627 -6.445 3.207 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.632 -5.046 1.045 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.379 -5.848 3.280 1.00 0.00 C ATOM 1185 CZ PHE A 78 0.117 -5.147 2.192 1.00 0.00 C ATOM 0 H PHE A 78 -5.825 -8.335 1.510 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.398 -7.990 0.102 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.445 -6.271 1.542 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.090 -7.238 2.959 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.458 -5.571 0.076 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.010 -6.989 4.058 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.252 -4.498 0.196 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.207 -5.929 4.184 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.090 -4.681 2.246 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.397 -9.955 2.686 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.666 -10.975 3.390 1.00 0.00 C ATOM 1197 C PHE A 79 -2.313 -12.107 2.422 1.00 0.00 C ATOM 1198 O PHE A 79 -1.128 -12.517 2.288 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.504 -11.521 4.555 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.951 -10.477 5.565 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -3.178 -9.350 5.833 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -5.169 -10.605 6.213 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -3.620 -8.391 6.723 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -5.610 -9.643 7.094 1.00 0.00 C ATOM 1205 CZ PHE A 79 -4.838 -8.540 7.349 1.00 0.00 C ATOM 0 H PHE A 79 -4.338 -9.792 3.045 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.750 -10.545 3.794 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.387 -12.014 4.149 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.924 -12.284 5.075 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -2.225 -9.225 5.341 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.783 -11.473 6.024 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -3.010 -7.524 6.928 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.565 -9.758 7.584 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.185 -7.787 8.041 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.312 -12.550 1.697 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.152 -13.637 0.767 1.00 0.00 C ATOM 1217 C GLU A 80 -2.259 -13.281 -0.407 1.00 0.00 C ATOM 1218 O GLU A 80 -1.303 -13.984 -0.665 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.496 -14.135 0.280 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.378 -14.703 1.379 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.764 -15.900 2.064 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -3.972 -15.734 3.017 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -5.084 -17.047 1.686 1.00 0.00 O ATOM 0 H GLU A 80 -4.256 -12.167 1.736 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.654 -14.439 1.312 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.022 -13.314 -0.206 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.335 -14.903 -0.477 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.573 -13.927 2.119 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.341 -14.988 0.955 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.549 -12.181 -1.077 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.817 -11.767 -2.297 1.00 0.00 C ATOM 1232 C ASN A 81 -0.356 -11.538 -2.044 1.00 0.00 C ATOM 1233 O ASN A 81 0.497 -11.945 -2.846 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.414 -10.506 -2.941 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.774 -10.724 -3.595 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -4.096 -11.827 -4.070 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.571 -9.693 -3.644 1.00 0.00 N ATOM 0 H ASN A 81 -3.294 -11.539 -0.805 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.927 -12.603 -2.987 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.509 -9.732 -2.179 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.718 -10.130 -3.691 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.489 -9.778 -4.081 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.277 -8.802 -3.245 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.046 -10.910 -0.924 1.00 0.00 N ATOM 1245 CA CYS A 82 1.319 -10.590 -0.619 1.00 0.00 C ATOM 1246 C CYS A 82 2.122 -11.852 -0.364 1.00 0.00 C ATOM 1247 O CYS A 82 3.151 -12.058 -0.978 1.00 0.00 O ATOM 1248 CB CYS A 82 1.416 -9.605 0.548 1.00 0.00 C ATOM 1249 SG CYS A 82 0.803 -10.204 2.135 1.00 0.00 S ATOM 0 H CYS A 82 -0.723 -10.617 -0.220 1.00 0.00 H new ATOM 0 HA CYS A 82 1.753 -10.093 -1.487 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.460 -9.316 0.669 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.864 -8.703 0.284 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.454 -9.897 2.259 1.00 0.00 H new ATOM 1255 N ARG A 83 1.626 -12.743 0.494 1.00 0.00 N ATOM 1256 CA ARG A 83 2.375 -13.964 0.764 1.00 0.00 C ATOM 1257 C ARG A 83 2.319 -14.970 -0.378 1.00 0.00 C ATOM 1258 O ARG A 83 3.212 -15.810 -0.511 1.00 0.00 O ATOM 1259 CB ARG A 83 2.087 -14.570 2.133 1.00 0.00 C ATOM 1260 CG ARG A 83 3.116 -14.174 3.211 1.00 0.00 C ATOM 1261 CD ARG A 83 3.267 -12.666 3.396 1.00 0.00 C ATOM 1262 NE ARG A 83 4.300 -12.325 4.420 1.00 0.00 N ATOM 1263 CZ ARG A 83 4.207 -12.561 5.744 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.089 -13.070 6.268 1.00 0.00 N ATOM 1265 NH2 ARG A 83 5.240 -12.252 6.540 1.00 0.00 N ATOM 0 H ARG A 83 0.743 -12.648 0.996 1.00 0.00 H new ATOM 0 HA ARG A 83 3.418 -13.653 0.816 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.094 -14.258 2.458 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.066 -15.656 2.043 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.822 -14.619 4.161 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.085 -14.597 2.947 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.537 -12.210 2.444 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.309 -12.240 3.693 1.00 0.00 H new ATOM 0 HE ARG A 83 5.152 -11.873 4.088 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.295 -13.284 5.665 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.029 -13.245 7.271 1.00 0.00 H new ATOM 0 HH21 ARG A 83 6.085 -11.843 6.143 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.181 -12.426 7.543 1.00 0.00 H new ATOM 1279 N ASP A 84 1.289 -14.875 -1.185 1.00 0.00 N ATOM 1280 CA ASP A 84 1.138 -15.698 -2.404 1.00 0.00 C ATOM 1281 C ASP A 84 2.285 -15.402 -3.364 1.00 0.00 C ATOM 1282 O ASP A 84 3.064 -16.309 -3.791 1.00 0.00 O ATOM 1283 CB ASP A 84 -0.183 -15.342 -3.110 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.421 -16.099 -4.387 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.960 -17.209 -4.348 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.066 -15.588 -5.463 1.00 0.00 O ATOM 0 H ASP A 84 0.517 -14.226 -1.030 1.00 0.00 H new ATOM 0 HA ASP A 84 1.142 -16.751 -2.121 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.011 -15.534 -2.427 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.190 -14.274 -3.327 1.00 0.00 H new ATOM 1291 N THR A 85 2.433 -14.136 -3.669 1.00 0.00 N ATOM 1292 CA THR A 85 3.451 -13.727 -4.563 1.00 0.00 C ATOM 1293 C THR A 85 4.815 -13.900 -3.871 1.00 0.00 C ATOM 1294 O THR A 85 5.808 -14.214 -4.517 1.00 0.00 O ATOM 1295 CB THR A 85 3.215 -12.270 -5.099 1.00 0.00 C ATOM 1296 OG1 THR A 85 3.909 -12.077 -6.350 1.00 0.00 O ATOM 1297 CG2 THR A 85 3.687 -11.201 -4.106 1.00 0.00 C ATOM 0 H THR A 85 1.853 -13.381 -3.303 1.00 0.00 H new ATOM 0 HA THR A 85 3.431 -14.359 -5.451 1.00 0.00 H new ATOM 0 HB THR A 85 2.140 -12.159 -5.239 1.00 0.00 H new ATOM 0 HG1 THR A 85 3.346 -11.555 -6.959 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.502 -10.211 -4.522 1.00 0.00 H new ATOM 0 HG22 THR A 85 3.141 -11.308 -3.169 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.754 -11.323 -3.920 1.00 0.00 H new ATOM 1305 N ALA A 86 4.819 -13.783 -2.530 1.00 0.00 N ATOM 1306 CA ALA A 86 6.011 -13.953 -1.728 1.00 0.00 C ATOM 1307 C ALA A 86 6.590 -15.340 -1.839 1.00 0.00 C ATOM 1308 O ALA A 86 7.793 -15.475 -1.990 1.00 0.00 O ATOM 1309 CB ALA A 86 5.773 -13.598 -0.285 1.00 0.00 C ATOM 0 H ALA A 86 3.984 -13.567 -1.985 1.00 0.00 H new ATOM 0 HA ALA A 86 6.745 -13.257 -2.134 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.694 -13.740 0.281 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.460 -12.556 -0.213 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.993 -14.240 0.124 1.00 0.00 H new ATOM 1315 N LYS A 87 5.757 -16.375 -1.791 1.00 0.00 N ATOM 1316 CA LYS A 87 6.278 -17.721 -1.939 1.00 0.00 C ATOM 1317 C LYS A 87 6.804 -17.899 -3.344 1.00 0.00 C ATOM 1318 O LYS A 87 7.788 -18.599 -3.565 1.00 0.00 O ATOM 1319 CB LYS A 87 5.259 -18.810 -1.551 1.00 0.00 C ATOM 1320 CG LYS A 87 3.912 -18.714 -2.243 1.00 0.00 C ATOM 1321 CD LYS A 87 3.009 -19.880 -1.885 1.00 0.00 C ATOM 1322 CE LYS A 87 3.616 -21.206 -2.340 1.00 0.00 C ATOM 1323 NZ LYS A 87 2.699 -22.335 -2.142 1.00 0.00 N ATOM 0 H LYS A 87 4.748 -16.309 -1.655 1.00 0.00 H new ATOM 0 HA LYS A 87 7.100 -17.847 -1.234 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.693 -19.785 -1.771 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.099 -18.768 -0.474 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.426 -17.779 -1.964 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.059 -18.687 -3.323 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.848 -19.901 -0.807 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.033 -19.744 -2.351 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.883 -21.138 -3.395 1.00 0.00 H new ATOM 0 HE3 LYS A 87 4.538 -21.389 -1.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.154 -23.213 -2.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 2.464 -22.418 -1.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 1.829 -22.175 -2.688 1.00 0.00 H new ATOM 1337 N ARG A 88 6.205 -17.179 -4.302 1.00 0.00 N ATOM 1338 CA ARG A 88 6.719 -17.238 -5.670 1.00 0.00 C ATOM 1339 C ARG A 88 8.075 -16.558 -5.794 1.00 0.00 C ATOM 1340 O ARG A 88 8.887 -16.913 -6.642 1.00 0.00 O ATOM 1341 CB ARG A 88 5.754 -16.681 -6.713 1.00 0.00 C ATOM 1342 CG ARG A 88 4.778 -17.695 -7.264 1.00 0.00 C ATOM 1343 CD ARG A 88 3.863 -18.221 -6.192 1.00 0.00 C ATOM 1344 NE ARG A 88 2.946 -19.250 -6.676 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.689 -19.387 -6.275 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.184 -18.518 -5.394 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.943 -20.390 -6.750 1.00 0.00 N ATOM 0 H ARG A 88 5.397 -16.573 -4.162 1.00 0.00 H new ATOM 0 HA ARG A 88 6.835 -18.301 -5.883 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.193 -15.859 -6.269 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.331 -16.264 -7.538 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.186 -17.238 -8.057 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.327 -18.523 -7.713 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.463 -18.630 -5.379 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.286 -17.394 -5.777 1.00 0.00 H new ATOM 0 HE ARG A 88 3.297 -19.909 -7.371 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.764 -17.759 -5.037 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.219 -18.614 -5.079 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.341 -21.049 -7.420 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.024 -20.497 -6.443 1.00 0.00 H new ATOM 1361 N ASN A 89 8.327 -15.614 -4.928 1.00 0.00 N ATOM 1362 CA ASN A 89 9.570 -14.884 -4.960 1.00 0.00 C ATOM 1363 C ASN A 89 10.639 -15.692 -4.234 1.00 0.00 C ATOM 1364 O ASN A 89 11.787 -15.741 -4.658 1.00 0.00 O ATOM 1365 CB ASN A 89 9.381 -13.516 -4.311 1.00 0.00 C ATOM 1366 CG ASN A 89 10.421 -12.482 -4.724 1.00 0.00 C ATOM 1367 OD1 ASN A 89 11.572 -12.788 -4.939 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.978 -11.246 -4.873 1.00 0.00 N ATOM 0 H ASN A 89 7.686 -15.330 -4.187 1.00 0.00 H new ATOM 0 HA ASN A 89 9.887 -14.728 -5.991 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.390 -13.140 -4.564 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.411 -13.633 -3.228 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.614 -10.510 -5.179 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.000 -11.028 -4.682 1.00 0.00 H new ATOM 1375 N GLN A 90 10.228 -16.384 -3.153 1.00 0.00 N ATOM 1376 CA GLN A 90 11.152 -17.210 -2.360 1.00 0.00 C ATOM 1377 C GLN A 90 11.642 -18.377 -3.185 1.00 0.00 C ATOM 1378 O GLN A 90 12.827 -18.695 -3.167 1.00 0.00 O ATOM 1379 CB GLN A 90 10.531 -17.748 -1.058 1.00 0.00 C ATOM 1380 CG GLN A 90 9.888 -16.716 -0.135 1.00 0.00 C ATOM 1381 CD GLN A 90 10.729 -15.481 0.077 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.582 -15.422 0.953 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.436 -14.466 -0.688 1.00 0.00 N ATOM 0 H GLN A 90 9.267 -16.386 -2.812 1.00 0.00 H new ATOM 0 HA GLN A 90 11.978 -16.556 -2.081 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.776 -18.489 -1.320 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.308 -18.269 -0.499 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.924 -16.421 -0.550 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.690 -17.180 0.831 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.718 -14.559 -1.406 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.925 -13.579 -0.568 1.00 0.00 H new ATOM 1392 N GLN A 91 10.736 -19.005 -3.934 1.00 0.00 N ATOM 1393 CA GLN A 91 11.118 -20.130 -4.798 1.00 0.00 C ATOM 1394 C GLN A 91 11.996 -19.665 -5.969 1.00 0.00 C ATOM 1395 O GLN A 91 12.716 -20.466 -6.575 1.00 0.00 O ATOM 1396 CB GLN A 91 9.887 -20.864 -5.332 1.00 0.00 C ATOM 1397 CG GLN A 91 8.992 -20.037 -6.229 1.00 0.00 C ATOM 1398 CD GLN A 91 7.824 -20.824 -6.764 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.903 -21.431 -7.823 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.758 -20.861 -6.035 1.00 0.00 N ATOM 0 H GLN A 91 9.746 -18.762 -3.963 1.00 0.00 H new ATOM 0 HA GLN A 91 11.696 -20.820 -4.184 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.218 -21.744 -5.884 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.299 -21.221 -4.486 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.621 -19.176 -5.673 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.577 -19.650 -7.063 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.723 -20.344 -5.157 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.952 -21.407 -6.338 1.00 0.00 H new ATOM 1409 N ALA A 92 11.907 -18.389 -6.296 1.00 0.00 N ATOM 1410 CA ALA A 92 12.733 -17.797 -7.343 1.00 0.00 C ATOM 1411 C ALA A 92 14.071 -17.377 -6.754 1.00 0.00 C ATOM 1412 O ALA A 92 15.066 -17.227 -7.479 1.00 0.00 O ATOM 1413 CB ALA A 92 12.026 -16.610 -7.975 1.00 0.00 C ATOM 0 H ALA A 92 11.266 -17.734 -5.849 1.00 0.00 H new ATOM 0 HA ALA A 92 12.905 -18.537 -8.125 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.658 -16.182 -8.753 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.083 -16.939 -8.413 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.829 -15.856 -7.213 1.00 0.00 H new ATOM 1419 N GLY A 93 14.085 -17.203 -5.429 1.00 0.00 N ATOM 1420 CA GLY A 93 15.283 -16.849 -4.706 1.00 0.00 C ATOM 1421 C GLY A 93 15.804 -15.490 -5.086 1.00 0.00 C ATOM 1422 O GLY A 93 16.976 -15.349 -5.422 1.00 0.00 O ATOM 0 H GLY A 93 13.260 -17.306 -4.839 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.077 -16.870 -3.636 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.053 -17.596 -4.897 1.00 0.00 H new ATOM 1426 N ASN A 94 14.958 -14.492 -5.042 1.00 0.00 N ATOM 1427 CA ASN A 94 15.381 -13.140 -5.427 1.00 0.00 C ATOM 1428 C ASN A 94 15.834 -12.356 -4.227 1.00 0.00 C ATOM 1429 O ASN A 94 16.753 -11.544 -4.316 1.00 0.00 O ATOM 1430 CB ASN A 94 14.260 -12.380 -6.120 1.00 0.00 C ATOM 1431 CG ASN A 94 13.879 -12.937 -7.468 1.00 0.00 C ATOM 1432 OD1 ASN A 94 14.705 -13.480 -8.195 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.619 -12.839 -7.800 1.00 0.00 N ATOM 0 H ASN A 94 13.984 -14.572 -4.750 1.00 0.00 H new ATOM 0 HA ASN A 94 16.213 -13.255 -6.122 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.381 -12.384 -5.476 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.562 -11.340 -6.241 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.295 -13.221 -8.688 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.960 -12.381 -7.171 1.00 0.00 H new ATOM 1440 N GLY A 95 15.199 -12.608 -3.109 1.00 0.00 N ATOM 1441 CA GLY A 95 15.532 -11.911 -1.878 1.00 0.00 C ATOM 1442 C GLY A 95 14.553 -10.808 -1.582 1.00 0.00 C ATOM 1443 O GLY A 95 14.903 -9.805 -0.939 1.00 0.00 O ATOM 0 H GLY A 95 14.446 -13.291 -3.020 1.00 0.00 H new ATOM 0 HA2 GLY A 95 15.543 -12.620 -1.050 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.537 -11.495 -1.955 1.00 0.00 H new ATOM 1447 N TRP A 96 13.320 -10.994 -2.028 1.00 0.00 N ATOM 1448 CA TRP A 96 12.280 -10.002 -1.856 1.00 0.00 C ATOM 1449 C TRP A 96 10.990 -10.645 -1.411 1.00 0.00 C ATOM 1450 O TRP A 96 10.917 -11.868 -1.235 1.00 0.00 O ATOM 1451 CB TRP A 96 12.015 -9.174 -3.124 1.00 0.00 C ATOM 1452 CG TRP A 96 13.135 -8.279 -3.516 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.691 -7.296 -2.754 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.816 -8.252 -4.771 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.689 -6.672 -3.443 1.00 0.00 N ATOM 1456 CE2 TRP A 96 14.787 -7.239 -4.696 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.697 -8.989 -5.950 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 15.650 -6.954 -5.756 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 14.550 -8.703 -7.000 1.00 0.00 C ATOM 1460 CH2 TRP A 96 15.510 -7.693 -6.902 1.00 0.00 C ATOM 0 H TRP A 96 13.017 -11.836 -2.518 1.00 0.00 H new ATOM 0 HA TRP A 96 12.647 -9.322 -1.087 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.802 -9.853 -3.949 1.00 0.00 H new ATOM 0 HB3 TRP A 96 11.120 -8.571 -2.969 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.385 -7.047 -1.749 1.00 0.00 H new ATOM 0 HE1 TRP A 96 15.268 -5.910 -3.089 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.954 -9.767 -6.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 16.400 -6.181 -5.676 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 14.472 -9.272 -7.915 1.00 0.00 H new ATOM 0 HH2 TRP A 96 16.154 -7.491 -7.745 1.00 0.00 H new ATOM 1471 N ASP A 97 10.016 -9.803 -1.167 1.00 0.00 N ATOM 1472 CA ASP A 97 8.654 -10.178 -0.841 1.00 0.00 C ATOM 1473 C ASP A 97 8.384 -10.520 0.595 1.00 0.00 C ATOM 1474 O ASP A 97 8.245 -9.635 1.375 1.00 0.00 O ATOM 1475 CB ASP A 97 7.972 -11.165 -1.798 1.00 0.00 C ATOM 1476 CG ASP A 97 7.351 -10.509 -3.026 1.00 0.00 C ATOM 1477 OD1 ASP A 97 6.720 -9.480 -2.884 1.00 0.00 O ATOM 1478 OD2 ASP A 97 7.475 -11.062 -4.147 1.00 0.00 O ATOM 0 H ASP A 97 10.153 -8.792 -1.190 1.00 0.00 H new ATOM 0 HA ASP A 97 8.161 -9.221 -1.011 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.704 -11.904 -2.124 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.196 -11.704 -1.255 1.00 0.00 H new ATOM 1483 N PHE A 98 8.486 -11.795 0.953 1.00 0.00 N ATOM 1484 CA PHE A 98 7.920 -12.356 2.216 1.00 0.00 C ATOM 1485 C PHE A 98 7.997 -11.446 3.482 1.00 0.00 C ATOM 1486 O PHE A 98 6.986 -11.246 4.164 1.00 0.00 O ATOM 1487 CB PHE A 98 8.495 -13.756 2.496 1.00 0.00 C ATOM 1488 CG PHE A 98 7.932 -14.405 3.729 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.666 -14.938 3.719 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.658 -14.449 4.900 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.139 -15.521 4.849 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.138 -15.031 6.025 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.876 -15.560 6.003 1.00 0.00 C ATOM 0 H PHE A 98 8.965 -12.491 0.382 1.00 0.00 H new ATOM 0 HA PHE A 98 6.850 -12.421 2.020 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.300 -14.398 1.637 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.578 -13.681 2.598 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.078 -14.899 2.814 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.648 -14.019 4.930 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.147 -15.947 4.826 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.725 -15.073 6.931 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.462 -16.008 6.894 1.00 0.00 H new ATOM 1503 N ASP A 99 9.173 -11.015 3.835 1.00 0.00 N ATOM 1504 CA ASP A 99 9.405 -10.121 4.969 1.00 0.00 C ATOM 1505 C ASP A 99 9.332 -8.651 4.567 1.00 0.00 C ATOM 1506 O ASP A 99 8.655 -7.886 5.201 1.00 0.00 O ATOM 1507 CB ASP A 99 10.734 -10.467 5.612 1.00 0.00 C ATOM 1508 CG ASP A 99 11.006 -9.663 6.828 1.00 0.00 C ATOM 1509 OD1 ASP A 99 10.359 -9.892 7.841 1.00 0.00 O ATOM 1510 OD2 ASP A 99 11.895 -8.799 6.800 1.00 0.00 O ATOM 0 H ASP A 99 10.027 -11.272 3.341 1.00 0.00 H new ATOM 0 HA ASP A 99 8.609 -10.268 5.699 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.743 -11.526 5.871 1.00 0.00 H new ATOM 0 HB3 ASP A 99 11.535 -10.309 4.890 1.00 0.00 H new ATOM 1515 N MET A 100 10.004 -8.263 3.483 1.00 0.00 N ATOM 1516 CA MET A 100 10.029 -6.831 3.056 1.00 0.00 C ATOM 1517 C MET A 100 8.636 -6.305 2.773 1.00 0.00 C ATOM 1518 O MET A 100 8.287 -5.172 3.117 1.00 0.00 O ATOM 1519 CB MET A 100 10.965 -6.607 1.871 1.00 0.00 C ATOM 1520 CG MET A 100 12.424 -6.855 2.171 1.00 0.00 C ATOM 1521 SD MET A 100 13.463 -6.592 0.736 1.00 0.00 S ATOM 1522 CE MET A 100 15.082 -6.860 1.445 1.00 0.00 C ATOM 0 H MET A 100 10.535 -8.894 2.883 1.00 0.00 H new ATOM 0 HA MET A 100 10.428 -6.257 3.893 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.659 -7.260 1.054 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.848 -5.582 1.521 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.745 -6.194 2.976 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.551 -7.877 2.527 1.00 0.00 H new ATOM 0 HE1 MET A 100 15.847 -6.561 0.728 1.00 0.00 H new ATOM 0 HE2 MET A 100 15.184 -6.267 2.354 1.00 0.00 H new ATOM 0 HE3 MET A 100 15.203 -7.916 1.686 1.00 0.00 H new ATOM 1532 N LEU A 101 7.864 -7.148 2.208 1.00 0.00 N ATOM 1533 CA LEU A 101 6.500 -6.942 1.949 1.00 0.00 C ATOM 1534 C LEU A 101 5.719 -7.697 3.023 1.00 0.00 C ATOM 1535 O LEU A 101 5.847 -8.910 3.147 1.00 0.00 O ATOM 1536 CB LEU A 101 6.188 -7.409 0.481 1.00 0.00 C ATOM 1537 CG LEU A 101 4.808 -8.027 0.139 1.00 0.00 C ATOM 1538 CD1 LEU A 101 4.453 -7.741 -1.317 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.878 -9.549 0.322 1.00 0.00 C ATOM 0 H LEU A 101 8.193 -8.061 1.894 1.00 0.00 H new ATOM 0 HA LEU A 101 6.207 -5.893 2.001 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.326 -6.546 -0.170 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.948 -8.141 0.206 1.00 0.00 H new ATOM 0 HG LEU A 101 4.055 -7.593 0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.482 -8.179 -1.548 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.412 -6.664 -1.477 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.211 -8.176 -1.968 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.910 -9.989 0.083 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.638 -9.961 -0.342 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.136 -9.780 1.356 1.00 0.00 H new ATOM 1551 N THR A 102 5.079 -6.948 3.902 1.00 0.00 N ATOM 1552 CA THR A 102 4.160 -7.522 4.886 1.00 0.00 C ATOM 1553 C THR A 102 4.810 -8.085 6.190 1.00 0.00 C ATOM 1554 O THR A 102 4.217 -7.966 7.272 1.00 0.00 O ATOM 1555 CB THR A 102 3.256 -8.577 4.201 1.00 0.00 C ATOM 1556 OG1 THR A 102 2.258 -7.950 3.401 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.660 -9.568 5.160 1.00 0.00 C ATOM 0 H THR A 102 5.175 -5.934 3.960 1.00 0.00 H new ATOM 0 HA THR A 102 3.565 -6.683 5.247 1.00 0.00 H new ATOM 0 HB THR A 102 3.904 -9.159 3.546 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.718 -8.635 2.955 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.039 -10.276 4.612 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.459 -10.105 5.671 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.049 -9.042 5.894 1.00 0.00 H new ATOM 1565 N GLY A 103 6.025 -8.594 6.140 1.00 0.00 N ATOM 1566 CA GLY A 103 6.557 -9.259 7.314 1.00 0.00 C ATOM 1567 C GLY A 103 7.160 -8.286 8.270 1.00 0.00 C ATOM 1568 O GLY A 103 6.890 -8.321 9.482 1.00 0.00 O ATOM 0 H GLY A 103 6.644 -8.564 5.330 1.00 0.00 H new ATOM 0 HA2 GLY A 103 5.761 -9.813 7.811 1.00 0.00 H new ATOM 0 HA3 GLY A 103 7.310 -9.987 7.011 1.00 0.00 H new ATOM 1572 N SER A 104 8.024 -7.442 7.726 1.00 0.00 N ATOM 1573 CA SER A 104 8.610 -6.311 8.416 1.00 0.00 C ATOM 1574 C SER A 104 9.480 -6.734 9.642 1.00 0.00 C ATOM 1575 O SER A 104 9.614 -5.977 10.629 1.00 0.00 O ATOM 1576 CB SER A 104 7.439 -5.409 8.803 1.00 0.00 C ATOM 1577 OG SER A 104 7.798 -4.282 9.584 1.00 0.00 O ATOM 0 H SER A 104 8.344 -7.531 6.762 1.00 0.00 H new ATOM 0 HA SER A 104 9.313 -5.783 7.772 1.00 0.00 H new ATOM 0 HB2 SER A 104 6.947 -5.063 7.894 1.00 0.00 H new ATOM 0 HB3 SER A 104 6.709 -6.000 9.355 1.00 0.00 H new ATOM 0 HG SER A 104 8.565 -4.508 10.151 1.00 0.00 H new ATOM 1583 N GLY A 105 10.121 -7.857 9.537 1.00 0.00 N ATOM 1584 CA GLY A 105 10.885 -8.342 10.638 1.00 0.00 C ATOM 1585 C GLY A 105 12.344 -8.595 10.331 1.00 0.00 C ATOM 1586 O GLY A 105 13.200 -7.778 10.664 1.00 0.00 O ATOM 0 H GLY A 105 10.129 -8.449 8.706 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.819 -7.622 11.454 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.436 -9.269 10.994 1.00 0.00 H new ATOM 1590 N ASN A 106 12.622 -9.673 9.641 1.00 0.00 N ATOM 1591 CA ASN A 106 14.007 -10.197 9.527 1.00 0.00 C ATOM 1592 C ASN A 106 14.947 -9.413 8.628 1.00 0.00 C ATOM 1593 O ASN A 106 16.061 -9.100 9.036 1.00 0.00 O ATOM 1594 CB ASN A 106 14.014 -11.669 9.098 1.00 0.00 C ATOM 1595 CG ASN A 106 13.447 -12.608 10.151 1.00 0.00 C ATOM 1596 OD1 ASN A 106 12.247 -12.851 10.208 1.00 0.00 O ATOM 1597 ND2 ASN A 106 14.291 -13.149 10.968 1.00 0.00 N ATOM 0 H ASN A 106 11.923 -10.222 9.141 1.00 0.00 H new ATOM 0 HA ASN A 106 14.400 -10.081 10.537 1.00 0.00 H new ATOM 0 HB2 ASN A 106 13.437 -11.775 8.179 1.00 0.00 H new ATOM 0 HB3 ASN A 106 15.037 -11.968 8.868 1.00 0.00 H new ATOM 0 HD21 ASN A 106 13.964 -13.797 11.684 1.00 0.00 H new ATOM 0 HD22 ASN A 106 15.284 -12.927 10.896 1.00 0.00 H new ATOM 1604 N TYR A 107 14.522 -9.045 7.450 1.00 0.00 N ATOM 1605 CA TYR A 107 15.447 -8.411 6.516 1.00 0.00 C ATOM 1606 C TYR A 107 14.873 -7.167 5.894 1.00 0.00 C ATOM 1607 O TYR A 107 15.355 -6.673 4.874 1.00 0.00 O ATOM 1608 CB TYR A 107 15.988 -9.414 5.456 1.00 0.00 C ATOM 1609 CG TYR A 107 14.944 -10.221 4.672 1.00 0.00 C ATOM 1610 CD1 TYR A 107 14.083 -9.618 3.759 1.00 0.00 C ATOM 1611 CD2 TYR A 107 14.839 -11.593 4.852 1.00 0.00 C ATOM 1612 CE1 TYR A 107 13.151 -10.367 3.053 1.00 0.00 C ATOM 1613 CE2 TYR A 107 13.917 -12.342 4.151 1.00 0.00 C ATOM 1614 CZ TYR A 107 13.077 -11.729 3.255 1.00 0.00 C ATOM 1615 OH TYR A 107 12.142 -12.473 2.566 1.00 0.00 O ATOM 0 H TYR A 107 13.568 -9.164 7.109 1.00 0.00 H new ATOM 0 HA TYR A 107 16.307 -8.086 7.101 1.00 0.00 H new ATOM 0 HB2 TYR A 107 16.595 -8.859 4.741 1.00 0.00 H new ATOM 0 HB3 TYR A 107 16.652 -10.116 5.960 1.00 0.00 H new ATOM 0 HD1 TYR A 107 14.141 -8.552 3.597 1.00 0.00 H new ATOM 0 HD2 TYR A 107 15.493 -12.085 5.556 1.00 0.00 H new ATOM 0 HE1 TYR A 107 12.488 -9.886 2.350 1.00 0.00 H new ATOM 0 HE2 TYR A 107 13.856 -13.409 4.307 1.00 0.00 H new ATOM 0 HH TYR A 107 12.222 -13.416 2.821 1.00 0.00 H new ATOM 1625 N SER A 108 13.883 -6.636 6.521 1.00 0.00 N ATOM 1626 CA SER A 108 13.281 -5.465 6.032 1.00 0.00 C ATOM 1627 C SER A 108 13.469 -4.282 6.961 1.00 0.00 C ATOM 1628 O SER A 108 14.034 -3.249 6.558 1.00 0.00 O ATOM 1629 CB SER A 108 11.825 -5.741 5.789 1.00 0.00 C ATOM 1630 OG SER A 108 11.239 -6.314 6.932 1.00 0.00 O ATOM 0 H SER A 108 13.476 -7.004 7.381 1.00 0.00 H new ATOM 0 HA SER A 108 13.769 -5.188 5.097 1.00 0.00 H new ATOM 0 HB2 SER A 108 11.310 -4.815 5.534 1.00 0.00 H new ATOM 0 HB3 SER A 108 11.712 -6.413 4.938 1.00 0.00 H new ATOM 0 HG SER A 108 11.520 -7.249 7.010 1.00 0.00 H new ATOM 1636 N SER A 109 13.002 -4.436 8.212 1.00 0.00 N ATOM 1637 CA SER A 109 12.940 -3.355 9.170 1.00 0.00 C ATOM 1638 C SER A 109 12.171 -2.204 8.506 1.00 0.00 C ATOM 1639 O SER A 109 11.357 -2.445 7.607 1.00 0.00 O ATOM 1640 CB SER A 109 14.350 -2.940 9.599 1.00 0.00 C ATOM 1641 OG SER A 109 15.065 -4.045 10.146 1.00 0.00 O ATOM 0 H SER A 109 12.658 -5.325 8.574 1.00 0.00 H new ATOM 0 HA SER A 109 12.423 -3.660 10.080 1.00 0.00 H new ATOM 0 HB2 SER A 109 14.892 -2.541 8.742 1.00 0.00 H new ATOM 0 HB3 SER A 109 14.289 -2.141 10.338 1.00 0.00 H new ATOM 0 HG SER A 109 15.963 -3.755 10.411 1.00 0.00 H new ATOM 1647 N THR A 110 12.323 -1.002 8.964 1.00 0.00 N ATOM 1648 CA THR A 110 11.746 0.095 8.244 1.00 0.00 C ATOM 1649 C THR A 110 12.677 0.490 7.060 1.00 0.00 C ATOM 1650 O THR A 110 12.248 1.035 6.047 1.00 0.00 O ATOM 1651 CB THR A 110 11.488 1.300 9.171 1.00 0.00 C ATOM 1652 OG1 THR A 110 10.870 0.824 10.374 1.00 0.00 O ATOM 1653 CG2 THR A 110 10.534 2.275 8.506 1.00 0.00 C ATOM 0 H THR A 110 12.830 -0.755 9.814 1.00 0.00 H new ATOM 0 HA THR A 110 10.780 -0.218 7.846 1.00 0.00 H new ATOM 0 HB THR A 110 12.434 1.799 9.383 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.701 1.579 10.976 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.359 3.122 9.169 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.969 2.630 7.572 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.588 1.775 8.299 1.00 0.00 H new ATOM 1661 N ASP A 111 13.932 0.120 7.172 1.00 0.00 N ATOM 1662 CA ASP A 111 14.947 0.598 6.246 1.00 0.00 C ATOM 1663 C ASP A 111 14.900 -0.028 4.850 1.00 0.00 C ATOM 1664 O ASP A 111 14.742 0.687 3.852 1.00 0.00 O ATOM 1665 CB ASP A 111 16.340 0.441 6.826 1.00 0.00 C ATOM 1666 CG ASP A 111 17.386 1.093 5.937 1.00 0.00 C ATOM 1667 OD1 ASP A 111 17.503 2.352 5.963 1.00 0.00 O ATOM 1668 OD2 ASP A 111 18.078 0.387 5.190 1.00 0.00 O ATOM 0 H ASP A 111 14.280 -0.511 7.894 1.00 0.00 H new ATOM 0 HA ASP A 111 14.709 1.653 6.112 1.00 0.00 H new ATOM 0 HB2 ASP A 111 16.375 0.888 7.820 1.00 0.00 H new ATOM 0 HB3 ASP A 111 16.570 -0.618 6.944 1.00 0.00 H new ATOM 1673 N ALA A 112 14.925 -1.345 4.769 1.00 0.00 N ATOM 1674 CA ALA A 112 15.128 -1.999 3.482 1.00 0.00 C ATOM 1675 C ALA A 112 13.882 -1.930 2.680 1.00 0.00 C ATOM 1676 O ALA A 112 13.902 -2.008 1.462 1.00 0.00 O ATOM 1677 CB ALA A 112 15.589 -3.439 3.654 1.00 0.00 C ATOM 0 H ALA A 112 14.810 -1.977 5.561 1.00 0.00 H new ATOM 0 HA ALA A 112 15.919 -1.471 2.949 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.730 -3.895 2.674 1.00 0.00 H new ATOM 0 HB2 ALA A 112 16.531 -3.456 4.202 1.00 0.00 H new ATOM 0 HB3 ALA A 112 14.836 -3.998 4.210 1.00 0.00 H new ATOM 1683 N GLN A 113 12.794 -1.755 3.364 1.00 0.00 N ATOM 1684 CA GLN A 113 11.575 -1.636 2.701 1.00 0.00 C ATOM 1685 C GLN A 113 11.305 -0.195 2.257 1.00 0.00 C ATOM 1686 O GLN A 113 10.626 0.032 1.293 1.00 0.00 O ATOM 1687 CB GLN A 113 10.455 -2.326 3.463 1.00 0.00 C ATOM 1688 CG GLN A 113 10.160 -1.880 4.885 1.00 0.00 C ATOM 1689 CD GLN A 113 9.226 -0.680 4.983 1.00 0.00 C ATOM 1690 OE1 GLN A 113 8.012 -0.839 5.005 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.760 0.505 5.124 1.00 0.00 N ATOM 0 H GLN A 113 12.746 -1.694 4.381 1.00 0.00 H new ATOM 0 HA GLN A 113 11.627 -2.185 1.761 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.539 -2.210 2.883 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.681 -3.392 3.491 1.00 0.00 H new ATOM 0 HG2 GLN A 113 9.720 -2.714 5.431 1.00 0.00 H new ATOM 0 HG3 GLN A 113 11.100 -1.636 5.379 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.774 0.613 5.102 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.163 1.321 5.256 1.00 0.00 H new ATOM 1700 N MET A 114 11.836 0.789 2.980 1.00 0.00 N ATOM 1701 CA MET A 114 11.754 2.182 2.524 1.00 0.00 C ATOM 1702 C MET A 114 12.639 2.398 1.300 1.00 0.00 C ATOM 1703 O MET A 114 12.282 3.129 0.378 1.00 0.00 O ATOM 1704 CB MET A 114 12.138 3.156 3.654 1.00 0.00 C ATOM 1705 CG MET A 114 12.067 4.623 3.256 1.00 0.00 C ATOM 1706 SD MET A 114 12.497 5.768 4.585 1.00 0.00 S ATOM 1707 CE MET A 114 14.190 5.297 4.942 1.00 0.00 C ATOM 0 H MET A 114 12.320 0.656 3.868 1.00 0.00 H new ATOM 0 HA MET A 114 10.721 2.386 2.242 1.00 0.00 H new ATOM 0 HB2 MET A 114 11.477 2.988 4.505 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.151 2.929 3.987 1.00 0.00 H new ATOM 0 HG2 MET A 114 12.737 4.793 2.413 1.00 0.00 H new ATOM 0 HG3 MET A 114 11.058 4.846 2.911 1.00 0.00 H new ATOM 0 HE1 MET A 114 14.687 6.105 5.478 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.195 4.397 5.556 1.00 0.00 H new ATOM 0 HE3 MET A 114 14.718 5.102 4.009 1.00 0.00 H new ATOM 1717 N GLN A 115 13.773 1.733 1.273 1.00 0.00 N ATOM 1718 CA GLN A 115 14.686 1.812 0.145 1.00 0.00 C ATOM 1719 C GLN A 115 14.527 0.580 -0.698 1.00 0.00 C ATOM 1720 O GLN A 115 15.495 -0.025 -1.146 1.00 0.00 O ATOM 1721 CB GLN A 115 16.130 2.016 0.601 1.00 0.00 C ATOM 1722 CG GLN A 115 16.435 3.440 1.021 1.00 0.00 C ATOM 1723 CD GLN A 115 16.847 3.606 2.473 1.00 0.00 C ATOM 1724 OE1 GLN A 115 17.607 4.489 2.800 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.361 2.777 3.341 1.00 0.00 N ATOM 0 H GLN A 115 14.091 1.124 2.027 1.00 0.00 H new ATOM 0 HA GLN A 115 14.438 2.685 -0.459 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.337 1.347 1.436 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.802 1.732 -0.209 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.232 3.827 0.386 1.00 0.00 H new ATOM 0 HG3 GLN A 115 15.554 4.054 0.837 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.722 2.041 3.041 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.617 2.860 4.325 1.00 0.00 H new ATOM 1734 N TYR A 116 13.272 0.228 -0.881 1.00 0.00 N ATOM 1735 CA TYR A 116 12.854 -0.888 -1.679 1.00 0.00 C ATOM 1736 C TYR A 116 13.382 -0.846 -3.085 1.00 0.00 C ATOM 1737 O TYR A 116 13.476 0.222 -3.716 1.00 0.00 O ATOM 1738 CB TYR A 116 11.312 -1.048 -1.694 1.00 0.00 C ATOM 1739 CG TYR A 116 10.467 0.223 -1.885 1.00 0.00 C ATOM 1740 CD1 TYR A 116 10.922 1.347 -2.573 1.00 0.00 C ATOM 1741 CD2 TYR A 116 9.206 0.280 -1.336 1.00 0.00 C ATOM 1742 CE1 TYR A 116 10.136 2.468 -2.696 1.00 0.00 C ATOM 1743 CE2 TYR A 116 8.422 1.390 -1.450 1.00 0.00 C ATOM 1744 CZ TYR A 116 8.878 2.476 -2.125 1.00 0.00 C ATOM 1745 OH TYR A 116 8.078 3.584 -2.210 1.00 0.00 O ATOM 0 H TYR A 116 12.493 0.734 -0.460 1.00 0.00 H new ATOM 0 HA TYR A 116 13.291 -1.762 -1.195 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.054 -1.746 -2.491 1.00 0.00 H new ATOM 0 HB3 TYR A 116 11.013 -1.512 -0.754 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.907 1.337 -3.016 1.00 0.00 H new ATOM 0 HD2 TYR A 116 8.827 -0.578 -0.800 1.00 0.00 H new ATOM 0 HE1 TYR A 116 10.498 3.333 -3.233 1.00 0.00 H new ATOM 0 HE2 TYR A 116 7.439 1.405 -1.003 1.00 0.00 H new ATOM 0 HH TYR A 116 8.179 3.994 -3.094 1.00 0.00 H new ATOM 1755 N ASP A 117 13.764 -1.992 -3.552 1.00 0.00 N ATOM 1756 CA ASP A 117 14.175 -2.167 -4.921 1.00 0.00 C ATOM 1757 C ASP A 117 12.978 -1.974 -5.836 1.00 0.00 C ATOM 1758 O ASP A 117 11.831 -2.165 -5.408 1.00 0.00 O ATOM 1759 CB ASP A 117 14.714 -3.567 -5.131 1.00 0.00 C ATOM 1760 CG ASP A 117 16.038 -3.806 -4.464 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.058 -4.117 -3.245 1.00 0.00 O ATOM 1762 OD2 ASP A 117 17.075 -3.714 -5.144 1.00 0.00 O ATOM 0 H ASP A 117 13.802 -2.845 -2.994 1.00 0.00 H new ATOM 0 HA ASP A 117 14.951 -1.436 -5.148 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.990 -4.287 -4.751 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.816 -3.752 -6.200 1.00 0.00 H new ATOM 1767 N PRO A 118 13.202 -1.621 -7.110 1.00 0.00 N ATOM 1768 CA PRO A 118 12.117 -1.450 -8.112 1.00 0.00 C ATOM 1769 C PRO A 118 11.216 -2.709 -8.255 1.00 0.00 C ATOM 1770 O PRO A 118 10.026 -2.603 -8.568 1.00 0.00 O ATOM 1771 CB PRO A 118 12.882 -1.181 -9.431 1.00 0.00 C ATOM 1772 CG PRO A 118 14.295 -1.606 -9.143 1.00 0.00 C ATOM 1773 CD PRO A 118 14.516 -1.299 -7.696 1.00 0.00 C ATOM 0 HA PRO A 118 11.432 -0.652 -7.825 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.458 -1.750 -10.258 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.834 -0.128 -9.710 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.435 -2.668 -9.345 1.00 0.00 H new ATOM 0 HG3 PRO A 118 15.003 -1.066 -9.772 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.314 -1.906 -7.267 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.789 -0.256 -7.537 1.00 0.00 H new ATOM 1781 N GLY A 119 11.764 -3.869 -7.905 1.00 0.00 N ATOM 1782 CA GLY A 119 11.029 -5.102 -8.090 1.00 0.00 C ATOM 1783 C GLY A 119 10.161 -5.329 -6.897 1.00 0.00 C ATOM 1784 O GLY A 119 9.011 -5.707 -7.010 1.00 0.00 O ATOM 0 H GLY A 119 12.695 -3.975 -7.501 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.422 -5.047 -8.993 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.718 -5.936 -8.219 1.00 0.00 H new ATOM 1788 N LEU A 120 10.735 -5.065 -5.760 1.00 0.00 N ATOM 1789 CA LEU A 120 9.976 -5.156 -4.517 1.00 0.00 C ATOM 1790 C LEU A 120 8.836 -4.138 -4.522 1.00 0.00 C ATOM 1791 O LEU A 120 7.724 -4.451 -4.121 1.00 0.00 O ATOM 1792 CB LEU A 120 10.866 -4.933 -3.304 1.00 0.00 C ATOM 1793 CG LEU A 120 10.144 -4.865 -1.952 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.432 -6.179 -1.624 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.121 -4.482 -0.871 1.00 0.00 C ATOM 0 H LEU A 120 11.711 -4.788 -5.652 1.00 0.00 H new ATOM 0 HA LEU A 120 9.563 -6.162 -4.451 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.601 -5.737 -3.263 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.418 -4.004 -3.447 1.00 0.00 H new ATOM 0 HG LEU A 120 9.372 -4.098 -2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.933 -6.091 -0.659 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.694 -6.395 -2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.162 -6.988 -1.583 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.603 -4.435 0.087 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.915 -5.226 -0.818 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.552 -3.507 -1.099 1.00 0.00 H new ATOM 1807 N PHE A 121 9.133 -2.913 -4.979 1.00 0.00 N ATOM 1808 CA PHE A 121 8.113 -1.882 -5.143 1.00 0.00 C ATOM 1809 C PHE A 121 6.983 -2.374 -6.074 1.00 0.00 C ATOM 1810 O PHE A 121 5.799 -2.168 -5.797 1.00 0.00 O ATOM 1811 CB PHE A 121 8.743 -0.570 -5.665 1.00 0.00 C ATOM 1812 CG PHE A 121 7.741 0.519 -5.930 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.159 1.213 -4.887 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.364 0.823 -7.220 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.224 2.209 -5.126 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.431 1.816 -7.473 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.855 2.504 -6.417 1.00 0.00 C ATOM 0 H PHE A 121 10.074 -2.617 -5.240 1.00 0.00 H new ATOM 0 HA PHE A 121 7.672 -1.674 -4.168 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.471 -0.212 -4.937 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.289 -0.780 -6.585 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.436 0.976 -3.870 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.801 0.280 -8.045 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.787 2.751 -4.300 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.154 2.053 -8.490 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.118 3.270 -6.608 1.00 0.00 H new ATOM 1827 N ALA A 122 7.361 -3.067 -7.134 1.00 0.00 N ATOM 1828 CA ALA A 122 6.398 -3.595 -8.086 1.00 0.00 C ATOM 1829 C ALA A 122 5.507 -4.635 -7.406 1.00 0.00 C ATOM 1830 O ALA A 122 4.277 -4.653 -7.604 1.00 0.00 O ATOM 1831 CB ALA A 122 7.109 -4.183 -9.317 1.00 0.00 C ATOM 0 H ALA A 122 8.333 -3.278 -7.358 1.00 0.00 H new ATOM 0 HA ALA A 122 5.765 -2.779 -8.436 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.367 -4.572 -10.015 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.694 -3.404 -9.806 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.771 -4.991 -9.004 1.00 0.00 H new ATOM 1837 N GLN A 123 6.128 -5.466 -6.575 1.00 0.00 N ATOM 1838 CA GLN A 123 5.436 -6.484 -5.826 1.00 0.00 C ATOM 1839 C GLN A 123 4.440 -5.882 -4.836 1.00 0.00 C ATOM 1840 O GLN A 123 3.256 -6.229 -4.853 1.00 0.00 O ATOM 1841 CB GLN A 123 6.441 -7.355 -5.098 1.00 0.00 C ATOM 1842 CG GLN A 123 7.317 -8.172 -6.040 1.00 0.00 C ATOM 1843 CD GLN A 123 6.522 -9.184 -6.845 1.00 0.00 C ATOM 1844 OE1 GLN A 123 6.854 -9.493 -7.998 1.00 0.00 O ATOM 1845 NE2 GLN A 123 5.544 -9.756 -6.238 1.00 0.00 N ATOM 0 H GLN A 123 7.134 -5.444 -6.408 1.00 0.00 H new ATOM 0 HA GLN A 123 4.868 -7.092 -6.530 1.00 0.00 H new ATOM 0 HB2 GLN A 123 7.076 -6.724 -4.476 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.909 -8.031 -4.428 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.837 -7.499 -6.722 1.00 0.00 H new ATOM 0 HG3 GLN A 123 8.080 -8.692 -5.461 1.00 0.00 H new ATOM 0 HE21 GLN A 123 5.299 -9.476 -5.288 1.00 0.00 H new ATOM 0 HE22 GLN A 123 5.013 -10.490 -6.706 1.00 0.00 H new ATOM 1854 N ILE A 124 4.905 -4.940 -4.005 1.00 0.00 N ATOM 1855 CA ILE A 124 4.035 -4.346 -2.995 1.00 0.00 C ATOM 1856 C ILE A 124 2.884 -3.571 -3.613 1.00 0.00 C ATOM 1857 O ILE A 124 1.739 -3.744 -3.192 1.00 0.00 O ATOM 1858 CB ILE A 124 4.773 -3.462 -1.936 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.650 -2.427 -2.600 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.599 -4.304 -0.979 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.155 -1.370 -1.668 1.00 0.00 C ATOM 0 H ILE A 124 5.860 -4.582 -4.014 1.00 0.00 H new ATOM 0 HA ILE A 124 3.637 -5.204 -2.453 1.00 0.00 H new ATOM 0 HB ILE A 124 4.002 -2.949 -1.361 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.501 -2.928 -3.060 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.088 -1.951 -3.403 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.096 -3.654 -0.259 1.00 0.00 H new ATOM 0 HG22 ILE A 124 4.947 -4.999 -0.451 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.348 -4.864 -1.540 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.777 -0.665 -2.220 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.311 -0.841 -1.226 1.00 0.00 H new ATOM 0 HD13 ILE A 124 6.746 -1.834 -0.878 1.00 0.00 H new ATOM 1873 N GLN A 125 3.175 -2.752 -4.628 1.00 0.00 N ATOM 1874 CA GLN A 125 2.151 -1.944 -5.271 1.00 0.00 C ATOM 1875 C GLN A 125 1.043 -2.820 -5.805 1.00 0.00 C ATOM 1876 O GLN A 125 -0.156 -2.573 -5.534 1.00 0.00 O ATOM 1877 CB GLN A 125 2.711 -1.135 -6.429 1.00 0.00 C ATOM 1878 CG GLN A 125 1.657 -0.228 -7.039 1.00 0.00 C ATOM 1879 CD GLN A 125 2.096 0.426 -8.314 1.00 0.00 C ATOM 1880 OE1 GLN A 125 2.895 -0.127 -9.075 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.591 1.602 -8.558 1.00 0.00 N ATOM 0 H GLN A 125 4.111 -2.636 -5.017 1.00 0.00 H new ATOM 0 HA GLN A 125 1.768 -1.263 -4.511 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.551 -0.534 -6.081 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.097 -1.811 -7.193 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.755 -0.810 -7.230 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.391 0.544 -6.317 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.934 2.021 -7.900 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.853 2.103 -9.407 1.00 0.00 H new ATOM 1890 N ALA A 126 1.443 -3.862 -6.537 1.00 0.00 N ATOM 1891 CA ALA A 126 0.507 -4.742 -7.155 1.00 0.00 C ATOM 1892 C ALA A 126 -0.317 -5.443 -6.113 1.00 0.00 C ATOM 1893 O ALA A 126 -1.531 -5.338 -6.118 1.00 0.00 O ATOM 1894 CB ALA A 126 1.205 -5.742 -8.063 1.00 0.00 C ATOM 0 H ALA A 126 2.421 -4.100 -6.704 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.160 -4.146 -7.778 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.464 -6.398 -8.519 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.746 -5.208 -8.844 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.906 -6.337 -7.478 1.00 0.00 H new ATOM 1900 N ALA A 127 0.363 -6.081 -5.171 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.296 -6.857 -4.117 1.00 0.00 C ATOM 1902 C ALA A 127 -1.302 -6.010 -3.352 1.00 0.00 C ATOM 1903 O ALA A 127 -2.423 -6.464 -3.071 1.00 0.00 O ATOM 1904 CB ALA A 127 0.726 -7.459 -3.157 1.00 0.00 C ATOM 0 H ALA A 127 1.381 -6.079 -5.111 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.835 -7.671 -4.602 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.209 -8.029 -2.385 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.397 -8.119 -3.707 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.303 -6.660 -2.692 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.929 -4.762 -3.091 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.759 -3.866 -2.335 1.00 0.00 C ATOM 1912 C ALA A 128 -3.067 -3.568 -3.026 1.00 0.00 C ATOM 1913 O ALA A 128 -4.071 -3.946 -2.543 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.032 -2.573 -2.019 1.00 0.00 C ATOM 0 H ALA A 128 -0.046 -4.356 -3.401 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.988 -4.379 -1.401 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.688 -1.917 -1.446 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.138 -2.792 -1.435 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.747 -2.079 -2.948 1.00 0.00 H new ATOM 1920 N THR A 129 -3.049 -2.981 -4.185 1.00 0.00 N ATOM 1921 CA THR A 129 -4.340 -2.553 -4.762 1.00 0.00 C ATOM 1922 C THR A 129 -5.228 -3.770 -5.132 1.00 0.00 C ATOM 1923 O THR A 129 -6.508 -3.748 -4.977 1.00 0.00 O ATOM 1924 CB THR A 129 -4.188 -1.533 -5.934 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.485 -1.123 -6.408 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.379 -2.096 -7.092 1.00 0.00 C ATOM 0 H THR A 129 -2.218 -2.784 -4.743 1.00 0.00 H new ATOM 0 HA THR A 129 -4.862 -2.003 -3.979 1.00 0.00 H new ATOM 0 HB THR A 129 -3.646 -0.674 -5.539 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.473 -0.163 -6.605 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.303 -1.347 -7.881 1.00 0.00 H new ATOM 0 HG22 THR A 129 -2.380 -2.359 -6.744 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.873 -2.985 -7.483 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.531 -4.878 -5.425 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.142 -6.140 -5.848 1.00 0.00 C ATOM 1936 C LYS A 130 -5.899 -6.742 -4.703 1.00 0.00 C ATOM 1937 O LYS A 130 -6.714 -7.601 -4.867 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.070 -7.098 -6.317 1.00 0.00 C ATOM 1939 CG LYS A 130 -3.617 -6.899 -7.774 1.00 0.00 C ATOM 1940 CD LYS A 130 -2.490 -7.858 -8.163 1.00 0.00 C ATOM 1941 CE LYS A 130 -2.910 -9.310 -8.041 1.00 0.00 C ATOM 1942 NZ LYS A 130 -1.812 -10.224 -8.341 1.00 0.00 N ATOM 0 H LYS A 130 -3.513 -4.920 -5.373 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.830 -5.948 -6.671 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.202 -6.997 -5.665 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -4.438 -8.117 -6.202 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -4.466 -7.049 -8.441 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.281 -5.871 -7.912 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.180 -7.656 -9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -1.624 -7.677 -7.526 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.273 -9.499 -7.031 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -3.740 -9.506 -8.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -2.142 -11.206 -8.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -1.482 -10.062 -9.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.029 -10.056 -7.677 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.504 -6.364 -3.558 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.160 -6.622 -2.338 1.00 0.00 C ATOM 1958 C ALA A 131 -7.223 -5.561 -2.113 1.00 0.00 C ATOM 1959 O ALA A 131 -8.425 -5.860 -2.139 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.089 -6.561 -1.308 1.00 0.00 C ATOM 0 H ALA A 131 -4.648 -5.824 -3.434 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.668 -7.586 -2.312 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.519 -6.752 -0.325 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.332 -7.314 -1.526 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.631 -5.572 -1.318 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.761 -4.318 -2.065 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.509 -3.121 -1.664 1.00 0.00 C ATOM 1968 C TRP A 132 -8.596 -2.678 -2.663 1.00 0.00 C ATOM 1969 O TRP A 132 -8.875 -1.497 -2.815 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.570 -1.938 -1.357 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.638 -2.218 -0.231 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.115 -3.400 0.045 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.131 -1.340 0.768 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.245 -3.344 1.005 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.230 -2.102 1.511 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.298 0.007 1.108 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.513 -1.592 2.531 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.585 0.483 2.132 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.705 -0.312 2.818 1.00 0.00 C ATOM 0 H TRP A 132 -5.798 -4.100 -2.319 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.030 -3.422 -0.755 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.992 -1.698 -2.250 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.168 -1.058 -1.118 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.382 -4.310 -0.471 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.665 -4.120 1.324 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.980 0.640 0.561 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.814 -2.198 3.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.705 1.516 2.425 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.142 0.124 3.630 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.126 -3.589 -3.394 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.296 -3.298 -4.197 1.00 0.00 C ATOM 1992 C ARG A 133 -11.672 -4.057 -3.841 1.00 0.00 C ATOM 1993 O ARG A 133 -12.738 -3.429 -3.815 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.929 -3.386 -5.702 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.008 -2.940 -6.674 1.00 0.00 C ATOM 1996 CD ARG A 133 -12.072 -3.990 -6.912 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.264 -3.401 -7.529 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.596 -3.473 -8.861 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.808 -4.101 -9.727 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.690 -2.878 -9.316 1.00 0.00 N ATOM 0 H ARG A 133 -8.782 -4.547 -3.465 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.563 -2.277 -3.924 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.039 -2.782 -5.875 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.664 -4.418 -5.932 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.480 -2.035 -6.292 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.545 -2.680 -7.626 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.675 -4.775 -7.556 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.342 -4.460 -5.966 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.903 -2.894 -6.917 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.944 -4.538 -9.406 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.067 -4.146 -10.712 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.293 -2.361 -8.676 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -14.928 -2.937 -10.306 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.626 -5.353 -3.535 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.835 -6.251 -3.760 1.00 0.00 C ATOM 2016 C LYS A 134 -14.082 -6.324 -2.802 1.00 0.00 C ATOM 2017 O LYS A 134 -14.800 -7.344 -2.859 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.459 -7.684 -4.123 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.916 -7.857 -5.524 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.617 -7.161 -5.722 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.584 -7.671 -4.777 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.073 -9.006 -5.175 1.00 0.00 N ATOM 0 H LYS A 134 -10.811 -5.824 -3.143 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.223 -5.632 -4.569 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.714 -8.041 -3.412 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.339 -8.317 -4.008 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.791 -8.919 -5.733 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.642 -7.475 -6.241 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.277 -7.304 -6.748 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.750 -6.089 -5.576 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.755 -6.965 -4.732 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -10.008 -7.730 -3.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -9.380 -9.716 -4.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.446 -9.255 -6.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.034 -8.983 -5.211 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.427 -5.350 -2.027 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.650 -5.573 -1.180 1.00 0.00 C ATOM 2038 C LEU A 135 -16.863 -4.859 -1.724 1.00 0.00 C ATOM 2039 O LEU A 135 -16.685 -3.843 -2.331 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.479 -5.416 0.387 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.611 -4.310 0.971 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.182 -4.600 0.730 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.966 -2.963 0.449 1.00 0.00 C ATOM 0 H LEU A 135 -13.956 -4.450 -1.932 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.824 -6.645 -1.278 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -16.477 -5.295 0.807 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.088 -6.362 0.762 1.00 0.00 H new ATOM 0 HG LEU A 135 -14.800 -4.289 2.044 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.572 -3.801 1.153 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -12.918 -5.546 1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.000 -4.666 -0.343 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.315 -2.215 0.900 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.841 -2.948 -0.634 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -16.003 -2.738 0.697 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.114 -5.437 -1.483 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.453 -4.978 -1.931 1.00 0.00 C ATOM 2057 C PRO A 136 -19.565 -3.620 -2.669 1.00 0.00 C ATOM 2058 O PRO A 136 -18.872 -3.383 -3.620 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.128 -4.958 -0.590 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.673 -6.242 0.045 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.361 -6.616 -0.649 1.00 0.00 C ATOM 0 HA PRO A 136 -19.868 -5.611 -2.715 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -19.829 -4.090 -0.002 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -21.213 -4.919 -0.686 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -19.525 -6.115 1.117 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.419 -7.026 -0.083 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.556 -6.787 0.065 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -18.458 -7.524 -1.244 1.00 0.00 H new ATOM 2069 N VAL A 137 -20.532 -2.788 -2.297 1.00 0.00 N ATOM 2070 CA VAL A 137 -20.706 -1.487 -2.959 1.00 0.00 C ATOM 2071 C VAL A 137 -20.990 -0.441 -1.886 1.00 0.00 C ATOM 2072 O VAL A 137 -20.071 0.020 -1.204 1.00 0.00 O ATOM 2073 CB VAL A 137 -21.841 -1.477 -4.074 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -21.921 -0.129 -4.782 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -21.651 -2.584 -5.114 1.00 0.00 C ATOM 0 H VAL A 137 -21.202 -2.981 -1.552 1.00 0.00 H new ATOM 0 HA VAL A 137 -19.784 -1.259 -3.494 1.00 0.00 H new ATOM 0 HB VAL A 137 -22.777 -1.661 -3.546 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -22.707 -0.160 -5.536 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -22.147 0.651 -4.055 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -20.966 0.087 -5.262 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -22.452 -2.532 -5.851 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -20.690 -2.454 -5.612 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -21.675 -3.555 -4.620 1.00 0.00 H new ATOM 2085 N LYS A 138 -22.261 -0.130 -1.680 1.00 0.00 N ATOM 2086 CA LYS A 138 -22.686 0.772 -0.667 1.00 0.00 C ATOM 2087 C LYS A 138 -24.094 0.371 -0.292 1.00 0.00 C ATOM 2088 O LYS A 138 -25.034 0.534 -1.072 1.00 0.00 O ATOM 2089 CB LYS A 138 -22.599 2.239 -1.149 1.00 0.00 C ATOM 2090 CG LYS A 138 -22.994 3.271 -0.092 1.00 0.00 C ATOM 2091 CD LYS A 138 -22.279 3.019 1.248 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.770 3.147 1.134 1.00 0.00 C ATOM 2093 NZ LYS A 138 -20.071 2.873 2.421 1.00 0.00 N ATOM 0 H LYS A 138 -23.026 -0.515 -2.233 1.00 0.00 H new ATOM 0 HA LYS A 138 -22.037 0.717 0.207 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -21.579 2.442 -1.476 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -23.243 2.362 -2.020 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -22.751 4.271 -0.451 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -24.073 3.241 0.060 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -22.646 3.728 1.991 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -22.530 2.021 1.608 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.407 2.455 0.374 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -20.519 4.152 0.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.145 3.346 2.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -20.644 3.234 3.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -19.936 1.848 2.531 1.00 0.00 H new ATOM 2107 N GLY A 139 -24.215 -0.206 0.851 1.00 0.00 N ATOM 2108 CA GLY A 139 -25.449 -0.795 1.275 1.00 0.00 C ATOM 2109 C GLY A 139 -25.123 -2.113 1.922 1.00 0.00 C ATOM 2110 O GLY A 139 -25.877 -2.645 2.743 1.00 0.00 O ATOM 0 H GLY A 139 -23.457 -0.287 1.529 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -25.965 -0.140 1.978 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -26.116 -0.940 0.425 1.00 0.00 H new ATOM 2114 N ASP A 140 -23.963 -2.593 1.550 1.00 0.00 N ATOM 2115 CA ASP A 140 -23.358 -3.802 2.047 1.00 0.00 C ATOM 2116 C ASP A 140 -21.967 -3.444 2.422 1.00 0.00 C ATOM 2117 O ASP A 140 -21.557 -3.717 3.541 1.00 0.00 O ATOM 2118 CB ASP A 140 -23.312 -4.929 1.006 1.00 0.00 C ATOM 2119 CG ASP A 140 -24.631 -5.583 0.757 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -25.110 -6.304 1.641 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -25.215 -5.402 -0.334 1.00 0.00 O ATOM 2122 OXT ASP A 140 -21.310 -2.740 1.613 1.00 0.00 O ATOM 0 H ASP A 140 -23.384 -2.124 0.854 1.00 0.00 H new ATOM 0 HA ASP A 140 -23.950 -4.177 2.882 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -22.935 -4.526 0.066 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -22.600 -5.685 1.336 1.00 0.00 H new TER 2127 ASP A 140