USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 730 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 112 THR OG1 : rot 81:sc= 1.09 USER MOD Set 1.2: A 116 ASN : amide:sc= -0.323 X(o=0.77,f=0.46) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.0318 K(o=-0.032,f=-1.3) USER MOD Single : A 65 LYS NZ :NH3+ 173:sc= 0.807 (180deg=0.563) USER MOD Single : A 75 ASN : amide:sc= 0.0476 X(o=0.048,f=-0.45) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= -0.279 USER MOD Single : A 81 ASN : amide:sc= 0.534 K(o=0.53,f=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0.887 K(o=0.89,f=-0.9) USER MOD Single : A 90 HIS : no HE2:sc= -1.54 K(o=-1.5,f=-6.5!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.213 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 169:sc= 1.26 USER MOD Single : A 110 ASN : amide:sc= 1.22 K(o=1.2,f=-0.0022) USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 GLN : amide:sc= -0.812 X(o=-0.81,f=-1.2) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.116 X(o=-0.12,f=-0.27) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 HIS : no HD1:sc= -0.0521 X(o=-0.052,f=-0.0052) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 141 SER OG : rot 79:sc= 0.963 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 HIS : no HD1:sc= 0.00498 X(o=0.005,f=-0.47) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 52 2.126 -15.592 -4.261 1.00 0.00 N ATOM 2 CA ALA A 52 1.989 -14.371 -5.046 1.00 0.00 C ATOM 3 C ALA A 52 1.363 -13.266 -4.203 1.00 0.00 C ATOM 4 O ALA A 52 1.135 -12.171 -4.700 1.00 0.00 O ATOM 5 CB ALA A 52 1.198 -14.609 -6.332 1.00 0.00 C ATOM 0 HA ALA A 52 2.987 -14.050 -5.345 1.00 0.00 H new ATOM 0 HB1 ALA A 52 1.118 -13.675 -6.888 1.00 0.00 H new ATOM 0 HB2 ALA A 52 1.711 -15.352 -6.942 1.00 0.00 H new ATOM 0 HB3 ALA A 52 0.200 -14.970 -6.084 1.00 0.00 H new ATOM 11 N GLU A 53 1.108 -13.492 -2.918 1.00 0.00 N ATOM 12 CA GLU A 53 0.843 -12.384 -2.002 1.00 0.00 C ATOM 13 C GLU A 53 2.162 -11.615 -1.804 1.00 0.00 C ATOM 14 O GLU A 53 2.172 -10.402 -1.671 1.00 0.00 O ATOM 15 CB GLU A 53 0.162 -12.878 -0.713 1.00 0.00 C ATOM 16 CG GLU A 53 -0.963 -13.873 -1.068 1.00 0.00 C ATOM 17 CD GLU A 53 -2.019 -14.156 -0.003 1.00 0.00 C ATOM 18 OE1 GLU A 53 -2.118 -13.454 1.030 1.00 0.00 O ATOM 19 OE2 GLU A 53 -2.819 -15.088 -0.220 1.00 0.00 O ATOM 0 H GLU A 53 1.079 -14.418 -2.490 1.00 0.00 H new ATOM 0 HA GLU A 53 0.120 -11.680 -2.414 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.894 -13.359 -0.064 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.248 -12.033 -0.160 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.473 -13.500 -1.956 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.499 -14.821 -1.341 1.00 0.00 H new ATOM 26 N ASN A 54 3.305 -12.277 -1.996 1.00 0.00 N ATOM 27 CA ASN A 54 4.627 -11.662 -2.128 1.00 0.00 C ATOM 28 C ASN A 54 4.778 -10.768 -3.369 1.00 0.00 C ATOM 29 O ASN A 54 5.854 -10.192 -3.555 1.00 0.00 O ATOM 30 CB ASN A 54 5.687 -12.776 -2.179 1.00 0.00 C ATOM 31 CG ASN A 54 6.226 -13.138 -0.805 1.00 0.00 C ATOM 32 OD1 ASN A 54 6.674 -12.260 -0.071 1.00 0.00 O ATOM 33 ND2 ASN A 54 6.219 -14.403 -0.428 1.00 0.00 N ATOM 0 H ASN A 54 3.336 -13.294 -2.066 1.00 0.00 H new ATOM 0 HA ASN A 54 4.761 -11.013 -1.262 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.253 -13.664 -2.640 1.00 0.00 H new ATOM 0 HB3 ASN A 54 6.512 -12.457 -2.816 1.00 0.00 H new ATOM 0 HD21 ASN A 54 6.589 -14.665 0.486 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.843 -15.119 -1.050 1.00 0.00 H new ATOM 40 N ARG A 55 3.770 -10.654 -4.248 1.00 0.00 N ATOM 41 CA ARG A 55 3.790 -9.702 -5.364 1.00 0.00 C ATOM 42 C ARG A 55 4.091 -8.315 -4.810 1.00 0.00 C ATOM 43 O ARG A 55 3.537 -7.928 -3.777 1.00 0.00 O ATOM 44 CB ARG A 55 2.428 -9.672 -6.077 1.00 0.00 C ATOM 45 CG ARG A 55 2.222 -10.714 -7.186 1.00 0.00 C ATOM 46 CD ARG A 55 0.801 -10.752 -7.791 1.00 0.00 C ATOM 47 NE ARG A 55 -0.257 -11.039 -6.809 1.00 0.00 N ATOM 48 CZ ARG A 55 -1.579 -10.810 -6.885 1.00 0.00 C ATOM 49 NH1 ARG A 55 -2.144 -10.282 -7.962 1.00 0.00 N ATOM 50 NH2 ARG A 55 -2.362 -11.079 -5.853 1.00 0.00 N ATOM 0 H ARG A 55 2.922 -11.218 -4.203 1.00 0.00 H new ATOM 0 HA ARG A 55 4.552 -10.007 -6.081 1.00 0.00 H new ATOM 0 HB2 ARG A 55 1.647 -9.808 -5.329 1.00 0.00 H new ATOM 0 HB3 ARG A 55 2.288 -8.681 -6.508 1.00 0.00 H new ATOM 0 HG2 ARG A 55 2.936 -10.517 -7.986 1.00 0.00 H new ATOM 0 HG3 ARG A 55 2.456 -11.700 -6.785 1.00 0.00 H new ATOM 0 HD2 ARG A 55 0.593 -9.793 -8.265 1.00 0.00 H new ATOM 0 HD3 ARG A 55 0.771 -11.509 -8.575 1.00 0.00 H new ATOM 0 HE ARG A 55 0.060 -11.476 -5.943 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -1.571 -10.035 -8.769 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -3.151 -10.123 -7.983 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -1.963 -11.462 -4.996 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -3.365 -10.904 -5.914 1.00 0.00 H new ATOM 64 N PRO A 56 4.808 -7.480 -5.570 1.00 0.00 N ATOM 65 CA PRO A 56 5.254 -6.165 -5.139 1.00 0.00 C ATOM 66 C PRO A 56 4.100 -5.154 -5.069 1.00 0.00 C ATOM 67 O PRO A 56 4.303 -3.962 -4.908 1.00 0.00 O ATOM 68 CB PRO A 56 6.323 -5.790 -6.157 1.00 0.00 C ATOM 69 CG PRO A 56 5.860 -6.447 -7.442 1.00 0.00 C ATOM 70 CD PRO A 56 5.207 -7.732 -6.942 1.00 0.00 C ATOM 0 HA PRO A 56 5.648 -6.165 -4.123 1.00 0.00 H new ATOM 0 HB2 PRO A 56 6.404 -4.709 -6.269 1.00 0.00 H new ATOM 0 HB3 PRO A 56 7.305 -6.154 -5.855 1.00 0.00 H new ATOM 0 HG2 PRO A 56 5.155 -5.819 -7.987 1.00 0.00 H new ATOM 0 HG3 PRO A 56 6.692 -6.651 -8.116 1.00 0.00 H new ATOM 0 HD2 PRO A 56 4.345 -7.994 -7.556 1.00 0.00 H new ATOM 0 HD3 PRO A 56 5.903 -8.569 -6.997 1.00 0.00 H new ATOM 78 N GLY A 57 2.866 -5.611 -5.202 1.00 0.00 N ATOM 79 CA GLY A 57 1.672 -4.811 -5.117 1.00 0.00 C ATOM 80 C GLY A 57 0.445 -5.697 -4.972 1.00 0.00 C ATOM 81 O GLY A 57 -0.632 -5.275 -5.382 1.00 0.00 O ATOM 0 H GLY A 57 2.669 -6.596 -5.380 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.741 -4.134 -4.266 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.578 -4.193 -6.010 1.00 0.00 H new ATOM 85 N ALA A 58 0.586 -6.937 -4.483 1.00 0.00 N ATOM 86 CA ALA A 58 -0.556 -7.806 -4.236 1.00 0.00 C ATOM 87 C ALA A 58 -1.548 -7.086 -3.329 1.00 0.00 C ATOM 88 O ALA A 58 -1.143 -6.402 -2.382 1.00 0.00 O ATOM 89 CB ALA A 58 -0.091 -9.114 -3.599 1.00 0.00 C ATOM 0 H ALA A 58 1.487 -7.355 -4.252 1.00 0.00 H new ATOM 0 HA ALA A 58 -1.047 -8.044 -5.180 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.952 -9.757 -3.418 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.604 -9.619 -4.270 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.408 -8.901 -2.653 1.00 0.00 H new ATOM 95 N PHE A 59 -2.833 -7.227 -3.635 1.00 0.00 N ATOM 96 CA PHE A 59 -3.893 -6.630 -2.851 1.00 0.00 C ATOM 97 C PHE A 59 -4.161 -7.516 -1.633 1.00 0.00 C ATOM 98 O PHE A 59 -4.422 -8.705 -1.807 1.00 0.00 O ATOM 99 CB PHE A 59 -5.155 -6.523 -3.722 1.00 0.00 C ATOM 100 CG PHE A 59 -5.208 -5.392 -4.737 1.00 0.00 C ATOM 101 CD1 PHE A 59 -4.210 -4.396 -4.828 1.00 0.00 C ATOM 102 CD2 PHE A 59 -6.348 -5.293 -5.554 1.00 0.00 C ATOM 103 CE1 PHE A 59 -4.394 -3.296 -5.681 1.00 0.00 C ATOM 104 CE2 PHE A 59 -6.505 -4.214 -6.441 1.00 0.00 C ATOM 105 CZ PHE A 59 -5.517 -3.226 -6.507 1.00 0.00 C ATOM 0 H PHE A 59 -3.164 -7.762 -4.438 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.608 -5.634 -2.514 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.275 -7.464 -4.259 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.015 -6.422 -3.059 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.307 -4.481 -4.242 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.112 -6.055 -5.499 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -3.664 -2.501 -5.698 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -7.382 -4.148 -7.067 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.624 -2.405 -7.200 1.00 0.00 H new ATOM 115 N ILE A 60 -4.112 -6.976 -0.408 1.00 0.00 N ATOM 116 CA ILE A 60 -4.384 -7.779 0.794 1.00 0.00 C ATOM 117 C ILE A 60 -5.886 -8.092 0.943 1.00 0.00 C ATOM 118 O ILE A 60 -6.241 -9.157 1.442 1.00 0.00 O ATOM 119 CB ILE A 60 -3.775 -7.104 2.051 1.00 0.00 C ATOM 120 CG1 ILE A 60 -2.233 -7.118 1.926 1.00 0.00 C ATOM 121 CG2 ILE A 60 -4.217 -7.847 3.324 1.00 0.00 C ATOM 122 CD1 ILE A 60 -1.457 -6.363 3.006 1.00 0.00 C ATOM 0 H ILE A 60 -3.889 -5.998 -0.223 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.891 -8.745 0.683 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.127 -6.075 2.122 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.899 -8.156 1.928 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -1.965 -6.699 0.956 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -3.782 -7.362 4.198 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.304 -7.824 3.400 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -3.878 -8.882 3.277 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.388 -6.445 2.811 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.748 -5.313 2.996 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.681 -6.792 3.982 1.00 0.00 H new ATOM 134 N LYS A 61 -6.755 -7.175 0.502 1.00 0.00 N ATOM 135 CA LYS A 61 -8.225 -7.242 0.475 1.00 0.00 C ATOM 136 C LYS A 61 -8.854 -8.136 1.542 1.00 0.00 C ATOM 137 O LYS A 61 -9.446 -9.180 1.260 1.00 0.00 O ATOM 138 CB LYS A 61 -8.765 -7.505 -0.942 1.00 0.00 C ATOM 139 CG LYS A 61 -8.054 -8.553 -1.787 1.00 0.00 C ATOM 140 CD LYS A 61 -8.481 -9.989 -1.457 1.00 0.00 C ATOM 141 CE LYS A 61 -8.482 -10.860 -2.715 1.00 0.00 C ATOM 142 NZ LYS A 61 -9.645 -11.768 -2.745 1.00 0.00 N ATOM 0 H LYS A 61 -6.421 -6.290 0.121 1.00 0.00 H new ATOM 0 HA LYS A 61 -8.557 -6.244 0.761 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -9.811 -7.799 -0.853 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.744 -6.562 -1.489 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -8.252 -8.355 -2.841 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.978 -8.459 -1.641 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.803 -10.413 -0.716 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -9.476 -9.984 -1.012 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -8.494 -10.223 -3.599 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -7.562 -11.444 -2.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.614 -12.343 -3.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.620 -12.392 -1.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.522 -11.209 -2.732 1.00 0.00 H new ATOM 156 N GLN A 62 -8.785 -7.686 2.788 1.00 0.00 N ATOM 157 CA GLN A 62 -9.634 -8.258 3.815 1.00 0.00 C ATOM 158 C GLN A 62 -11.078 -7.825 3.529 1.00 0.00 C ATOM 159 O GLN A 62 -11.320 -6.713 3.055 1.00 0.00 O ATOM 160 CB GLN A 62 -9.190 -7.775 5.196 1.00 0.00 C ATOM 161 CG GLN A 62 -7.693 -7.970 5.460 1.00 0.00 C ATOM 162 CD GLN A 62 -7.341 -7.924 6.943 1.00 0.00 C ATOM 163 OE1 GLN A 62 -8.168 -7.680 7.816 1.00 0.00 O ATOM 164 NE2 GLN A 62 -6.089 -8.185 7.258 1.00 0.00 N ATOM 0 H GLN A 62 -8.163 -6.942 3.104 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.563 -9.346 3.806 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -9.434 -6.718 5.298 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -9.758 -8.308 5.958 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -7.378 -8.928 5.047 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.133 -7.197 4.935 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.410 -8.387 6.524 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.799 -8.186 8.236 1.00 0.00 H new ATOM 173 N GLY A 63 -12.048 -8.679 3.850 1.00 0.00 N ATOM 174 CA GLY A 63 -13.483 -8.388 3.787 1.00 0.00 C ATOM 175 C GLY A 63 -13.940 -7.347 4.821 1.00 0.00 C ATOM 176 O GLY A 63 -14.704 -7.657 5.736 1.00 0.00 O ATOM 0 H GLY A 63 -11.852 -9.626 4.173 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -13.730 -8.030 2.788 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -14.041 -9.312 3.941 1.00 0.00 H new ATOM 180 N ARG A 64 -13.518 -6.089 4.682 1.00 0.00 N ATOM 181 CA ARG A 64 -13.864 -4.971 5.569 1.00 0.00 C ATOM 182 C ARG A 64 -14.293 -3.785 4.719 1.00 0.00 C ATOM 183 O ARG A 64 -13.757 -3.587 3.630 1.00 0.00 O ATOM 184 CB ARG A 64 -12.726 -4.580 6.542 1.00 0.00 C ATOM 185 CG ARG A 64 -11.369 -5.157 6.149 1.00 0.00 C ATOM 186 CD ARG A 64 -10.176 -4.562 6.900 1.00 0.00 C ATOM 187 NE ARG A 64 -10.041 -5.080 8.268 1.00 0.00 N ATOM 188 CZ ARG A 64 -8.938 -4.990 9.026 1.00 0.00 C ATOM 189 NH1 ARG A 64 -7.868 -4.303 8.649 1.00 0.00 N ATOM 190 NH2 ARG A 64 -8.901 -5.608 10.197 1.00 0.00 N ATOM 0 H ARG A 64 -12.902 -5.808 3.920 1.00 0.00 H new ATOM 0 HA ARG A 64 -14.687 -5.295 6.207 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -12.652 -3.493 6.585 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -12.982 -4.922 7.545 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -11.386 -6.234 6.317 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -11.221 -5.003 5.080 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.262 -4.775 6.345 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -10.281 -3.478 6.937 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.852 -5.546 8.675 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -7.864 -3.817 7.752 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.049 -4.260 9.256 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.707 -6.146 10.515 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.067 -5.545 10.781 1.00 0.00 H new ATOM 204 N LYS A 65 -15.251 -3.006 5.216 1.00 0.00 N ATOM 205 CA LYS A 65 -15.553 -1.676 4.708 1.00 0.00 C ATOM 206 C LYS A 65 -14.794 -0.681 5.581 1.00 0.00 C ATOM 207 O LYS A 65 -14.714 -0.898 6.793 1.00 0.00 O ATOM 208 CB LYS A 65 -17.067 -1.434 4.782 1.00 0.00 C ATOM 209 CG LYS A 65 -17.441 -0.168 3.996 1.00 0.00 C ATOM 210 CD LYS A 65 -18.935 0.170 3.987 1.00 0.00 C ATOM 211 CE LYS A 65 -19.498 0.111 5.400 1.00 0.00 C ATOM 212 NZ LYS A 65 -20.659 0.987 5.593 1.00 0.00 N ATOM 0 H LYS A 65 -15.846 -3.288 5.995 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.251 -1.564 3.667 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -17.600 -2.294 4.376 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.376 -1.329 5.822 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.895 0.677 4.416 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -17.104 -0.285 2.966 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -19.087 1.165 3.569 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -19.470 -0.531 3.346 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -19.783 -0.916 5.629 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.718 0.390 6.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -21.070 0.817 6.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -20.360 1.980 5.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -21.371 0.785 4.862 1.00 0.00 H new ATOM 226 N LEU A 66 -14.246 0.384 4.998 1.00 0.00 N ATOM 227 CA LEU A 66 -13.438 1.378 5.684 1.00 0.00 C ATOM 228 C LEU A 66 -14.125 2.734 5.576 1.00 0.00 C ATOM 229 O LEU A 66 -15.009 2.949 4.743 1.00 0.00 O ATOM 230 CB LEU A 66 -12.067 1.507 5.003 1.00 0.00 C ATOM 231 CG LEU A 66 -11.051 0.363 5.141 1.00 0.00 C ATOM 232 CD1 LEU A 66 -10.262 0.538 6.443 1.00 0.00 C ATOM 233 CD2 LEU A 66 -11.613 -1.061 5.085 1.00 0.00 C ATOM 0 H LEU A 66 -14.359 0.581 4.003 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.317 1.073 6.723 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.243 1.663 3.939 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.595 2.413 5.384 1.00 0.00 H new ATOM 0 HG LEU A 66 -10.422 0.450 4.255 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -9.540 -0.273 6.543 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.735 1.492 6.424 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -10.948 0.519 7.290 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.799 -1.778 5.194 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.330 -1.201 5.894 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -12.110 -1.219 4.128 1.00 0.00 H new ATOM 245 N ASP A 67 -13.617 3.679 6.353 1.00 0.00 N ATOM 246 CA ASP A 67 -13.938 5.082 6.319 1.00 0.00 C ATOM 247 C ASP A 67 -12.742 5.799 5.689 1.00 0.00 C ATOM 248 O ASP A 67 -11.896 6.371 6.385 1.00 0.00 O ATOM 249 CB ASP A 67 -14.236 5.530 7.750 1.00 0.00 C ATOM 250 CG ASP A 67 -15.633 5.100 8.194 1.00 0.00 C ATOM 251 OD1 ASP A 67 -16.625 5.795 7.861 1.00 0.00 O ATOM 252 OD2 ASP A 67 -15.764 4.042 8.848 1.00 0.00 O ATOM 0 H ASP A 67 -12.924 3.462 7.069 1.00 0.00 H new ATOM 0 HA ASP A 67 -14.820 5.314 5.722 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -13.493 5.108 8.426 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -14.150 6.614 7.818 1.00 0.00 H new ATOM 257 N ILE A 68 -12.630 5.706 4.364 1.00 0.00 N ATOM 258 CA ILE A 68 -11.755 6.513 3.514 1.00 0.00 C ATOM 259 C ILE A 68 -12.740 7.308 2.646 1.00 0.00 C ATOM 260 O ILE A 68 -13.731 6.735 2.184 1.00 0.00 O ATOM 261 CB ILE A 68 -10.799 5.625 2.665 1.00 0.00 C ATOM 262 CG1 ILE A 68 -9.988 4.599 3.493 1.00 0.00 C ATOM 263 CG2 ILE A 68 -9.841 6.497 1.827 1.00 0.00 C ATOM 264 CD1 ILE A 68 -9.153 3.632 2.638 1.00 0.00 C ATOM 0 H ILE A 68 -13.175 5.031 3.827 1.00 0.00 H new ATOM 0 HA ILE A 68 -11.085 7.160 4.081 1.00 0.00 H new ATOM 0 HB ILE A 68 -11.448 5.047 2.008 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.324 5.136 4.170 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -10.675 4.021 4.112 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -9.182 5.855 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -10.420 7.131 1.156 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.243 7.122 2.491 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -8.613 2.944 3.289 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -9.812 3.067 1.979 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -8.440 4.199 2.039 1.00 0.00 H new ATOM 276 N ASP A 69 -12.543 8.616 2.469 1.00 0.00 N ATOM 277 CA ASP A 69 -13.431 9.430 1.633 1.00 0.00 C ATOM 278 C ASP A 69 -12.936 9.432 0.191 1.00 0.00 C ATOM 279 O ASP A 69 -11.752 9.206 -0.062 1.00 0.00 O ATOM 280 CB ASP A 69 -13.546 10.865 2.182 1.00 0.00 C ATOM 281 CG ASP A 69 -14.761 11.066 3.081 1.00 0.00 C ATOM 282 OD1 ASP A 69 -15.784 10.359 2.911 1.00 0.00 O ATOM 283 OD2 ASP A 69 -14.695 11.924 3.992 1.00 0.00 O ATOM 0 H ASP A 69 -11.775 9.136 2.894 1.00 0.00 H new ATOM 0 HA ASP A 69 -14.428 8.990 1.656 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -12.643 11.107 2.742 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -13.600 11.564 1.347 1.00 0.00 H new ATOM 288 N PHE A 70 -13.833 9.716 -0.758 1.00 0.00 N ATOM 289 CA PHE A 70 -13.556 9.653 -2.198 1.00 0.00 C ATOM 290 C PHE A 70 -14.330 10.701 -3.008 1.00 0.00 C ATOM 291 O PHE A 70 -14.066 10.862 -4.203 1.00 0.00 O ATOM 292 CB PHE A 70 -13.924 8.254 -2.720 1.00 0.00 C ATOM 293 CG PHE A 70 -13.057 7.131 -2.192 1.00 0.00 C ATOM 294 CD1 PHE A 70 -11.856 6.807 -2.849 1.00 0.00 C ATOM 295 CD2 PHE A 70 -13.424 6.432 -1.028 1.00 0.00 C ATOM 296 CE1 PHE A 70 -11.017 5.807 -2.329 1.00 0.00 C ATOM 297 CE2 PHE A 70 -12.575 5.445 -0.508 1.00 0.00 C ATOM 298 CZ PHE A 70 -11.367 5.130 -1.151 1.00 0.00 C ATOM 0 H PHE A 70 -14.789 10.001 -0.544 1.00 0.00 H new ATOM 0 HA PHE A 70 -12.494 9.862 -2.327 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -14.962 8.046 -2.460 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -13.863 8.260 -3.808 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -11.579 7.327 -3.754 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -14.359 6.655 -0.535 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -10.098 5.558 -2.839 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -12.853 4.922 0.395 1.00 0.00 H new ATOM 0 HZ PHE A 70 -10.713 4.374 -0.742 1.00 0.00 H new ATOM 308 N GLY A 71 -15.296 11.396 -2.404 1.00 0.00 N ATOM 309 CA GLY A 71 -16.315 12.130 -3.125 1.00 0.00 C ATOM 310 C GLY A 71 -17.574 11.272 -3.232 1.00 0.00 C ATOM 311 O GLY A 71 -17.614 10.109 -2.823 1.00 0.00 O ATOM 0 H GLY A 71 -15.386 11.460 -1.390 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -16.540 13.064 -2.610 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -15.955 12.393 -4.119 1.00 0.00 H new ATOM 315 N ALA A 72 -18.633 11.878 -3.749 1.00 0.00 N ATOM 316 CA ALA A 72 -19.993 11.375 -3.714 1.00 0.00 C ATOM 317 C ALA A 72 -20.169 9.998 -4.338 1.00 0.00 C ATOM 318 O ALA A 72 -20.805 9.128 -3.743 1.00 0.00 O ATOM 319 CB ALA A 72 -20.894 12.366 -4.454 1.00 0.00 C ATOM 0 H ALA A 72 -18.561 12.776 -4.226 1.00 0.00 H new ATOM 0 HA ALA A 72 -20.260 11.272 -2.662 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -21.922 12.005 -4.438 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -20.844 13.339 -3.965 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -20.559 12.462 -5.487 1.00 0.00 H new ATOM 325 N GLU A 73 -19.708 9.815 -5.571 1.00 0.00 N ATOM 326 CA GLU A 73 -19.937 8.553 -6.261 1.00 0.00 C ATOM 327 C GLU A 73 -18.972 7.491 -5.750 1.00 0.00 C ATOM 328 O GLU A 73 -19.375 6.350 -5.540 1.00 0.00 O ATOM 329 CB GLU A 73 -19.955 8.716 -7.783 1.00 0.00 C ATOM 330 CG GLU A 73 -18.969 9.704 -8.424 1.00 0.00 C ATOM 331 CD GLU A 73 -19.158 9.824 -9.941 1.00 0.00 C ATOM 332 OE1 GLU A 73 -20.271 9.590 -10.456 1.00 0.00 O ATOM 333 OE2 GLU A 73 -18.211 10.236 -10.652 1.00 0.00 O ATOM 0 H GLU A 73 -19.184 10.510 -6.103 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.940 8.198 -6.023 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -19.776 7.735 -8.224 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -20.962 9.017 -8.073 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -19.095 10.686 -7.967 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -17.949 9.383 -8.213 1.00 0.00 H new ATOM 340 N GLY A 74 -17.730 7.878 -5.460 1.00 0.00 N ATOM 341 CA GLY A 74 -16.729 6.955 -4.953 1.00 0.00 C ATOM 342 C GLY A 74 -17.126 6.366 -3.603 1.00 0.00 C ATOM 343 O GLY A 74 -17.107 5.149 -3.443 1.00 0.00 O ATOM 0 H GLY A 74 -17.396 8.835 -5.571 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -16.583 6.148 -5.671 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -15.775 7.473 -4.856 1.00 0.00 H new ATOM 347 N ASN A 75 -17.508 7.209 -2.638 1.00 0.00 N ATOM 348 CA ASN A 75 -17.828 6.766 -1.279 1.00 0.00 C ATOM 349 C ASN A 75 -19.027 5.812 -1.268 1.00 0.00 C ATOM 350 O ASN A 75 -19.044 4.848 -0.500 1.00 0.00 O ATOM 351 CB ASN A 75 -18.031 7.971 -0.337 1.00 0.00 C ATOM 352 CG ASN A 75 -19.470 8.448 -0.208 1.00 0.00 C ATOM 353 OD1 ASN A 75 -20.292 7.856 0.475 1.00 0.00 O ATOM 354 ND2 ASN A 75 -19.793 9.532 -0.884 1.00 0.00 N ATOM 0 H ASN A 75 -17.604 8.215 -2.777 1.00 0.00 H new ATOM 0 HA ASN A 75 -16.976 6.202 -0.899 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -17.661 7.706 0.653 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -17.419 8.800 -0.694 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -20.746 9.893 -0.844 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -19.090 10.010 -1.448 1.00 0.00 H new ATOM 361 N ARG A 76 -20.009 6.054 -2.139 1.00 0.00 N ATOM 362 CA ARG A 76 -21.197 5.218 -2.258 1.00 0.00 C ATOM 363 C ARG A 76 -20.898 3.917 -2.987 1.00 0.00 C ATOM 364 O ARG A 76 -21.464 2.882 -2.639 1.00 0.00 O ATOM 365 CB ARG A 76 -22.292 6.017 -2.968 1.00 0.00 C ATOM 366 CG ARG A 76 -22.980 6.971 -1.976 1.00 0.00 C ATOM 367 CD ARG A 76 -24.312 6.403 -1.476 1.00 0.00 C ATOM 368 NE ARG A 76 -25.344 6.440 -2.519 1.00 0.00 N ATOM 369 CZ ARG A 76 -26.065 7.512 -2.867 1.00 0.00 C ATOM 370 NH1 ARG A 76 -25.933 8.667 -2.214 1.00 0.00 N ATOM 371 NH2 ARG A 76 -26.923 7.406 -3.870 1.00 0.00 N ATOM 0 H ARG A 76 -19.998 6.843 -2.785 1.00 0.00 H new ATOM 0 HA ARG A 76 -21.539 4.940 -1.261 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -21.861 6.586 -3.792 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -23.027 5.337 -3.400 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -22.320 7.152 -1.128 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -23.152 7.934 -2.457 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -24.167 5.375 -1.144 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -24.649 6.973 -0.610 1.00 0.00 H new ATOM 0 HE ARG A 76 -25.528 5.572 -3.023 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -25.276 8.742 -1.438 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -26.489 9.476 -2.491 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -27.025 6.518 -4.362 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -27.482 8.212 -4.150 1.00 0.00 H new ATOM 385 N TYR A 77 -20.024 3.935 -3.993 1.00 0.00 N ATOM 386 CA TYR A 77 -19.595 2.701 -4.636 1.00 0.00 C ATOM 387 C TYR A 77 -18.761 1.863 -3.662 1.00 0.00 C ATOM 388 O TYR A 77 -18.785 0.635 -3.740 1.00 0.00 O ATOM 389 CB TYR A 77 -18.840 3.008 -5.939 1.00 0.00 C ATOM 390 CG TYR A 77 -19.068 2.001 -7.052 1.00 0.00 C ATOM 391 CD1 TYR A 77 -20.379 1.787 -7.525 1.00 0.00 C ATOM 392 CD2 TYR A 77 -17.981 1.372 -7.693 1.00 0.00 C ATOM 393 CE1 TYR A 77 -20.612 0.910 -8.596 1.00 0.00 C ATOM 394 CE2 TYR A 77 -18.204 0.557 -8.819 1.00 0.00 C ATOM 395 CZ TYR A 77 -19.522 0.281 -9.236 1.00 0.00 C ATOM 396 OH TYR A 77 -19.727 -0.578 -10.265 1.00 0.00 O ATOM 0 H TYR A 77 -19.605 4.783 -4.375 1.00 0.00 H new ATOM 0 HA TYR A 77 -20.470 2.110 -4.907 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -19.138 3.995 -6.293 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -17.773 3.056 -5.723 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -21.208 2.300 -7.061 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -16.978 1.515 -7.320 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -21.621 0.717 -8.929 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -17.367 0.144 -9.362 1.00 0.00 H new ATOM 0 HH TYR A 77 -18.865 -0.916 -10.586 1.00 0.00 H new ATOM 406 N TYR A 78 -18.030 2.489 -2.732 1.00 0.00 N ATOM 407 CA TYR A 78 -17.325 1.794 -1.661 1.00 0.00 C ATOM 408 C TYR A 78 -18.361 1.052 -0.811 1.00 0.00 C ATOM 409 O TYR A 78 -18.340 -0.173 -0.794 1.00 0.00 O ATOM 410 CB TYR A 78 -16.507 2.786 -0.818 1.00 0.00 C ATOM 411 CG TYR A 78 -15.324 2.194 -0.087 1.00 0.00 C ATOM 412 CD1 TYR A 78 -15.536 1.287 0.961 1.00 0.00 C ATOM 413 CD2 TYR A 78 -14.014 2.585 -0.409 1.00 0.00 C ATOM 414 CE1 TYR A 78 -14.448 0.688 1.616 1.00 0.00 C ATOM 415 CE2 TYR A 78 -12.927 2.071 0.322 1.00 0.00 C ATOM 416 CZ TYR A 78 -13.134 1.075 1.295 1.00 0.00 C ATOM 417 OH TYR A 78 -12.075 0.462 1.877 1.00 0.00 O ATOM 0 H TYR A 78 -17.913 3.502 -2.706 1.00 0.00 H new ATOM 0 HA TYR A 78 -16.618 1.076 -2.077 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -16.148 3.582 -1.471 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -17.170 3.248 -0.087 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -16.544 1.047 1.267 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -13.841 3.280 -1.217 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -14.620 -0.070 2.366 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -11.930 2.442 0.136 1.00 0.00 H new ATOM 0 HH TYR A 78 -11.243 0.854 1.538 1.00 0.00 H new ATOM 427 N GLU A 79 -19.297 1.780 -0.184 1.00 0.00 N ATOM 428 CA GLU A 79 -20.417 1.277 0.627 1.00 0.00 C ATOM 429 C GLU A 79 -21.116 0.087 -0.028 1.00 0.00 C ATOM 430 O GLU A 79 -21.524 -0.868 0.639 1.00 0.00 O ATOM 431 CB GLU A 79 -21.443 2.412 0.777 1.00 0.00 C ATOM 432 CG GLU A 79 -21.166 3.338 1.960 1.00 0.00 C ATOM 433 CD GLU A 79 -21.534 2.721 3.310 1.00 0.00 C ATOM 434 OE1 GLU A 79 -22.076 1.591 3.362 1.00 0.00 O ATOM 435 OE2 GLU A 79 -21.256 3.329 4.362 1.00 0.00 O ATOM 0 H GLU A 79 -19.292 2.799 -0.232 1.00 0.00 H new ATOM 0 HA GLU A 79 -20.021 0.949 1.588 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -21.456 3.002 -0.140 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -22.437 1.979 0.891 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -20.109 3.603 1.965 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -21.726 4.264 1.827 1.00 0.00 H new ATOM 442 N ALA A 80 -21.248 0.130 -1.351 1.00 0.00 N ATOM 443 CA ALA A 80 -21.789 -0.980 -2.099 1.00 0.00 C ATOM 444 C ALA A 80 -20.871 -2.195 -2.113 1.00 0.00 C ATOM 445 O ALA A 80 -21.262 -3.271 -1.654 1.00 0.00 O ATOM 446 CB ALA A 80 -22.138 -0.527 -3.518 1.00 0.00 C ATOM 0 H ALA A 80 -20.983 0.932 -1.923 1.00 0.00 H new ATOM 0 HA ALA A 80 -22.698 -1.304 -1.591 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -22.546 -1.368 -4.079 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -22.878 0.272 -3.473 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -21.239 -0.162 -4.015 1.00 0.00 H new ATOM 452 N ASN A 81 -19.685 -2.074 -2.698 1.00 0.00 N ATOM 453 CA ASN A 81 -18.862 -3.213 -3.080 1.00 0.00 C ATOM 454 C ASN A 81 -17.429 -2.991 -2.609 1.00 0.00 C ATOM 455 O ASN A 81 -16.527 -2.824 -3.415 1.00 0.00 O ATOM 456 CB ASN A 81 -19.041 -3.536 -4.585 1.00 0.00 C ATOM 457 CG ASN A 81 -19.033 -2.361 -5.558 1.00 0.00 C ATOM 458 OD1 ASN A 81 -20.005 -2.134 -6.276 1.00 0.00 O ATOM 459 ND2 ASN A 81 -17.954 -1.609 -5.613 1.00 0.00 N ATOM 0 H ASN A 81 -19.264 -1.172 -2.922 1.00 0.00 H new ATOM 0 HA ASN A 81 -19.189 -4.122 -2.575 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -18.248 -4.223 -4.879 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -19.985 -4.068 -4.706 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -17.914 -0.821 -6.260 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -17.158 -1.814 -5.009 1.00 0.00 H new ATOM 466 N TYR A 82 -17.222 -2.997 -1.291 1.00 0.00 N ATOM 467 CA TYR A 82 -15.963 -2.620 -0.641 1.00 0.00 C ATOM 468 C TYR A 82 -14.948 -3.758 -0.518 1.00 0.00 C ATOM 469 O TYR A 82 -13.750 -3.552 -0.687 1.00 0.00 O ATOM 470 CB TYR A 82 -16.275 -2.080 0.759 1.00 0.00 C ATOM 471 CG TYR A 82 -17.306 -2.863 1.547 1.00 0.00 C ATOM 472 CD1 TYR A 82 -16.894 -3.992 2.281 1.00 0.00 C ATOM 473 CD2 TYR A 82 -18.663 -2.465 1.557 1.00 0.00 C ATOM 474 CE1 TYR A 82 -17.821 -4.741 3.021 1.00 0.00 C ATOM 475 CE2 TYR A 82 -19.588 -3.191 2.327 1.00 0.00 C ATOM 476 CZ TYR A 82 -19.169 -4.324 3.064 1.00 0.00 C ATOM 477 OH TYR A 82 -20.046 -5.031 3.824 1.00 0.00 O ATOM 0 H TYR A 82 -17.945 -3.272 -0.626 1.00 0.00 H new ATOM 0 HA TYR A 82 -15.500 -1.868 -1.280 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -15.349 -2.052 1.333 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -16.621 -1.051 0.663 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -15.854 -4.284 2.274 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -18.985 -1.612 0.979 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -17.507 -5.627 3.552 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -20.623 -2.883 2.356 1.00 0.00 H new ATOM 0 HH TYR A 82 -20.936 -4.627 3.758 1.00 0.00 H new ATOM 487 N TRP A 83 -15.404 -4.983 -0.241 1.00 0.00 N ATOM 488 CA TRP A 83 -14.577 -6.183 -0.042 1.00 0.00 C ATOM 489 C TRP A 83 -13.917 -6.672 -1.345 1.00 0.00 C ATOM 490 O TRP A 83 -13.304 -7.740 -1.396 1.00 0.00 O ATOM 491 CB TRP A 83 -15.477 -7.265 0.556 1.00 0.00 C ATOM 492 CG TRP A 83 -16.628 -7.694 -0.307 1.00 0.00 C ATOM 493 CD1 TRP A 83 -17.799 -7.037 -0.467 1.00 0.00 C ATOM 494 CD2 TRP A 83 -16.731 -8.893 -1.129 1.00 0.00 C ATOM 495 NE1 TRP A 83 -18.619 -7.750 -1.313 1.00 0.00 N ATOM 496 CE2 TRP A 83 -18.017 -8.911 -1.745 1.00 0.00 C ATOM 497 CE3 TRP A 83 -15.864 -9.969 -1.409 1.00 0.00 C ATOM 498 CZ2 TRP A 83 -18.426 -9.956 -2.585 1.00 0.00 C ATOM 499 CZ3 TRP A 83 -16.265 -11.026 -2.248 1.00 0.00 C ATOM 500 CH2 TRP A 83 -17.545 -11.024 -2.828 1.00 0.00 C ATOM 0 H TRP A 83 -16.401 -5.177 -0.145 1.00 0.00 H new ATOM 0 HA TRP A 83 -13.753 -5.944 0.631 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -14.866 -8.140 0.779 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -15.872 -6.902 1.505 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -18.053 -6.096 -0.002 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -19.556 -7.455 -1.586 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -14.876 -9.983 -0.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -19.406 -9.941 -3.040 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -15.586 -11.842 -2.447 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -17.852 -11.844 -3.461 1.00 0.00 H new ATOM 511 N GLN A 84 -14.104 -5.894 -2.406 1.00 0.00 N ATOM 512 CA GLN A 84 -13.695 -6.088 -3.783 1.00 0.00 C ATOM 513 C GLN A 84 -12.431 -5.264 -4.073 1.00 0.00 C ATOM 514 O GLN A 84 -12.053 -5.094 -5.230 1.00 0.00 O ATOM 515 CB GLN A 84 -14.882 -5.652 -4.645 1.00 0.00 C ATOM 516 CG GLN A 84 -16.082 -6.593 -4.465 1.00 0.00 C ATOM 517 CD GLN A 84 -16.100 -7.769 -5.437 1.00 0.00 C ATOM 518 OE1 GLN A 84 -15.629 -7.693 -6.573 1.00 0.00 O ATOM 519 NE2 GLN A 84 -16.675 -8.881 -5.021 1.00 0.00 N ATOM 0 H GLN A 84 -14.605 -5.011 -2.303 1.00 0.00 H new ATOM 0 HA GLN A 84 -13.440 -7.126 -3.998 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.172 -4.635 -4.380 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -14.585 -5.635 -5.694 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -16.079 -6.978 -3.445 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -17.001 -6.020 -4.587 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -17.062 -8.933 -4.079 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -16.733 -9.688 -5.642 1.00 0.00 H new ATOM 528 N PHE A 85 -11.821 -4.692 -3.033 1.00 0.00 N ATOM 529 CA PHE A 85 -10.702 -3.771 -3.062 1.00 0.00 C ATOM 530 C PHE A 85 -9.773 -4.135 -1.902 1.00 0.00 C ATOM 531 O PHE A 85 -10.231 -4.750 -0.933 1.00 0.00 O ATOM 532 CB PHE A 85 -11.215 -2.345 -2.839 1.00 0.00 C ATOM 533 CG PHE A 85 -12.064 -1.747 -3.935 1.00 0.00 C ATOM 534 CD1 PHE A 85 -13.413 -2.121 -4.065 1.00 0.00 C ATOM 535 CD2 PHE A 85 -11.546 -0.721 -4.742 1.00 0.00 C ATOM 536 CE1 PHE A 85 -14.227 -1.470 -5.002 1.00 0.00 C ATOM 537 CE2 PHE A 85 -12.369 -0.072 -5.671 1.00 0.00 C ATOM 538 CZ PHE A 85 -13.707 -0.452 -5.805 1.00 0.00 C ATOM 0 H PHE A 85 -12.127 -4.881 -2.078 1.00 0.00 H new ATOM 0 HA PHE A 85 -10.184 -3.831 -4.019 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -11.794 -2.333 -1.916 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -10.354 -1.695 -2.683 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -13.820 -2.906 -3.446 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -10.510 -0.432 -4.646 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -15.263 -1.757 -5.104 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.969 0.722 -6.284 1.00 0.00 H new ATOM 0 HZ PHE A 85 -14.339 0.041 -6.529 1.00 0.00 H new ATOM 548 N PRO A 86 -8.485 -3.757 -1.962 1.00 0.00 N ATOM 549 CA PRO A 86 -7.527 -4.045 -0.909 1.00 0.00 C ATOM 550 C PRO A 86 -7.876 -3.327 0.410 1.00 0.00 C ATOM 551 O PRO A 86 -8.748 -2.458 0.451 1.00 0.00 O ATOM 552 CB PRO A 86 -6.158 -3.642 -1.461 1.00 0.00 C ATOM 553 CG PRO A 86 -6.481 -2.655 -2.577 1.00 0.00 C ATOM 554 CD PRO A 86 -7.844 -3.097 -3.081 1.00 0.00 C ATOM 0 HA PRO A 86 -7.537 -5.103 -0.646 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.537 -3.184 -0.691 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -5.611 -4.506 -1.839 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.506 -1.630 -2.207 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.733 -2.690 -3.369 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.431 -2.243 -3.420 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -7.746 -3.774 -3.930 1.00 0.00 H new ATOM 562 N ASP A 87 -7.145 -3.678 1.475 1.00 0.00 N ATOM 563 CA ASP A 87 -7.106 -2.970 2.767 1.00 0.00 C ATOM 564 C ASP A 87 -5.657 -2.644 3.185 1.00 0.00 C ATOM 565 O ASP A 87 -5.404 -1.961 4.176 1.00 0.00 O ATOM 566 CB ASP A 87 -7.817 -3.803 3.840 1.00 0.00 C ATOM 567 CG ASP A 87 -7.716 -3.179 5.238 1.00 0.00 C ATOM 568 OD1 ASP A 87 -8.399 -2.176 5.527 1.00 0.00 O ATOM 569 OD2 ASP A 87 -7.050 -3.784 6.103 1.00 0.00 O ATOM 0 H ASP A 87 -6.538 -4.497 1.463 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.631 -2.021 2.657 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.868 -3.914 3.571 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.386 -4.804 3.862 1.00 0.00 H new ATOM 574 N GLY A 88 -4.687 -3.091 2.388 1.00 0.00 N ATOM 575 CA GLY A 88 -3.274 -2.797 2.494 1.00 0.00 C ATOM 576 C GLY A 88 -2.594 -3.368 1.252 1.00 0.00 C ATOM 577 O GLY A 88 -3.222 -4.108 0.476 1.00 0.00 O ATOM 0 H GLY A 88 -4.890 -3.708 1.602 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.110 -1.722 2.561 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.857 -3.240 3.398 1.00 0.00 H new ATOM 581 N ILE A 89 -1.322 -3.025 1.062 1.00 0.00 N ATOM 582 CA ILE A 89 -0.470 -3.520 -0.010 1.00 0.00 C ATOM 583 C ILE A 89 0.795 -4.092 0.630 1.00 0.00 C ATOM 584 O ILE A 89 1.231 -3.631 1.686 1.00 0.00 O ATOM 585 CB ILE A 89 -0.141 -2.385 -1.010 1.00 0.00 C ATOM 586 CG1 ILE A 89 -1.390 -1.726 -1.627 1.00 0.00 C ATOM 587 CG2 ILE A 89 0.793 -2.877 -2.130 1.00 0.00 C ATOM 588 CD1 ILE A 89 -2.225 -2.628 -2.543 1.00 0.00 C ATOM 0 H ILE A 89 -0.840 -2.369 1.676 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.978 -4.300 -0.578 1.00 0.00 H new ATOM 0 HB ILE A 89 0.367 -1.621 -0.421 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.028 -1.368 -0.819 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.075 -0.851 -2.196 1.00 0.00 H new ATOM 0 HG21 ILE A 89 1.004 -2.056 -2.815 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.726 -3.235 -1.695 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.311 -3.689 -2.675 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.079 -2.068 -2.924 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.611 -2.967 -3.378 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.579 -3.491 -1.979 1.00 0.00 H new ATOM 600 N HIS A 90 1.381 -5.084 -0.037 1.00 0.00 N ATOM 601 CA HIS A 90 2.626 -5.721 0.352 1.00 0.00 C ATOM 602 C HIS A 90 3.783 -4.796 -0.040 1.00 0.00 C ATOM 603 O HIS A 90 4.007 -3.788 0.629 1.00 0.00 O ATOM 604 CB HIS A 90 2.704 -7.114 -0.294 1.00 0.00 C ATOM 605 CG HIS A 90 1.536 -7.990 0.056 1.00 0.00 C ATOM 606 ND1 HIS A 90 0.280 -7.931 -0.504 1.00 0.00 N ATOM 607 CD2 HIS A 90 1.560 -9.057 0.909 1.00 0.00 C ATOM 608 CE1 HIS A 90 -0.429 -8.953 -0.013 1.00 0.00 C ATOM 609 NE2 HIS A 90 0.296 -9.653 0.874 1.00 0.00 N ATOM 0 H HIS A 90 0.984 -5.476 -0.891 1.00 0.00 H new ATOM 0 HA HIS A 90 2.685 -5.877 1.429 1.00 0.00 H new ATOM 0 HB2 HIS A 90 2.756 -7.004 -1.377 1.00 0.00 H new ATOM 0 HB3 HIS A 90 3.625 -7.603 0.021 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -0.050 -7.234 -1.172 1.00 0.00 H new ATOM 0 HD2 HIS A 90 2.402 -9.381 1.502 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -1.446 -9.184 -0.292 1.00 0.00 H new ATOM 617 N TYR A 91 4.471 -5.089 -1.155 1.00 0.00 N ATOM 618 CA TYR A 91 5.549 -4.311 -1.785 1.00 0.00 C ATOM 619 C TYR A 91 6.883 -4.340 -1.014 1.00 0.00 C ATOM 620 O TYR A 91 7.910 -3.929 -1.562 1.00 0.00 O ATOM 621 CB TYR A 91 5.076 -2.868 -2.034 1.00 0.00 C ATOM 622 CG TYR A 91 5.851 -1.977 -2.986 1.00 0.00 C ATOM 623 CD1 TYR A 91 6.646 -2.479 -4.038 1.00 0.00 C ATOM 624 CD2 TYR A 91 5.693 -0.589 -2.835 1.00 0.00 C ATOM 625 CE1 TYR A 91 7.274 -1.602 -4.935 1.00 0.00 C ATOM 626 CE2 TYR A 91 6.352 0.300 -3.700 1.00 0.00 C ATOM 627 CZ TYR A 91 7.141 -0.205 -4.757 1.00 0.00 C ATOM 628 OH TYR A 91 7.744 0.660 -5.613 1.00 0.00 O ATOM 0 H TYR A 91 4.273 -5.941 -1.679 1.00 0.00 H new ATOM 0 HA TYR A 91 5.766 -4.795 -2.737 1.00 0.00 H new ATOM 0 HB2 TYR A 91 4.050 -2.920 -2.399 1.00 0.00 H new ATOM 0 HB3 TYR A 91 5.046 -2.364 -1.068 1.00 0.00 H new ATOM 0 HD1 TYR A 91 6.772 -3.545 -4.153 1.00 0.00 H new ATOM 0 HD2 TYR A 91 5.061 -0.203 -2.049 1.00 0.00 H new ATOM 0 HE1 TYR A 91 7.856 -1.991 -5.757 1.00 0.00 H new ATOM 0 HE2 TYR A 91 6.256 1.366 -3.557 1.00 0.00 H new ATOM 0 HH TYR A 91 7.546 1.581 -5.342 1.00 0.00 H new ATOM 638 N ASN A 92 6.885 -4.887 0.208 1.00 0.00 N ATOM 639 CA ASN A 92 7.772 -4.589 1.337 1.00 0.00 C ATOM 640 C ASN A 92 7.480 -3.188 1.864 1.00 0.00 C ATOM 641 O ASN A 92 7.090 -2.287 1.120 1.00 0.00 O ATOM 642 CB ASN A 92 9.280 -4.753 1.060 1.00 0.00 C ATOM 643 CG ASN A 92 9.759 -6.199 1.019 1.00 0.00 C ATOM 644 OD1 ASN A 92 8.997 -7.122 0.746 1.00 0.00 O ATOM 645 ND2 ASN A 92 11.038 -6.433 1.259 1.00 0.00 N ATOM 0 H ASN A 92 6.209 -5.610 0.452 1.00 0.00 H new ATOM 0 HA ASN A 92 7.546 -5.346 2.088 1.00 0.00 H new ATOM 0 HB2 ASN A 92 9.516 -4.278 0.108 1.00 0.00 H new ATOM 0 HB3 ASN A 92 9.838 -4.220 1.829 1.00 0.00 H new ATOM 0 HD21 ASN A 92 11.398 -7.386 1.218 1.00 0.00 H new ATOM 0 HD22 ASN A 92 11.664 -5.660 1.485 1.00 0.00 H new ATOM 652 N GLY A 93 7.737 -2.994 3.154 1.00 0.00 N ATOM 653 CA GLY A 93 7.735 -1.701 3.795 1.00 0.00 C ATOM 654 C GLY A 93 9.099 -1.070 3.565 1.00 0.00 C ATOM 655 O GLY A 93 10.114 -1.650 3.972 1.00 0.00 O ATOM 0 H GLY A 93 7.957 -3.759 3.792 1.00 0.00 H new ATOM 0 HA2 GLY A 93 6.947 -1.071 3.382 1.00 0.00 H new ATOM 0 HA3 GLY A 93 7.536 -1.803 4.862 1.00 0.00 H new ATOM 659 N CYS A 94 9.094 0.097 2.929 1.00 0.00 N ATOM 660 CA CYS A 94 10.173 1.001 2.626 1.00 0.00 C ATOM 661 C CYS A 94 11.072 0.466 1.521 1.00 0.00 C ATOM 662 O CYS A 94 10.956 -0.682 1.081 1.00 0.00 O ATOM 663 CB CYS A 94 10.918 1.455 3.889 1.00 0.00 C ATOM 664 SG CYS A 94 11.331 3.217 3.833 1.00 0.00 S ATOM 0 H CYS A 94 8.213 0.468 2.573 1.00 0.00 H new ATOM 0 HA CYS A 94 9.737 1.912 2.217 1.00 0.00 H new ATOM 0 HB2 CYS A 94 10.302 1.254 4.766 1.00 0.00 H new ATOM 0 HB3 CYS A 94 11.832 0.871 4.001 1.00 0.00 H new ATOM 669 N SER A 95 11.897 1.372 1.023 1.00 0.00 N ATOM 670 CA SER A 95 12.837 1.175 -0.081 1.00 0.00 C ATOM 671 C SER A 95 13.896 2.279 -0.179 1.00 0.00 C ATOM 672 O SER A 95 15.023 2.012 -0.603 1.00 0.00 O ATOM 673 CB SER A 95 12.056 1.110 -1.401 1.00 0.00 C ATOM 674 OG SER A 95 11.056 2.117 -1.470 1.00 0.00 O ATOM 0 H SER A 95 11.935 2.321 1.396 1.00 0.00 H new ATOM 0 HA SER A 95 13.366 0.242 0.113 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.745 1.224 -2.238 1.00 0.00 H new ATOM 0 HB3 SER A 95 11.592 0.129 -1.501 1.00 0.00 H new ATOM 0 HG SER A 95 10.580 2.047 -2.324 1.00 0.00 H new ATOM 680 N GLU A 96 13.579 3.511 0.224 1.00 0.00 N ATOM 681 CA GLU A 96 14.389 4.706 -0.001 1.00 0.00 C ATOM 682 C GLU A 96 14.388 5.578 1.243 1.00 0.00 C ATOM 683 O GLU A 96 13.578 5.396 2.152 1.00 0.00 O ATOM 684 CB GLU A 96 13.797 5.504 -1.188 1.00 0.00 C ATOM 685 CG GLU A 96 14.600 5.394 -2.493 1.00 0.00 C ATOM 686 CD GLU A 96 15.808 6.337 -2.526 1.00 0.00 C ATOM 687 OE1 GLU A 96 16.425 6.594 -1.460 1.00 0.00 O ATOM 688 OE2 GLU A 96 16.183 6.809 -3.622 1.00 0.00 O ATOM 0 H GLU A 96 12.719 3.709 0.735 1.00 0.00 H new ATOM 0 HA GLU A 96 15.413 4.409 -0.226 1.00 0.00 H new ATOM 0 HB2 GLU A 96 12.780 5.157 -1.372 1.00 0.00 H new ATOM 0 HB3 GLU A 96 13.729 6.555 -0.905 1.00 0.00 H new ATOM 0 HG2 GLU A 96 14.943 4.367 -2.618 1.00 0.00 H new ATOM 0 HG3 GLU A 96 13.947 5.617 -3.337 1.00 0.00 H new ATOM 695 N ALA A 97 15.244 6.592 1.206 1.00 0.00 N ATOM 696 CA ALA A 97 15.260 7.704 2.140 1.00 0.00 C ATOM 697 C ALA A 97 15.094 9.046 1.422 1.00 0.00 C ATOM 698 O ALA A 97 14.889 10.070 2.068 1.00 0.00 O ATOM 699 CB ALA A 97 16.564 7.624 2.917 1.00 0.00 C ATOM 0 H ALA A 97 15.973 6.662 0.496 1.00 0.00 H new ATOM 0 HA ALA A 97 14.416 7.637 2.827 1.00 0.00 H new ATOM 0 HB1 ALA A 97 16.613 8.446 3.631 1.00 0.00 H new ATOM 0 HB2 ALA A 97 16.611 6.675 3.452 1.00 0.00 H new ATOM 0 HB3 ALA A 97 17.404 7.693 2.226 1.00 0.00 H new ATOM 705 N ASN A 98 15.134 9.059 0.087 1.00 0.00 N ATOM 706 CA ASN A 98 14.879 10.232 -0.739 1.00 0.00 C ATOM 707 C ASN A 98 13.797 9.839 -1.726 1.00 0.00 C ATOM 708 O ASN A 98 14.086 9.378 -2.834 1.00 0.00 O ATOM 709 CB ASN A 98 16.157 10.724 -1.429 1.00 0.00 C ATOM 710 CG ASN A 98 17.042 11.441 -0.429 1.00 0.00 C ATOM 711 OD1 ASN A 98 16.868 12.624 -0.160 1.00 0.00 O ATOM 712 ND2 ASN A 98 17.960 10.744 0.210 1.00 0.00 N ATOM 0 H ASN A 98 15.352 8.227 -0.461 1.00 0.00 H new ATOM 0 HA ASN A 98 14.545 11.075 -0.134 1.00 0.00 H new ATOM 0 HB2 ASN A 98 16.694 9.880 -1.863 1.00 0.00 H new ATOM 0 HB3 ASN A 98 15.902 11.396 -2.249 1.00 0.00 H new ATOM 0 HD21 ASN A 98 18.528 11.189 0.931 1.00 0.00 H new ATOM 0 HD22 ASN A 98 18.102 9.760 -0.016 1.00 0.00 H new ATOM 719 N VAL A 99 12.547 9.915 -1.279 1.00 0.00 N ATOM 720 CA VAL A 99 11.371 9.612 -2.066 1.00 0.00 C ATOM 721 C VAL A 99 10.208 10.405 -1.474 1.00 0.00 C ATOM 722 O VAL A 99 10.298 10.934 -0.367 1.00 0.00 O ATOM 723 CB VAL A 99 11.157 8.091 -2.039 1.00 0.00 C ATOM 724 CG1 VAL A 99 10.756 7.604 -0.642 1.00 0.00 C ATOM 725 CG2 VAL A 99 10.167 7.609 -3.093 1.00 0.00 C ATOM 0 H VAL A 99 12.325 10.200 -0.325 1.00 0.00 H new ATOM 0 HA VAL A 99 11.468 9.900 -3.113 1.00 0.00 H new ATOM 0 HB VAL A 99 12.120 7.647 -2.291 1.00 0.00 H new ATOM 0 HG11 VAL A 99 10.613 6.524 -0.660 1.00 0.00 H new ATOM 0 HG12 VAL A 99 11.543 7.854 0.070 1.00 0.00 H new ATOM 0 HG13 VAL A 99 9.827 8.088 -0.341 1.00 0.00 H new ATOM 0 HG21 VAL A 99 10.059 6.527 -3.023 1.00 0.00 H new ATOM 0 HG22 VAL A 99 9.199 8.082 -2.926 1.00 0.00 H new ATOM 0 HG23 VAL A 99 10.534 7.873 -4.085 1.00 0.00 H new ATOM 735 N THR A 100 9.094 10.462 -2.187 1.00 0.00 N ATOM 736 CA THR A 100 7.961 11.305 -1.841 1.00 0.00 C ATOM 737 C THR A 100 6.662 10.517 -1.876 1.00 0.00 C ATOM 738 O THR A 100 6.597 9.401 -2.403 1.00 0.00 O ATOM 739 CB THR A 100 7.941 12.515 -2.800 1.00 0.00 C ATOM 740 OG1 THR A 100 8.002 12.115 -4.160 1.00 0.00 O ATOM 741 CG2 THR A 100 9.089 13.483 -2.518 1.00 0.00 C ATOM 0 H THR A 100 8.950 9.915 -3.036 1.00 0.00 H new ATOM 0 HA THR A 100 8.064 11.670 -0.819 1.00 0.00 H new ATOM 0 HB THR A 100 6.993 13.022 -2.621 1.00 0.00 H new ATOM 0 HG1 THR A 100 7.985 12.908 -4.735 1.00 0.00 H new ATOM 0 HG21 THR A 100 9.039 14.320 -3.214 1.00 0.00 H new ATOM 0 HG22 THR A 100 9.008 13.855 -1.497 1.00 0.00 H new ATOM 0 HG23 THR A 100 10.040 12.965 -2.641 1.00 0.00 H new ATOM 749 N LYS A 101 5.600 11.123 -1.339 1.00 0.00 N ATOM 750 CA LYS A 101 4.266 10.555 -1.358 1.00 0.00 C ATOM 751 C LYS A 101 3.685 10.476 -2.765 1.00 0.00 C ATOM 752 O LYS A 101 2.685 9.790 -2.958 1.00 0.00 O ATOM 753 CB LYS A 101 3.336 11.424 -0.502 1.00 0.00 C ATOM 754 CG LYS A 101 2.719 10.547 0.570 1.00 0.00 C ATOM 755 CD LYS A 101 1.587 11.273 1.301 1.00 0.00 C ATOM 756 CE LYS A 101 0.298 11.244 0.473 1.00 0.00 C ATOM 757 NZ LYS A 101 -0.651 12.289 0.902 1.00 0.00 N ATOM 0 H LYS A 101 5.651 12.031 -0.876 1.00 0.00 H new ATOM 0 HA LYS A 101 4.341 9.541 -0.964 1.00 0.00 H new ATOM 0 HB2 LYS A 101 3.893 12.244 -0.048 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.558 11.872 -1.121 1.00 0.00 H new ATOM 0 HG2 LYS A 101 2.335 9.633 0.118 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.486 10.251 1.286 1.00 0.00 H new ATOM 0 HD2 LYS A 101 1.413 10.803 2.269 1.00 0.00 H new ATOM 0 HD3 LYS A 101 1.877 12.306 1.495 1.00 0.00 H new ATOM 0 HE2 LYS A 101 0.539 11.382 -0.581 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.172 10.265 0.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -1.511 12.238 0.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -0.901 12.142 1.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.211 13.225 0.789 1.00 0.00 H new ATOM 771 N GLU A 102 4.252 11.206 -3.722 1.00 0.00 N ATOM 772 CA GLU A 102 4.054 10.907 -5.118 1.00 0.00 C ATOM 773 C GLU A 102 4.910 9.683 -5.437 1.00 0.00 C ATOM 774 O GLU A 102 4.363 8.604 -5.633 1.00 0.00 O ATOM 775 CB GLU A 102 4.403 12.136 -5.978 1.00 0.00 C ATOM 776 CG GLU A 102 3.218 12.562 -6.845 1.00 0.00 C ATOM 777 CD GLU A 102 2.667 11.444 -7.744 1.00 0.00 C ATOM 778 OE1 GLU A 102 3.437 10.586 -8.223 1.00 0.00 O ATOM 779 OE2 GLU A 102 1.429 11.399 -7.948 1.00 0.00 O ATOM 0 H GLU A 102 4.853 12.011 -3.544 1.00 0.00 H new ATOM 0 HA GLU A 102 3.013 10.677 -5.345 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.699 12.962 -5.332 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.258 11.906 -6.614 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.418 12.921 -6.198 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.522 13.401 -7.471 1.00 0.00 H new ATOM 786 N ALA A 103 6.239 9.837 -5.441 1.00 0.00 N ATOM 787 CA ALA A 103 7.165 8.907 -6.066 1.00 0.00 C ATOM 788 C ALA A 103 6.996 7.461 -5.601 1.00 0.00 C ATOM 789 O ALA A 103 6.879 6.573 -6.446 1.00 0.00 O ATOM 790 CB ALA A 103 8.600 9.390 -5.841 1.00 0.00 C ATOM 0 H ALA A 103 6.703 10.631 -4.999 1.00 0.00 H new ATOM 0 HA ALA A 103 6.935 8.896 -7.131 1.00 0.00 H new ATOM 0 HB1 ALA A 103 9.296 8.694 -6.309 1.00 0.00 H new ATOM 0 HB2 ALA A 103 8.724 10.379 -6.282 1.00 0.00 H new ATOM 0 HB3 ALA A 103 8.803 9.442 -4.771 1.00 0.00 H new ATOM 796 N PHE A 104 7.002 7.221 -4.287 1.00 0.00 N ATOM 797 CA PHE A 104 6.938 5.878 -3.716 1.00 0.00 C ATOM 798 C PHE A 104 5.559 5.267 -3.970 1.00 0.00 C ATOM 799 O PHE A 104 5.466 4.109 -4.368 1.00 0.00 O ATOM 800 CB PHE A 104 7.300 5.907 -2.214 1.00 0.00 C ATOM 801 CG PHE A 104 6.449 5.003 -1.352 1.00 0.00 C ATOM 802 CD1 PHE A 104 6.732 3.627 -1.257 1.00 0.00 C ATOM 803 CD2 PHE A 104 5.302 5.533 -0.735 1.00 0.00 C ATOM 804 CE1 PHE A 104 5.867 2.782 -0.540 1.00 0.00 C ATOM 805 CE2 PHE A 104 4.413 4.677 -0.071 1.00 0.00 C ATOM 806 CZ PHE A 104 4.703 3.306 0.049 1.00 0.00 C ATOM 0 H PHE A 104 7.052 7.961 -3.586 1.00 0.00 H new ATOM 0 HA PHE A 104 7.675 5.242 -4.206 1.00 0.00 H new ATOM 0 HB2 PHE A 104 8.345 5.621 -2.099 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.207 6.930 -1.849 1.00 0.00 H new ATOM 0 HD1 PHE A 104 7.612 3.221 -1.734 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.107 6.595 -0.773 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.096 1.731 -0.442 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.501 5.072 0.351 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.033 2.657 0.593 1.00 0.00 H new ATOM 816 N VAL A 105 4.481 6.030 -3.768 1.00 0.00 N ATOM 817 CA VAL A 105 3.126 5.528 -3.972 1.00 0.00 C ATOM 818 C VAL A 105 2.941 5.206 -5.458 1.00 0.00 C ATOM 819 O VAL A 105 2.404 4.163 -5.815 1.00 0.00 O ATOM 820 CB VAL A 105 2.109 6.559 -3.454 1.00 0.00 C ATOM 821 CG1 VAL A 105 0.676 6.133 -3.759 1.00 0.00 C ATOM 822 CG2 VAL A 105 2.224 6.811 -1.945 1.00 0.00 C ATOM 0 H VAL A 105 4.525 7.002 -3.462 1.00 0.00 H new ATOM 0 HA VAL A 105 2.959 4.610 -3.409 1.00 0.00 H new ATOM 0 HB VAL A 105 2.348 7.483 -3.980 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.016 6.885 -3.379 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.548 6.034 -4.837 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.471 5.176 -3.279 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.480 7.548 -1.641 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.053 5.879 -1.406 1.00 0.00 H new ATOM 0 HG23 VAL A 105 3.221 7.186 -1.714 1.00 0.00 H new ATOM 832 N THR A 106 3.424 6.066 -6.345 1.00 0.00 N ATOM 833 CA THR A 106 3.492 5.806 -7.762 1.00 0.00 C ATOM 834 C THR A 106 4.285 4.521 -8.038 1.00 0.00 C ATOM 835 O THR A 106 3.825 3.704 -8.835 1.00 0.00 O ATOM 836 CB THR A 106 4.048 7.070 -8.425 1.00 0.00 C ATOM 837 OG1 THR A 106 2.994 8.020 -8.449 1.00 0.00 O ATOM 838 CG2 THR A 106 4.538 6.789 -9.834 1.00 0.00 C ATOM 0 H THR A 106 3.786 6.983 -6.085 1.00 0.00 H new ATOM 0 HA THR A 106 2.512 5.608 -8.197 1.00 0.00 H new ATOM 0 HB THR A 106 4.905 7.443 -7.864 1.00 0.00 H new ATOM 0 HG1 THR A 106 3.350 8.898 -8.700 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.926 7.708 -10.274 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.329 6.040 -9.801 1.00 0.00 H new ATOM 0 HG23 THR A 106 3.711 6.417 -10.439 1.00 0.00 H new ATOM 846 N GLY A 107 5.430 4.295 -7.390 1.00 0.00 N ATOM 847 CA GLY A 107 6.169 3.041 -7.484 1.00 0.00 C ATOM 848 C GLY A 107 5.289 1.856 -7.084 1.00 0.00 C ATOM 849 O GLY A 107 5.247 0.847 -7.797 1.00 0.00 O ATOM 0 H GLY A 107 5.871 4.985 -6.781 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.530 2.903 -8.503 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.046 3.082 -6.838 1.00 0.00 H new ATOM 853 N CYS A 108 4.538 1.995 -5.990 1.00 0.00 N ATOM 854 CA CYS A 108 3.664 0.931 -5.493 1.00 0.00 C ATOM 855 C CYS A 108 2.561 0.648 -6.509 1.00 0.00 C ATOM 856 O CYS A 108 2.127 -0.489 -6.670 1.00 0.00 O ATOM 857 CB CYS A 108 3.102 1.223 -4.086 1.00 0.00 C ATOM 858 SG CYS A 108 1.440 1.957 -3.966 1.00 0.00 S ATOM 0 H CYS A 108 4.518 2.844 -5.426 1.00 0.00 H new ATOM 0 HA CYS A 108 4.268 0.031 -5.378 1.00 0.00 H new ATOM 0 HB2 CYS A 108 3.095 0.287 -3.528 1.00 0.00 H new ATOM 0 HB3 CYS A 108 3.799 1.890 -3.580 1.00 0.00 H new ATOM 863 N ILE A 109 2.125 1.670 -7.241 1.00 0.00 N ATOM 864 CA ILE A 109 1.119 1.568 -8.278 1.00 0.00 C ATOM 865 C ILE A 109 1.670 0.907 -9.528 1.00 0.00 C ATOM 866 O ILE A 109 0.998 0.062 -10.110 1.00 0.00 O ATOM 867 CB ILE A 109 0.530 2.962 -8.516 1.00 0.00 C ATOM 868 CG1 ILE A 109 -0.651 3.081 -7.542 1.00 0.00 C ATOM 869 CG2 ILE A 109 0.102 3.246 -9.956 1.00 0.00 C ATOM 870 CD1 ILE A 109 -0.922 4.542 -7.235 1.00 0.00 C ATOM 0 H ILE A 109 2.478 2.619 -7.120 1.00 0.00 H new ATOM 0 HA ILE A 109 0.308 0.912 -7.961 1.00 0.00 H new ATOM 0 HB ILE A 109 1.301 3.712 -8.339 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -1.539 2.621 -7.975 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -0.430 2.542 -6.621 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -0.302 4.256 -10.023 1.00 0.00 H new ATOM 0 HG22 ILE A 109 0.964 3.155 -10.617 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -0.662 2.529 -10.256 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.761 4.619 -6.543 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -0.037 4.989 -6.783 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -1.163 5.069 -8.158 1.00 0.00 H new ATOM 882 N ASN A 110 2.886 1.259 -9.938 1.00 0.00 N ATOM 883 CA ASN A 110 3.565 0.578 -11.051 1.00 0.00 C ATOM 884 C ASN A 110 3.671 -0.913 -10.766 1.00 0.00 C ATOM 885 O ASN A 110 3.618 -1.738 -11.678 1.00 0.00 O ATOM 886 CB ASN A 110 4.990 1.101 -11.281 1.00 0.00 C ATOM 887 CG ASN A 110 5.038 2.378 -12.084 1.00 0.00 C ATOM 888 OD1 ASN A 110 5.495 2.387 -13.220 1.00 0.00 O ATOM 889 ND2 ASN A 110 4.639 3.482 -11.492 1.00 0.00 N ATOM 0 H ASN A 110 3.428 2.014 -9.518 1.00 0.00 H new ATOM 0 HA ASN A 110 2.965 0.775 -11.939 1.00 0.00 H new ATOM 0 HB2 ASN A 110 5.467 1.270 -10.316 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.571 0.335 -11.795 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.706 4.375 -11.980 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.262 3.445 -10.545 1.00 0.00 H new ATOM 896 N ALA A 111 3.827 -1.265 -9.494 1.00 0.00 N ATOM 897 CA ALA A 111 3.898 -2.633 -9.059 1.00 0.00 C ATOM 898 C ALA A 111 2.500 -3.248 -9.033 1.00 0.00 C ATOM 899 O ALA A 111 2.281 -4.308 -9.613 1.00 0.00 O ATOM 900 CB ALA A 111 4.610 -2.635 -7.714 1.00 0.00 C ATOM 0 H ALA A 111 3.908 -0.589 -8.734 1.00 0.00 H new ATOM 0 HA ALA A 111 4.467 -3.261 -9.744 1.00 0.00 H new ATOM 0 HB1 ALA A 111 4.687 -3.658 -7.344 1.00 0.00 H new ATOM 0 HB2 ALA A 111 5.609 -2.216 -7.831 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.045 -2.033 -7.002 1.00 0.00 H new ATOM 906 N THR A 112 1.534 -2.590 -8.397 1.00 0.00 N ATOM 907 CA THR A 112 0.204 -3.140 -8.184 1.00 0.00 C ATOM 908 C THR A 112 -0.584 -3.279 -9.493 1.00 0.00 C ATOM 909 O THR A 112 -1.360 -4.230 -9.626 1.00 0.00 O ATOM 910 CB THR A 112 -0.530 -2.311 -7.118 1.00 0.00 C ATOM 911 OG1 THR A 112 -1.494 -3.090 -6.467 1.00 0.00 O ATOM 912 CG2 THR A 112 -1.302 -1.144 -7.717 1.00 0.00 C ATOM 0 H THR A 112 1.656 -1.653 -8.013 1.00 0.00 H new ATOM 0 HA THR A 112 0.299 -4.158 -7.807 1.00 0.00 H new ATOM 0 HB THR A 112 0.249 -1.954 -6.444 1.00 0.00 H new ATOM 0 HG1 THR A 112 -1.061 -3.640 -5.781 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.802 -0.592 -6.921 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.612 -0.482 -8.241 1.00 0.00 H new ATOM 0 HG23 THR A 112 -2.046 -1.522 -8.419 1.00 0.00 H new ATOM 920 N GLN A 113 -0.380 -2.387 -10.474 1.00 0.00 N ATOM 921 CA GLN A 113 -1.069 -2.502 -11.762 1.00 0.00 C ATOM 922 C GLN A 113 -0.722 -3.843 -12.415 1.00 0.00 C ATOM 923 O GLN A 113 -1.582 -4.478 -13.028 1.00 0.00 O ATOM 924 CB GLN A 113 -0.771 -1.306 -12.692 1.00 0.00 C ATOM 925 CG GLN A 113 0.698 -1.180 -13.124 1.00 0.00 C ATOM 926 CD GLN A 113 0.990 -0.027 -14.077 1.00 0.00 C ATOM 927 OE1 GLN A 113 1.585 -0.231 -15.134 1.00 0.00 O ATOM 928 NE2 GLN A 113 0.648 1.194 -13.700 1.00 0.00 N ATOM 0 H GLN A 113 0.249 -1.588 -10.399 1.00 0.00 H new ATOM 0 HA GLN A 113 -2.144 -2.475 -11.581 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -1.392 -1.393 -13.584 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -1.067 -0.387 -12.186 1.00 0.00 H new ATOM 0 HG2 GLN A 113 1.315 -1.061 -12.233 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.003 -2.112 -13.600 1.00 0.00 H new ATOM 0 HE21 GLN A 113 0.155 1.336 -12.819 1.00 0.00 H new ATOM 0 HE22 GLN A 113 0.877 1.993 -14.291 1.00 0.00 H new ATOM 937 N ALA A 114 0.522 -4.292 -12.232 1.00 0.00 N ATOM 938 CA ALA A 114 1.016 -5.553 -12.740 1.00 0.00 C ATOM 939 C ALA A 114 0.857 -6.685 -11.724 1.00 0.00 C ATOM 940 O ALA A 114 0.912 -7.847 -12.120 1.00 0.00 O ATOM 941 CB ALA A 114 2.483 -5.363 -13.129 1.00 0.00 C ATOM 0 H ALA A 114 1.224 -3.767 -11.711 1.00 0.00 H new ATOM 0 HA ALA A 114 0.429 -5.846 -13.610 1.00 0.00 H new ATOM 0 HB1 ALA A 114 2.881 -6.301 -13.516 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.559 -4.592 -13.896 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.056 -5.060 -12.252 1.00 0.00 H new ATOM 947 N ALA A 115 0.622 -6.393 -10.437 1.00 0.00 N ATOM 948 CA ALA A 115 0.206 -7.426 -9.503 1.00 0.00 C ATOM 949 C ALA A 115 -1.139 -7.939 -10.000 1.00 0.00 C ATOM 950 O ALA A 115 -1.279 -9.126 -10.282 1.00 0.00 O ATOM 951 CB ALA A 115 0.131 -6.913 -8.055 1.00 0.00 C ATOM 0 H ALA A 115 0.714 -5.461 -10.032 1.00 0.00 H new ATOM 0 HA ALA A 115 0.941 -8.231 -9.472 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.184 -7.723 -7.398 1.00 0.00 H new ATOM 0 HB2 ALA A 115 1.113 -6.555 -7.745 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -0.589 -6.096 -7.995 1.00 0.00 H new ATOM 957 N ASN A 116 -2.106 -7.034 -10.140 1.00 0.00 N ATOM 958 CA ASN A 116 -3.509 -7.358 -10.326 1.00 0.00 C ATOM 959 C ASN A 116 -3.899 -6.978 -11.759 1.00 0.00 C ATOM 960 O ASN A 116 -4.825 -6.190 -11.968 1.00 0.00 O ATOM 961 CB ASN A 116 -4.376 -6.681 -9.235 1.00 0.00 C ATOM 962 CG ASN A 116 -3.753 -6.636 -7.848 1.00 0.00 C ATOM 963 OD1 ASN A 116 -3.851 -7.568 -7.054 1.00 0.00 O ATOM 964 ND2 ASN A 116 -3.066 -5.550 -7.549 1.00 0.00 N ATOM 0 H ASN A 116 -1.925 -6.030 -10.126 1.00 0.00 H new ATOM 0 HA ASN A 116 -3.688 -8.426 -10.205 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.597 -5.661 -9.550 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -5.328 -7.208 -9.171 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -2.603 -5.473 -6.643 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -2.998 -4.788 -8.224 1.00 0.00 H new ATOM 971 N GLN A 117 -3.173 -7.511 -12.756 1.00 0.00 N ATOM 972 CA GLN A 117 -3.321 -7.163 -14.173 1.00 0.00 C ATOM 973 C GLN A 117 -4.787 -7.220 -14.599 1.00 0.00 C ATOM 974 O GLN A 117 -5.396 -6.176 -14.853 1.00 0.00 O ATOM 975 CB GLN A 117 -2.456 -8.083 -15.064 1.00 0.00 C ATOM 976 CG GLN A 117 -0.962 -7.759 -15.196 1.00 0.00 C ATOM 977 CD GLN A 117 -0.575 -6.490 -15.964 1.00 0.00 C ATOM 978 OE1 GLN A 117 0.599 -6.133 -15.995 1.00 0.00 O ATOM 979 NE2 GLN A 117 -1.483 -5.764 -16.590 1.00 0.00 N ATOM 0 H GLN A 117 -2.451 -8.212 -12.592 1.00 0.00 H new ATOM 0 HA GLN A 117 -2.969 -6.140 -14.303 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -2.545 -9.099 -14.680 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -2.888 -8.081 -16.065 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.545 -7.684 -14.192 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -0.476 -8.606 -15.681 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -2.463 -6.048 -16.573 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -1.205 -4.920 -17.090 1.00 0.00 H new ATOM 988 N GLY A 118 -5.365 -8.421 -14.591 1.00 0.00 N ATOM 989 CA GLY A 118 -6.760 -8.659 -14.918 1.00 0.00 C ATOM 990 C GLY A 118 -7.695 -8.306 -13.769 1.00 0.00 C ATOM 991 O GLY A 118 -8.695 -8.997 -13.570 1.00 0.00 O ATOM 0 H GLY A 118 -4.858 -9.273 -14.350 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -7.030 -8.072 -15.796 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.894 -9.708 -15.183 1.00 0.00 H new ATOM 995 N GLU A 119 -7.400 -7.256 -13.007 1.00 0.00 N ATOM 996 CA GLU A 119 -8.302 -6.682 -12.021 1.00 0.00 C ATOM 997 C GLU A 119 -8.412 -5.184 -12.253 1.00 0.00 C ATOM 998 O GLU A 119 -9.535 -4.683 -12.259 1.00 0.00 O ATOM 999 CB GLU A 119 -7.870 -7.098 -10.612 1.00 0.00 C ATOM 1000 CG GLU A 119 -8.176 -6.076 -9.514 1.00 0.00 C ATOM 1001 CD GLU A 119 -8.202 -6.696 -8.112 1.00 0.00 C ATOM 1002 OE1 GLU A 119 -7.620 -7.785 -7.892 1.00 0.00 O ATOM 1003 OE2 GLU A 119 -8.938 -6.167 -7.247 1.00 0.00 O ATOM 0 H GLU A 119 -6.504 -6.771 -13.062 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.314 -7.071 -12.130 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.361 -8.038 -10.360 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -6.797 -7.291 -10.619 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.427 -5.285 -9.542 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.140 -5.609 -9.717 1.00 0.00 H new ATOM 1010 N PHE A 120 -7.300 -4.488 -12.516 1.00 0.00 N ATOM 1011 CA PHE A 120 -7.382 -3.144 -13.076 1.00 0.00 C ATOM 1012 C PHE A 120 -7.965 -3.164 -14.490 1.00 0.00 C ATOM 1013 O PHE A 120 -8.789 -2.305 -14.810 1.00 0.00 O ATOM 1014 CB PHE A 120 -6.019 -2.465 -13.074 1.00 0.00 C ATOM 1015 CG PHE A 120 -5.577 -2.008 -11.705 1.00 0.00 C ATOM 1016 CD1 PHE A 120 -4.841 -2.871 -10.877 1.00 0.00 C ATOM 1017 CD2 PHE A 120 -5.902 -0.714 -11.259 1.00 0.00 C ATOM 1018 CE1 PHE A 120 -4.382 -2.423 -9.630 1.00 0.00 C ATOM 1019 CE2 PHE A 120 -5.442 -0.266 -10.015 1.00 0.00 C ATOM 1020 CZ PHE A 120 -4.666 -1.114 -9.210 1.00 0.00 C ATOM 0 H PHE A 120 -6.353 -4.829 -12.352 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.054 -2.568 -12.440 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -5.277 -3.156 -13.475 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -6.049 -1.605 -13.743 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -4.629 -3.879 -11.200 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.506 -0.066 -11.876 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -3.811 -3.084 -8.994 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -5.684 0.730 -9.675 1.00 0.00 H new ATOM 0 HZ PHE A 120 -4.286 -0.758 -8.264 1.00 0.00 H new ATOM 1030 N GLN A 121 -7.594 -4.142 -15.325 1.00 0.00 N ATOM 1031 CA GLN A 121 -8.369 -4.462 -16.513 1.00 0.00 C ATOM 1032 C GLN A 121 -9.586 -5.258 -16.061 1.00 0.00 C ATOM 1033 O GLN A 121 -9.622 -6.491 -16.109 1.00 0.00 O ATOM 1034 CB GLN A 121 -7.551 -5.210 -17.575 1.00 0.00 C ATOM 1035 CG GLN A 121 -6.725 -4.258 -18.458 1.00 0.00 C ATOM 1036 CD GLN A 121 -6.909 -4.601 -19.937 1.00 0.00 C ATOM 1037 OE1 GLN A 121 -6.729 -5.748 -20.342 1.00 0.00 O ATOM 1038 NE2 GLN A 121 -7.315 -3.643 -20.752 1.00 0.00 N ATOM 0 H GLN A 121 -6.763 -4.720 -15.194 1.00 0.00 H new ATOM 0 HA GLN A 121 -8.680 -3.541 -17.005 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -6.883 -5.917 -17.083 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -8.224 -5.793 -18.204 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -7.031 -3.228 -18.277 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -5.671 -4.329 -18.191 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -7.459 -2.698 -20.396 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -7.485 -3.849 -21.736 1.00 0.00 H new ATOM 1047 N LYS A 122 -10.592 -4.536 -15.588 1.00 0.00 N ATOM 1048 CA LYS A 122 -11.977 -4.953 -15.742 1.00 0.00 C ATOM 1049 C LYS A 122 -12.451 -4.539 -17.144 1.00 0.00 C ATOM 1050 O LYS A 122 -11.858 -3.640 -17.745 1.00 0.00 O ATOM 1051 CB LYS A 122 -12.816 -4.332 -14.613 1.00 0.00 C ATOM 1052 CG LYS A 122 -12.920 -5.255 -13.395 1.00 0.00 C ATOM 1053 CD LYS A 122 -13.929 -6.389 -13.621 1.00 0.00 C ATOM 1054 CE LYS A 122 -14.084 -7.292 -12.401 1.00 0.00 C ATOM 1055 NZ LYS A 122 -13.090 -8.384 -12.408 1.00 0.00 N ATOM 0 H LYS A 122 -10.473 -3.653 -15.091 1.00 0.00 H new ATOM 0 HA LYS A 122 -12.087 -6.034 -15.661 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.371 -3.384 -14.311 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.816 -4.111 -14.985 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.940 -5.679 -13.176 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -13.217 -4.673 -12.523 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -14.898 -5.961 -13.877 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -13.610 -6.989 -14.474 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -13.971 -6.701 -11.492 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -15.089 -7.713 -12.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -13.222 -8.979 -11.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.215 -8.962 -13.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.131 -7.981 -12.400 1.00 0.00 H new ATOM 1069 N PRO A 123 -13.496 -5.187 -17.682 1.00 0.00 N ATOM 1070 CA PRO A 123 -14.011 -4.950 -19.026 1.00 0.00 C ATOM 1071 C PRO A 123 -15.113 -3.877 -19.075 1.00 0.00 C ATOM 1072 O PRO A 123 -15.662 -3.635 -20.150 1.00 0.00 O ATOM 1073 CB PRO A 123 -14.585 -6.311 -19.436 1.00 0.00 C ATOM 1074 CG PRO A 123 -15.190 -6.796 -18.121 1.00 0.00 C ATOM 1075 CD PRO A 123 -14.172 -6.332 -17.093 1.00 0.00 C ATOM 0 HA PRO A 123 -13.229 -4.575 -19.686 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -15.334 -6.220 -20.223 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -13.814 -6.986 -19.806 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -16.173 -6.360 -17.943 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -15.314 -7.879 -18.108 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -14.660 -6.058 -16.158 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -13.463 -7.126 -16.861 1.00 0.00 H new ATOM 1083 N ASP A 124 -15.494 -3.297 -17.933 1.00 0.00 N ATOM 1084 CA ASP A 124 -16.694 -2.469 -17.782 1.00 0.00 C ATOM 1085 C ASP A 124 -16.340 -1.208 -16.998 1.00 0.00 C ATOM 1086 O ASP A 124 -16.496 -0.098 -17.510 1.00 0.00 O ATOM 1087 CB ASP A 124 -17.798 -3.286 -17.095 1.00 0.00 C ATOM 1088 CG ASP A 124 -19.049 -2.443 -16.838 1.00 0.00 C ATOM 1089 OD1 ASP A 124 -19.073 -1.688 -15.847 1.00 0.00 O ATOM 1090 OD2 ASP A 124 -20.027 -2.571 -17.617 1.00 0.00 O ATOM 0 H ASP A 124 -14.964 -3.393 -17.067 1.00 0.00 H new ATOM 0 HA ASP A 124 -17.071 -2.161 -18.757 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -18.058 -4.142 -17.717 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -17.424 -3.680 -16.150 1.00 0.00 H new ATOM 1095 N ASN A 125 -15.799 -1.406 -15.791 1.00 0.00 N ATOM 1096 CA ASN A 125 -15.040 -0.470 -14.967 1.00 0.00 C ATOM 1097 C ASN A 125 -15.517 0.984 -15.020 1.00 0.00 C ATOM 1098 O ASN A 125 -15.032 1.761 -15.844 1.00 0.00 O ATOM 1099 CB ASN A 125 -13.522 -0.660 -15.200 1.00 0.00 C ATOM 1100 CG ASN A 125 -12.921 -0.226 -16.533 1.00 0.00 C ATOM 1101 OD1 ASN A 125 -13.123 -0.858 -17.564 1.00 0.00 O ATOM 1102 ND2 ASN A 125 -12.087 0.802 -16.551 1.00 0.00 N ATOM 0 H ASN A 125 -15.892 -2.310 -15.327 1.00 0.00 H new ATOM 0 HA ASN A 125 -15.247 -0.727 -13.928 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -12.997 -0.121 -14.411 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -13.298 -1.718 -15.066 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -11.618 1.063 -17.418 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -11.914 1.333 -15.698 1.00 0.00 H new ATOM 1109 N LYS A 126 -16.402 1.393 -14.090 1.00 0.00 N ATOM 1110 CA LYS A 126 -16.701 2.807 -13.842 1.00 0.00 C ATOM 1111 C LYS A 126 -16.044 3.334 -12.570 1.00 0.00 C ATOM 1112 O LYS A 126 -14.970 3.931 -12.658 1.00 0.00 O ATOM 1113 CB LYS A 126 -18.205 3.102 -13.863 1.00 0.00 C ATOM 1114 CG LYS A 126 -18.555 4.559 -13.481 1.00 0.00 C ATOM 1115 CD LYS A 126 -17.622 5.690 -13.973 1.00 0.00 C ATOM 1116 CE LYS A 126 -18.226 6.449 -15.160 1.00 0.00 C ATOM 1117 NZ LYS A 126 -17.198 7.072 -16.019 1.00 0.00 N ATOM 0 H LYS A 126 -16.925 0.751 -13.494 1.00 0.00 H new ATOM 0 HA LYS A 126 -16.257 3.353 -14.675 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -18.594 2.893 -14.860 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -18.710 2.424 -13.175 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -19.557 4.769 -13.854 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -18.601 4.616 -12.393 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -17.431 6.386 -13.156 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -16.660 5.268 -14.263 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -18.826 5.763 -15.758 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -18.900 7.221 -14.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -17.659 7.572 -16.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -16.640 7.748 -15.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -16.569 6.335 -16.398 1.00 0.00 H new ATOM 1131 N LEU A 127 -16.667 3.216 -11.394 1.00 0.00 N ATOM 1132 CA LEU A 127 -16.136 3.904 -10.211 1.00 0.00 C ATOM 1133 C LEU A 127 -14.963 3.127 -9.645 1.00 0.00 C ATOM 1134 O LEU A 127 -14.142 3.707 -8.943 1.00 0.00 O ATOM 1135 CB LEU A 127 -17.198 4.117 -9.113 1.00 0.00 C ATOM 1136 CG LEU A 127 -17.639 5.569 -8.874 1.00 0.00 C ATOM 1137 CD1 LEU A 127 -16.522 6.536 -8.474 1.00 0.00 C ATOM 1138 CD2 LEU A 127 -18.318 6.122 -10.114 1.00 0.00 C ATOM 0 H LEU A 127 -17.513 2.669 -11.235 1.00 0.00 H new ATOM 0 HA LEU A 127 -15.812 4.892 -10.538 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.079 3.528 -9.369 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -16.809 3.718 -8.176 1.00 0.00 H new ATOM 0 HG LEU A 127 -18.319 5.508 -8.025 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -16.938 7.533 -8.329 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -16.062 6.197 -7.546 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.769 6.568 -9.262 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -18.626 7.152 -9.932 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -17.622 6.094 -10.953 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -19.194 5.518 -10.349 1.00 0.00 H new ATOM 1150 N HIS A 128 -14.885 1.826 -9.933 1.00 0.00 N ATOM 1151 CA HIS A 128 -13.938 0.958 -9.268 1.00 0.00 C ATOM 1152 C HIS A 128 -12.495 1.405 -9.517 1.00 0.00 C ATOM 1153 O HIS A 128 -11.727 1.412 -8.569 1.00 0.00 O ATOM 1154 CB HIS A 128 -14.247 -0.524 -9.559 1.00 0.00 C ATOM 1155 CG HIS A 128 -13.180 -1.287 -10.288 1.00 0.00 C ATOM 1156 ND1 HIS A 128 -12.375 -2.270 -9.760 1.00 0.00 N ATOM 1157 CD2 HIS A 128 -12.845 -1.126 -11.600 1.00 0.00 C ATOM 1158 CE1 HIS A 128 -11.565 -2.695 -10.740 1.00 0.00 C ATOM 1159 NE2 HIS A 128 -11.801 -2.012 -11.876 1.00 0.00 N ATOM 0 H HIS A 128 -15.471 1.359 -10.625 1.00 0.00 H new ATOM 0 HA HIS A 128 -14.054 1.050 -8.188 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -14.443 -1.027 -8.612 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -15.166 -0.575 -10.143 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -13.303 -0.440 -12.297 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -10.827 -3.476 -10.633 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -11.313 -2.120 -12.765 1.00 0.00 H new ATOM 1167 N GLN A 129 -12.129 1.874 -10.714 1.00 0.00 N ATOM 1168 CA GLN A 129 -10.822 2.473 -10.977 1.00 0.00 C ATOM 1169 C GLN A 129 -10.641 3.708 -10.112 1.00 0.00 C ATOM 1170 O GLN A 129 -9.702 3.770 -9.327 1.00 0.00 O ATOM 1171 CB GLN A 129 -10.715 2.828 -12.461 1.00 0.00 C ATOM 1172 CG GLN A 129 -9.432 3.521 -12.875 1.00 0.00 C ATOM 1173 CD GLN A 129 -9.487 3.807 -14.370 1.00 0.00 C ATOM 1174 OE1 GLN A 129 -9.766 4.933 -14.774 1.00 0.00 O ATOM 1175 NE2 GLN A 129 -9.332 2.797 -15.201 1.00 0.00 N ATOM 0 H GLN A 129 -12.738 1.847 -11.532 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.033 1.762 -10.730 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -10.818 1.913 -13.044 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -11.556 3.470 -12.725 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.308 4.450 -12.318 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.572 2.893 -12.643 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -9.100 1.871 -14.841 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.444 2.941 -16.205 1.00 0.00 H new ATOM 1184 N GLN A 130 -11.525 4.692 -10.282 1.00 0.00 N ATOM 1185 CA GLN A 130 -11.500 5.951 -9.568 1.00 0.00 C ATOM 1186 C GLN A 130 -11.294 5.770 -8.056 1.00 0.00 C ATOM 1187 O GLN A 130 -10.419 6.427 -7.485 1.00 0.00 O ATOM 1188 CB GLN A 130 -12.775 6.763 -9.912 1.00 0.00 C ATOM 1189 CG GLN A 130 -12.457 7.884 -10.911 1.00 0.00 C ATOM 1190 CD GLN A 130 -13.279 9.134 -10.609 1.00 0.00 C ATOM 1191 OE1 GLN A 130 -12.787 10.074 -9.986 1.00 0.00 O ATOM 1192 NE2 GLN A 130 -14.542 9.158 -10.999 1.00 0.00 N ATOM 0 H GLN A 130 -12.299 4.624 -10.943 1.00 0.00 H new ATOM 0 HA GLN A 130 -10.632 6.521 -9.899 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -13.531 6.100 -10.332 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -13.196 7.190 -9.002 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -11.395 8.124 -10.868 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -12.666 7.543 -11.925 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -14.932 8.369 -11.515 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -15.127 9.966 -10.784 1.00 0.00 H new ATOM 1201 N VAL A 131 -12.057 4.872 -7.424 1.00 0.00 N ATOM 1202 CA VAL A 131 -11.880 4.486 -6.029 1.00 0.00 C ATOM 1203 C VAL A 131 -10.516 3.806 -5.871 1.00 0.00 C ATOM 1204 O VAL A 131 -9.700 4.287 -5.094 1.00 0.00 O ATOM 1205 CB VAL A 131 -13.062 3.607 -5.553 1.00 0.00 C ATOM 1206 CG1 VAL A 131 -12.888 3.097 -4.114 1.00 0.00 C ATOM 1207 CG2 VAL A 131 -14.382 4.387 -5.594 1.00 0.00 C ATOM 0 H VAL A 131 -12.829 4.386 -7.881 1.00 0.00 H new ATOM 0 HA VAL A 131 -11.886 5.366 -5.386 1.00 0.00 H new ATOM 0 HB VAL A 131 -13.080 2.760 -6.238 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -13.748 2.487 -3.838 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -11.981 2.496 -4.048 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -12.811 3.945 -3.434 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.195 3.745 -5.254 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -14.311 5.257 -4.942 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -14.580 4.714 -6.615 1.00 0.00 H new ATOM 1217 N LEU A 132 -10.252 2.705 -6.585 1.00 0.00 N ATOM 1218 CA LEU A 132 -9.091 1.835 -6.383 1.00 0.00 C ATOM 1219 C LEU A 132 -7.785 2.611 -6.498 1.00 0.00 C ATOM 1220 O LEU A 132 -6.819 2.255 -5.831 1.00 0.00 O ATOM 1221 CB LEU A 132 -9.122 0.639 -7.369 1.00 0.00 C ATOM 1222 CG LEU A 132 -8.060 -0.454 -7.204 1.00 0.00 C ATOM 1223 CD1 LEU A 132 -8.157 -1.111 -5.824 1.00 0.00 C ATOM 1224 CD2 LEU A 132 -8.291 -1.492 -8.324 1.00 0.00 C ATOM 0 H LEU A 132 -10.859 2.387 -7.341 1.00 0.00 H new ATOM 0 HA LEU A 132 -9.144 1.439 -5.369 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -10.102 0.168 -7.292 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -9.038 1.037 -8.380 1.00 0.00 H new ATOM 0 HG LEU A 132 -7.060 -0.026 -7.279 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.392 -1.883 -5.734 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -8.005 -0.358 -5.051 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -9.142 -1.561 -5.704 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -7.552 -2.289 -8.240 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.292 -1.914 -8.229 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -8.193 -1.007 -9.295 1.00 0.00 H new ATOM 1236 N TRP A 133 -7.738 3.659 -7.317 1.00 0.00 N ATOM 1237 CA TRP A 133 -6.596 4.547 -7.423 1.00 0.00 C ATOM 1238 C TRP A 133 -6.373 5.253 -6.085 1.00 0.00 C ATOM 1239 O TRP A 133 -5.421 4.931 -5.380 1.00 0.00 O ATOM 1240 CB TRP A 133 -6.780 5.490 -8.619 1.00 0.00 C ATOM 1241 CG TRP A 133 -5.503 5.849 -9.303 1.00 0.00 C ATOM 1242 CD1 TRP A 133 -5.012 7.097 -9.449 1.00 0.00 C ATOM 1243 CD2 TRP A 133 -4.566 4.963 -9.986 1.00 0.00 C ATOM 1244 NE1 TRP A 133 -3.829 7.047 -10.159 1.00 0.00 N ATOM 1245 CE2 TRP A 133 -3.538 5.760 -10.566 1.00 0.00 C ATOM 1246 CE3 TRP A 133 -4.481 3.568 -10.180 1.00 0.00 C ATOM 1247 CZ2 TRP A 133 -2.525 5.200 -11.358 1.00 0.00 C ATOM 1248 CZ3 TRP A 133 -3.493 2.997 -11.003 1.00 0.00 C ATOM 1249 CH2 TRP A 133 -2.531 3.815 -11.618 1.00 0.00 C ATOM 0 H TRP A 133 -8.509 3.915 -7.934 1.00 0.00 H new ATOM 0 HA TRP A 133 -5.681 3.990 -7.625 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -7.449 5.021 -9.341 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -7.268 6.403 -8.279 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -5.473 7.997 -9.069 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -3.244 7.858 -10.358 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -5.192 2.923 -9.685 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -1.745 5.826 -11.766 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -3.474 1.929 -11.162 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -1.800 3.385 -12.286 1.00 0.00 H new ATOM 1260 N ARG A 134 -7.279 6.151 -5.681 1.00 0.00 N ATOM 1261 CA ARG A 134 -7.169 6.907 -4.429 1.00 0.00 C ATOM 1262 C ARG A 134 -6.985 5.981 -3.222 1.00 0.00 C ATOM 1263 O ARG A 134 -6.229 6.311 -2.312 1.00 0.00 O ATOM 1264 CB ARG A 134 -8.415 7.805 -4.293 1.00 0.00 C ATOM 1265 CG ARG A 134 -8.624 8.453 -2.913 1.00 0.00 C ATOM 1266 CD ARG A 134 -7.496 9.412 -2.507 1.00 0.00 C ATOM 1267 NE ARG A 134 -7.599 9.753 -1.075 1.00 0.00 N ATOM 1268 CZ ARG A 134 -6.605 9.685 -0.177 1.00 0.00 C ATOM 1269 NH1 ARG A 134 -5.345 9.588 -0.575 1.00 0.00 N ATOM 1270 NH2 ARG A 134 -6.846 9.723 1.126 1.00 0.00 N ATOM 0 H ARG A 134 -8.116 6.375 -6.219 1.00 0.00 H new ATOM 0 HA ARG A 134 -6.278 7.534 -4.455 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.353 8.597 -5.040 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -9.297 7.210 -4.532 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -9.569 8.997 -2.916 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.710 7.668 -2.162 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -6.529 8.952 -2.709 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -7.548 10.320 -3.108 1.00 0.00 H new ATOM 0 HE ARG A 134 -8.508 10.069 -0.738 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -5.125 9.565 -1.571 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -4.595 9.537 0.114 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -7.804 9.806 1.465 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -6.073 9.670 1.789 1.00 0.00 H new ATOM 1284 N LEU A 135 -7.678 4.844 -3.220 1.00 0.00 N ATOM 1285 CA LEU A 135 -7.653 3.836 -2.173 1.00 0.00 C ATOM 1286 C LEU A 135 -6.230 3.323 -2.045 1.00 0.00 C ATOM 1287 O LEU A 135 -5.598 3.562 -1.022 1.00 0.00 O ATOM 1288 CB LEU A 135 -8.689 2.748 -2.510 1.00 0.00 C ATOM 1289 CG LEU A 135 -9.109 1.842 -1.355 1.00 0.00 C ATOM 1290 CD1 LEU A 135 -10.450 1.198 -1.695 1.00 0.00 C ATOM 1291 CD2 LEU A 135 -8.116 0.736 -1.079 1.00 0.00 C ATOM 0 H LEU A 135 -8.301 4.593 -3.988 1.00 0.00 H new ATOM 0 HA LEU A 135 -7.935 4.236 -1.199 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -9.580 3.234 -2.907 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -8.285 2.124 -3.307 1.00 0.00 H new ATOM 0 HG LEU A 135 -9.168 2.468 -0.465 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.760 0.548 -0.876 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.199 1.975 -1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.350 0.610 -2.607 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.471 0.127 -0.248 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -8.010 0.112 -1.967 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -7.149 1.170 -0.823 1.00 0.00 H new ATOM 1303 N VAL A 136 -5.698 2.664 -3.078 1.00 0.00 N ATOM 1304 CA VAL A 136 -4.362 2.082 -3.042 1.00 0.00 C ATOM 1305 C VAL A 136 -3.303 3.158 -2.801 1.00 0.00 C ATOM 1306 O VAL A 136 -2.317 2.876 -2.118 1.00 0.00 O ATOM 1307 CB VAL A 136 -4.096 1.284 -4.329 1.00 0.00 C ATOM 1308 CG1 VAL A 136 -2.702 0.653 -4.334 1.00 0.00 C ATOM 1309 CG2 VAL A 136 -5.088 0.126 -4.534 1.00 0.00 C ATOM 0 H VAL A 136 -6.186 2.521 -3.962 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.302 1.387 -2.204 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.202 2.019 -5.126 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -2.557 0.099 -5.261 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -1.948 1.436 -4.257 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -2.607 -0.026 -3.487 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.848 -0.399 -5.459 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -5.018 -0.566 -3.695 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -6.102 0.522 -4.594 1.00 0.00 H new ATOM 1319 N GLN A 137 -3.512 4.385 -3.291 1.00 0.00 N ATOM 1320 CA GLN A 137 -2.617 5.483 -2.979 1.00 0.00 C ATOM 1321 C GLN A 137 -2.509 5.656 -1.466 1.00 0.00 C ATOM 1322 O GLN A 137 -1.394 5.718 -0.943 1.00 0.00 O ATOM 1323 CB GLN A 137 -3.041 6.786 -3.679 1.00 0.00 C ATOM 1324 CG GLN A 137 -2.712 6.740 -5.176 1.00 0.00 C ATOM 1325 CD GLN A 137 -3.064 8.021 -5.912 1.00 0.00 C ATOM 1326 OE1 GLN A 137 -4.125 8.606 -5.714 1.00 0.00 O ATOM 1327 NE2 GLN A 137 -2.168 8.502 -6.757 1.00 0.00 N ATOM 0 H GLN A 137 -4.291 4.633 -3.901 1.00 0.00 H new ATOM 0 HA GLN A 137 -1.628 5.238 -3.365 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -4.111 6.944 -3.543 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -2.533 7.633 -3.217 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -1.648 6.539 -5.300 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -3.249 5.908 -5.633 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -1.292 8.003 -6.910 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -2.353 9.372 -7.256 1.00 0.00 H new ATOM 1336 N GLU A 138 -3.641 5.688 -0.756 1.00 0.00 N ATOM 1337 CA GLU A 138 -3.634 5.812 0.692 1.00 0.00 C ATOM 1338 C GLU A 138 -3.106 4.557 1.389 1.00 0.00 C ATOM 1339 O GLU A 138 -2.439 4.668 2.410 1.00 0.00 O ATOM 1340 CB GLU A 138 -5.017 6.228 1.225 1.00 0.00 C ATOM 1341 CG GLU A 138 -4.904 6.870 2.618 1.00 0.00 C ATOM 1342 CD GLU A 138 -3.938 8.064 2.624 1.00 0.00 C ATOM 1343 OE1 GLU A 138 -4.305 9.127 2.076 1.00 0.00 O ATOM 1344 OE2 GLU A 138 -2.768 7.924 3.061 1.00 0.00 O ATOM 0 H GLU A 138 -4.572 5.629 -1.168 1.00 0.00 H new ATOM 0 HA GLU A 138 -2.933 6.610 0.936 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -5.480 6.932 0.533 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -5.668 5.355 1.275 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -5.890 7.199 2.947 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -4.562 6.123 3.335 1.00 0.00 H new ATOM 1351 N LEU A 139 -3.332 3.362 0.840 1.00 0.00 N ATOM 1352 CA LEU A 139 -2.804 2.117 1.409 1.00 0.00 C ATOM 1353 C LEU A 139 -1.280 2.123 1.440 1.00 0.00 C ATOM 1354 O LEU A 139 -0.673 1.575 2.368 1.00 0.00 O ATOM 1355 CB LEU A 139 -3.283 0.908 0.597 1.00 0.00 C ATOM 1356 CG LEU A 139 -4.805 0.719 0.633 1.00 0.00 C ATOM 1357 CD1 LEU A 139 -5.169 -0.584 -0.065 1.00 0.00 C ATOM 1358 CD2 LEU A 139 -5.433 0.790 2.023 1.00 0.00 C ATOM 0 H LEU A 139 -3.883 3.228 -0.008 1.00 0.00 H new ATOM 0 HA LEU A 139 -3.177 2.044 2.431 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -2.962 1.024 -0.438 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -2.803 0.008 0.980 1.00 0.00 H new ATOM 0 HG LEU A 139 -5.229 1.571 0.101 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.250 -0.720 -0.040 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -4.831 -0.549 -1.101 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -4.687 -1.417 0.446 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.510 0.645 1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -5.008 0.010 2.655 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.230 1.766 2.465 1.00 0.00 H new ATOM 1370 N CYS A 140 -0.668 2.723 0.422 1.00 0.00 N ATOM 1371 CA CYS A 140 0.765 2.922 0.360 1.00 0.00 C ATOM 1372 C CYS A 140 1.170 4.072 1.285 1.00 0.00 C ATOM 1373 O CYS A 140 2.072 3.888 2.102 1.00 0.00 O ATOM 1374 CB CYS A 140 1.185 3.085 -1.102 1.00 0.00 C ATOM 1375 SG CYS A 140 0.834 1.583 -2.061 1.00 0.00 S ATOM 0 H CYS A 140 -1.166 3.087 -0.390 1.00 0.00 H new ATOM 0 HA CYS A 140 1.308 2.053 0.732 1.00 0.00 H new ATOM 0 HB2 CYS A 140 0.658 3.931 -1.542 1.00 0.00 H new ATOM 0 HB3 CYS A 140 2.250 3.311 -1.154 1.00 0.00 H new ATOM 1380 N SER A 141 0.533 5.252 1.215 1.00 0.00 N ATOM 1381 CA SER A 141 0.936 6.384 2.054 1.00 0.00 C ATOM 1382 C SER A 141 0.517 6.290 3.527 1.00 0.00 C ATOM 1383 O SER A 141 0.816 7.219 4.277 1.00 0.00 O ATOM 1384 CB SER A 141 0.506 7.721 1.436 1.00 0.00 C ATOM 1385 OG SER A 141 -0.880 7.836 1.194 1.00 0.00 O ATOM 0 H SER A 141 -0.253 5.443 0.593 1.00 0.00 H new ATOM 0 HA SER A 141 2.025 6.334 2.074 1.00 0.00 H new ATOM 0 HB2 SER A 141 0.814 8.529 2.099 1.00 0.00 H new ATOM 0 HB3 SER A 141 1.039 7.860 0.495 1.00 0.00 H new ATOM 0 HG SER A 141 -1.341 8.053 2.031 1.00 0.00 H new ATOM 1391 N LEU A 142 -0.164 5.215 3.938 1.00 0.00 N ATOM 1392 CA LEU A 142 -0.849 5.038 5.215 1.00 0.00 C ATOM 1393 C LEU A 142 -0.022 5.591 6.371 1.00 0.00 C ATOM 1394 O LEU A 142 -0.459 6.498 7.083 1.00 0.00 O ATOM 1395 CB LEU A 142 -1.164 3.540 5.381 1.00 0.00 C ATOM 1396 CG LEU A 142 -2.409 3.218 6.225 1.00 0.00 C ATOM 1397 CD1 LEU A 142 -2.413 3.878 7.608 1.00 0.00 C ATOM 1398 CD2 LEU A 142 -3.699 3.595 5.495 1.00 0.00 C ATOM 0 H LEU A 142 -0.255 4.391 3.343 1.00 0.00 H new ATOM 0 HA LEU A 142 -1.781 5.603 5.225 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -1.293 3.101 4.392 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -0.301 3.053 5.836 1.00 0.00 H new ATOM 0 HG LEU A 142 -2.364 2.139 6.375 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -3.323 3.602 8.140 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -1.545 3.541 8.175 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -2.374 4.961 7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -4.556 3.353 6.123 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -3.697 4.664 5.281 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -3.764 3.038 4.561 1.00 0.00 H new ATOM 1410 N LYS A 143 1.222 5.128 6.484 1.00 0.00 N ATOM 1411 CA LYS A 143 2.267 5.793 7.239 1.00 0.00 C ATOM 1412 C LYS A 143 3.449 5.913 6.291 1.00 0.00 C ATOM 1413 O LYS A 143 3.819 4.924 5.656 1.00 0.00 O ATOM 1414 CB LYS A 143 2.613 4.985 8.500 1.00 0.00 C ATOM 1415 CG LYS A 143 3.433 5.826 9.487 1.00 0.00 C ATOM 1416 CD LYS A 143 3.959 4.960 10.637 1.00 0.00 C ATOM 1417 CE LYS A 143 4.623 5.826 11.710 1.00 0.00 C ATOM 1418 NZ LYS A 143 3.642 6.486 12.600 1.00 0.00 N ATOM 0 H LYS A 143 1.531 4.262 6.042 1.00 0.00 H new ATOM 0 HA LYS A 143 1.960 6.778 7.591 1.00 0.00 H new ATOM 0 HB2 LYS A 143 1.696 4.646 8.981 1.00 0.00 H new ATOM 0 HB3 LYS A 143 3.176 4.094 8.222 1.00 0.00 H new ATOM 0 HG2 LYS A 143 4.269 6.293 8.966 1.00 0.00 H new ATOM 0 HG3 LYS A 143 2.816 6.631 9.885 1.00 0.00 H new ATOM 0 HD2 LYS A 143 3.138 4.394 11.077 1.00 0.00 H new ATOM 0 HD3 LYS A 143 4.677 4.235 10.253 1.00 0.00 H new ATOM 0 HE2 LYS A 143 5.291 5.207 12.309 1.00 0.00 H new ATOM 0 HE3 LYS A 143 5.239 6.586 11.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 4.145 7.059 13.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 3.020 7.100 12.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 3.071 5.764 13.083 1.00 0.00 H new ATOM 1432 N HIS A 144 4.018 7.107 6.185 1.00 0.00 N ATOM 1433 CA HIS A 144 5.266 7.387 5.491 1.00 0.00 C ATOM 1434 C HIS A 144 6.412 6.531 6.050 1.00 0.00 C ATOM 1435 O HIS A 144 6.255 5.931 7.116 1.00 0.00 O ATOM 1436 CB HIS A 144 5.574 8.884 5.652 1.00 0.00 C ATOM 1437 CG HIS A 144 5.832 9.287 7.089 1.00 0.00 C ATOM 1438 ND1 HIS A 144 4.904 9.427 8.105 1.00 0.00 N ATOM 1439 CD2 HIS A 144 7.064 9.545 7.621 1.00 0.00 C ATOM 1440 CE1 HIS A 144 5.585 9.731 9.225 1.00 0.00 C ATOM 1441 NE2 HIS A 144 6.900 9.810 8.981 1.00 0.00 N ATOM 0 H HIS A 144 3.603 7.942 6.599 1.00 0.00 H new ATOM 0 HA HIS A 144 5.167 7.136 4.435 1.00 0.00 H new ATOM 0 HB2 HIS A 144 6.446 9.136 5.048 1.00 0.00 H new ATOM 0 HB3 HIS A 144 4.738 9.465 5.263 1.00 0.00 H new ATOM 0 HD2 HIS A 144 8.000 9.544 7.083 1.00 0.00 H new ATOM 0 HE1 HIS A 144 5.132 9.890 10.192 1.00 0.00 H new ATOM 0 HE2 HIS A 144 7.635 10.022 9.656 1.00 0.00 H new ATOM 1449 N CYS A 145 7.575 6.498 5.384 1.00 0.00 N ATOM 1450 CA CYS A 145 8.793 6.001 6.024 1.00 0.00 C ATOM 1451 C CYS A 145 9.270 7.047 7.029 1.00 0.00 C ATOM 1452 O CYS A 145 8.868 6.955 8.186 1.00 0.00 O ATOM 1453 CB CYS A 145 9.883 5.595 5.031 1.00 0.00 C ATOM 1454 SG CYS A 145 9.513 4.125 4.042 1.00 0.00 S ATOM 0 H CYS A 145 7.694 6.805 4.419 1.00 0.00 H new ATOM 0 HA CYS A 145 8.558 5.074 6.547 1.00 0.00 H new ATOM 0 HB2 CYS A 145 10.067 6.431 4.356 1.00 0.00 H new ATOM 0 HB3 CYS A 145 10.807 5.420 5.582 1.00 0.00 H new ATOM 1459 N GLU A 146 10.059 8.049 6.619 1.00 0.00 N ATOM 1460 CA GLU A 146 10.662 8.990 7.560 1.00 0.00 C ATOM 1461 C GLU A 146 10.713 10.417 7.015 1.00 0.00 C ATOM 1462 O GLU A 146 9.994 11.275 7.516 1.00 0.00 O ATOM 1463 CB GLU A 146 12.064 8.488 7.958 1.00 0.00 C ATOM 1464 CG GLU A 146 12.103 7.728 9.292 1.00 0.00 C ATOM 1465 CD GLU A 146 12.112 8.657 10.502 1.00 0.00 C ATOM 1466 OE1 GLU A 146 11.037 9.188 10.875 1.00 0.00 O ATOM 1467 OE2 GLU A 146 13.199 8.826 11.114 1.00 0.00 O ATOM 0 H GLU A 146 10.292 8.225 5.642 1.00 0.00 H new ATOM 0 HA GLU A 146 10.029 9.033 8.446 1.00 0.00 H new ATOM 0 HB2 GLU A 146 12.442 7.837 7.170 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.740 9.341 8.018 1.00 0.00 H new ATOM 0 HG2 GLU A 146 11.238 7.067 9.354 1.00 0.00 H new ATOM 0 HG3 GLU A 146 12.990 7.096 9.319 1.00 0.00 H new ATOM 1474 N PHE A 147 11.561 10.684 6.025 1.00 0.00 N ATOM 1475 CA PHE A 147 11.885 12.019 5.505 1.00 0.00 C ATOM 1476 C PHE A 147 10.656 12.740 4.957 1.00 0.00 C ATOM 1477 O PHE A 147 10.507 13.952 5.108 1.00 0.00 O ATOM 1478 CB PHE A 147 12.958 11.826 4.426 1.00 0.00 C ATOM 1479 CG PHE A 147 12.890 12.671 3.169 1.00 0.00 C ATOM 1480 CD1 PHE A 147 13.309 14.013 3.180 1.00 0.00 C ATOM 1481 CD2 PHE A 147 12.494 12.074 1.957 1.00 0.00 C ATOM 1482 CE1 PHE A 147 13.361 14.738 1.976 1.00 0.00 C ATOM 1483 CE2 PHE A 147 12.548 12.798 0.758 1.00 0.00 C ATOM 1484 CZ PHE A 147 12.995 14.128 0.761 1.00 0.00 C ATOM 0 H PHE A 147 12.067 9.944 5.538 1.00 0.00 H new ATOM 0 HA PHE A 147 12.255 12.657 6.308 1.00 0.00 H new ATOM 0 HB2 PHE A 147 13.928 12.002 4.890 1.00 0.00 H new ATOM 0 HB3 PHE A 147 12.936 10.780 4.122 1.00 0.00 H new ATOM 0 HD1 PHE A 147 13.590 14.485 4.110 1.00 0.00 H new ATOM 0 HD2 PHE A 147 12.146 11.052 1.951 1.00 0.00 H new ATOM 0 HE1 PHE A 147 13.684 15.769 1.983 1.00 0.00 H new ATOM 0 HE2 PHE A 147 12.246 12.332 -0.168 1.00 0.00 H new ATOM 0 HZ PHE A 147 13.058 14.681 -0.164 1.00 0.00 H new ATOM 1494 N TRP A 148 9.758 11.995 4.329 1.00 0.00 N ATOM 1495 CA TRP A 148 8.562 12.502 3.683 1.00 0.00 C ATOM 1496 C TRP A 148 7.354 12.413 4.617 1.00 0.00 C ATOM 1497 O TRP A 148 6.239 12.105 4.185 1.00 0.00 O ATOM 1498 CB TRP A 148 8.389 11.746 2.368 1.00 0.00 C ATOM 1499 CG TRP A 148 8.414 10.246 2.433 1.00 0.00 C ATOM 1500 CD1 TRP A 148 9.500 9.471 2.666 1.00 0.00 C ATOM 1501 CD2 TRP A 148 7.301 9.317 2.276 1.00 0.00 C ATOM 1502 NE1 TRP A 148 9.172 8.157 2.435 1.00 0.00 N ATOM 1503 CE2 TRP A 148 7.827 7.997 2.223 1.00 0.00 C ATOM 1504 CE3 TRP A 148 5.899 9.447 2.215 1.00 0.00 C ATOM 1505 CZ2 TRP A 148 7.013 6.877 2.038 1.00 0.00 C ATOM 1506 CZ3 TRP A 148 5.065 8.315 2.115 1.00 0.00 C ATOM 1507 CH2 TRP A 148 5.623 7.033 2.016 1.00 0.00 C ATOM 0 H TRP A 148 9.849 10.982 4.254 1.00 0.00 H new ATOM 0 HA TRP A 148 8.655 13.564 3.454 1.00 0.00 H new ATOM 0 HB2 TRP A 148 7.440 12.050 1.926 1.00 0.00 H new ATOM 0 HB3 TRP A 148 9.176 12.068 1.686 1.00 0.00 H new ATOM 0 HD1 TRP A 148 10.469 9.829 2.983 1.00 0.00 H new ATOM 0 HE1 TRP A 148 9.848 7.393 2.423 1.00 0.00 H new ATOM 0 HE3 TRP A 148 5.456 10.431 2.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 7.453 5.899 1.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 3.992 8.436 2.115 1.00 0.00 H new ATOM 0 HH2 TRP A 148 4.982 6.169 1.923 1.00 0.00 H new