USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 946 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 205 THR OG1 : rot 180:sc= -0.179 USER MOD Set 1.2: A 206 HIS : no HD1:sc= -0.0311 X(o=-0.21,f=-0.58) USER MOD Set 2.1: A 204 THR OG1 : rot -163:sc= 0.632 USER MOD Set 2.2: A 210 THR OG1 : rot 89:sc= -0.996 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -1.99 K(o=-2,f=-3.3!) USER MOD Single : A 120 ASN : amide:sc= -0.0294 X(o=-0.029,f=-0.46) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.559 USER MOD Single : A 125 MET CE :methyl 169:sc= 0 (180deg=-0.149) USER MOD Single : A 126 ASN : amide:sc= -0.217 X(o=-0.22,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -3.51! C(o=-3.5!,f=-3.9!) USER MOD Single : A 145 THR OG1 : rot 170:sc= -0.991 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 164:sc= -0.106 (180deg=-0.439) USER MOD Single : A 168 HIS :FLIP no HD1:sc= -0.946 F(o=-2.1,f=-0.95) USER MOD Single : A 172 HIS : no HD1:sc= -0.223 X(o=-0.22,f=-0.11) USER MOD Single : A 183 HIS : no HE2:sc= -1.59 X(o=-1.6,f=-1.4) USER MOD Single : A 196 HIS : no HD1:sc= -0.43 X(o=-0.43,f=-0.85) USER MOD Single : A 207 SER OG : rot 180:sc= 0 USER MOD Single : A 211 ASN : amide:sc= -3.73 K(o=-3.7,f=-8.6!) USER MOD Single : A 215 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 HIS : no HD1:sc= -1.53 X(o=-1.5,f=-1.3) USER MOD Single : A 222 HIS : no HD1:sc= 0.0294 K(o=0.029,f=-0.53) USER MOD Single : A 223 SER OG : rot -13:sc= 0.335 USER MOD Single : A 228 HIS : no HD1:sc= -0.364 K(o=-0.36,f=-1.3) USER MOD Single : A 233 LYS NZ :NH3+ 158:sc= -0.0237 (180deg=-0.2) USER MOD Single : A 236 MET CE :methyl 161:sc= -2.02 (180deg=-2.63!) USER MOD Single : A 239 THR OG1 : rot 180:sc= 0 USER MOD Single : A 240 TYR OH : rot 180:sc= -0.706 USER MOD Single : A 241 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 TYR OH : rot 180:sc= 0 USER MOD Single : A 246 ASN : amide:sc= -0.12 K(o=-0.12,f=-1.4!) USER MOD Single : A 247 THR OG1 : rot 180:sc= 0 USER MOD Single : A 251 SER OG : rot 180:sc= -0.0534 USER MOD ----------------------------------------------------------------- ATOM 39 N ILE A 114 -5.948 10.789 10.509 1.00 3.19 N ATOM 40 CA ILE A 114 -6.121 11.168 9.112 1.00 2.65 C ATOM 41 C ILE A 114 -6.504 9.963 8.259 1.00 2.40 C ATOM 42 O ILE A 114 -5.822 8.937 8.272 1.00 3.24 O ATOM 43 CB ILE A 114 -4.841 11.803 8.538 1.00 2.93 C ATOM 44 CG1 ILE A 114 -4.492 13.080 9.305 1.00 3.92 C ATOM 45 CG2 ILE A 114 -5.015 12.099 7.056 1.00 3.48 C ATOM 46 CD1 ILE A 114 -3.627 12.837 10.522 1.00 4.53 C ATOM 0 HA ILE A 114 -6.926 11.902 9.082 1.00 2.65 H new ATOM 0 HB ILE A 114 -4.019 11.096 8.653 1.00 2.93 H new ATOM 0 HG12 ILE A 114 -3.976 13.767 8.634 1.00 3.92 H new ATOM 0 HG13 ILE A 114 -5.414 13.570 9.617 1.00 3.92 H new ATOM 0 HG21 ILE A 114 -4.102 12.548 6.665 1.00 3.48 H new ATOM 0 HG22 ILE A 114 -5.222 11.172 6.522 1.00 3.48 H new ATOM 0 HG23 ILE A 114 -5.847 12.790 6.918 1.00 3.48 H new ATOM 0 HD11 ILE A 114 -3.419 13.786 11.016 1.00 4.53 H new ATOM 0 HD12 ILE A 114 -4.149 12.175 11.213 1.00 4.53 H new ATOM 0 HD13 ILE A 114 -2.689 12.375 10.215 1.00 4.53 H new ATOM 58 N THR A 115 -7.598 10.094 7.516 1.00 2.15 N ATOM 59 CA THR A 115 -8.072 9.016 6.656 1.00 2.06 C ATOM 60 C THR A 115 -8.833 9.566 5.455 1.00 2.08 C ATOM 61 O THR A 115 -9.779 10.339 5.608 1.00 3.43 O ATOM 62 CB THR A 115 -8.984 8.043 7.426 1.00 3.45 C ATOM 63 OG1 THR A 115 -9.636 7.155 6.511 1.00 4.70 O ATOM 64 CG2 THR A 115 -10.026 8.802 8.233 1.00 4.27 C ATOM 0 H THR A 115 -8.173 10.936 7.492 1.00 2.15 H new ATOM 0 HA THR A 115 -7.190 8.477 6.309 1.00 2.06 H new ATOM 0 HB THR A 115 -8.365 7.466 8.113 1.00 3.45 H new ATOM 0 HG1 THR A 115 -10.213 6.538 7.008 1.00 4.70 H new ATOM 0 HG21 THR A 115 -10.658 8.094 8.768 1.00 4.27 H new ATOM 0 HG22 THR A 115 -9.527 9.456 8.948 1.00 4.27 H new ATOM 0 HG23 THR A 115 -10.641 9.402 7.561 1.00 4.27 H new ATOM 72 N TYR A 116 -8.414 9.162 4.261 1.00 2.41 N ATOM 73 CA TYR A 116 -9.056 9.615 3.033 1.00 3.46 C ATOM 74 C TYR A 116 -8.995 8.537 1.956 1.00 3.00 C ATOM 75 O TYR A 116 -7.927 8.001 1.658 1.00 3.94 O ATOM 76 CB TYR A 116 -8.389 10.895 2.527 1.00 5.71 C ATOM 77 CG TYR A 116 -8.826 11.297 1.136 1.00 7.55 C ATOM 78 CD1 TYR A 116 -10.123 11.732 0.893 1.00 8.74 C ATOM 79 CD2 TYR A 116 -7.943 11.241 0.065 1.00 8.56 C ATOM 80 CE1 TYR A 116 -10.527 12.100 -0.376 1.00 10.68 C ATOM 81 CE2 TYR A 116 -8.338 11.608 -1.207 1.00 10.57 C ATOM 82 CZ TYR A 116 -9.631 12.036 -1.422 1.00 11.54 C ATOM 83 OH TYR A 116 -10.029 12.401 -2.688 1.00 13.64 O ATOM 0 H TYR A 116 -7.633 8.522 4.117 1.00 2.41 H new ATOM 0 HA TYR A 116 -10.103 9.821 3.255 1.00 3.46 H new ATOM 0 HB2 TYR A 116 -8.612 11.708 3.218 1.00 5.71 H new ATOM 0 HB3 TYR A 116 -7.308 10.758 2.534 1.00 5.71 H new ATOM 0 HD1 TYR A 116 -10.827 11.783 1.710 1.00 8.74 H new ATOM 0 HD2 TYR A 116 -6.930 10.905 0.230 1.00 8.56 H new ATOM 0 HE1 TYR A 116 -11.539 12.436 -0.548 1.00 10.68 H new ATOM 0 HE2 TYR A 116 -7.638 11.560 -2.028 1.00 10.57 H new ATOM 0 HH TYR A 116 -9.278 12.299 -3.309 1.00 13.64 H new ATOM 93 N ARG A 117 -10.148 8.224 1.375 1.00 2.77 N ATOM 94 CA ARG A 117 -10.227 7.209 0.331 1.00 2.37 C ATOM 95 C ARG A 117 -11.632 7.147 -0.262 1.00 3.08 C ATOM 96 O ARG A 117 -12.626 7.211 0.462 1.00 4.36 O ATOM 97 CB ARG A 117 -9.838 5.839 0.890 1.00 2.36 C ATOM 98 CG ARG A 117 -10.887 5.238 1.812 1.00 3.06 C ATOM 99 CD ARG A 117 -10.511 3.827 2.238 1.00 4.78 C ATOM 100 NE ARG A 117 -10.471 2.906 1.105 1.00 5.82 N ATOM 101 CZ ARG A 117 -10.450 1.584 1.233 1.00 7.21 C ATOM 102 NH1 ARG A 117 -10.467 1.031 2.438 1.00 7.98 N ATOM 103 NH2 ARG A 117 -10.414 0.812 0.154 1.00 8.37 N ATOM 0 H ARG A 117 -11.041 8.658 1.609 1.00 2.77 H new ATOM 0 HA ARG A 117 -9.528 7.483 -0.460 1.00 2.37 H new ATOM 0 HB2 ARG A 117 -9.660 5.155 0.061 1.00 2.36 H new ATOM 0 HB3 ARG A 117 -8.898 5.931 1.434 1.00 2.36 H new ATOM 0 HG2 ARG A 117 -11.001 5.868 2.694 1.00 3.06 H new ATOM 0 HG3 ARG A 117 -11.852 5.221 1.305 1.00 3.06 H new ATOM 0 HD2 ARG A 117 -9.537 3.843 2.727 1.00 4.78 H new ATOM 0 HD3 ARG A 117 -11.230 3.466 2.973 1.00 4.78 H new ATOM 0 HE ARG A 117 -10.459 3.300 0.164 1.00 5.82 H new ATOM 0 HH11 ARG A 117 -10.496 1.621 3.270 1.00 7.98 H new ATOM 0 HH12 ARG A 117 -10.451 0.016 2.533 1.00 7.98 H new ATOM 0 HH21 ARG A 117 -10.402 1.234 -0.775 1.00 8.37 H new ATOM 0 HH22 ARG A 117 -10.398 -0.203 0.253 1.00 8.37 H new ATOM 117 N ILE A 118 -11.706 7.024 -1.583 1.00 3.31 N ATOM 118 CA ILE A 118 -12.988 6.954 -2.273 1.00 4.38 C ATOM 119 C ILE A 118 -13.192 5.586 -2.917 1.00 3.67 C ATOM 120 O ILE A 118 -12.237 4.949 -3.358 1.00 2.99 O ATOM 121 CB ILE A 118 -13.105 8.042 -3.356 1.00 6.04 C ATOM 122 CG1 ILE A 118 -12.816 9.420 -2.759 1.00 7.17 C ATOM 123 CG2 ILE A 118 -14.488 8.012 -3.990 1.00 7.75 C ATOM 124 CD1 ILE A 118 -13.798 9.831 -1.684 1.00 7.90 C ATOM 0 H ILE A 118 -10.893 6.971 -2.197 1.00 3.31 H new ATOM 0 HA ILE A 118 -13.760 7.118 -1.521 1.00 4.38 H new ATOM 0 HB ILE A 118 -12.367 7.842 -4.132 1.00 6.04 H new ATOM 0 HG12 ILE A 118 -11.810 9.422 -2.340 1.00 7.17 H new ATOM 0 HG13 ILE A 118 -12.831 10.163 -3.557 1.00 7.17 H new ATOM 0 HG21 ILE A 118 -14.555 8.787 -4.754 1.00 7.75 H new ATOM 0 HG22 ILE A 118 -14.658 7.037 -4.447 1.00 7.75 H new ATOM 0 HG23 ILE A 118 -15.243 8.191 -3.225 1.00 7.75 H new ATOM 0 HD11 ILE A 118 -13.532 10.818 -1.306 1.00 7.90 H new ATOM 0 HD12 ILE A 118 -14.804 9.862 -2.103 1.00 7.90 H new ATOM 0 HD13 ILE A 118 -13.767 9.109 -0.868 1.00 7.90 H new ATOM 136 N ASN A 119 -14.444 5.143 -2.969 1.00 4.84 N ATOM 137 CA ASN A 119 -14.774 3.852 -3.560 1.00 5.14 C ATOM 138 C ASN A 119 -14.178 3.726 -4.959 1.00 4.67 C ATOM 139 O ASN A 119 -14.694 4.298 -5.918 1.00 5.52 O ATOM 140 CB ASN A 119 -16.291 3.668 -3.622 1.00 7.04 C ATOM 141 CG ASN A 119 -17.012 4.942 -4.017 1.00 7.73 C ATOM 142 OD1 ASN A 119 -16.463 5.785 -4.726 1.00 7.66 O ATOM 143 ND2 ASN A 119 -18.250 5.088 -3.559 1.00 8.87 N ATOM 0 H ASN A 119 -15.247 5.659 -2.609 1.00 4.84 H new ATOM 0 HA ASN A 119 -14.346 3.072 -2.930 1.00 5.14 H new ATOM 0 HB2 ASN A 119 -16.530 2.882 -4.338 1.00 7.04 H new ATOM 0 HB3 ASN A 119 -16.654 3.335 -2.650 1.00 7.04 H new ATOM 0 HD21 ASN A 119 -18.785 5.925 -3.792 1.00 8.87 H new ATOM 0 HD22 ASN A 119 -18.666 4.363 -2.974 1.00 8.87 H new ATOM 150 N ASN A 120 -13.088 2.973 -5.067 1.00 3.58 N ATOM 151 CA ASN A 120 -12.422 2.772 -6.349 1.00 3.18 C ATOM 152 C ASN A 120 -11.672 1.444 -6.370 1.00 2.50 C ATOM 153 O ASN A 120 -10.651 1.306 -7.044 1.00 2.99 O ATOM 154 CB ASN A 120 -11.452 3.923 -6.629 1.00 3.81 C ATOM 155 CG ASN A 120 -11.685 4.557 -7.987 1.00 4.63 C ATOM 156 OD1 ASN A 120 -12.046 3.878 -8.948 1.00 4.96 O ATOM 157 ND2 ASN A 120 -11.479 5.866 -8.071 1.00 5.57 N ATOM 0 H ASN A 120 -12.647 2.492 -4.283 1.00 3.58 H new ATOM 0 HA ASN A 120 -13.185 2.750 -7.127 1.00 3.18 H new ATOM 0 HB2 ASN A 120 -11.559 4.682 -5.854 1.00 3.81 H new ATOM 0 HB3 ASN A 120 -10.428 3.553 -6.574 1.00 3.81 H new ATOM 0 HD21 ASN A 120 -11.620 6.349 -8.959 1.00 5.57 H new ATOM 0 HD22 ASN A 120 -11.180 6.389 -7.248 1.00 5.57 H new ATOM 164 N TYR A 121 -12.186 0.469 -5.628 1.00 2.11 N ATOM 165 CA TYR A 121 -11.564 -0.848 -5.559 1.00 1.74 C ATOM 166 C TYR A 121 -11.556 -1.518 -6.930 1.00 1.75 C ATOM 167 O TYR A 121 -12.478 -1.342 -7.727 1.00 2.05 O ATOM 168 CB TYR A 121 -12.301 -1.731 -4.551 1.00 2.10 C ATOM 169 CG TYR A 121 -13.701 -2.106 -4.985 1.00 2.40 C ATOM 170 CD1 TYR A 121 -14.761 -1.224 -4.816 1.00 3.14 C ATOM 171 CD2 TYR A 121 -13.963 -3.342 -5.562 1.00 3.59 C ATOM 172 CE1 TYR A 121 -16.041 -1.562 -5.210 1.00 3.95 C ATOM 173 CE2 TYR A 121 -15.240 -3.688 -5.960 1.00 4.57 C ATOM 174 CZ TYR A 121 -16.276 -2.795 -5.781 1.00 4.41 C ATOM 175 OH TYR A 121 -17.549 -3.136 -6.175 1.00 5.61 O ATOM 0 H TYR A 121 -13.032 0.566 -5.066 1.00 2.11 H new ATOM 0 HA TYR A 121 -10.532 -0.719 -5.232 1.00 1.74 H new ATOM 0 HB2 TYR A 121 -11.724 -2.641 -4.388 1.00 2.10 H new ATOM 0 HB3 TYR A 121 -12.353 -1.211 -3.595 1.00 2.10 H new ATOM 0 HD1 TYR A 121 -14.581 -0.257 -4.369 1.00 3.14 H new ATOM 0 HD2 TYR A 121 -13.155 -4.045 -5.702 1.00 3.59 H new ATOM 0 HE1 TYR A 121 -16.854 -0.864 -5.072 1.00 3.95 H new ATOM 0 HE2 TYR A 121 -15.426 -4.653 -6.409 1.00 4.57 H new ATOM 0 HH TYR A 121 -17.542 -4.038 -6.559 1.00 5.61 H new ATOM 185 N THR A 122 -10.507 -2.290 -7.197 1.00 1.71 N ATOM 186 CA THR A 122 -10.376 -2.988 -8.470 1.00 1.87 C ATOM 187 C THR A 122 -11.591 -3.867 -8.742 1.00 2.13 C ATOM 188 O THR A 122 -12.181 -4.451 -7.833 1.00 2.22 O ATOM 189 CB THR A 122 -9.107 -3.860 -8.506 1.00 2.01 C ATOM 190 OG1 THR A 122 -9.149 -4.740 -9.634 1.00 2.48 O ATOM 191 CG2 THR A 122 -8.973 -4.672 -7.226 1.00 2.34 C ATOM 0 H THR A 122 -9.736 -2.448 -6.548 1.00 1.71 H new ATOM 0 HA THR A 122 -10.303 -2.223 -9.243 1.00 1.87 H new ATOM 0 HB THR A 122 -8.242 -3.202 -8.592 1.00 2.01 H new ATOM 0 HG1 THR A 122 -8.338 -5.290 -9.650 1.00 2.48 H new ATOM 0 HG21 THR A 122 -8.070 -5.280 -7.274 1.00 2.34 H new ATOM 0 HG22 THR A 122 -8.911 -3.997 -6.372 1.00 2.34 H new ATOM 0 HG23 THR A 122 -9.842 -5.321 -7.114 1.00 2.34 H new ATOM 199 N PRO A 123 -11.975 -3.968 -10.024 1.00 2.37 N ATOM 200 CA PRO A 123 -13.123 -4.776 -10.445 1.00 2.77 C ATOM 201 C PRO A 123 -12.862 -6.272 -10.304 1.00 2.96 C ATOM 202 O PRO A 123 -13.777 -7.086 -10.426 1.00 4.25 O ATOM 203 CB PRO A 123 -13.300 -4.400 -11.918 1.00 3.02 C ATOM 204 CG PRO A 123 -11.949 -3.950 -12.359 1.00 2.79 C ATOM 205 CD PRO A 123 -11.318 -3.300 -11.160 1.00 2.38 C ATOM 0 HA PRO A 123 -14.004 -4.583 -9.833 1.00 2.77 H new ATOM 0 HB2 PRO A 123 -13.645 -5.251 -12.505 1.00 3.02 H new ATOM 0 HB3 PRO A 123 -14.040 -3.609 -12.039 1.00 3.02 H new ATOM 0 HG2 PRO A 123 -11.351 -4.793 -12.706 1.00 2.79 H new ATOM 0 HG3 PRO A 123 -12.023 -3.248 -13.190 1.00 2.79 H new ATOM 0 HD2 PRO A 123 -10.238 -3.449 -11.144 1.00 2.38 H new ATOM 0 HD3 PRO A 123 -11.492 -2.224 -11.148 1.00 2.38 H new ATOM 213 N ASP A 124 -11.608 -6.627 -10.047 1.00 2.62 N ATOM 214 CA ASP A 124 -11.226 -8.025 -9.888 1.00 2.77 C ATOM 215 C ASP A 124 -12.123 -8.721 -8.869 1.00 2.73 C ATOM 216 O ASP A 124 -12.988 -9.518 -9.231 1.00 3.33 O ATOM 217 CB ASP A 124 -9.763 -8.131 -9.454 1.00 2.86 C ATOM 218 CG ASP A 124 -9.321 -9.567 -9.253 1.00 3.18 C ATOM 219 OD1 ASP A 124 -9.256 -10.313 -10.252 1.00 3.93 O ATOM 220 OD2 ASP A 124 -9.040 -9.944 -8.096 1.00 3.64 O ATOM 0 H ASP A 124 -10.838 -5.965 -9.944 1.00 2.62 H new ATOM 0 HA ASP A 124 -11.348 -8.520 -10.851 1.00 2.77 H new ATOM 0 HB2 ASP A 124 -9.129 -7.661 -10.206 1.00 2.86 H new ATOM 0 HB3 ASP A 124 -9.621 -7.577 -8.526 1.00 2.86 H new ATOM 225 N MET A 125 -11.911 -8.414 -7.594 1.00 2.57 N ATOM 226 CA MET A 125 -12.701 -9.010 -6.523 1.00 2.62 C ATOM 227 C MET A 125 -13.625 -7.975 -5.888 1.00 2.79 C ATOM 228 O MET A 125 -13.488 -6.776 -6.130 1.00 3.08 O ATOM 229 CB MET A 125 -11.783 -9.612 -5.457 1.00 2.60 C ATOM 230 CG MET A 125 -11.420 -11.065 -5.720 1.00 2.81 C ATOM 231 SD MET A 125 -9.982 -11.603 -4.774 1.00 3.45 S ATOM 232 CE MET A 125 -10.736 -11.969 -3.191 1.00 3.76 C ATOM 0 H MET A 125 -11.199 -7.756 -7.277 1.00 2.57 H new ATOM 0 HA MET A 125 -13.313 -9.802 -6.955 1.00 2.62 H new ATOM 0 HB2 MET A 125 -10.868 -9.022 -5.401 1.00 2.60 H new ATOM 0 HB3 MET A 125 -12.270 -9.538 -4.485 1.00 2.60 H new ATOM 0 HG2 MET A 125 -12.271 -11.699 -5.472 1.00 2.81 H new ATOM 0 HG3 MET A 125 -11.222 -11.199 -6.783 1.00 2.81 H new ATOM 0 HE1 MET A 125 -10.020 -12.495 -2.560 1.00 3.76 H new ATOM 0 HE2 MET A 125 -11.033 -11.039 -2.706 1.00 3.76 H new ATOM 0 HE3 MET A 125 -11.615 -12.596 -3.343 1.00 3.76 H new ATOM 242 N ASN A 126 -14.565 -8.446 -5.076 1.00 2.78 N ATOM 243 CA ASN A 126 -15.512 -7.561 -4.407 1.00 2.97 C ATOM 244 C ASN A 126 -14.818 -6.741 -3.324 1.00 2.61 C ATOM 245 O ASN A 126 -13.811 -7.167 -2.758 1.00 2.23 O ATOM 246 CB ASN A 126 -16.655 -8.372 -3.795 1.00 3.15 C ATOM 247 CG ASN A 126 -17.778 -8.626 -4.782 1.00 3.70 C ATOM 248 OD1 ASN A 126 -18.935 -8.294 -4.522 1.00 4.19 O ATOM 249 ND2 ASN A 126 -17.441 -9.217 -5.922 1.00 4.36 N ATOM 0 H ASN A 126 -14.692 -9.436 -4.865 1.00 2.78 H new ATOM 0 HA ASN A 126 -15.919 -6.876 -5.151 1.00 2.97 H new ATOM 0 HB2 ASN A 126 -16.268 -9.326 -3.436 1.00 3.15 H new ATOM 0 HB3 ASN A 126 -17.050 -7.841 -2.929 1.00 3.15 H new ATOM 0 HD21 ASN A 126 -18.154 -9.413 -6.625 1.00 4.36 H new ATOM 0 HD22 ASN A 126 -16.469 -9.475 -6.095 1.00 4.36 H new ATOM 256 N ARG A 127 -15.364 -5.563 -3.040 1.00 2.95 N ATOM 257 CA ARG A 127 -14.798 -4.683 -2.025 1.00 3.00 C ATOM 258 C ARG A 127 -14.733 -5.385 -0.672 1.00 2.65 C ATOM 259 O ARG A 127 -13.739 -5.279 0.045 1.00 2.66 O ATOM 260 CB ARG A 127 -15.628 -3.404 -1.908 1.00 3.67 C ATOM 261 CG ARG A 127 -17.097 -3.656 -1.611 1.00 3.93 C ATOM 262 CD ARG A 127 -17.975 -2.537 -2.150 1.00 4.21 C ATOM 263 NE ARG A 127 -19.333 -2.602 -1.618 1.00 4.77 N ATOM 264 CZ ARG A 127 -20.257 -3.446 -2.062 1.00 4.62 C ATOM 265 NH1 ARG A 127 -19.970 -4.294 -3.040 1.00 4.17 N ATOM 266 NH2 ARG A 127 -21.471 -3.445 -1.526 1.00 5.52 N ATOM 0 H ARG A 127 -16.198 -5.196 -3.499 1.00 2.95 H new ATOM 0 HA ARG A 127 -13.784 -4.423 -2.330 1.00 3.00 H new ATOM 0 HB2 ARG A 127 -15.209 -2.780 -1.119 1.00 3.67 H new ATOM 0 HB3 ARG A 127 -15.545 -2.841 -2.838 1.00 3.67 H new ATOM 0 HG2 ARG A 127 -17.401 -4.604 -2.054 1.00 3.93 H new ATOM 0 HG3 ARG A 127 -17.241 -3.747 -0.534 1.00 3.93 H new ATOM 0 HD2 ARG A 127 -17.532 -1.574 -1.896 1.00 4.21 H new ATOM 0 HD3 ARG A 127 -18.009 -2.595 -3.238 1.00 4.21 H new ATOM 0 HE ARG A 127 -19.586 -1.964 -0.864 1.00 4.77 H new ATOM 0 HH11 ARG A 127 -19.037 -4.299 -3.453 1.00 4.17 H new ATOM 0 HH12 ARG A 127 -20.682 -4.941 -3.379 1.00 4.17 H new ATOM 0 HH21 ARG A 127 -21.695 -2.795 -0.772 1.00 5.52 H new ATOM 0 HH22 ARG A 127 -22.180 -4.094 -1.868 1.00 5.52 H new ATOM 280 N GLU A 128 -15.800 -6.101 -0.330 1.00 2.55 N ATOM 281 CA GLU A 128 -15.863 -6.819 0.938 1.00 2.36 C ATOM 282 C GLU A 128 -15.003 -8.078 0.894 1.00 1.97 C ATOM 283 O GLU A 128 -14.445 -8.497 1.908 1.00 2.22 O ATOM 284 CB GLU A 128 -17.311 -7.188 1.268 1.00 2.47 C ATOM 285 CG GLU A 128 -17.957 -6.266 2.288 1.00 3.11 C ATOM 286 CD GLU A 128 -18.798 -7.016 3.302 1.00 3.38 C ATOM 287 OE1 GLU A 128 -19.251 -8.135 2.985 1.00 3.20 O ATOM 288 OE2 GLU A 128 -19.005 -6.483 4.413 1.00 4.76 O ATOM 0 H GLU A 128 -16.632 -6.199 -0.913 1.00 2.55 H new ATOM 0 HA GLU A 128 -15.476 -6.163 1.718 1.00 2.36 H new ATOM 0 HB2 GLU A 128 -17.900 -7.170 0.351 1.00 2.47 H new ATOM 0 HB3 GLU A 128 -17.340 -8.210 1.645 1.00 2.47 H new ATOM 0 HG2 GLU A 128 -17.181 -5.706 2.809 1.00 3.11 H new ATOM 0 HG3 GLU A 128 -18.582 -5.539 1.770 1.00 3.11 H new ATOM 295 N ASP A 129 -14.901 -8.676 -0.288 1.00 1.83 N ATOM 296 CA ASP A 129 -14.108 -9.888 -0.466 1.00 2.00 C ATOM 297 C ASP A 129 -12.640 -9.629 -0.140 1.00 2.01 C ATOM 298 O ASP A 129 -12.037 -10.341 0.663 1.00 2.42 O ATOM 299 CB ASP A 129 -14.242 -10.405 -1.899 1.00 2.40 C ATOM 300 CG ASP A 129 -15.404 -11.364 -2.062 1.00 3.56 C ATOM 301 OD1 ASP A 129 -16.291 -11.377 -1.183 1.00 4.23 O ATOM 302 OD2 ASP A 129 -15.427 -12.102 -3.069 1.00 4.69 O ATOM 0 H ASP A 129 -15.357 -8.342 -1.137 1.00 1.83 H new ATOM 0 HA ASP A 129 -14.486 -10.645 0.221 1.00 2.00 H new ATOM 0 HB2 ASP A 129 -14.374 -9.561 -2.576 1.00 2.40 H new ATOM 0 HB3 ASP A 129 -13.318 -10.905 -2.190 1.00 2.40 H new ATOM 307 N VAL A 130 -12.071 -8.607 -0.770 1.00 1.95 N ATOM 308 CA VAL A 130 -10.673 -8.254 -0.547 1.00 2.25 C ATOM 309 C VAL A 130 -10.486 -7.580 0.807 1.00 2.63 C ATOM 310 O VAL A 130 -9.452 -7.742 1.455 1.00 2.97 O ATOM 311 CB VAL A 130 -10.148 -7.318 -1.652 1.00 2.46 C ATOM 312 CG1 VAL A 130 -10.149 -8.027 -2.998 1.00 2.95 C ATOM 313 CG2 VAL A 130 -10.978 -6.045 -1.710 1.00 3.02 C ATOM 0 H VAL A 130 -12.556 -8.009 -1.439 1.00 1.95 H new ATOM 0 HA VAL A 130 -10.104 -9.183 -0.568 1.00 2.25 H new ATOM 0 HB VAL A 130 -9.120 -7.044 -1.414 1.00 2.46 H new ATOM 0 HG11 VAL A 130 -9.775 -7.350 -3.766 1.00 2.95 H new ATOM 0 HG12 VAL A 130 -9.508 -8.907 -2.946 1.00 2.95 H new ATOM 0 HG13 VAL A 130 -11.165 -8.333 -3.247 1.00 2.95 H new ATOM 0 HG21 VAL A 130 -10.593 -5.395 -2.496 1.00 3.02 H new ATOM 0 HG22 VAL A 130 -12.017 -6.297 -1.924 1.00 3.02 H new ATOM 0 HG23 VAL A 130 -10.920 -5.529 -0.752 1.00 3.02 H new ATOM 323 N ASP A 131 -11.492 -6.822 1.229 1.00 2.69 N ATOM 324 CA ASP A 131 -11.440 -6.124 2.508 1.00 3.15 C ATOM 325 C ASP A 131 -11.138 -7.095 3.645 1.00 3.37 C ATOM 326 O ASP A 131 -10.572 -6.711 4.669 1.00 3.85 O ATOM 327 CB ASP A 131 -12.761 -5.402 2.774 1.00 3.18 C ATOM 328 CG ASP A 131 -12.902 -4.964 4.218 1.00 4.55 C ATOM 329 OD1 ASP A 131 -12.183 -4.028 4.627 1.00 5.06 O ATOM 330 OD2 ASP A 131 -13.730 -5.558 4.941 1.00 5.72 O ATOM 0 H ASP A 131 -12.354 -6.675 0.704 1.00 2.69 H new ATOM 0 HA ASP A 131 -10.637 -5.388 2.460 1.00 3.15 H new ATOM 0 HB2 ASP A 131 -12.832 -4.530 2.124 1.00 3.18 H new ATOM 0 HB3 ASP A 131 -13.590 -6.061 2.515 1.00 3.18 H new ATOM 335 N TYR A 132 -11.522 -8.353 3.460 1.00 3.17 N ATOM 336 CA TYR A 132 -11.296 -9.378 4.472 1.00 3.57 C ATOM 337 C TYR A 132 -9.806 -9.662 4.636 1.00 3.61 C ATOM 338 O TYR A 132 -9.260 -9.554 5.733 1.00 3.83 O ATOM 339 CB TYR A 132 -12.034 -10.665 4.098 1.00 3.64 C ATOM 340 CG TYR A 132 -13.009 -11.132 5.154 1.00 4.17 C ATOM 341 CD1 TYR A 132 -12.582 -11.897 6.233 1.00 5.20 C ATOM 342 CD2 TYR A 132 -14.358 -10.808 5.074 1.00 4.31 C ATOM 343 CE1 TYR A 132 -13.469 -12.327 7.200 1.00 5.75 C ATOM 344 CE2 TYR A 132 -15.253 -11.233 6.038 1.00 4.96 C ATOM 345 CZ TYR A 132 -14.804 -11.992 7.098 1.00 5.42 C ATOM 346 OH TYR A 132 -15.691 -12.417 8.060 1.00 6.12 O ATOM 0 H TYR A 132 -11.991 -8.688 2.618 1.00 3.17 H new ATOM 0 HA TYR A 132 -11.683 -9.008 5.421 1.00 3.57 H new ATOM 0 HB2 TYR A 132 -12.572 -10.507 3.163 1.00 3.64 H new ATOM 0 HB3 TYR A 132 -11.303 -11.453 3.916 1.00 3.64 H new ATOM 0 HD1 TYR A 132 -11.538 -12.160 6.317 1.00 5.20 H new ATOM 0 HD2 TYR A 132 -14.713 -10.214 4.245 1.00 4.31 H new ATOM 0 HE1 TYR A 132 -13.120 -12.922 8.031 1.00 5.75 H new ATOM 0 HE2 TYR A 132 -16.298 -10.972 5.961 1.00 4.96 H new ATOM 0 HH TYR A 132 -16.590 -12.095 7.841 1.00 6.12 H new ATOM 356 N ALA A 133 -9.155 -10.026 3.536 1.00 3.44 N ATOM 357 CA ALA A 133 -7.728 -10.324 3.556 1.00 3.50 C ATOM 358 C ALA A 133 -6.911 -9.073 3.862 1.00 3.54 C ATOM 359 O ALA A 133 -5.989 -9.107 4.678 1.00 3.72 O ATOM 360 CB ALA A 133 -7.296 -10.927 2.228 1.00 3.41 C ATOM 0 H ALA A 133 -9.593 -10.122 2.620 1.00 3.44 H new ATOM 0 HA ALA A 133 -7.544 -11.050 4.348 1.00 3.50 H new ATOM 0 HB1 ALA A 133 -6.228 -11.144 2.257 1.00 3.41 H new ATOM 0 HB2 ALA A 133 -7.849 -11.849 2.050 1.00 3.41 H new ATOM 0 HB3 ALA A 133 -7.500 -10.220 1.424 1.00 3.41 H new ATOM 366 N ILE A 134 -7.254 -7.972 3.203 1.00 3.43 N ATOM 367 CA ILE A 134 -6.552 -6.711 3.405 1.00 3.55 C ATOM 368 C ILE A 134 -6.609 -6.278 4.866 1.00 3.84 C ATOM 369 O ILE A 134 -5.712 -5.592 5.357 1.00 3.88 O ATOM 370 CB ILE A 134 -7.140 -5.591 2.526 1.00 3.49 C ATOM 371 CG1 ILE A 134 -7.066 -5.980 1.049 1.00 3.66 C ATOM 372 CG2 ILE A 134 -6.405 -4.282 2.773 1.00 3.77 C ATOM 373 CD1 ILE A 134 -7.998 -5.181 0.165 1.00 3.31 C ATOM 0 H ILE A 134 -8.014 -7.928 2.524 1.00 3.43 H new ATOM 0 HA ILE A 134 -5.514 -6.879 3.118 1.00 3.55 H new ATOM 0 HB ILE A 134 -8.188 -5.452 2.793 1.00 3.49 H new ATOM 0 HG12 ILE A 134 -6.043 -5.847 0.698 1.00 3.66 H new ATOM 0 HG13 ILE A 134 -7.303 -7.039 0.949 1.00 3.66 H new ATOM 0 HG21 ILE A 134 -6.832 -3.501 2.144 1.00 3.77 H new ATOM 0 HG22 ILE A 134 -6.506 -4.000 3.821 1.00 3.77 H new ATOM 0 HG23 ILE A 134 -5.350 -4.406 2.531 1.00 3.77 H new ATOM 0 HD11 ILE A 134 -7.891 -5.511 -0.868 1.00 3.31 H new ATOM 0 HD12 ILE A 134 -9.027 -5.333 0.490 1.00 3.31 H new ATOM 0 HD13 ILE A 134 -7.748 -4.122 0.235 1.00 3.31 H new ATOM 385 N ARG A 135 -7.669 -6.685 5.557 1.00 4.09 N ATOM 386 CA ARG A 135 -7.843 -6.340 6.963 1.00 4.42 C ATOM 387 C ARG A 135 -6.616 -6.739 7.777 1.00 4.35 C ATOM 388 O ARG A 135 -6.190 -6.013 8.675 1.00 4.43 O ATOM 389 CB ARG A 135 -9.088 -7.026 7.528 1.00 4.82 C ATOM 390 CG ARG A 135 -9.461 -6.557 8.925 1.00 5.70 C ATOM 391 CD ARG A 135 -10.853 -7.026 9.317 1.00 5.97 C ATOM 392 NE ARG A 135 -10.813 -8.052 10.356 1.00 7.68 N ATOM 393 CZ ARG A 135 -11.896 -8.530 10.959 1.00 8.42 C ATOM 394 NH1 ARG A 135 -13.097 -8.078 10.628 1.00 7.86 N ATOM 395 NH2 ARG A 135 -11.778 -9.463 11.895 1.00 10.09 N ATOM 0 H ARG A 135 -8.420 -7.254 5.166 1.00 4.09 H new ATOM 0 HA ARG A 135 -7.968 -5.259 7.033 1.00 4.42 H new ATOM 0 HB2 ARG A 135 -9.928 -6.846 6.857 1.00 4.82 H new ATOM 0 HB3 ARG A 135 -8.922 -8.103 7.548 1.00 4.82 H new ATOM 0 HG2 ARG A 135 -8.733 -6.935 9.643 1.00 5.70 H new ATOM 0 HG3 ARG A 135 -9.417 -5.469 8.969 1.00 5.70 H new ATOM 0 HD2 ARG A 135 -11.436 -6.175 9.670 1.00 5.97 H new ATOM 0 HD3 ARG A 135 -11.364 -7.420 8.438 1.00 5.97 H new ATOM 0 HE ARG A 135 -9.904 -8.422 10.634 1.00 7.68 H new ATOM 0 HH11 ARG A 135 -13.192 -7.361 9.909 1.00 7.86 H new ATOM 0 HH12 ARG A 135 -13.927 -8.447 11.093 1.00 7.86 H new ATOM 0 HH21 ARG A 135 -10.855 -9.814 12.152 1.00 10.09 H new ATOM 0 HH22 ARG A 135 -12.610 -9.829 12.358 1.00 10.09 H new ATOM 409 N LYS A 136 -6.051 -7.898 7.456 1.00 4.24 N ATOM 410 CA LYS A 136 -4.872 -8.395 8.156 1.00 4.22 C ATOM 411 C LYS A 136 -3.734 -7.383 8.090 1.00 3.87 C ATOM 412 O LYS A 136 -3.031 -7.160 9.076 1.00 3.85 O ATOM 413 CB LYS A 136 -4.420 -9.727 7.553 1.00 4.20 C ATOM 414 CG LYS A 136 -4.176 -10.812 8.588 1.00 5.11 C ATOM 415 CD LYS A 136 -4.536 -12.187 8.051 1.00 5.35 C ATOM 416 CE LYS A 136 -5.041 -13.102 9.155 1.00 6.02 C ATOM 417 NZ LYS A 136 -5.022 -14.533 8.742 1.00 6.97 N ATOM 0 H LYS A 136 -6.391 -8.511 6.715 1.00 4.24 H new ATOM 0 HA LYS A 136 -5.138 -8.548 9.202 1.00 4.22 H new ATOM 0 HB2 LYS A 136 -5.176 -10.072 6.848 1.00 4.20 H new ATOM 0 HB3 LYS A 136 -3.504 -9.567 6.984 1.00 4.20 H new ATOM 0 HG2 LYS A 136 -3.128 -10.801 8.888 1.00 5.11 H new ATOM 0 HG3 LYS A 136 -4.765 -10.603 9.481 1.00 5.11 H new ATOM 0 HD2 LYS A 136 -5.300 -12.089 7.280 1.00 5.35 H new ATOM 0 HD3 LYS A 136 -3.662 -12.634 7.578 1.00 5.35 H new ATOM 0 HE2 LYS A 136 -4.424 -12.973 10.044 1.00 6.02 H new ATOM 0 HE3 LYS A 136 -6.057 -12.816 9.427 1.00 6.02 H new ATOM 0 HZ1 LYS A 136 -5.374 -15.124 9.522 1.00 6.97 H new ATOM 0 HZ2 LYS A 136 -5.631 -14.662 7.909 1.00 6.97 H new ATOM 0 HZ3 LYS A 136 -4.049 -14.813 8.507 1.00 6.97 H new ATOM 431 N ALA A 137 -3.558 -6.771 6.924 1.00 3.65 N ATOM 432 CA ALA A 137 -2.507 -5.780 6.731 1.00 3.41 C ATOM 433 C ALA A 137 -2.702 -4.586 7.660 1.00 3.55 C ATOM 434 O ALA A 137 -1.744 -4.073 8.238 1.00 3.38 O ATOM 435 CB ALA A 137 -2.471 -5.323 5.281 1.00 3.26 C ATOM 0 H ALA A 137 -4.130 -6.944 6.098 1.00 3.65 H new ATOM 0 HA ALA A 137 -1.553 -6.246 6.976 1.00 3.41 H new ATOM 0 HB1 ALA A 137 -1.681 -4.583 5.152 1.00 3.26 H new ATOM 0 HB2 ALA A 137 -2.276 -6.179 4.635 1.00 3.26 H new ATOM 0 HB3 ALA A 137 -3.431 -4.879 5.015 1.00 3.26 H new ATOM 441 N PHE A 138 -3.949 -4.147 7.797 1.00 3.96 N ATOM 442 CA PHE A 138 -4.270 -3.012 8.655 1.00 4.25 C ATOM 443 C PHE A 138 -3.699 -3.210 10.056 1.00 4.29 C ATOM 444 O PHE A 138 -3.470 -2.245 10.785 1.00 4.26 O ATOM 445 CB PHE A 138 -5.785 -2.816 8.732 1.00 5.10 C ATOM 446 CG PHE A 138 -6.243 -1.477 8.230 1.00 4.62 C ATOM 447 CD1 PHE A 138 -5.744 -0.308 8.781 1.00 4.93 C ATOM 448 CD2 PHE A 138 -7.173 -1.386 7.207 1.00 4.74 C ATOM 449 CE1 PHE A 138 -6.163 0.927 8.322 1.00 5.06 C ATOM 450 CE2 PHE A 138 -7.596 -0.155 6.743 1.00 4.97 C ATOM 451 CZ PHE A 138 -7.091 1.003 7.301 1.00 4.99 C ATOM 0 H PHE A 138 -4.754 -4.560 7.325 1.00 3.96 H new ATOM 0 HA PHE A 138 -3.817 -2.121 8.220 1.00 4.25 H new ATOM 0 HB2 PHE A 138 -6.274 -3.599 8.153 1.00 5.10 H new ATOM 0 HB3 PHE A 138 -6.107 -2.937 9.766 1.00 5.10 H new ATOM 0 HD1 PHE A 138 -5.019 -0.362 9.579 1.00 4.93 H new ATOM 0 HD2 PHE A 138 -7.572 -2.288 6.767 1.00 4.74 H new ATOM 0 HE1 PHE A 138 -5.766 1.830 8.761 1.00 5.06 H new ATOM 0 HE2 PHE A 138 -8.321 -0.099 5.945 1.00 4.97 H new ATOM 0 HZ PHE A 138 -7.421 1.966 6.940 1.00 4.99 H new ATOM 461 N GLN A 139 -3.472 -4.466 10.424 1.00 4.50 N ATOM 462 CA GLN A 139 -2.930 -4.791 11.738 1.00 4.75 C ATOM 463 C GLN A 139 -1.493 -4.298 11.870 1.00 4.02 C ATOM 464 O GLN A 139 -1.071 -3.863 12.942 1.00 4.05 O ATOM 465 CB GLN A 139 -2.987 -6.301 11.977 1.00 5.44 C ATOM 466 CG GLN A 139 -2.773 -6.695 13.430 1.00 6.37 C ATOM 467 CD GLN A 139 -3.258 -8.099 13.732 1.00 6.89 C ATOM 468 OE1 GLN A 139 -4.455 -8.379 13.680 1.00 7.08 O ATOM 469 NE2 GLN A 139 -2.327 -8.992 14.049 1.00 7.65 N ATOM 0 H GLN A 139 -3.655 -5.276 9.831 1.00 4.50 H new ATOM 0 HA GLN A 139 -3.539 -4.288 12.489 1.00 4.75 H new ATOM 0 HB2 GLN A 139 -3.955 -6.677 11.646 1.00 5.44 H new ATOM 0 HB3 GLN A 139 -2.229 -6.787 11.362 1.00 5.44 H new ATOM 0 HG2 GLN A 139 -1.712 -6.622 13.670 1.00 6.37 H new ATOM 0 HG3 GLN A 139 -3.295 -5.988 14.075 1.00 6.37 H new ATOM 0 HE21 GLN A 139 -1.345 -8.716 14.080 1.00 7.65 H new ATOM 0 HE22 GLN A 139 -2.594 -9.953 14.261 1.00 7.65 H new ATOM 478 N VAL A 140 -0.745 -4.367 10.774 1.00 3.44 N ATOM 479 CA VAL A 140 0.645 -3.927 10.767 1.00 2.88 C ATOM 480 C VAL A 140 0.741 -2.411 10.635 1.00 2.10 C ATOM 481 O VAL A 140 1.699 -1.796 11.103 1.00 1.98 O ATOM 482 CB VAL A 140 1.436 -4.582 9.619 1.00 2.85 C ATOM 483 CG1 VAL A 140 1.266 -3.790 8.332 1.00 2.06 C ATOM 484 CG2 VAL A 140 2.907 -4.705 9.989 1.00 3.65 C ATOM 0 H VAL A 140 -1.079 -4.724 9.879 1.00 3.44 H new ATOM 0 HA VAL A 140 1.079 -4.234 11.719 1.00 2.88 H new ATOM 0 HB VAL A 140 1.041 -5.584 9.454 1.00 2.85 H new ATOM 0 HG11 VAL A 140 1.832 -4.268 7.533 1.00 2.06 H new ATOM 0 HG12 VAL A 140 0.211 -3.759 8.061 1.00 2.06 H new ATOM 0 HG13 VAL A 140 1.633 -2.774 8.479 1.00 2.06 H new ATOM 0 HG21 VAL A 140 3.451 -5.170 9.167 1.00 3.65 H new ATOM 0 HG22 VAL A 140 3.318 -3.714 10.182 1.00 3.65 H new ATOM 0 HG23 VAL A 140 3.007 -5.320 10.884 1.00 3.65 H new ATOM 494 N TRP A 141 -0.258 -1.815 9.995 1.00 2.05 N ATOM 495 CA TRP A 141 -0.287 -0.369 9.801 1.00 1.78 C ATOM 496 C TRP A 141 -0.855 0.333 11.029 1.00 1.95 C ATOM 497 O TRP A 141 -0.406 1.418 11.398 1.00 1.79 O ATOM 498 CB TRP A 141 -1.118 -0.016 8.566 1.00 2.50 C ATOM 499 CG TRP A 141 -0.677 -0.736 7.328 1.00 3.22 C ATOM 500 CD1 TRP A 141 0.605 -1.044 6.972 1.00 3.42 C ATOM 501 CD2 TRP A 141 -1.517 -1.235 6.281 1.00 4.95 C ATOM 502 NE1 TRP A 141 0.612 -1.704 5.767 1.00 4.52 N ATOM 503 CE2 TRP A 141 -0.677 -1.835 5.323 1.00 5.46 C ATOM 504 CE3 TRP A 141 -2.897 -1.235 6.062 1.00 6.63 C ATOM 505 CZ2 TRP A 141 -1.174 -2.427 4.165 1.00 7.24 C ATOM 506 CZ3 TRP A 141 -3.388 -1.823 4.911 1.00 8.50 C ATOM 507 CH2 TRP A 141 -2.529 -2.412 3.975 1.00 8.69 C ATOM 0 H TRP A 141 -1.059 -2.310 9.602 1.00 2.05 H new ATOM 0 HA TRP A 141 0.737 -0.027 9.651 1.00 1.78 H new ATOM 0 HB2 TRP A 141 -2.164 -0.251 8.761 1.00 2.50 H new ATOM 0 HB3 TRP A 141 -1.060 1.059 8.393 1.00 2.50 H new ATOM 0 HD1 TRP A 141 1.484 -0.804 7.552 1.00 3.42 H new ATOM 0 HE1 TRP A 141 1.443 -2.042 5.281 1.00 4.52 H new ATOM 0 HE3 TRP A 141 -3.568 -0.784 6.778 1.00 6.63 H new ATOM 0 HZ2 TRP A 141 -0.513 -2.882 3.442 1.00 7.24 H new ATOM 0 HZ3 TRP A 141 -4.453 -1.828 4.731 1.00 8.50 H new ATOM 0 HH2 TRP A 141 -2.944 -2.863 3.086 1.00 8.69 H new ATOM 518 N SER A 142 -1.845 -0.292 11.659 1.00 2.55 N ATOM 519 CA SER A 142 -2.477 0.276 12.844 1.00 2.91 C ATOM 520 C SER A 142 -1.656 -0.026 14.094 1.00 3.00 C ATOM 521 O SER A 142 -1.665 0.741 15.056 1.00 3.19 O ATOM 522 CB SER A 142 -3.895 -0.276 13.006 1.00 3.45 C ATOM 523 OG SER A 142 -4.708 0.618 13.746 1.00 3.27 O ATOM 0 H SER A 142 -2.227 -1.192 11.368 1.00 2.55 H new ATOM 0 HA SER A 142 -2.528 1.357 12.716 1.00 2.91 H new ATOM 0 HB2 SER A 142 -4.337 -0.447 12.024 1.00 3.45 H new ATOM 0 HB3 SER A 142 -3.858 -1.241 13.511 1.00 3.45 H new ATOM 0 HG SER A 142 -5.609 0.244 13.835 1.00 3.27 H new ATOM 529 N ASN A 143 -0.947 -1.150 14.072 1.00 3.02 N ATOM 530 CA ASN A 143 -0.120 -1.555 15.203 1.00 3.36 C ATOM 531 C ASN A 143 0.740 -0.394 15.692 1.00 2.85 C ATOM 532 O ASN A 143 1.033 -0.282 16.882 1.00 3.11 O ATOM 533 CB ASN A 143 0.771 -2.736 14.814 1.00 3.79 C ATOM 534 CG ASN A 143 1.960 -2.894 15.741 1.00 4.88 C ATOM 535 OD1 ASN A 143 3.088 -2.549 15.387 1.00 6.06 O ATOM 536 ND2 ASN A 143 1.713 -3.417 16.936 1.00 5.26 N ATOM 0 H ASN A 143 -0.929 -1.797 13.283 1.00 3.02 H new ATOM 0 HA ASN A 143 -0.782 -1.860 16.013 1.00 3.36 H new ATOM 0 HB2 ASN A 143 0.181 -3.652 14.826 1.00 3.79 H new ATOM 0 HB3 ASN A 143 1.126 -2.599 13.793 1.00 3.79 H new ATOM 0 HD21 ASN A 143 2.474 -3.547 17.603 1.00 5.26 H new ATOM 0 HD22 ASN A 143 0.763 -3.689 17.187 1.00 5.26 H new ATOM 543 N VAL A 144 1.141 0.470 14.764 1.00 2.31 N ATOM 544 CA VAL A 144 1.966 1.624 15.099 1.00 2.21 C ATOM 545 C VAL A 144 1.117 2.880 15.256 1.00 2.27 C ATOM 546 O VAL A 144 0.978 3.416 16.356 1.00 3.07 O ATOM 547 CB VAL A 144 3.042 1.876 14.026 1.00 2.29 C ATOM 548 CG1 VAL A 144 4.120 2.807 14.558 1.00 3.51 C ATOM 549 CG2 VAL A 144 3.645 0.560 13.558 1.00 2.42 C ATOM 0 H VAL A 144 0.907 0.392 13.774 1.00 2.31 H new ATOM 0 HA VAL A 144 2.455 1.398 16.047 1.00 2.21 H new ATOM 0 HB VAL A 144 2.571 2.358 13.170 1.00 2.29 H new ATOM 0 HG11 VAL A 144 4.871 2.973 13.786 1.00 3.51 H new ATOM 0 HG12 VAL A 144 3.672 3.760 14.839 1.00 3.51 H new ATOM 0 HG13 VAL A 144 4.591 2.356 15.431 1.00 3.51 H new ATOM 0 HG21 VAL A 144 4.403 0.756 12.800 1.00 2.42 H new ATOM 0 HG22 VAL A 144 4.102 0.048 14.405 1.00 2.42 H new ATOM 0 HG23 VAL A 144 2.862 -0.068 13.134 1.00 2.42 H new ATOM 559 N THR A 145 0.548 3.345 14.148 1.00 1.96 N ATOM 560 CA THR A 145 -0.289 4.539 14.162 1.00 2.40 C ATOM 561 C THR A 145 -1.724 4.200 14.547 1.00 2.84 C ATOM 562 O THR A 145 -2.264 3.159 14.171 1.00 3.28 O ATOM 563 CB THR A 145 -0.289 5.241 12.791 1.00 2.54 C ATOM 564 OG1 THR A 145 -1.178 6.363 12.815 1.00 3.21 O ATOM 565 CG2 THR A 145 -0.708 4.278 11.690 1.00 2.86 C ATOM 0 H THR A 145 0.651 2.913 13.230 1.00 1.96 H new ATOM 0 HA THR A 145 0.134 5.213 14.907 1.00 2.40 H new ATOM 0 HB THR A 145 0.724 5.586 12.584 1.00 2.54 H new ATOM 0 HG1 THR A 145 -1.054 6.896 12.002 1.00 3.21 H new ATOM 0 HG21 THR A 145 -0.701 4.796 10.731 1.00 2.86 H new ATOM 0 HG22 THR A 145 -0.012 3.440 11.655 1.00 2.86 H new ATOM 0 HG23 THR A 145 -1.712 3.907 11.894 1.00 2.86 H new ATOM 573 N PRO A 146 -2.360 5.098 15.313 1.00 3.22 N ATOM 574 CA PRO A 146 -3.743 4.917 15.764 1.00 3.89 C ATOM 575 C PRO A 146 -4.746 5.036 14.622 1.00 4.56 C ATOM 576 O PRO A 146 -5.665 4.225 14.502 1.00 6.26 O ATOM 577 CB PRO A 146 -3.940 6.053 16.770 1.00 4.31 C ATOM 578 CG PRO A 146 -2.964 7.099 16.356 1.00 4.32 C ATOM 579 CD PRO A 146 -1.778 6.361 15.798 1.00 3.53 C ATOM 0 HA PRO A 146 -3.908 3.925 16.184 1.00 3.89 H new ATOM 0 HB2 PRO A 146 -4.962 6.432 16.744 1.00 4.31 H new ATOM 0 HB3 PRO A 146 -3.751 5.716 17.789 1.00 4.31 H new ATOM 0 HG2 PRO A 146 -3.397 7.763 15.608 1.00 4.32 H new ATOM 0 HG3 PRO A 146 -2.674 7.720 17.204 1.00 4.32 H new ATOM 0 HD2 PRO A 146 -1.300 6.919 14.993 1.00 3.53 H new ATOM 0 HD3 PRO A 146 -1.018 6.187 16.560 1.00 3.53 H new ATOM 587 N LEU A 147 -4.564 6.051 13.785 1.00 3.72 N ATOM 588 CA LEU A 147 -5.453 6.276 12.650 1.00 4.50 C ATOM 589 C LEU A 147 -6.901 6.405 13.111 1.00 4.49 C ATOM 590 O LEU A 147 -7.194 6.330 14.305 1.00 4.92 O ATOM 591 CB LEU A 147 -5.326 5.133 11.643 1.00 5.57 C ATOM 592 CG LEU A 147 -4.723 5.498 10.286 1.00 6.27 C ATOM 593 CD1 LEU A 147 -5.715 6.301 9.460 1.00 6.75 C ATOM 594 CD2 LEU A 147 -3.427 6.273 10.469 1.00 6.13 C ATOM 0 H LEU A 147 -3.809 6.732 13.871 1.00 3.72 H new ATOM 0 HA LEU A 147 -5.159 7.209 12.169 1.00 4.50 H new ATOM 0 HB2 LEU A 147 -4.716 4.348 12.090 1.00 5.57 H new ATOM 0 HB3 LEU A 147 -6.317 4.711 11.476 1.00 5.57 H new ATOM 0 HG LEU A 147 -4.498 4.576 9.750 1.00 6.27 H new ATOM 0 HD11 LEU A 147 -5.268 6.552 8.498 1.00 6.75 H new ATOM 0 HD12 LEU A 147 -6.617 5.710 9.299 1.00 6.75 H new ATOM 0 HD13 LEU A 147 -5.972 7.218 9.991 1.00 6.75 H new ATOM 0 HD21 LEU A 147 -3.012 6.524 9.493 1.00 6.13 H new ATOM 0 HD22 LEU A 147 -3.626 7.189 11.025 1.00 6.13 H new ATOM 0 HD23 LEU A 147 -2.712 5.662 11.020 1.00 6.13 H new ATOM 606 N LYS A 148 -7.805 6.597 12.156 1.00 4.31 N ATOM 607 CA LYS A 148 -9.225 6.732 12.462 1.00 4.48 C ATOM 608 C LYS A 148 -10.081 6.271 11.287 1.00 4.42 C ATOM 609 O LYS A 148 -9.711 6.453 10.127 1.00 4.20 O ATOM 610 CB LYS A 148 -9.556 8.186 12.808 1.00 4.50 C ATOM 611 CG LYS A 148 -8.944 8.654 14.117 1.00 4.52 C ATOM 612 CD LYS A 148 -9.452 7.838 15.294 1.00 5.51 C ATOM 613 CE LYS A 148 -10.194 8.707 16.297 1.00 6.54 C ATOM 614 NZ LYS A 148 -10.122 8.149 17.675 1.00 7.61 N ATOM 0 H LYS A 148 -7.580 6.663 11.163 1.00 4.31 H new ATOM 0 HA LYS A 148 -9.448 6.100 13.321 1.00 4.48 H new ATOM 0 HB2 LYS A 148 -9.206 8.831 12.002 1.00 4.50 H new ATOM 0 HB3 LYS A 148 -10.639 8.301 12.861 1.00 4.50 H new ATOM 0 HG2 LYS A 148 -7.858 8.576 14.061 1.00 4.52 H new ATOM 0 HG3 LYS A 148 -9.180 9.707 14.274 1.00 4.52 H new ATOM 0 HD2 LYS A 148 -10.114 7.051 14.933 1.00 5.51 H new ATOM 0 HD3 LYS A 148 -8.613 7.347 15.787 1.00 5.51 H new ATOM 0 HE2 LYS A 148 -9.771 9.712 16.290 1.00 6.54 H new ATOM 0 HE3 LYS A 148 -11.238 8.798 15.996 1.00 6.54 H new ATOM 0 HZ1 LYS A 148 -10.640 8.770 18.329 1.00 7.61 H new ATOM 0 HZ2 LYS A 148 -10.548 7.200 17.688 1.00 7.61 H new ATOM 0 HZ3 LYS A 148 -9.127 8.086 17.972 1.00 7.61 H new ATOM 628 N PHE A 149 -11.227 5.673 11.595 1.00 4.87 N ATOM 629 CA PHE A 149 -12.136 5.185 10.564 1.00 4.95 C ATOM 630 C PHE A 149 -13.188 6.238 10.225 1.00 4.78 C ATOM 631 O PHE A 149 -14.100 6.495 11.009 1.00 5.45 O ATOM 632 CB PHE A 149 -12.819 3.896 11.025 1.00 5.90 C ATOM 633 CG PHE A 149 -13.716 3.288 9.985 1.00 7.07 C ATOM 634 CD1 PHE A 149 -13.209 2.900 8.756 1.00 7.85 C ATOM 635 CD2 PHE A 149 -15.066 3.105 10.237 1.00 8.06 C ATOM 636 CE1 PHE A 149 -14.031 2.339 7.796 1.00 9.59 C ATOM 637 CE2 PHE A 149 -15.893 2.545 9.282 1.00 9.54 C ATOM 638 CZ PHE A 149 -15.376 2.163 8.059 1.00 10.32 C ATOM 0 H PHE A 149 -11.548 5.515 12.550 1.00 4.87 H new ATOM 0 HA PHE A 149 -11.552 4.978 9.667 1.00 4.95 H new ATOM 0 HB2 PHE A 149 -12.056 3.170 11.304 1.00 5.90 H new ATOM 0 HB3 PHE A 149 -13.404 4.104 11.921 1.00 5.90 H new ATOM 0 HD1 PHE A 149 -12.159 3.037 8.545 1.00 7.85 H new ATOM 0 HD2 PHE A 149 -15.477 3.403 11.190 1.00 8.06 H new ATOM 0 HE1 PHE A 149 -13.622 2.039 6.842 1.00 9.59 H new ATOM 0 HE2 PHE A 149 -16.943 2.406 9.492 1.00 9.54 H new ATOM 0 HZ PHE A 149 -16.022 1.728 7.310 1.00 10.32 H new ATOM 648 N SER A 150 -13.051 6.843 9.049 1.00 4.11 N ATOM 649 CA SER A 150 -13.986 7.871 8.606 1.00 4.17 C ATOM 650 C SER A 150 -13.838 8.132 7.110 1.00 3.70 C ATOM 651 O SER A 150 -12.783 8.560 6.644 1.00 3.28 O ATOM 652 CB SER A 150 -13.759 9.168 9.386 1.00 4.15 C ATOM 653 OG SER A 150 -14.779 10.113 9.113 1.00 4.60 O ATOM 0 H SER A 150 -12.303 6.639 8.387 1.00 4.11 H new ATOM 0 HA SER A 150 -14.998 7.513 8.797 1.00 4.17 H new ATOM 0 HB2 SER A 150 -13.734 8.954 10.454 1.00 4.15 H new ATOM 0 HB3 SER A 150 -12.789 9.589 9.123 1.00 4.15 H new ATOM 0 HG SER A 150 -14.612 10.932 9.625 1.00 4.60 H new ATOM 659 N LYS A 151 -14.905 7.869 6.362 1.00 4.07 N ATOM 660 CA LYS A 151 -14.897 8.075 4.919 1.00 3.92 C ATOM 661 C LYS A 151 -14.860 9.563 4.582 1.00 3.58 C ATOM 662 O LYS A 151 -15.822 10.289 4.833 1.00 4.33 O ATOM 663 CB LYS A 151 -16.130 7.428 4.284 1.00 4.99 C ATOM 664 CG LYS A 151 -15.875 6.031 3.747 1.00 5.00 C ATOM 665 CD LYS A 151 -15.433 5.082 4.848 1.00 4.21 C ATOM 666 CE LYS A 151 -15.178 3.682 4.309 1.00 3.95 C ATOM 667 NZ LYS A 151 -14.239 3.696 3.154 1.00 3.82 N ATOM 0 H LYS A 151 -15.786 7.513 6.732 1.00 4.07 H new ATOM 0 HA LYS A 151 -14.000 7.606 4.515 1.00 3.92 H new ATOM 0 HB2 LYS A 151 -16.929 7.383 5.025 1.00 4.99 H new ATOM 0 HB3 LYS A 151 -16.484 8.062 3.471 1.00 4.99 H new ATOM 0 HG2 LYS A 151 -16.782 5.649 3.279 1.00 5.00 H new ATOM 0 HG3 LYS A 151 -15.110 6.072 2.972 1.00 5.00 H new ATOM 0 HD2 LYS A 151 -14.526 5.464 5.316 1.00 4.21 H new ATOM 0 HD3 LYS A 151 -16.198 5.041 5.623 1.00 4.21 H new ATOM 0 HE2 LYS A 151 -14.769 3.056 5.102 1.00 3.95 H new ATOM 0 HE3 LYS A 151 -16.123 3.233 4.004 1.00 3.95 H new ATOM 0 HZ1 LYS A 151 -13.879 2.735 2.987 1.00 3.82 H new ATOM 0 HZ2 LYS A 151 -14.738 4.031 2.305 1.00 3.82 H new ATOM 0 HZ3 LYS A 151 -13.443 4.332 3.361 1.00 3.82 H new ATOM 681 N ILE A 152 -13.745 10.008 4.012 1.00 3.06 N ATOM 682 CA ILE A 152 -13.585 11.408 3.638 1.00 3.57 C ATOM 683 C ILE A 152 -13.670 11.586 2.126 1.00 3.81 C ATOM 684 O ILE A 152 -13.126 10.788 1.365 1.00 3.64 O ATOM 685 CB ILE A 152 -12.242 11.973 4.137 1.00 3.96 C ATOM 686 CG1 ILE A 152 -12.182 11.932 5.665 1.00 4.07 C ATOM 687 CG2 ILE A 152 -12.046 13.395 3.631 1.00 5.39 C ATOM 688 CD1 ILE A 152 -13.227 12.797 6.334 1.00 4.12 C ATOM 0 H ILE A 152 -12.939 9.420 3.799 1.00 3.06 H new ATOM 0 HA ILE A 152 -14.399 11.957 4.112 1.00 3.57 H new ATOM 0 HB ILE A 152 -11.435 11.354 3.745 1.00 3.96 H new ATOM 0 HG12 ILE A 152 -12.307 10.902 5.998 1.00 4.07 H new ATOM 0 HG13 ILE A 152 -11.193 12.254 5.990 1.00 4.07 H new ATOM 0 HG21 ILE A 152 -11.093 13.781 3.992 1.00 5.39 H new ATOM 0 HG22 ILE A 152 -12.049 13.397 2.541 1.00 5.39 H new ATOM 0 HG23 ILE A 152 -12.855 14.026 3.998 1.00 5.39 H new ATOM 0 HD11 ILE A 152 -13.125 12.719 7.416 1.00 4.12 H new ATOM 0 HD12 ILE A 152 -13.089 13.835 6.030 1.00 4.12 H new ATOM 0 HD13 ILE A 152 -14.221 12.461 6.038 1.00 4.12 H new ATOM 752 N ALA A 157 -6.012 13.914 1.254 1.00 4.92 N ATOM 753 CA ALA A 157 -5.454 13.892 2.601 1.00 4.91 C ATOM 754 C ALA A 157 -4.081 13.227 2.615 1.00 4.57 C ATOM 755 O ALA A 157 -3.479 13.003 1.565 1.00 4.82 O ATOM 756 CB ALA A 157 -6.400 13.175 3.552 1.00 5.04 C ATOM 0 HA ALA A 157 -5.333 14.922 2.935 1.00 4.91 H new ATOM 0 HB1 ALA A 157 -5.971 13.166 4.554 1.00 5.04 H new ATOM 0 HB2 ALA A 157 -7.358 13.694 3.572 1.00 5.04 H new ATOM 0 HB3 ALA A 157 -6.550 12.150 3.212 1.00 5.04 H new ATOM 762 N ASP A 158 -3.594 12.915 3.810 1.00 4.76 N ATOM 763 CA ASP A 158 -2.292 12.274 3.961 1.00 4.65 C ATOM 764 C ASP A 158 -2.182 11.047 3.062 1.00 3.73 C ATOM 765 O ASP A 158 -1.093 10.692 2.610 1.00 4.10 O ATOM 766 CB ASP A 158 -2.062 11.875 5.420 1.00 5.40 C ATOM 767 CG ASP A 158 -1.906 13.076 6.331 1.00 6.35 C ATOM 768 OD1 ASP A 158 -2.481 14.139 6.016 1.00 6.81 O ATOM 769 OD2 ASP A 158 -1.209 12.953 7.360 1.00 7.18 O ATOM 0 H ASP A 158 -4.080 13.095 4.688 1.00 4.76 H new ATOM 0 HA ASP A 158 -1.526 12.990 3.663 1.00 4.65 H new ATOM 0 HB2 ASP A 158 -2.900 11.268 5.764 1.00 5.40 H new ATOM 0 HB3 ASP A 158 -1.169 11.253 5.487 1.00 5.40 H new ATOM 774 N ILE A 159 -3.316 10.404 2.807 1.00 2.85 N ATOM 775 CA ILE A 159 -3.347 9.217 1.961 1.00 2.12 C ATOM 776 C ILE A 159 -4.151 9.468 0.690 1.00 2.00 C ATOM 777 O ILE A 159 -5.368 9.280 0.665 1.00 2.11 O ATOM 778 CB ILE A 159 -3.948 8.010 2.706 1.00 1.84 C ATOM 779 CG1 ILE A 159 -4.168 6.845 1.740 1.00 2.46 C ATOM 780 CG2 ILE A 159 -5.255 8.401 3.380 1.00 3.56 C ATOM 781 CD1 ILE A 159 -4.361 5.514 2.432 1.00 3.45 C ATOM 0 H ILE A 159 -4.225 10.685 3.174 1.00 2.85 H new ATOM 0 HA ILE A 159 -2.314 8.992 1.696 1.00 2.12 H new ATOM 0 HB ILE A 159 -3.246 7.691 3.476 1.00 1.84 H new ATOM 0 HG12 ILE A 159 -5.042 7.055 1.124 1.00 2.46 H new ATOM 0 HG13 ILE A 159 -3.313 6.775 1.067 1.00 2.46 H new ATOM 0 HG21 ILE A 159 -5.668 7.538 3.902 1.00 3.56 H new ATOM 0 HG22 ILE A 159 -5.070 9.203 4.095 1.00 3.56 H new ATOM 0 HG23 ILE A 159 -5.965 8.743 2.627 1.00 3.56 H new ATOM 0 HD11 ILE A 159 -4.512 4.734 1.685 1.00 3.45 H new ATOM 0 HD12 ILE A 159 -3.477 5.282 3.026 1.00 3.45 H new ATOM 0 HD13 ILE A 159 -5.233 5.566 3.084 1.00 3.45 H new ATOM 793 N LEU A 160 -3.464 9.891 -0.365 1.00 2.11 N ATOM 794 CA LEU A 160 -4.114 10.167 -1.641 1.00 2.21 C ATOM 795 C LEU A 160 -3.988 8.974 -2.585 1.00 1.96 C ATOM 796 O LEU A 160 -2.978 8.270 -2.580 1.00 1.92 O ATOM 797 CB LEU A 160 -3.503 11.411 -2.289 1.00 2.70 C ATOM 798 CG LEU A 160 -4.024 11.766 -3.682 1.00 2.47 C ATOM 799 CD1 LEU A 160 -5.508 12.098 -3.628 1.00 2.47 C ATOM 800 CD2 LEU A 160 -3.237 12.931 -4.265 1.00 3.68 C ATOM 0 H LEU A 160 -2.457 10.050 -0.362 1.00 2.11 H new ATOM 0 HA LEU A 160 -5.172 10.347 -1.451 1.00 2.21 H new ATOM 0 HB2 LEU A 160 -3.677 12.262 -1.630 1.00 2.70 H new ATOM 0 HB3 LEU A 160 -2.424 11.271 -2.351 1.00 2.70 H new ATOM 0 HG LEU A 160 -3.889 10.901 -4.331 1.00 2.47 H new ATOM 0 HD11 LEU A 160 -5.861 12.348 -4.628 1.00 2.47 H new ATOM 0 HD12 LEU A 160 -6.060 11.236 -3.253 1.00 2.47 H new ATOM 0 HD13 LEU A 160 -5.667 12.948 -2.964 1.00 2.47 H new ATOM 0 HD21 LEU A 160 -3.621 13.170 -5.257 1.00 3.68 H new ATOM 0 HD22 LEU A 160 -3.341 13.801 -3.616 1.00 3.68 H new ATOM 0 HD23 LEU A 160 -2.184 12.658 -4.340 1.00 3.68 H new ATOM 812 N VAL A 161 -5.019 8.755 -3.394 1.00 2.08 N ATOM 813 CA VAL A 161 -5.022 7.651 -4.346 1.00 2.01 C ATOM 814 C VAL A 161 -4.519 8.101 -5.712 1.00 2.12 C ATOM 815 O VAL A 161 -5.157 8.910 -6.386 1.00 2.55 O ATOM 816 CB VAL A 161 -6.432 7.050 -4.503 1.00 2.41 C ATOM 817 CG1 VAL A 161 -6.410 5.885 -5.481 1.00 2.74 C ATOM 818 CG2 VAL A 161 -6.977 6.612 -3.152 1.00 2.94 C ATOM 0 H VAL A 161 -5.863 9.327 -3.409 1.00 2.08 H new ATOM 0 HA VAL A 161 -4.352 6.889 -3.949 1.00 2.01 H new ATOM 0 HB VAL A 161 -7.093 7.818 -4.905 1.00 2.41 H new ATOM 0 HG11 VAL A 161 -7.414 5.473 -5.579 1.00 2.74 H new ATOM 0 HG12 VAL A 161 -6.064 6.233 -6.454 1.00 2.74 H new ATOM 0 HG13 VAL A 161 -5.736 5.112 -5.111 1.00 2.74 H new ATOM 0 HG21 VAL A 161 -7.974 6.190 -3.281 1.00 2.94 H new ATOM 0 HG22 VAL A 161 -6.317 5.859 -2.720 1.00 2.94 H new ATOM 0 HG23 VAL A 161 -7.031 7.473 -2.485 1.00 2.94 H new ATOM 828 N VAL A 162 -3.369 7.571 -6.117 1.00 1.83 N ATOM 829 CA VAL A 162 -2.779 7.917 -7.405 1.00 2.02 C ATOM 830 C VAL A 162 -2.851 6.744 -8.375 1.00 1.85 C ATOM 831 O VAL A 162 -2.737 5.585 -7.975 1.00 1.70 O ATOM 832 CB VAL A 162 -1.309 8.352 -7.251 1.00 2.08 C ATOM 833 CG1 VAL A 162 -0.740 8.794 -8.590 1.00 2.44 C ATOM 834 CG2 VAL A 162 -1.188 9.462 -6.218 1.00 2.46 C ATOM 0 H VAL A 162 -2.827 6.900 -5.572 1.00 1.83 H new ATOM 0 HA VAL A 162 -3.357 8.751 -7.804 1.00 2.02 H new ATOM 0 HB VAL A 162 -0.730 7.497 -6.902 1.00 2.08 H new ATOM 0 HG11 VAL A 162 0.299 9.098 -8.461 1.00 2.44 H new ATOM 0 HG12 VAL A 162 -0.791 7.967 -9.298 1.00 2.44 H new ATOM 0 HG13 VAL A 162 -1.319 9.635 -8.972 1.00 2.44 H new ATOM 0 HG21 VAL A 162 -0.143 9.757 -6.122 1.00 2.46 H new ATOM 0 HG22 VAL A 162 -1.780 10.321 -6.535 1.00 2.46 H new ATOM 0 HG23 VAL A 162 -1.554 9.105 -5.255 1.00 2.46 H new ATOM 844 N PHE A 163 -3.041 7.051 -9.654 1.00 2.38 N ATOM 845 CA PHE A 163 -3.129 6.022 -10.683 1.00 2.37 C ATOM 846 C PHE A 163 -2.387 6.450 -11.946 1.00 2.48 C ATOM 847 O PHE A 163 -2.289 7.639 -12.247 1.00 3.08 O ATOM 848 CB PHE A 163 -4.593 5.725 -11.014 1.00 2.84 C ATOM 849 CG PHE A 163 -4.803 4.382 -11.652 1.00 2.70 C ATOM 850 CD1 PHE A 163 -4.469 3.219 -10.977 1.00 3.73 C ATOM 851 CD2 PHE A 163 -5.336 4.282 -12.927 1.00 3.18 C ATOM 852 CE1 PHE A 163 -4.661 1.982 -11.562 1.00 5.01 C ATOM 853 CE2 PHE A 163 -5.530 3.048 -13.518 1.00 4.05 C ATOM 854 CZ PHE A 163 -5.193 1.896 -12.834 1.00 4.98 C ATOM 0 H PHE A 163 -3.137 8.005 -10.003 1.00 2.38 H new ATOM 0 HA PHE A 163 -2.660 5.117 -10.297 1.00 2.37 H new ATOM 0 HB2 PHE A 163 -5.182 5.780 -10.099 1.00 2.84 H new ATOM 0 HB3 PHE A 163 -4.970 6.499 -11.683 1.00 2.84 H new ATOM 0 HD1 PHE A 163 -4.054 3.280 -9.982 1.00 3.73 H new ATOM 0 HD2 PHE A 163 -5.603 5.179 -13.465 1.00 3.18 H new ATOM 0 HE1 PHE A 163 -4.395 1.083 -11.025 1.00 5.01 H new ATOM 0 HE2 PHE A 163 -5.945 2.984 -14.513 1.00 4.05 H new ATOM 0 HZ PHE A 163 -5.345 0.930 -13.293 1.00 4.98 H new ATOM 864 N ALA A 164 -1.867 5.472 -12.680 1.00 2.07 N ATOM 865 CA ALA A 164 -1.136 5.747 -13.911 1.00 2.17 C ATOM 866 C ALA A 164 -1.186 4.552 -14.857 1.00 2.24 C ATOM 867 O ALA A 164 -0.525 3.539 -14.628 1.00 2.09 O ATOM 868 CB ALA A 164 0.307 6.114 -13.596 1.00 2.06 C ATOM 0 H ALA A 164 -1.938 4.482 -12.444 1.00 2.07 H new ATOM 0 HA ALA A 164 -1.614 6.591 -14.409 1.00 2.17 H new ATOM 0 HB1 ALA A 164 0.842 6.317 -14.524 1.00 2.06 H new ATOM 0 HB2 ALA A 164 0.327 7.002 -12.964 1.00 2.06 H new ATOM 0 HB3 ALA A 164 0.787 5.286 -13.074 1.00 2.06 H new ATOM 874 N ARG A 165 -1.973 4.677 -15.920 1.00 2.66 N ATOM 875 CA ARG A 165 -2.111 3.607 -16.900 1.00 2.93 C ATOM 876 C ARG A 165 -1.741 4.097 -18.296 1.00 3.24 C ATOM 877 O ARG A 165 -1.397 5.263 -18.485 1.00 3.38 O ATOM 878 CB ARG A 165 -3.542 3.066 -16.900 1.00 3.56 C ATOM 879 CG ARG A 165 -3.631 1.577 -17.187 1.00 3.41 C ATOM 880 CD ARG A 165 -4.285 0.826 -16.038 1.00 3.66 C ATOM 881 NE ARG A 165 -5.742 0.903 -16.093 1.00 4.72 N ATOM 882 CZ ARG A 165 -6.548 0.041 -15.482 1.00 5.38 C ATOM 883 NH1 ARG A 165 -6.040 -0.958 -14.773 1.00 5.25 N ATOM 884 NH2 ARG A 165 -7.864 0.177 -15.579 1.00 6.64 N ATOM 0 H ARG A 165 -2.525 5.510 -16.125 1.00 2.66 H new ATOM 0 HA ARG A 165 -1.427 2.805 -16.622 1.00 2.93 H new ATOM 0 HB2 ARG A 165 -3.998 3.268 -15.931 1.00 3.56 H new ATOM 0 HB3 ARG A 165 -4.125 3.606 -17.645 1.00 3.56 H new ATOM 0 HG2 ARG A 165 -4.203 1.415 -18.101 1.00 3.41 H new ATOM 0 HG3 ARG A 165 -2.631 1.179 -17.361 1.00 3.41 H new ATOM 0 HD2 ARG A 165 -3.976 -0.219 -16.065 1.00 3.66 H new ATOM 0 HD3 ARG A 165 -3.936 1.237 -15.091 1.00 3.66 H new ATOM 0 HE ARG A 165 -6.165 1.660 -16.630 1.00 4.72 H new ATOM 0 HH11 ARG A 165 -5.029 -1.066 -14.696 1.00 5.25 H new ATOM 0 HH12 ARG A 165 -6.661 -1.618 -14.305 1.00 5.25 H new ATOM 0 HH21 ARG A 165 -8.259 0.944 -16.123 1.00 6.64 H new ATOM 0 HH22 ARG A 165 -8.481 -0.486 -15.109 1.00 6.64 H new ATOM 898 N GLY A 166 -1.813 3.197 -19.273 1.00 3.56 N ATOM 899 CA GLY A 166 -1.482 3.557 -20.639 1.00 3.96 C ATOM 900 C GLY A 166 -0.145 4.263 -20.745 1.00 3.59 C ATOM 901 O GLY A 166 0.903 3.619 -20.777 1.00 3.33 O ATOM 0 H GLY A 166 -2.095 2.225 -19.142 1.00 3.56 H new ATOM 0 HA2 GLY A 166 -1.464 2.657 -21.254 1.00 3.96 H new ATOM 0 HA3 GLY A 166 -2.263 4.202 -21.041 1.00 3.96 H new ATOM 905 N ALA A 167 -0.180 5.590 -20.802 1.00 3.95 N ATOM 906 CA ALA A 167 1.038 6.383 -20.905 1.00 4.07 C ATOM 907 C ALA A 167 1.695 6.561 -19.540 1.00 3.74 C ATOM 908 O ALA A 167 1.117 6.209 -18.512 1.00 3.49 O ATOM 909 CB ALA A 167 0.735 7.738 -21.528 1.00 4.96 C ATOM 0 H ALA A 167 -1.040 6.139 -20.779 1.00 3.95 H new ATOM 0 HA ALA A 167 1.737 5.848 -21.548 1.00 4.07 H new ATOM 0 HB1 ALA A 167 1.654 8.320 -21.599 1.00 4.96 H new ATOM 0 HB2 ALA A 167 0.318 7.595 -22.525 1.00 4.96 H new ATOM 0 HB3 ALA A 167 0.015 8.271 -20.907 1.00 4.96 H new ATOM 915 N HIS A 168 2.905 7.110 -19.538 1.00 3.90 N ATOM 916 CA HIS A 168 3.641 7.334 -18.299 1.00 3.94 C ATOM 917 C HIS A 168 3.054 8.510 -17.524 1.00 4.24 C ATOM 918 O HIS A 168 3.681 9.562 -17.404 1.00 5.38 O ATOM 919 CB HIS A 168 5.118 7.591 -18.597 1.00 4.64 C ATOM 920 CG HIS A 168 5.344 8.611 -19.669 1.00 4.87 C ATOM 921 ND1 HIS A 168 4.540 9.592 -20.142 1.00 5.92 N flip ATOM 922 CD2 HIS A 168 6.516 8.697 -20.391 1.00 5.05 C flip ATOM 923 CE1 HIS A 168 5.233 10.246 -21.131 1.00 6.46 C flip ATOM 924 NE2 HIS A 168 6.423 9.688 -21.261 1.00 6.09 N flip ATOM 0 H HIS A 168 3.397 7.408 -20.380 1.00 3.90 H new ATOM 0 HA HIS A 168 3.553 6.437 -17.686 1.00 3.94 H new ATOM 0 HB2 HIS A 168 5.612 7.921 -17.683 1.00 4.64 H new ATOM 0 HB3 HIS A 168 5.589 6.654 -18.894 1.00 4.64 H new ATOM 0 HD2 HIS A 168 7.375 8.055 -20.265 1.00 5.05 H new ATOM 0 HE1 HIS A 168 4.865 11.081 -21.709 1.00 6.46 H new ATOM 0 HE2 HIS A 168 7.147 9.973 -21.920 1.00 6.09 H new ATOM 932 N GLY A 169 1.845 8.325 -17.001 1.00 3.46 N ATOM 933 CA GLY A 169 1.194 9.379 -16.246 1.00 3.93 C ATOM 934 C GLY A 169 1.086 10.672 -17.031 1.00 4.47 C ATOM 935 O GLY A 169 0.573 10.686 -18.150 1.00 4.91 O ATOM 0 H GLY A 169 1.305 7.464 -17.087 1.00 3.46 H new ATOM 0 HA2 GLY A 169 0.197 9.050 -15.954 1.00 3.93 H new ATOM 0 HA3 GLY A 169 1.751 9.561 -15.327 1.00 3.93 H new ATOM 939 N ASP A 170 1.567 11.761 -16.442 1.00 5.08 N ATOM 940 CA ASP A 170 1.522 13.065 -17.093 1.00 5.86 C ATOM 941 C ASP A 170 2.772 13.296 -17.935 1.00 6.18 C ATOM 942 O ASP A 170 2.722 13.960 -18.970 1.00 6.68 O ATOM 943 CB ASP A 170 1.382 14.175 -16.049 1.00 6.72 C ATOM 944 CG ASP A 170 0.038 14.872 -16.122 1.00 7.50 C ATOM 945 OD1 ASP A 170 -0.980 14.237 -15.773 1.00 7.46 O ATOM 946 OD2 ASP A 170 0.003 16.053 -16.526 1.00 8.66 O ATOM 0 H ASP A 170 1.993 11.767 -15.515 1.00 5.08 H new ATOM 0 HA ASP A 170 0.654 13.085 -17.752 1.00 5.86 H new ATOM 0 HB2 ASP A 170 1.515 13.752 -15.053 1.00 6.72 H new ATOM 0 HB3 ASP A 170 2.176 14.908 -16.193 1.00 6.72 H new ATOM 951 N ASP A 171 3.894 12.745 -17.483 1.00 6.24 N ATOM 952 CA ASP A 171 5.158 12.891 -18.195 1.00 6.77 C ATOM 953 C ASP A 171 6.190 11.892 -17.680 1.00 6.52 C ATOM 954 O ASP A 171 6.503 10.907 -18.349 1.00 6.54 O ATOM 955 CB ASP A 171 5.691 14.317 -18.045 1.00 7.85 C ATOM 956 CG ASP A 171 5.240 15.225 -19.172 1.00 8.16 C ATOM 957 OD1 ASP A 171 5.552 14.918 -20.342 1.00 8.35 O ATOM 958 OD2 ASP A 171 4.577 16.243 -18.885 1.00 8.56 O ATOM 0 H ASP A 171 3.953 12.193 -16.627 1.00 6.24 H new ATOM 0 HA ASP A 171 4.978 12.688 -19.251 1.00 6.77 H new ATOM 0 HB2 ASP A 171 5.355 14.729 -17.094 1.00 7.85 H new ATOM 0 HB3 ASP A 171 6.780 14.293 -18.015 1.00 7.85 H new ATOM 963 N HIS A 172 6.716 12.155 -16.488 1.00 6.70 N ATOM 964 CA HIS A 172 7.714 11.279 -15.883 1.00 6.72 C ATOM 965 C HIS A 172 7.135 9.890 -15.630 1.00 5.81 C ATOM 966 O HIS A 172 6.045 9.566 -16.100 1.00 5.32 O ATOM 967 CB HIS A 172 8.223 11.879 -14.573 1.00 7.51 C ATOM 968 CG HIS A 172 8.572 13.332 -14.675 1.00 8.27 C ATOM 969 ND1 HIS A 172 8.445 14.213 -13.621 1.00 9.15 N ATOM 970 CD2 HIS A 172 9.049 14.057 -15.714 1.00 8.74 C ATOM 971 CE1 HIS A 172 8.826 15.417 -14.009 1.00 9.88 C ATOM 972 NE2 HIS A 172 9.198 15.349 -15.274 1.00 9.67 N ATOM 0 H HIS A 172 6.468 12.967 -15.922 1.00 6.70 H new ATOM 0 HA HIS A 172 8.548 11.185 -16.578 1.00 6.72 H new ATOM 0 HB2 HIS A 172 7.462 11.750 -13.804 1.00 7.51 H new ATOM 0 HB3 HIS A 172 9.103 11.325 -14.247 1.00 7.51 H new ATOM 0 HD2 HIS A 172 9.271 13.688 -16.704 1.00 8.74 H new ATOM 0 HE1 HIS A 172 8.832 16.306 -13.396 1.00 9.88 H new ATOM 0 HE2 HIS A 172 9.541 16.130 -15.834 1.00 9.67 H new ATOM 980 N ALA A 173 7.873 9.074 -14.884 1.00 6.17 N ATOM 981 CA ALA A 173 7.432 7.721 -14.568 1.00 5.58 C ATOM 982 C ALA A 173 7.345 6.864 -15.826 1.00 4.31 C ATOM 983 O ALA A 173 7.672 7.317 -16.922 1.00 4.58 O ATOM 984 CB ALA A 173 6.088 7.757 -13.856 1.00 6.06 C ATOM 0 H ALA A 173 8.778 9.326 -14.488 1.00 6.17 H new ATOM 0 HA ALA A 173 8.170 7.270 -13.904 1.00 5.58 H new ATOM 0 HB1 ALA A 173 5.771 6.740 -13.626 1.00 6.06 H new ATOM 0 HB2 ALA A 173 6.181 8.326 -12.931 1.00 6.06 H new ATOM 0 HB3 ALA A 173 5.348 8.231 -14.500 1.00 6.06 H new ATOM 990 N PHE A 174 6.902 5.622 -15.660 1.00 3.82 N ATOM 991 CA PHE A 174 6.773 4.700 -16.783 1.00 4.05 C ATOM 992 C PHE A 174 5.504 3.862 -16.655 1.00 3.78 C ATOM 993 O PHE A 174 4.706 3.778 -17.589 1.00 4.78 O ATOM 994 CB PHE A 174 7.996 3.785 -16.861 1.00 5.64 C ATOM 995 CG PHE A 174 9.141 4.379 -17.631 1.00 6.76 C ATOM 996 CD1 PHE A 174 9.866 5.439 -17.111 1.00 7.09 C ATOM 997 CD2 PHE A 174 9.492 3.877 -18.874 1.00 7.99 C ATOM 998 CE1 PHE A 174 10.920 5.988 -17.817 1.00 8.47 C ATOM 999 CE2 PHE A 174 10.545 4.422 -19.585 1.00 9.31 C ATOM 1000 CZ PHE A 174 11.260 5.478 -19.055 1.00 9.49 C ATOM 0 H PHE A 174 6.626 5.231 -14.759 1.00 3.82 H new ATOM 0 HA PHE A 174 6.708 5.288 -17.699 1.00 4.05 H new ATOM 0 HB2 PHE A 174 8.330 3.552 -15.850 1.00 5.64 H new ATOM 0 HB3 PHE A 174 7.706 2.843 -17.326 1.00 5.64 H new ATOM 0 HD1 PHE A 174 9.605 5.841 -16.143 1.00 7.09 H new ATOM 0 HD2 PHE A 174 8.937 3.051 -19.292 1.00 7.99 H new ATOM 0 HE1 PHE A 174 11.477 6.815 -17.401 1.00 8.47 H new ATOM 0 HE2 PHE A 174 10.808 4.023 -20.553 1.00 9.31 H new ATOM 0 HZ PHE A 174 12.084 5.905 -19.608 1.00 9.49 H new ATOM 1084 N LEU A 181 7.544 1.148 -8.047 1.00 3.68 N ATOM 1085 CA LEU A 181 7.199 0.467 -6.804 1.00 3.64 C ATOM 1086 C LEU A 181 6.560 1.435 -5.813 1.00 3.46 C ATOM 1087 O LEU A 181 5.403 1.269 -5.426 1.00 3.51 O ATOM 1088 CB LEU A 181 8.445 -0.167 -6.183 1.00 4.00 C ATOM 1089 CG LEU A 181 9.299 -1.023 -7.120 1.00 4.27 C ATOM 1090 CD1 LEU A 181 10.760 -0.976 -6.701 1.00 5.49 C ATOM 1091 CD2 LEU A 181 8.794 -2.458 -7.140 1.00 4.19 C ATOM 0 HA LEU A 181 6.478 -0.317 -7.036 1.00 3.64 H new ATOM 0 HB2 LEU A 181 9.071 0.629 -5.779 1.00 4.00 H new ATOM 0 HB3 LEU A 181 8.133 -0.785 -5.341 1.00 4.00 H new ATOM 0 HG LEU A 181 9.218 -0.617 -8.128 1.00 4.27 H new ATOM 0 HD11 LEU A 181 11.353 -1.591 -7.379 1.00 5.49 H new ATOM 0 HD12 LEU A 181 11.116 0.053 -6.739 1.00 5.49 H new ATOM 0 HD13 LEU A 181 10.859 -1.357 -5.685 1.00 5.49 H new ATOM 0 HD21 LEU A 181 9.413 -3.052 -7.812 1.00 4.19 H new ATOM 0 HD22 LEU A 181 8.845 -2.876 -6.135 1.00 4.19 H new ATOM 0 HD23 LEU A 181 7.761 -2.475 -7.488 1.00 4.19 H new ATOM 1103 N ALA A 182 7.320 2.446 -5.407 1.00 3.56 N ATOM 1104 CA ALA A 182 6.827 3.443 -4.465 1.00 3.58 C ATOM 1105 C ALA A 182 6.849 4.838 -5.080 1.00 4.08 C ATOM 1106 O ALA A 182 7.810 5.217 -5.751 1.00 4.55 O ATOM 1107 CB ALA A 182 7.652 3.414 -3.186 1.00 3.70 C ATOM 0 H ALA A 182 8.280 2.597 -5.716 1.00 3.56 H new ATOM 0 HA ALA A 182 5.793 3.198 -4.223 1.00 3.58 H new ATOM 0 HB1 ALA A 182 7.273 4.164 -2.491 1.00 3.70 H new ATOM 0 HB2 ALA A 182 7.580 2.427 -2.729 1.00 3.70 H new ATOM 0 HB3 ALA A 182 8.694 3.631 -3.420 1.00 3.70 H new ATOM 1113 N HIS A 183 5.784 5.599 -4.847 1.00 4.25 N ATOM 1114 CA HIS A 183 5.682 6.954 -5.379 1.00 4.96 C ATOM 1115 C HIS A 183 6.834 7.821 -4.881 1.00 5.29 C ATOM 1116 O HIS A 183 7.621 7.399 -4.034 1.00 5.60 O ATOM 1117 CB HIS A 183 4.346 7.581 -4.979 1.00 5.69 C ATOM 1118 CG HIS A 183 3.181 7.058 -5.761 1.00 6.69 C ATOM 1119 ND1 HIS A 183 2.132 6.375 -5.183 1.00 7.92 N ATOM 1120 CD2 HIS A 183 2.902 7.123 -7.084 1.00 7.39 C ATOM 1121 CE1 HIS A 183 1.259 6.040 -6.116 1.00 9.21 C ATOM 1122 NE2 HIS A 183 1.702 6.483 -7.279 1.00 8.88 N ATOM 0 H HIS A 183 4.980 5.301 -4.294 1.00 4.25 H new ATOM 0 HA HIS A 183 5.737 6.897 -6.466 1.00 4.96 H new ATOM 0 HB2 HIS A 183 4.172 7.400 -3.918 1.00 5.69 H new ATOM 0 HB3 HIS A 183 4.407 8.661 -5.112 1.00 5.69 H new ATOM 0 HD1 HIS A 183 2.044 6.162 -4.189 1.00 7.92 H new ATOM 0 HD2 HIS A 183 3.510 7.591 -7.845 1.00 7.39 H new ATOM 0 HE1 HIS A 183 0.340 5.497 -5.955 1.00 9.21 H new ATOM 1130 N ALA A 184 6.927 9.035 -5.414 1.00 5.87 N ATOM 1131 CA ALA A 184 7.982 9.962 -5.023 1.00 6.58 C ATOM 1132 C ALA A 184 7.500 10.914 -3.933 1.00 6.09 C ATOM 1133 O ALA A 184 8.023 12.019 -3.785 1.00 6.38 O ATOM 1134 CB ALA A 184 8.471 10.745 -6.232 1.00 7.90 C ATOM 0 H ALA A 184 6.285 9.399 -6.118 1.00 5.87 H new ATOM 0 HA ALA A 184 8.812 9.381 -4.620 1.00 6.58 H new ATOM 0 HB1 ALA A 184 9.259 11.433 -5.925 1.00 7.90 H new ATOM 0 HB2 ALA A 184 8.863 10.054 -6.979 1.00 7.90 H new ATOM 0 HB3 ALA A 184 7.642 11.309 -6.660 1.00 7.90 H new ATOM 1140 N PHE A 185 6.501 10.479 -3.173 1.00 5.80 N ATOM 1141 CA PHE A 185 5.948 11.293 -2.097 1.00 5.47 C ATOM 1142 C PHE A 185 5.436 10.416 -0.959 1.00 4.85 C ATOM 1143 O PHE A 185 5.940 10.477 0.162 1.00 4.78 O ATOM 1144 CB PHE A 185 4.815 12.174 -2.627 1.00 5.95 C ATOM 1145 CG PHE A 185 5.294 13.431 -3.295 1.00 6.61 C ATOM 1146 CD1 PHE A 185 6.133 14.309 -2.627 1.00 7.23 C ATOM 1147 CD2 PHE A 185 4.905 13.735 -4.589 1.00 7.19 C ATOM 1148 CE1 PHE A 185 6.576 15.466 -3.239 1.00 8.01 C ATOM 1149 CE2 PHE A 185 5.346 14.891 -5.206 1.00 7.92 C ATOM 1150 CZ PHE A 185 6.181 15.758 -4.529 1.00 8.16 C ATOM 0 H PHE A 185 6.058 9.567 -3.282 1.00 5.80 H new ATOM 0 HA PHE A 185 6.744 11.930 -1.711 1.00 5.47 H new ATOM 0 HB2 PHE A 185 4.220 11.599 -3.337 1.00 5.95 H new ATOM 0 HB3 PHE A 185 4.156 12.440 -1.801 1.00 5.95 H new ATOM 0 HD1 PHE A 185 6.444 14.086 -1.617 1.00 7.23 H new ATOM 0 HD2 PHE A 185 4.250 13.062 -5.122 1.00 7.19 H new ATOM 0 HE1 PHE A 185 7.231 16.141 -2.708 1.00 8.01 H new ATOM 0 HE2 PHE A 185 5.038 15.116 -6.216 1.00 7.92 H new ATOM 0 HZ PHE A 185 6.524 16.663 -5.008 1.00 8.16 H new ATOM 1160 N GLY A 186 4.429 9.599 -1.256 1.00 5.13 N ATOM 1161 CA GLY A 186 3.864 8.721 -0.248 1.00 4.93 C ATOM 1162 C GLY A 186 3.537 9.452 1.040 1.00 4.26 C ATOM 1163 O GLY A 186 2.588 10.232 1.112 1.00 4.37 O ATOM 0 H GLY A 186 3.995 9.530 -2.176 1.00 5.13 H new ATOM 0 HA2 GLY A 186 2.958 8.259 -0.640 1.00 4.93 H new ATOM 0 HA3 GLY A 186 4.567 7.916 -0.037 1.00 4.93 H new ATOM 1167 N PRO A 187 4.335 9.198 2.088 1.00 4.16 N ATOM 1168 CA PRO A 187 4.144 9.827 3.398 1.00 4.23 C ATOM 1169 C PRO A 187 4.475 11.315 3.381 1.00 4.65 C ATOM 1170 O PRO A 187 5.544 11.728 3.829 1.00 5.40 O ATOM 1171 CB PRO A 187 5.124 9.071 4.300 1.00 4.86 C ATOM 1172 CG PRO A 187 6.179 8.569 3.376 1.00 5.26 C ATOM 1173 CD PRO A 187 5.485 8.279 2.074 1.00 4.71 C ATOM 0 HA PRO A 187 3.107 9.771 3.730 1.00 4.23 H new ATOM 0 HB2 PRO A 187 5.545 9.725 5.063 1.00 4.86 H new ATOM 0 HB3 PRO A 187 4.630 8.250 4.821 1.00 4.86 H new ATOM 0 HG2 PRO A 187 6.966 9.311 3.242 1.00 5.26 H new ATOM 0 HG3 PRO A 187 6.652 7.671 3.775 1.00 5.26 H new ATOM 0 HD2 PRO A 187 6.137 8.465 1.221 1.00 4.71 H new ATOM 0 HD3 PRO A 187 5.167 7.238 2.011 1.00 4.71 H new ATOM 1251 N ALA A 195 -0.953 4.207 -3.709 1.00 1.45 N ATOM 1252 CA ALA A 195 -2.156 3.593 -4.258 1.00 2.21 C ATOM 1253 C ALA A 195 -1.992 3.298 -5.745 1.00 1.75 C ATOM 1254 O ALA A 195 -2.938 3.430 -6.523 1.00 2.16 O ATOM 1255 CB ALA A 195 -3.361 4.494 -4.027 1.00 3.41 C ATOM 0 HA ALA A 195 -2.319 2.647 -3.742 1.00 2.21 H new ATOM 0 HB1 ALA A 195 -4.252 4.023 -4.442 1.00 3.41 H new ATOM 0 HB2 ALA A 195 -3.498 4.651 -2.957 1.00 3.41 H new ATOM 0 HB3 ALA A 195 -3.197 5.454 -4.516 1.00 3.41 H new ATOM 1261 N HIS A 196 -0.786 2.897 -6.135 1.00 1.26 N ATOM 1262 CA HIS A 196 -0.499 2.582 -7.530 1.00 1.01 C ATOM 1263 C HIS A 196 0.115 1.191 -7.657 1.00 1.02 C ATOM 1264 O HIS A 196 1.213 0.938 -7.161 1.00 1.13 O ATOM 1265 CB HIS A 196 0.446 3.626 -8.125 1.00 0.97 C ATOM 1266 CG HIS A 196 0.712 3.429 -9.586 1.00 2.03 C ATOM 1267 ND1 HIS A 196 -0.239 2.962 -10.468 1.00 3.87 N ATOM 1268 CD2 HIS A 196 1.831 3.640 -10.319 1.00 2.61 C ATOM 1269 CE1 HIS A 196 0.283 2.892 -11.680 1.00 4.92 C ATOM 1270 NE2 HIS A 196 1.538 3.299 -11.616 1.00 4.07 N ATOM 0 H HIS A 196 0.008 2.783 -5.505 1.00 1.26 H new ATOM 0 HA HIS A 196 -1.439 2.597 -8.082 1.00 1.01 H new ATOM 0 HB2 HIS A 196 0.021 4.618 -7.972 1.00 0.97 H new ATOM 0 HB3 HIS A 196 1.392 3.598 -7.585 1.00 0.97 H new ATOM 0 HD2 HIS A 196 2.778 4.008 -9.952 1.00 2.61 H new ATOM 0 HE1 HIS A 196 -0.229 2.559 -12.571 1.00 4.92 H new ATOM 0 HE2 HIS A 196 2.185 3.351 -12.403 1.00 4.07 H new ATOM 1278 N PHE A 197 -0.601 0.293 -8.325 1.00 1.27 N ATOM 1279 CA PHE A 197 -0.128 -1.073 -8.517 1.00 1.39 C ATOM 1280 C PHE A 197 0.070 -1.377 -9.999 1.00 2.02 C ATOM 1281 O PHE A 197 -0.495 -0.706 -10.862 1.00 2.51 O ATOM 1282 CB PHE A 197 -1.118 -2.068 -7.908 1.00 1.52 C ATOM 1283 CG PHE A 197 -1.385 -1.832 -6.449 1.00 1.81 C ATOM 1284 CD1 PHE A 197 -2.284 -0.859 -6.044 1.00 2.94 C ATOM 1285 CD2 PHE A 197 -0.736 -2.584 -5.483 1.00 2.76 C ATOM 1286 CE1 PHE A 197 -2.532 -0.639 -4.702 1.00 3.81 C ATOM 1287 CE2 PHE A 197 -0.981 -2.369 -4.139 1.00 3.62 C ATOM 1288 CZ PHE A 197 -1.878 -1.395 -3.749 1.00 3.82 C ATOM 0 H PHE A 197 -1.511 0.487 -8.743 1.00 1.27 H new ATOM 0 HA PHE A 197 0.833 -1.173 -8.013 1.00 1.39 H new ATOM 0 HB2 PHE A 197 -2.059 -2.012 -8.455 1.00 1.52 H new ATOM 0 HB3 PHE A 197 -0.732 -3.079 -8.040 1.00 1.52 H new ATOM 0 HD1 PHE A 197 -2.797 -0.265 -6.786 1.00 2.94 H new ATOM 0 HD2 PHE A 197 -0.032 -3.346 -5.783 1.00 2.76 H new ATOM 0 HE1 PHE A 197 -3.236 0.122 -4.399 1.00 3.81 H new ATOM 0 HE2 PHE A 197 -0.471 -2.963 -3.395 1.00 3.62 H new ATOM 0 HZ PHE A 197 -2.068 -1.224 -2.700 1.00 3.82 H new ATOM 1298 N ASP A 198 0.876 -2.393 -10.286 1.00 2.46 N ATOM 1299 CA ASP A 198 1.150 -2.788 -11.663 1.00 3.20 C ATOM 1300 C ASP A 198 -0.148 -2.967 -12.444 1.00 3.48 C ATOM 1301 O ASP A 198 -1.068 -3.647 -11.990 1.00 3.96 O ATOM 1302 CB ASP A 198 1.961 -4.084 -11.693 1.00 4.42 C ATOM 1303 CG ASP A 198 3.446 -3.842 -11.504 1.00 5.21 C ATOM 1304 OD1 ASP A 198 3.927 -2.761 -11.905 1.00 5.79 O ATOM 1305 OD2 ASP A 198 4.126 -4.733 -10.954 1.00 5.99 O ATOM 0 H ASP A 198 1.352 -2.959 -9.583 1.00 2.46 H new ATOM 0 HA ASP A 198 1.731 -1.995 -12.134 1.00 3.20 H new ATOM 0 HB2 ASP A 198 1.602 -4.752 -10.910 1.00 4.42 H new ATOM 0 HB3 ASP A 198 1.796 -4.590 -12.644 1.00 4.42 H new ATOM 1310 N GLU A 199 -0.214 -2.352 -13.621 1.00 4.16 N ATOM 1311 CA GLU A 199 -1.401 -2.442 -14.464 1.00 5.17 C ATOM 1312 C GLU A 199 -1.445 -3.779 -15.198 1.00 4.84 C ATOM 1313 O GLU A 199 -2.499 -4.408 -15.302 1.00 5.68 O ATOM 1314 CB GLU A 199 -1.426 -1.293 -15.473 1.00 6.44 C ATOM 1315 CG GLU A 199 -1.344 0.082 -14.831 1.00 7.31 C ATOM 1316 CD GLU A 199 -2.184 0.190 -13.574 1.00 8.45 C ATOM 1317 OE1 GLU A 199 -3.315 -0.341 -13.570 1.00 9.36 O ATOM 1318 OE2 GLU A 199 -1.713 0.806 -12.595 1.00 9.02 O ATOM 0 H GLU A 199 0.540 -1.787 -14.012 1.00 4.16 H new ATOM 0 HA GLU A 199 -2.278 -2.370 -13.821 1.00 5.17 H new ATOM 0 HB2 GLU A 199 -0.593 -1.411 -16.166 1.00 6.44 H new ATOM 0 HB3 GLU A 199 -2.342 -1.356 -16.061 1.00 6.44 H new ATOM 0 HG2 GLU A 199 -0.305 0.304 -14.589 1.00 7.31 H new ATOM 0 HG3 GLU A 199 -1.672 0.834 -15.549 1.00 7.31 H new ATOM 1325 N ASP A 200 -0.295 -4.207 -15.706 1.00 4.30 N ATOM 1326 CA ASP A 200 -0.201 -5.469 -16.431 1.00 4.56 C ATOM 1327 C ASP A 200 0.073 -6.626 -15.474 1.00 4.12 C ATOM 1328 O ASP A 200 0.976 -7.430 -15.702 1.00 4.73 O ATOM 1329 CB ASP A 200 0.902 -5.394 -17.488 1.00 5.39 C ATOM 1330 CG ASP A 200 0.914 -6.606 -18.399 1.00 6.41 C ATOM 1331 OD1 ASP A 200 -0.027 -6.750 -19.207 1.00 7.46 O ATOM 1332 OD2 ASP A 200 1.864 -7.410 -18.303 1.00 6.58 O ATOM 0 H ASP A 200 0.586 -3.698 -15.629 1.00 4.30 H new ATOM 0 HA ASP A 200 -1.156 -5.647 -16.925 1.00 4.56 H new ATOM 0 HB2 ASP A 200 0.766 -4.494 -18.087 1.00 5.39 H new ATOM 0 HB3 ASP A 200 1.869 -5.305 -16.994 1.00 5.39 H new ATOM 1337 N GLU A 201 -0.712 -6.700 -14.404 1.00 3.89 N ATOM 1338 CA GLU A 201 -0.552 -7.758 -13.413 1.00 3.75 C ATOM 1339 C GLU A 201 -1.766 -8.682 -13.402 1.00 3.62 C ATOM 1340 O GLU A 201 -1.668 -9.850 -13.026 1.00 4.15 O ATOM 1341 CB GLU A 201 -0.344 -7.156 -12.022 1.00 4.31 C ATOM 1342 CG GLU A 201 1.087 -7.263 -11.520 1.00 4.97 C ATOM 1343 CD GLU A 201 1.487 -8.690 -11.198 1.00 6.05 C ATOM 1344 OE1 GLU A 201 0.818 -9.620 -11.694 1.00 6.77 O ATOM 1345 OE2 GLU A 201 2.469 -8.875 -10.449 1.00 6.85 O ATOM 0 H GLU A 201 -1.464 -6.041 -14.201 1.00 3.89 H new ATOM 0 HA GLU A 201 0.326 -8.344 -13.683 1.00 3.75 H new ATOM 0 HB2 GLU A 201 -0.635 -6.106 -12.043 1.00 4.31 H new ATOM 0 HB3 GLU A 201 -1.006 -7.657 -11.316 1.00 4.31 H new ATOM 0 HG2 GLU A 201 1.764 -6.861 -12.274 1.00 4.97 H new ATOM 0 HG3 GLU A 201 1.202 -6.647 -10.628 1.00 4.97 H new ATOM 1352 N PHE A 202 -2.911 -8.150 -13.818 1.00 3.81 N ATOM 1353 CA PHE A 202 -4.145 -8.926 -13.856 1.00 4.31 C ATOM 1354 C PHE A 202 -4.606 -9.283 -12.445 1.00 3.68 C ATOM 1355 O PHE A 202 -5.497 -10.113 -12.264 1.00 4.94 O ATOM 1356 CB PHE A 202 -3.947 -10.201 -14.678 1.00 5.23 C ATOM 1357 CG PHE A 202 -5.126 -10.547 -15.541 1.00 6.32 C ATOM 1358 CD1 PHE A 202 -5.528 -9.698 -16.560 1.00 7.08 C ATOM 1359 CD2 PHE A 202 -5.833 -11.720 -15.334 1.00 7.09 C ATOM 1360 CE1 PHE A 202 -6.613 -10.014 -17.357 1.00 8.28 C ATOM 1361 CE2 PHE A 202 -6.918 -12.041 -16.128 1.00 8.25 C ATOM 1362 CZ PHE A 202 -7.309 -11.186 -17.139 1.00 8.74 C ATOM 0 H PHE A 202 -3.010 -7.185 -14.133 1.00 3.81 H new ATOM 0 HA PHE A 202 -4.914 -8.315 -14.328 1.00 4.31 H new ATOM 0 HB2 PHE A 202 -3.067 -10.083 -15.310 1.00 5.23 H new ATOM 0 HB3 PHE A 202 -3.745 -11.032 -14.002 1.00 5.23 H new ATOM 0 HD1 PHE A 202 -4.988 -8.779 -16.734 1.00 7.08 H new ATOM 0 HD2 PHE A 202 -5.533 -12.392 -14.543 1.00 7.09 H new ATOM 0 HE1 PHE A 202 -6.915 -9.345 -18.149 1.00 8.28 H new ATOM 0 HE2 PHE A 202 -7.459 -12.960 -15.958 1.00 8.25 H new ATOM 0 HZ PHE A 202 -8.158 -11.434 -17.758 1.00 8.74 H new ATOM 1372 N TRP A 203 -3.991 -8.652 -11.451 1.00 2.31 N ATOM 1373 CA TRP A 203 -4.337 -8.904 -10.057 1.00 2.21 C ATOM 1374 C TRP A 203 -4.095 -10.364 -9.691 1.00 2.12 C ATOM 1375 O TRP A 203 -3.904 -11.211 -10.565 1.00 2.91 O ATOM 1376 CB TRP A 203 -5.799 -8.536 -9.799 1.00 3.05 C ATOM 1377 CG TRP A 203 -5.971 -7.491 -8.738 1.00 4.31 C ATOM 1378 CD1 TRP A 203 -6.567 -7.650 -7.520 1.00 5.87 C ATOM 1379 CD2 TRP A 203 -5.542 -6.127 -8.802 1.00 5.14 C ATOM 1380 NE1 TRP A 203 -6.535 -6.467 -6.823 1.00 7.31 N ATOM 1381 CE2 TRP A 203 -5.911 -5.517 -7.587 1.00 6.94 C ATOM 1382 CE3 TRP A 203 -4.881 -5.362 -9.766 1.00 5.25 C ATOM 1383 CZ2 TRP A 203 -5.641 -4.178 -7.314 1.00 8.44 C ATOM 1384 CZ3 TRP A 203 -4.614 -4.033 -9.494 1.00 6.94 C ATOM 1385 CH2 TRP A 203 -4.993 -3.453 -8.276 1.00 8.35 C ATOM 0 H TRP A 203 -3.251 -7.963 -11.584 1.00 2.31 H new ATOM 0 HA TRP A 203 -3.697 -8.282 -9.431 1.00 2.21 H new ATOM 0 HB2 TRP A 203 -6.245 -8.178 -10.727 1.00 3.05 H new ATOM 0 HB3 TRP A 203 -6.346 -9.433 -9.508 1.00 3.05 H new ATOM 0 HD1 TRP A 203 -7.000 -8.571 -7.158 1.00 5.87 H new ATOM 0 HE1 TRP A 203 -6.915 -6.320 -5.888 1.00 7.31 H new ATOM 0 HE3 TRP A 203 -4.584 -5.801 -10.707 1.00 5.25 H new ATOM 0 HZ2 TRP A 203 -5.933 -3.728 -6.376 1.00 8.44 H new ATOM 0 HZ3 TRP A 203 -4.105 -3.432 -10.233 1.00 6.94 H new ATOM 0 HH2 TRP A 203 -4.769 -2.412 -8.093 1.00 8.35 H new ATOM 1396 N THR A 204 -4.105 -10.654 -8.394 1.00 2.30 N ATOM 1397 CA THR A 204 -3.885 -12.012 -7.912 1.00 2.39 C ATOM 1398 C THR A 204 -4.473 -12.204 -6.519 1.00 2.45 C ATOM 1399 O THR A 204 -5.209 -11.351 -6.021 1.00 3.28 O ATOM 1400 CB THR A 204 -2.385 -12.360 -7.877 1.00 3.50 C ATOM 1401 OG1 THR A 204 -1.646 -11.424 -8.670 1.00 4.07 O ATOM 1402 CG2 THR A 204 -2.144 -13.771 -8.392 1.00 4.14 C ATOM 0 H THR A 204 -4.263 -9.966 -7.658 1.00 2.30 H new ATOM 0 HA THR A 204 -4.389 -12.680 -8.610 1.00 2.39 H new ATOM 0 HB THR A 204 -2.046 -12.306 -6.842 1.00 3.50 H new ATOM 0 HG1 THR A 204 -0.759 -11.791 -8.867 1.00 4.07 H new ATOM 0 HG21 THR A 204 -1.078 -13.994 -8.358 1.00 4.14 H new ATOM 0 HG22 THR A 204 -2.684 -14.483 -7.768 1.00 4.14 H new ATOM 0 HG23 THR A 204 -2.498 -13.848 -9.420 1.00 4.14 H new ATOM 1410 N THR A 205 -4.143 -13.329 -5.892 1.00 2.39 N ATOM 1411 CA THR A 205 -4.639 -13.632 -4.555 1.00 2.94 C ATOM 1412 C THR A 205 -3.540 -14.231 -3.684 1.00 2.69 C ATOM 1413 O THR A 205 -2.360 -13.925 -3.858 1.00 2.84 O ATOM 1414 CB THR A 205 -5.828 -14.610 -4.606 1.00 3.99 C ATOM 1415 OG1 THR A 205 -5.363 -15.932 -4.900 1.00 3.97 O ATOM 1416 CG2 THR A 205 -6.840 -14.177 -5.657 1.00 4.92 C ATOM 0 H THR A 205 -3.535 -14.045 -6.289 1.00 2.39 H new ATOM 0 HA THR A 205 -4.971 -12.690 -4.119 1.00 2.94 H new ATOM 0 HB THR A 205 -6.316 -14.606 -3.631 1.00 3.99 H new ATOM 0 HG1 THR A 205 -6.125 -16.548 -4.929 1.00 3.97 H new ATOM 0 HG21 THR A 205 -7.671 -14.883 -5.675 1.00 4.92 H new ATOM 0 HG22 THR A 205 -7.214 -13.182 -5.414 1.00 4.92 H new ATOM 0 HG23 THR A 205 -6.361 -14.155 -6.636 1.00 4.92 H new ATOM 1424 N HIS A 206 -3.935 -15.086 -2.747 1.00 3.01 N ATOM 1425 CA HIS A 206 -2.983 -15.729 -1.849 1.00 3.10 C ATOM 1426 C HIS A 206 -1.823 -16.337 -2.632 1.00 2.50 C ATOM 1427 O HIS A 206 -0.735 -16.540 -2.091 1.00 3.06 O ATOM 1428 CB HIS A 206 -3.679 -16.812 -1.023 1.00 3.81 C ATOM 1429 CG HIS A 206 -4.345 -17.864 -1.856 1.00 4.24 C ATOM 1430 ND1 HIS A 206 -3.665 -18.925 -2.414 1.00 4.58 N ATOM 1431 CD2 HIS A 206 -5.640 -18.014 -2.221 1.00 5.19 C ATOM 1432 CE1 HIS A 206 -4.511 -19.682 -3.089 1.00 5.64 C ATOM 1433 NE2 HIS A 206 -5.717 -19.151 -2.988 1.00 5.97 N ATOM 0 H HIS A 206 -4.908 -15.350 -2.590 1.00 3.01 H new ATOM 0 HA HIS A 206 -2.586 -14.969 -1.176 1.00 3.10 H new ATOM 0 HB2 HIS A 206 -2.946 -17.287 -0.370 1.00 3.81 H new ATOM 0 HB3 HIS A 206 -4.424 -16.344 -0.379 1.00 3.81 H new ATOM 0 HD2 HIS A 206 -6.460 -17.362 -1.958 1.00 5.19 H new ATOM 0 HE1 HIS A 206 -4.260 -20.582 -3.631 1.00 5.64 H new ATOM 0 HE2 HIS A 206 -6.567 -19.525 -3.411 1.00 5.97 H new ATOM 1441 N SER A 207 -2.062 -16.625 -3.907 1.00 2.34 N ATOM 1442 CA SER A 207 -1.039 -17.214 -4.763 1.00 3.06 C ATOM 1443 C SER A 207 0.224 -16.359 -4.766 1.00 3.77 C ATOM 1444 O SER A 207 1.315 -16.843 -5.066 1.00 4.79 O ATOM 1445 CB SER A 207 -1.567 -17.370 -6.190 1.00 4.21 C ATOM 1446 OG SER A 207 -1.422 -18.705 -6.644 1.00 4.96 O ATOM 0 H SER A 207 -2.956 -16.460 -4.370 1.00 2.34 H new ATOM 0 HA SER A 207 -0.790 -18.198 -4.366 1.00 3.06 H new ATOM 0 HB2 SER A 207 -2.618 -17.082 -6.226 1.00 4.21 H new ATOM 0 HB3 SER A 207 -1.029 -16.695 -6.856 1.00 4.21 H new ATOM 0 HG SER A 207 -1.768 -18.779 -7.558 1.00 4.96 H new ATOM 1452 N GLY A 208 0.068 -15.081 -4.430 1.00 3.89 N ATOM 1453 CA GLY A 208 1.203 -14.178 -4.401 1.00 5.23 C ATOM 1454 C GLY A 208 1.579 -13.674 -5.780 1.00 4.57 C ATOM 1455 O GLY A 208 1.854 -14.462 -6.683 1.00 4.63 O ATOM 0 H GLY A 208 -0.824 -14.656 -4.178 1.00 3.89 H new ATOM 0 HA2 GLY A 208 0.971 -13.329 -3.758 1.00 5.23 H new ATOM 0 HA3 GLY A 208 2.058 -14.689 -3.959 1.00 5.23 H new ATOM 1459 N GLY A 209 1.589 -12.354 -5.944 1.00 4.78 N ATOM 1460 CA GLY A 209 1.933 -11.769 -7.226 1.00 4.37 C ATOM 1461 C GLY A 209 1.541 -10.307 -7.321 1.00 3.61 C ATOM 1462 O GLY A 209 2.400 -9.429 -7.399 1.00 4.23 O ATOM 0 H GLY A 209 1.365 -11.680 -5.212 1.00 4.78 H new ATOM 0 HA2 GLY A 209 3.006 -11.865 -7.389 1.00 4.37 H new ATOM 0 HA3 GLY A 209 1.438 -12.327 -8.021 1.00 4.37 H new ATOM 1466 N THR A 210 0.237 -10.045 -7.314 1.00 2.95 N ATOM 1467 CA THR A 210 -0.268 -8.681 -7.403 1.00 2.71 C ATOM 1468 C THR A 210 -0.932 -8.255 -6.098 1.00 2.73 C ATOM 1469 O THR A 210 -1.502 -9.078 -5.384 1.00 2.48 O ATOM 1470 CB THR A 210 -1.279 -8.530 -8.554 1.00 2.95 C ATOM 1471 OG1 THR A 210 -0.814 -9.235 -9.710 1.00 3.86 O ATOM 1472 CG2 THR A 210 -1.492 -7.063 -8.899 1.00 3.55 C ATOM 0 H THR A 210 -0.488 -10.760 -7.248 1.00 2.95 H new ATOM 0 HA THR A 210 0.590 -8.038 -7.598 1.00 2.71 H new ATOM 0 HB THR A 210 -2.230 -8.952 -8.230 1.00 2.95 H new ATOM 0 HG1 THR A 210 -1.128 -10.163 -9.676 1.00 3.86 H new ATOM 0 HG21 THR A 210 -2.210 -6.982 -9.715 1.00 3.55 H new ATOM 0 HG22 THR A 210 -1.874 -6.535 -8.025 1.00 3.55 H new ATOM 0 HG23 THR A 210 -0.544 -6.620 -9.204 1.00 3.55 H new ATOM 1480 N ASN A 211 -0.856 -6.963 -5.795 1.00 3.85 N ATOM 1481 CA ASN A 211 -1.450 -6.428 -4.575 1.00 4.55 C ATOM 1482 C ASN A 211 -1.367 -7.442 -3.439 1.00 3.00 C ATOM 1483 O ASN A 211 -0.313 -7.622 -2.828 1.00 3.52 O ATOM 1484 CB ASN A 211 -2.910 -6.040 -4.823 1.00 6.02 C ATOM 1485 CG ASN A 211 -3.040 -4.779 -5.654 1.00 8.06 C ATOM 1486 OD1 ASN A 211 -2.619 -4.737 -6.810 1.00 8.56 O ATOM 1487 ND2 ASN A 211 -3.625 -3.742 -5.067 1.00 9.58 N ATOM 0 H ASN A 211 -0.389 -6.268 -6.377 1.00 3.85 H new ATOM 0 HA ASN A 211 -0.888 -5.540 -4.286 1.00 4.55 H new ATOM 0 HB2 ASN A 211 -3.420 -6.860 -5.329 1.00 6.02 H new ATOM 0 HB3 ASN A 211 -3.412 -5.895 -3.866 1.00 6.02 H new ATOM 0 HD21 ASN A 211 -3.740 -2.866 -5.576 1.00 9.58 H new ATOM 0 HD22 ASN A 211 -3.959 -3.821 -4.107 1.00 9.58 H new ATOM 1494 N LEU A 212 -2.485 -8.104 -3.161 1.00 2.29 N ATOM 1495 CA LEU A 212 -2.540 -9.102 -2.099 1.00 1.94 C ATOM 1496 C LEU A 212 -2.273 -8.464 -0.739 1.00 1.84 C ATOM 1497 O LEU A 212 -1.693 -7.382 -0.652 1.00 1.90 O ATOM 1498 CB LEU A 212 -1.522 -10.213 -2.362 1.00 3.02 C ATOM 1499 CG LEU A 212 -1.673 -11.477 -1.515 1.00 4.47 C ATOM 1500 CD1 LEU A 212 -3.095 -12.008 -1.599 1.00 4.76 C ATOM 1501 CD2 LEU A 212 -0.678 -12.539 -1.960 1.00 5.91 C ATOM 0 H LEU A 212 -3.366 -7.967 -3.657 1.00 2.29 H new ATOM 0 HA LEU A 212 -3.542 -9.531 -2.089 1.00 1.94 H new ATOM 0 HB2 LEU A 212 -1.585 -10.495 -3.413 1.00 3.02 H new ATOM 0 HB3 LEU A 212 -0.523 -9.808 -2.200 1.00 3.02 H new ATOM 0 HG LEU A 212 -1.462 -11.223 -0.476 1.00 4.47 H new ATOM 0 HD11 LEU A 212 -3.184 -12.908 -0.990 1.00 4.76 H new ATOM 0 HD12 LEU A 212 -3.788 -11.251 -1.232 1.00 4.76 H new ATOM 0 HD13 LEU A 212 -3.334 -12.246 -2.635 1.00 4.76 H new ATOM 0 HD21 LEU A 212 -0.800 -13.432 -1.346 1.00 5.91 H new ATOM 0 HD22 LEU A 212 -0.857 -12.790 -3.005 1.00 5.91 H new ATOM 0 HD23 LEU A 212 0.337 -12.157 -1.847 1.00 5.91 H new ATOM 1513 N PHE A 213 -2.700 -9.144 0.321 1.00 1.98 N ATOM 1514 CA PHE A 213 -2.506 -8.644 1.677 1.00 2.30 C ATOM 1515 C PHE A 213 -1.055 -8.814 2.117 1.00 2.24 C ATOM 1516 O PHE A 213 -0.667 -8.373 3.200 1.00 2.76 O ATOM 1517 CB PHE A 213 -3.434 -9.375 2.650 1.00 2.70 C ATOM 1518 CG PHE A 213 -3.244 -10.865 2.655 1.00 3.48 C ATOM 1519 CD1 PHE A 213 -2.256 -11.448 3.433 1.00 4.69 C ATOM 1520 CD2 PHE A 213 -4.052 -11.683 1.882 1.00 4.10 C ATOM 1521 CE1 PHE A 213 -2.079 -12.818 3.441 1.00 5.90 C ATOM 1522 CE2 PHE A 213 -3.879 -13.054 1.886 1.00 5.44 C ATOM 1523 CZ PHE A 213 -2.890 -13.622 2.665 1.00 6.15 C ATOM 0 H PHE A 213 -3.182 -10.041 0.267 1.00 1.98 H new ATOM 0 HA PHE A 213 -2.747 -7.581 1.684 1.00 2.30 H new ATOM 0 HB2 PHE A 213 -3.266 -8.992 3.657 1.00 2.70 H new ATOM 0 HB3 PHE A 213 -4.469 -9.150 2.392 1.00 2.70 H new ATOM 0 HD1 PHE A 213 -1.617 -10.824 4.040 1.00 4.69 H new ATOM 0 HD2 PHE A 213 -4.826 -11.244 1.269 1.00 4.10 H new ATOM 0 HE1 PHE A 213 -1.307 -13.260 4.054 1.00 5.90 H new ATOM 0 HE2 PHE A 213 -4.517 -13.681 1.280 1.00 5.44 H new ATOM 0 HZ PHE A 213 -2.751 -14.693 2.667 1.00 6.15 H new ATOM 1533 N LEU A 214 -0.257 -9.456 1.271 1.00 1.80 N ATOM 1534 CA LEU A 214 1.152 -9.685 1.571 1.00 1.94 C ATOM 1535 C LEU A 214 2.000 -8.489 1.149 1.00 1.82 C ATOM 1536 O LEU A 214 2.661 -7.860 1.976 1.00 1.91 O ATOM 1537 CB LEU A 214 1.645 -10.949 0.865 1.00 1.99 C ATOM 1538 CG LEU A 214 2.673 -11.785 1.627 1.00 2.52 C ATOM 1539 CD1 LEU A 214 2.466 -13.267 1.351 1.00 3.38 C ATOM 1540 CD2 LEU A 214 4.087 -11.364 1.252 1.00 3.60 C ATOM 0 H LEU A 214 -0.562 -9.827 0.371 1.00 1.80 H new ATOM 0 HA LEU A 214 1.252 -9.816 2.648 1.00 1.94 H new ATOM 0 HB2 LEU A 214 0.783 -11.579 0.648 1.00 1.99 H new ATOM 0 HB3 LEU A 214 2.079 -10.661 -0.093 1.00 1.99 H new ATOM 0 HG LEU A 214 2.534 -11.612 2.694 1.00 2.52 H new ATOM 0 HD11 LEU A 214 3.207 -13.847 1.902 1.00 3.38 H new ATOM 0 HD12 LEU A 214 1.466 -13.560 1.670 1.00 3.38 H new ATOM 0 HD13 LEU A 214 2.577 -13.457 0.283 1.00 3.38 H new ATOM 0 HD21 LEU A 214 4.806 -11.970 1.804 1.00 3.60 H new ATOM 0 HD22 LEU A 214 4.238 -11.508 0.182 1.00 3.60 H new ATOM 0 HD23 LEU A 214 4.232 -10.313 1.501 1.00 3.60 H new ATOM 1552 N THR A 215 1.975 -8.179 -0.143 1.00 1.66 N ATOM 1553 CA THR A 215 2.740 -7.058 -0.675 1.00 1.58 C ATOM 1554 C THR A 215 2.110 -5.727 -0.283 1.00 1.42 C ATOM 1555 O THR A 215 2.793 -4.706 -0.201 1.00 1.34 O ATOM 1556 CB THR A 215 2.848 -7.129 -2.210 1.00 1.71 C ATOM 1557 OG1 THR A 215 3.361 -8.406 -2.606 1.00 1.89 O ATOM 1558 CG2 THR A 215 3.751 -6.026 -2.741 1.00 1.69 C ATOM 0 H THR A 215 1.433 -8.689 -0.841 1.00 1.66 H new ATOM 0 HA THR A 215 3.739 -7.125 -0.244 1.00 1.58 H new ATOM 0 HB THR A 215 1.851 -6.993 -2.629 1.00 1.71 H new ATOM 0 HG1 THR A 215 3.425 -8.444 -3.583 1.00 1.89 H new ATOM 0 HG21 THR A 215 3.812 -6.097 -3.827 1.00 1.69 H new ATOM 0 HG22 THR A 215 3.341 -5.055 -2.463 1.00 1.69 H new ATOM 0 HG23 THR A 215 4.748 -6.135 -2.314 1.00 1.69 H new ATOM 1566 N ALA A 216 0.803 -5.744 -0.040 1.00 1.44 N ATOM 1567 CA ALA A 216 0.082 -4.538 0.346 1.00 1.38 C ATOM 1568 C ALA A 216 0.747 -3.859 1.538 1.00 1.21 C ATOM 1569 O ALA A 216 0.825 -2.632 1.603 1.00 1.16 O ATOM 1570 CB ALA A 216 -1.368 -4.870 0.668 1.00 1.52 C ATOM 0 H ALA A 216 0.222 -6.580 -0.104 1.00 1.44 H new ATOM 0 HA ALA A 216 0.107 -3.845 -0.495 1.00 1.38 H new ATOM 0 HB1 ALA A 216 -1.895 -3.960 0.955 1.00 1.52 H new ATOM 0 HB2 ALA A 216 -1.846 -5.304 -0.210 1.00 1.52 H new ATOM 0 HB3 ALA A 216 -1.404 -5.584 1.491 1.00 1.52 H new ATOM 1576 N VAL A 217 1.226 -4.664 2.481 1.00 1.21 N ATOM 1577 CA VAL A 217 1.886 -4.140 3.671 1.00 1.11 C ATOM 1578 C VAL A 217 3.051 -3.230 3.299 1.00 0.99 C ATOM 1579 O VAL A 217 3.277 -2.201 3.936 1.00 1.05 O ATOM 1580 CB VAL A 217 2.405 -5.277 4.572 1.00 1.21 C ATOM 1581 CG1 VAL A 217 3.238 -4.716 5.714 1.00 1.18 C ATOM 1582 CG2 VAL A 217 1.246 -6.107 5.103 1.00 1.39 C ATOM 0 H VAL A 217 1.169 -5.682 2.444 1.00 1.21 H new ATOM 0 HA VAL A 217 1.140 -3.564 4.218 1.00 1.11 H new ATOM 0 HB VAL A 217 3.044 -5.928 3.975 1.00 1.21 H new ATOM 0 HG11 VAL A 217 3.596 -5.534 6.339 1.00 1.18 H new ATOM 0 HG12 VAL A 217 4.090 -4.170 5.309 1.00 1.18 H new ATOM 0 HG13 VAL A 217 2.626 -4.042 6.313 1.00 1.18 H new ATOM 0 HG21 VAL A 217 1.631 -6.905 5.737 1.00 1.39 H new ATOM 0 HG22 VAL A 217 0.579 -5.471 5.685 1.00 1.39 H new ATOM 0 HG23 VAL A 217 0.696 -6.540 4.268 1.00 1.39 H new ATOM 1592 N HIS A 218 3.788 -3.616 2.261 1.00 0.96 N ATOM 1593 CA HIS A 218 4.930 -2.833 1.802 1.00 1.00 C ATOM 1594 C HIS A 218 4.470 -1.534 1.148 1.00 0.97 C ATOM 1595 O HIS A 218 4.953 -0.454 1.487 1.00 1.10 O ATOM 1596 CB HIS A 218 5.768 -3.646 0.815 1.00 1.20 C ATOM 1597 CG HIS A 218 6.859 -2.855 0.162 1.00 2.49 C ATOM 1598 ND1 HIS A 218 6.657 -2.074 -0.956 1.00 3.96 N ATOM 1599 CD2 HIS A 218 8.169 -2.726 0.477 1.00 3.46 C ATOM 1600 CE1 HIS A 218 7.795 -1.499 -1.301 1.00 5.15 C ATOM 1601 NE2 HIS A 218 8.729 -1.878 -0.447 1.00 4.83 N ATOM 0 H HIS A 218 3.615 -4.465 1.723 1.00 0.96 H new ATOM 0 HA HIS A 218 5.542 -2.585 2.669 1.00 1.00 H new ATOM 0 HB2 HIS A 218 6.209 -4.494 1.338 1.00 1.20 H new ATOM 0 HB3 HIS A 218 5.113 -4.052 0.044 1.00 1.20 H new ATOM 0 HD2 HIS A 218 8.679 -3.201 1.302 1.00 3.46 H new ATOM 0 HE1 HIS A 218 7.938 -0.832 -2.139 1.00 5.15 H new ATOM 0 HE2 HIS A 218 9.707 -1.588 -0.470 1.00 4.83 H new ATOM 1609 N GLU A 219 3.535 -1.647 0.210 1.00 0.96 N ATOM 1610 CA GLU A 219 3.013 -0.480 -0.492 1.00 1.08 C ATOM 1611 C GLU A 219 2.566 0.593 0.496 1.00 1.18 C ATOM 1612 O GLU A 219 3.117 1.694 0.524 1.00 1.36 O ATOM 1613 CB GLU A 219 1.842 -0.881 -1.392 1.00 1.16 C ATOM 1614 CG GLU A 219 2.252 -1.197 -2.820 1.00 1.59 C ATOM 1615 CD GLU A 219 2.891 -0.013 -3.519 1.00 1.98 C ATOM 1616 OE1 GLU A 219 4.121 0.160 -3.390 1.00 3.08 O ATOM 1617 OE2 GLU A 219 2.161 0.741 -4.195 1.00 2.79 O ATOM 0 H GLU A 219 3.124 -2.534 -0.081 1.00 0.96 H new ATOM 0 HA GLU A 219 3.812 -0.070 -1.109 1.00 1.08 H new ATOM 0 HB2 GLU A 219 1.348 -1.753 -0.964 1.00 1.16 H new ATOM 0 HB3 GLU A 219 1.110 -0.073 -1.403 1.00 1.16 H new ATOM 0 HG2 GLU A 219 2.951 -2.033 -2.817 1.00 1.59 H new ATOM 0 HG3 GLU A 219 1.375 -1.517 -3.383 1.00 1.59 H new ATOM 1624 N ILE A 220 1.562 0.265 1.303 1.00 1.16 N ATOM 1625 CA ILE A 220 1.041 1.201 2.292 1.00 1.35 C ATOM 1626 C ILE A 220 2.101 1.547 3.333 1.00 1.45 C ATOM 1627 O ILE A 220 2.074 2.624 3.927 1.00 1.60 O ATOM 1628 CB ILE A 220 -0.198 0.632 3.007 1.00 1.41 C ATOM 1629 CG1 ILE A 220 -1.383 0.561 2.042 1.00 2.15 C ATOM 1630 CG2 ILE A 220 -0.546 1.481 4.220 1.00 1.83 C ATOM 1631 CD1 ILE A 220 -1.860 1.917 1.570 1.00 2.20 C ATOM 0 H ILE A 220 1.094 -0.641 1.291 1.00 1.16 H new ATOM 0 HA ILE A 220 0.756 2.104 1.753 1.00 1.35 H new ATOM 0 HB ILE A 220 0.030 -0.378 3.348 1.00 1.41 H new ATOM 0 HG12 ILE A 220 -1.101 -0.037 1.176 1.00 2.15 H new ATOM 0 HG13 ILE A 220 -2.209 0.044 2.531 1.00 2.15 H new ATOM 0 HG21 ILE A 220 -1.424 1.066 4.715 1.00 1.83 H new ATOM 0 HG22 ILE A 220 0.294 1.485 4.915 1.00 1.83 H new ATOM 0 HG23 ILE A 220 -0.758 2.502 3.901 1.00 1.83 H new ATOM 0 HD11 ILE A 220 -2.702 1.790 0.889 1.00 2.20 H new ATOM 0 HD12 ILE A 220 -2.174 2.511 2.428 1.00 2.20 H new ATOM 0 HD13 ILE A 220 -1.048 2.428 1.052 1.00 2.20 H new ATOM 1643 N GLY A 221 3.035 0.626 3.548 1.00 1.42 N ATOM 1644 CA GLY A 221 4.092 0.853 4.516 1.00 1.56 C ATOM 1645 C GLY A 221 4.830 2.154 4.274 1.00 1.75 C ATOM 1646 O GLY A 221 5.270 2.812 5.217 1.00 2.01 O ATOM 0 H GLY A 221 3.079 -0.273 3.069 1.00 1.42 H new ATOM 0 HA2 GLY A 221 3.666 0.862 5.519 1.00 1.56 H new ATOM 0 HA3 GLY A 221 4.800 0.025 4.478 1.00 1.56 H new ATOM 1650 N HIS A 222 4.969 2.527 3.005 1.00 1.80 N ATOM 1651 CA HIS A 222 5.660 3.759 2.642 1.00 2.17 C ATOM 1652 C HIS A 222 4.824 4.981 3.011 1.00 2.56 C ATOM 1653 O HIS A 222 5.257 5.828 3.792 1.00 3.28 O ATOM 1654 CB HIS A 222 5.970 3.772 1.145 1.00 2.32 C ATOM 1655 CG HIS A 222 7.385 4.148 0.829 1.00 2.75 C ATOM 1656 ND1 HIS A 222 8.352 3.224 0.491 1.00 2.85 N ATOM 1657 CD2 HIS A 222 7.995 5.356 0.800 1.00 4.13 C ATOM 1658 CE1 HIS A 222 9.495 3.848 0.270 1.00 3.74 C ATOM 1659 NE2 HIS A 222 9.305 5.142 0.450 1.00 4.46 N ATOM 0 H HIS A 222 4.612 1.994 2.212 1.00 1.80 H new ATOM 0 HA HIS A 222 6.595 3.799 3.200 1.00 2.17 H new ATOM 0 HB2 HIS A 222 5.764 2.785 0.731 1.00 2.32 H new ATOM 0 HB3 HIS A 222 5.297 4.472 0.649 1.00 2.32 H new ATOM 0 HD2 HIS A 222 7.536 6.310 1.013 1.00 4.13 H new ATOM 0 HE1 HIS A 222 10.427 3.379 -0.010 1.00 3.74 H new ATOM 0 HE2 HIS A 222 10.016 5.866 0.346 1.00 4.46 H new ATOM 1667 N SER A 223 3.626 5.065 2.443 1.00 2.19 N ATOM 1668 CA SER A 223 2.731 6.186 2.709 1.00 2.55 C ATOM 1669 C SER A 223 2.516 6.365 4.208 1.00 2.61 C ATOM 1670 O SER A 223 2.448 7.489 4.708 1.00 3.00 O ATOM 1671 CB SER A 223 1.387 5.969 2.011 1.00 2.61 C ATOM 1672 OG SER A 223 0.816 4.725 2.378 1.00 3.85 O ATOM 0 H SER A 223 3.252 4.371 1.796 1.00 2.19 H new ATOM 0 HA SER A 223 3.194 7.091 2.316 1.00 2.55 H new ATOM 0 HB2 SER A 223 0.704 6.777 2.272 1.00 2.61 H new ATOM 0 HB3 SER A 223 1.525 6.005 0.930 1.00 2.61 H new ATOM 0 HG SER A 223 1.490 4.176 2.830 1.00 3.85 H new ATOM 1678 N LEU A 224 2.407 5.249 4.921 1.00 2.36 N ATOM 1679 CA LEU A 224 2.199 5.281 6.365 1.00 2.54 C ATOM 1680 C LEU A 224 3.462 5.740 7.087 1.00 2.53 C ATOM 1681 O LEU A 224 3.393 6.357 8.149 1.00 2.92 O ATOM 1682 CB LEU A 224 1.783 3.899 6.870 1.00 2.43 C ATOM 1683 CG LEU A 224 0.295 3.715 7.172 1.00 2.86 C ATOM 1684 CD1 LEU A 224 -0.061 4.351 8.507 1.00 3.45 C ATOM 1685 CD2 LEU A 224 -0.553 4.305 6.055 1.00 2.62 C ATOM 0 H LEU A 224 2.459 4.311 4.523 1.00 2.36 H new ATOM 0 HA LEU A 224 1.402 5.994 6.577 1.00 2.54 H new ATOM 0 HB2 LEU A 224 2.077 3.159 6.126 1.00 2.43 H new ATOM 0 HB3 LEU A 224 2.347 3.680 7.777 1.00 2.43 H new ATOM 0 HG LEU A 224 0.086 2.647 7.234 1.00 2.86 H new ATOM 0 HD11 LEU A 224 -1.124 4.210 8.705 1.00 3.45 H new ATOM 0 HD12 LEU A 224 0.521 3.882 9.300 1.00 3.45 H new ATOM 0 HD13 LEU A 224 0.164 5.417 8.474 1.00 3.45 H new ATOM 0 HD21 LEU A 224 -1.609 4.165 6.287 1.00 2.62 H new ATOM 0 HD22 LEU A 224 -0.340 5.370 5.960 1.00 2.62 H new ATOM 0 HD23 LEU A 224 -0.318 3.803 5.116 1.00 2.62 H new ATOM 1697 N GLY A 225 4.617 5.435 6.502 1.00 2.36 N ATOM 1698 CA GLY A 225 5.879 5.826 7.103 1.00 2.45 C ATOM 1699 C GLY A 225 7.025 4.931 6.675 1.00 2.22 C ATOM 1700 O GLY A 225 7.550 4.157 7.476 1.00 3.27 O ATOM 0 H GLY A 225 4.701 4.924 5.623 1.00 2.36 H new ATOM 0 HA2 GLY A 225 6.105 6.857 6.829 1.00 2.45 H new ATOM 0 HA3 GLY A 225 5.785 5.798 8.189 1.00 2.45 H new ATOM 1704 N LEU A 226 7.415 5.036 5.409 1.00 2.09 N ATOM 1705 CA LEU A 226 8.506 4.228 4.876 1.00 2.19 C ATOM 1706 C LEU A 226 8.129 2.751 4.849 1.00 2.82 C ATOM 1707 O LEU A 226 7.702 2.191 5.858 1.00 3.66 O ATOM 1708 CB LEU A 226 9.771 4.428 5.713 1.00 3.12 C ATOM 1709 CG LEU A 226 11.097 4.351 4.955 1.00 3.49 C ATOM 1710 CD1 LEU A 226 11.429 5.694 4.322 1.00 4.13 C ATOM 1711 CD2 LEU A 226 12.217 3.905 5.883 1.00 4.79 C ATOM 0 H LEU A 226 6.992 5.672 4.733 1.00 2.09 H new ATOM 0 HA LEU A 226 8.699 4.553 3.853 1.00 2.19 H new ATOM 0 HB2 LEU A 226 9.710 5.401 6.200 1.00 3.12 H new ATOM 0 HB3 LEU A 226 9.783 3.677 6.502 1.00 3.12 H new ATOM 0 HG LEU A 226 10.996 3.613 4.159 1.00 3.49 H new ATOM 0 HD11 LEU A 226 12.376 5.620 3.787 1.00 4.13 H new ATOM 0 HD12 LEU A 226 10.639 5.973 3.625 1.00 4.13 H new ATOM 0 HD13 LEU A 226 11.510 6.453 5.100 1.00 4.13 H new ATOM 0 HD21 LEU A 226 13.153 3.856 5.326 1.00 4.79 H new ATOM 0 HD22 LEU A 226 12.318 4.619 6.701 1.00 4.79 H new ATOM 0 HD23 LEU A 226 11.984 2.920 6.288 1.00 4.79 H new ATOM 1723 N GLY A 227 8.291 2.124 3.688 1.00 3.70 N ATOM 1724 CA GLY A 227 7.964 0.717 3.552 1.00 5.08 C ATOM 1725 C GLY A 227 9.131 -0.103 3.039 1.00 4.86 C ATOM 1726 O GLY A 227 9.042 -1.327 2.934 1.00 5.66 O ATOM 0 H GLY A 227 8.643 2.566 2.839 1.00 3.70 H new ATOM 0 HA2 GLY A 227 7.646 0.326 4.519 1.00 5.08 H new ATOM 0 HA3 GLY A 227 7.120 0.608 2.871 1.00 5.08 H new ATOM 1730 N HIS A 228 10.230 0.573 2.716 1.00 4.29 N ATOM 1731 CA HIS A 228 11.420 -0.101 2.209 1.00 4.45 C ATOM 1732 C HIS A 228 12.080 -0.935 3.303 1.00 4.18 C ATOM 1733 O HIS A 228 12.337 -2.125 3.121 1.00 5.08 O ATOM 1734 CB HIS A 228 12.415 0.921 1.660 1.00 4.40 C ATOM 1735 CG HIS A 228 13.558 0.304 0.913 1.00 4.98 C ATOM 1736 ND1 HIS A 228 14.866 0.378 1.344 1.00 5.64 N ATOM 1737 CD2 HIS A 228 13.582 -0.403 -0.241 1.00 5.98 C ATOM 1738 CE1 HIS A 228 15.646 -0.256 0.486 1.00 6.82 C ATOM 1739 NE2 HIS A 228 14.891 -0.739 -0.485 1.00 6.84 N ATOM 0 H HIS A 228 10.321 1.586 2.796 1.00 4.29 H new ATOM 0 HA HIS A 228 11.114 -0.768 1.403 1.00 4.45 H new ATOM 0 HB2 HIS A 228 11.889 1.609 0.998 1.00 4.40 H new ATOM 0 HB3 HIS A 228 12.809 1.512 2.487 1.00 4.40 H new ATOM 0 HD2 HIS A 228 12.730 -0.656 -0.855 1.00 5.98 H new ATOM 0 HE1 HIS A 228 16.718 -0.361 0.565 1.00 6.82 H new ATOM 0 HE2 HIS A 228 15.226 -1.275 -1.286 1.00 6.84 H new ATOM 1795 N LYS A 233 14.156 -10.502 6.809 1.00 2.86 N ATOM 1796 CA LYS A 233 13.098 -11.477 7.046 1.00 3.15 C ATOM 1797 C LYS A 233 11.790 -10.783 7.410 1.00 2.77 C ATOM 1798 O LYS A 233 11.315 -10.887 8.541 1.00 3.16 O ATOM 1799 CB LYS A 233 13.505 -12.441 8.163 1.00 3.95 C ATOM 1800 CG LYS A 233 14.748 -13.252 7.843 1.00 4.65 C ATOM 1801 CD LYS A 233 15.978 -12.683 8.531 1.00 4.47 C ATOM 1802 CE LYS A 233 16.569 -13.671 9.525 1.00 5.17 C ATOM 1803 NZ LYS A 233 17.067 -14.903 8.852 1.00 6.04 N ATOM 0 HA LYS A 233 12.945 -12.041 6.126 1.00 3.15 H new ATOM 0 HB2 LYS A 233 13.677 -11.873 9.077 1.00 3.95 H new ATOM 0 HB3 LYS A 233 12.678 -13.123 8.363 1.00 3.95 H new ATOM 0 HG2 LYS A 233 14.600 -14.285 8.157 1.00 4.65 H new ATOM 0 HG3 LYS A 233 14.907 -13.266 6.765 1.00 4.65 H new ATOM 0 HD2 LYS A 233 16.728 -12.425 7.783 1.00 4.47 H new ATOM 0 HD3 LYS A 233 15.713 -11.760 9.047 1.00 4.47 H new ATOM 0 HE2 LYS A 233 17.388 -13.196 10.066 1.00 5.17 H new ATOM 0 HE3 LYS A 233 15.813 -13.940 10.263 1.00 5.17 H new ATOM 0 HZ1 LYS A 233 17.772 -15.369 9.458 1.00 6.04 H new ATOM 0 HZ2 LYS A 233 16.272 -15.552 8.683 1.00 6.04 H new ATOM 0 HZ3 LYS A 233 17.505 -14.649 7.944 1.00 6.04 H new ATOM 1817 N ALA A 234 11.211 -10.076 6.445 1.00 2.82 N ATOM 1818 CA ALA A 234 9.956 -9.368 6.663 1.00 2.63 C ATOM 1819 C ALA A 234 9.311 -8.973 5.340 1.00 2.52 C ATOM 1820 O ALA A 234 9.876 -9.200 4.270 1.00 2.54 O ATOM 1821 CB ALA A 234 10.188 -8.137 7.527 1.00 2.73 C ATOM 0 H ALA A 234 11.592 -9.978 5.504 1.00 2.82 H new ATOM 0 HA ALA A 234 9.274 -10.041 7.183 1.00 2.63 H new ATOM 0 HB1 ALA A 234 9.242 -7.618 7.682 1.00 2.73 H new ATOM 0 HB2 ALA A 234 10.597 -8.441 8.491 1.00 2.73 H new ATOM 0 HB3 ALA A 234 10.891 -7.470 7.028 1.00 2.73 H new ATOM 1827 N VAL A 235 8.123 -8.382 5.419 1.00 2.64 N ATOM 1828 CA VAL A 235 7.400 -7.955 4.227 1.00 2.80 C ATOM 1829 C VAL A 235 8.093 -6.774 3.557 1.00 2.95 C ATOM 1830 O VAL A 235 7.744 -6.388 2.442 1.00 3.31 O ATOM 1831 CB VAL A 235 5.948 -7.563 4.561 1.00 3.25 C ATOM 1832 CG1 VAL A 235 5.174 -8.767 5.073 1.00 4.30 C ATOM 1833 CG2 VAL A 235 5.924 -6.431 5.576 1.00 3.47 C ATOM 0 H VAL A 235 7.641 -8.188 6.297 1.00 2.64 H new ATOM 0 HA VAL A 235 7.391 -8.803 3.542 1.00 2.80 H new ATOM 0 HB VAL A 235 5.464 -7.213 3.649 1.00 3.25 H new ATOM 0 HG11 VAL A 235 4.151 -8.471 5.304 1.00 4.30 H new ATOM 0 HG12 VAL A 235 5.163 -9.544 4.309 1.00 4.30 H new ATOM 0 HG13 VAL A 235 5.652 -9.151 5.974 1.00 4.30 H new ATOM 0 HG21 VAL A 235 4.891 -6.166 5.801 1.00 3.47 H new ATOM 0 HG22 VAL A 235 6.424 -6.751 6.490 1.00 3.47 H new ATOM 0 HG23 VAL A 235 6.440 -5.563 5.165 1.00 3.47 H new ATOM 1843 N MET A 236 9.077 -6.205 4.245 1.00 2.94 N ATOM 1844 CA MET A 236 9.822 -5.068 3.716 1.00 3.27 C ATOM 1845 C MET A 236 10.324 -5.357 2.304 1.00 3.19 C ATOM 1846 O MET A 236 10.218 -6.482 1.815 1.00 3.58 O ATOM 1847 CB MET A 236 11.001 -4.733 4.630 1.00 3.50 C ATOM 1848 CG MET A 236 12.182 -5.676 4.470 1.00 4.20 C ATOM 1849 SD MET A 236 13.597 -4.888 3.675 1.00 5.45 S ATOM 1850 CE MET A 236 14.406 -6.308 2.941 1.00 6.85 C ATOM 0 H MET A 236 9.377 -6.512 5.170 1.00 2.94 H new ATOM 0 HA MET A 236 9.149 -4.212 3.676 1.00 3.27 H new ATOM 0 HB2 MET A 236 11.330 -3.714 4.426 1.00 3.50 H new ATOM 0 HB3 MET A 236 10.665 -4.758 5.667 1.00 3.50 H new ATOM 0 HG2 MET A 236 12.481 -6.047 5.450 1.00 4.20 H new ATOM 0 HG3 MET A 236 11.875 -6.541 3.882 1.00 4.20 H new ATOM 0 HE1 MET A 236 15.082 -5.975 2.154 1.00 6.85 H new ATOM 0 HE2 MET A 236 14.973 -6.839 3.705 1.00 6.85 H new ATOM 0 HE3 MET A 236 13.656 -6.975 2.517 1.00 6.85 H new ATOM 1860 N PHE A 237 10.870 -4.334 1.655 1.00 3.34 N ATOM 1861 CA PHE A 237 11.387 -4.478 0.299 1.00 3.30 C ATOM 1862 C PHE A 237 10.253 -4.716 -0.693 1.00 3.20 C ATOM 1863 O PHE A 237 9.257 -5.375 -0.392 1.00 3.05 O ATOM 1864 CB PHE A 237 12.388 -5.633 0.232 1.00 3.10 C ATOM 1865 CG PHE A 237 13.752 -5.218 -0.239 1.00 3.54 C ATOM 1866 CD1 PHE A 237 14.397 -4.133 0.333 1.00 4.06 C ATOM 1867 CD2 PHE A 237 14.390 -5.911 -1.255 1.00 4.27 C ATOM 1868 CE1 PHE A 237 15.652 -3.748 -0.099 1.00 4.75 C ATOM 1869 CE2 PHE A 237 15.645 -5.531 -1.692 1.00 4.89 C ATOM 1870 CZ PHE A 237 16.277 -4.449 -1.112 1.00 4.94 C ATOM 0 H PHE A 237 10.966 -3.397 2.046 1.00 3.34 H new ATOM 0 HA PHE A 237 11.893 -3.551 0.030 1.00 3.30 H new ATOM 0 HB2 PHE A 237 12.476 -6.085 1.220 1.00 3.10 H new ATOM 0 HB3 PHE A 237 12.000 -6.401 -0.437 1.00 3.10 H new ATOM 0 HD1 PHE A 237 13.913 -3.582 1.126 1.00 4.06 H new ATOM 0 HD2 PHE A 237 13.901 -6.759 -1.711 1.00 4.27 H new ATOM 0 HE1 PHE A 237 16.144 -2.900 0.355 1.00 4.75 H new ATOM 0 HE2 PHE A 237 16.130 -6.079 -2.486 1.00 4.89 H new ATOM 0 HZ PHE A 237 17.259 -4.151 -1.450 1.00 4.94 H new ATOM 1880 N PRO A 238 10.404 -4.166 -1.907 1.00 3.51 N ATOM 1881 CA PRO A 238 9.403 -4.303 -2.970 1.00 3.70 C ATOM 1882 C PRO A 238 9.329 -5.725 -3.515 1.00 3.32 C ATOM 1883 O PRO A 238 8.247 -6.300 -3.636 1.00 3.95 O ATOM 1884 CB PRO A 238 9.899 -3.341 -4.051 1.00 4.20 C ATOM 1885 CG PRO A 238 11.368 -3.237 -3.822 1.00 4.12 C ATOM 1886 CD PRO A 238 11.565 -3.367 -2.337 1.00 3.90 C ATOM 0 HA PRO A 238 8.397 -4.082 -2.614 1.00 3.70 H new ATOM 0 HB2 PRO A 238 9.680 -3.720 -5.049 1.00 4.20 H new ATOM 0 HB3 PRO A 238 9.415 -2.368 -3.967 1.00 4.20 H new ATOM 0 HG2 PRO A 238 11.903 -4.022 -4.357 1.00 4.12 H new ATOM 0 HG3 PRO A 238 11.753 -2.284 -4.185 1.00 4.12 H new ATOM 0 HD2 PRO A 238 12.505 -3.864 -2.098 1.00 3.90 H new ATOM 0 HD3 PRO A 238 11.586 -2.393 -1.848 1.00 3.90 H new ATOM 1894 N THR A 239 10.487 -6.289 -3.845 1.00 2.91 N ATOM 1895 CA THR A 239 10.553 -7.644 -4.378 1.00 2.74 C ATOM 1896 C THR A 239 10.863 -8.653 -3.279 1.00 2.72 C ATOM 1897 O THR A 239 12.023 -8.862 -2.923 1.00 3.69 O ATOM 1898 CB THR A 239 11.621 -7.761 -5.483 1.00 3.27 C ATOM 1899 OG1 THR A 239 11.607 -6.588 -6.304 1.00 4.41 O ATOM 1900 CG2 THR A 239 11.376 -8.991 -6.343 1.00 3.80 C ATOM 0 H THR A 239 11.392 -5.828 -3.752 1.00 2.91 H new ATOM 0 HA THR A 239 9.574 -7.864 -4.804 1.00 2.74 H new ATOM 0 HB THR A 239 12.596 -7.858 -5.007 1.00 3.27 H new ATOM 0 HG1 THR A 239 12.290 -6.669 -7.003 1.00 4.41 H new ATOM 0 HG21 THR A 239 12.142 -9.053 -7.116 1.00 3.80 H new ATOM 0 HG22 THR A 239 11.416 -9.884 -5.720 1.00 3.80 H new ATOM 0 HG23 THR A 239 10.394 -8.918 -6.810 1.00 3.80 H new ATOM 1908 N TYR A 240 9.819 -9.278 -2.745 1.00 2.52 N ATOM 1909 CA TYR A 240 9.979 -10.265 -1.684 1.00 3.35 C ATOM 1910 C TYR A 240 9.301 -11.580 -2.056 1.00 2.73 C ATOM 1911 O TYR A 240 8.320 -11.598 -2.801 1.00 2.19 O ATOM 1912 CB TYR A 240 9.401 -9.733 -0.372 1.00 4.46 C ATOM 1913 CG TYR A 240 10.002 -10.375 0.858 1.00 6.30 C ATOM 1914 CD1 TYR A 240 11.353 -10.233 1.150 1.00 7.61 C ATOM 1915 CD2 TYR A 240 9.219 -11.123 1.728 1.00 7.31 C ATOM 1916 CE1 TYR A 240 11.907 -10.818 2.273 1.00 9.51 C ATOM 1917 CE2 TYR A 240 9.763 -11.710 2.854 1.00 9.31 C ATOM 1918 CZ TYR A 240 11.108 -11.555 3.122 1.00 10.28 C ATOM 1919 OH TYR A 240 11.654 -12.140 4.241 1.00 12.35 O ATOM 0 H TYR A 240 8.853 -9.118 -3.030 1.00 2.52 H new ATOM 0 HA TYR A 240 11.045 -10.451 -1.554 1.00 3.35 H new ATOM 0 HB2 TYR A 240 9.561 -8.656 -0.324 1.00 4.46 H new ATOM 0 HB3 TYR A 240 8.323 -9.896 -0.367 1.00 4.46 H new ATOM 0 HD1 TYR A 240 11.981 -9.655 0.488 1.00 7.61 H new ATOM 0 HD2 TYR A 240 8.166 -11.248 1.520 1.00 7.31 H new ATOM 0 HE1 TYR A 240 12.959 -10.699 2.484 1.00 9.51 H new ATOM 0 HE2 TYR A 240 9.139 -12.287 3.521 1.00 9.31 H new ATOM 0 HH TYR A 240 10.956 -12.622 4.732 1.00 12.35 H new ATOM 1929 N LYS A 241 9.830 -12.680 -1.532 1.00 3.75 N ATOM 1930 CA LYS A 241 9.276 -14.001 -1.806 1.00 3.77 C ATOM 1931 C LYS A 241 8.201 -14.362 -0.786 1.00 3.40 C ATOM 1932 O LYS A 241 8.422 -15.193 0.096 1.00 4.55 O ATOM 1933 CB LYS A 241 10.385 -15.055 -1.789 1.00 5.23 C ATOM 1934 CG LYS A 241 11.234 -15.024 -0.530 1.00 4.60 C ATOM 1935 CD LYS A 241 12.703 -14.807 -0.853 1.00 5.16 C ATOM 1936 CE LYS A 241 13.512 -14.512 0.400 1.00 4.85 C ATOM 1937 NZ LYS A 241 14.686 -13.642 0.111 1.00 5.15 N ATOM 0 H LYS A 241 10.642 -12.683 -0.915 1.00 3.75 H new ATOM 0 HA LYS A 241 8.820 -13.978 -2.796 1.00 3.77 H new ATOM 0 HB2 LYS A 241 9.937 -16.043 -1.891 1.00 5.23 H new ATOM 0 HB3 LYS A 241 11.029 -14.906 -2.655 1.00 5.23 H new ATOM 0 HG2 LYS A 241 10.884 -14.228 0.127 1.00 4.60 H new ATOM 0 HG3 LYS A 241 11.115 -15.961 0.014 1.00 4.60 H new ATOM 0 HD2 LYS A 241 13.103 -15.693 -1.345 1.00 5.16 H new ATOM 0 HD3 LYS A 241 12.804 -13.980 -1.555 1.00 5.16 H new ATOM 0 HE2 LYS A 241 12.874 -14.027 1.138 1.00 4.85 H new ATOM 0 HE3 LYS A 241 13.854 -15.449 0.840 1.00 4.85 H new ATOM 0 HZ1 LYS A 241 15.211 -13.464 0.991 1.00 5.15 H new ATOM 0 HZ2 LYS A 241 15.309 -14.115 -0.574 1.00 5.15 H new ATOM 0 HZ3 LYS A 241 14.359 -12.738 -0.285 1.00 5.15 H new ATOM 1951 N TYR A 242 7.037 -13.735 -0.913 1.00 2.36 N ATOM 1952 CA TYR A 242 5.928 -13.990 -0.001 1.00 2.28 C ATOM 1953 C TYR A 242 6.381 -13.881 1.452 1.00 2.46 C ATOM 1954 O TYR A 242 7.488 -13.425 1.737 1.00 3.15 O ATOM 1955 CB TYR A 242 5.336 -15.377 -0.259 1.00 2.86 C ATOM 1956 CG TYR A 242 5.200 -15.713 -1.727 1.00 3.21 C ATOM 1957 CD1 TYR A 242 4.745 -14.766 -2.637 1.00 4.01 C ATOM 1958 CD2 TYR A 242 5.524 -16.977 -2.204 1.00 3.90 C ATOM 1959 CE1 TYR A 242 4.618 -15.069 -3.979 1.00 5.12 C ATOM 1960 CE2 TYR A 242 5.402 -17.288 -3.544 1.00 4.75 C ATOM 1961 CZ TYR A 242 4.948 -16.331 -4.428 1.00 5.26 C ATOM 1962 OH TYR A 242 4.823 -16.637 -5.764 1.00 6.54 O ATOM 0 H TYR A 242 6.837 -13.047 -1.638 1.00 2.36 H new ATOM 0 HA TYR A 242 5.162 -13.236 -0.182 1.00 2.28 H new ATOM 0 HB2 TYR A 242 5.966 -16.127 0.220 1.00 2.86 H new ATOM 0 HB3 TYR A 242 4.355 -15.437 0.212 1.00 2.86 H new ATOM 0 HD1 TYR A 242 4.486 -13.777 -2.289 1.00 4.01 H new ATOM 0 HD2 TYR A 242 5.877 -17.730 -1.515 1.00 3.90 H new ATOM 0 HE1 TYR A 242 4.262 -14.322 -4.673 1.00 5.12 H new ATOM 0 HE2 TYR A 242 5.661 -18.275 -3.898 1.00 4.75 H new ATOM 0 HH TYR A 242 5.097 -17.566 -5.914 1.00 6.54 H new ATOM 1972 N VAL A 243 5.516 -14.304 2.368 1.00 2.45 N ATOM 1973 CA VAL A 243 5.825 -14.256 3.792 1.00 3.02 C ATOM 1974 C VAL A 243 4.811 -15.055 4.602 1.00 3.37 C ATOM 1975 O VAL A 243 3.676 -15.257 4.170 1.00 3.14 O ATOM 1976 CB VAL A 243 5.853 -12.806 4.312 1.00 3.07 C ATOM 1977 CG1 VAL A 243 4.449 -12.224 4.345 1.00 2.89 C ATOM 1978 CG2 VAL A 243 6.497 -12.747 5.689 1.00 4.21 C ATOM 0 H VAL A 243 4.595 -14.684 2.149 1.00 2.45 H new ATOM 0 HA VAL A 243 6.814 -14.698 3.916 1.00 3.02 H new ATOM 0 HB VAL A 243 6.453 -12.204 3.630 1.00 3.07 H new ATOM 0 HG11 VAL A 243 4.488 -11.199 4.715 1.00 2.89 H new ATOM 0 HG12 VAL A 243 4.029 -12.231 3.339 1.00 2.89 H new ATOM 0 HG13 VAL A 243 3.822 -12.824 5.004 1.00 2.89 H new ATOM 0 HG21 VAL A 243 6.509 -11.716 6.041 1.00 4.21 H new ATOM 0 HG22 VAL A 243 5.926 -13.362 6.385 1.00 4.21 H new ATOM 0 HG23 VAL A 243 7.519 -13.121 5.629 1.00 4.21 H new ATOM 1988 N ASP A 244 5.228 -15.508 5.779 1.00 4.20 N ATOM 1989 CA ASP A 244 4.355 -16.285 6.652 1.00 4.74 C ATOM 1990 C ASP A 244 3.025 -15.570 6.866 1.00 4.29 C ATOM 1991 O ASP A 244 2.960 -14.552 7.556 1.00 4.31 O ATOM 1992 CB ASP A 244 5.036 -16.535 7.999 1.00 5.77 C ATOM 1993 CG ASP A 244 5.172 -18.012 8.313 1.00 6.20 C ATOM 1994 OD1 ASP A 244 6.060 -18.664 7.725 1.00 6.74 O ATOM 1995 OD2 ASP A 244 4.390 -18.516 9.147 1.00 6.40 O ATOM 0 H ASP A 244 6.165 -15.351 6.151 1.00 4.20 H new ATOM 0 HA ASP A 244 4.159 -17.243 6.169 1.00 4.74 H new ATOM 0 HB2 ASP A 244 6.024 -16.075 7.994 1.00 5.77 H new ATOM 0 HB3 ASP A 244 4.462 -16.050 8.789 1.00 5.77 H new ATOM 2000 N ILE A 245 1.966 -16.108 6.270 1.00 4.17 N ATOM 2001 CA ILE A 245 0.638 -15.521 6.396 1.00 3.94 C ATOM 2002 C ILE A 245 -0.196 -16.266 7.433 1.00 4.08 C ATOM 2003 O ILE A 245 -1.424 -16.282 7.361 1.00 4.21 O ATOM 2004 CB ILE A 245 -0.110 -15.528 5.050 1.00 4.00 C ATOM 2005 CG1 ILE A 245 -0.467 -16.961 4.647 1.00 4.43 C ATOM 2006 CG2 ILE A 245 0.733 -14.864 3.972 1.00 4.78 C ATOM 2007 CD1 ILE A 245 -1.953 -17.241 4.666 1.00 4.24 C ATOM 0 H ILE A 245 2.002 -16.950 5.695 1.00 4.17 H new ATOM 0 HA ILE A 245 0.778 -14.489 6.719 1.00 3.94 H new ATOM 0 HB ILE A 245 -1.034 -14.961 5.162 1.00 4.00 H new ATOM 0 HG12 ILE A 245 -0.082 -17.155 3.646 1.00 4.43 H new ATOM 0 HG13 ILE A 245 0.034 -17.655 5.322 1.00 4.43 H new ATOM 0 HG21 ILE A 245 0.191 -14.877 3.027 1.00 4.78 H new ATOM 0 HG22 ILE A 245 0.941 -13.833 4.257 1.00 4.78 H new ATOM 0 HG23 ILE A 245 1.672 -15.406 3.859 1.00 4.78 H new ATOM 0 HD11 ILE A 245 -2.132 -18.275 4.370 1.00 4.24 H new ATOM 0 HD12 ILE A 245 -2.341 -17.079 5.672 1.00 4.24 H new ATOM 0 HD13 ILE A 245 -2.458 -16.571 3.970 1.00 4.24 H new ATOM 2019 N ASN A 246 0.480 -16.882 8.397 1.00 4.62 N ATOM 2020 CA ASN A 246 -0.199 -17.628 9.450 1.00 5.04 C ATOM 2021 C ASN A 246 -0.615 -16.704 10.590 1.00 4.30 C ATOM 2022 O ASN A 246 -1.768 -16.713 11.024 1.00 4.39 O ATOM 2023 CB ASN A 246 0.709 -18.738 9.984 1.00 6.23 C ATOM 2024 CG ASN A 246 -0.044 -19.743 10.834 1.00 7.22 C ATOM 2025 OD1 ASN A 246 -1.204 -19.528 11.188 1.00 7.24 O ATOM 2026 ND2 ASN A 246 0.613 -20.848 11.165 1.00 8.34 N ATOM 0 H ASN A 246 1.497 -16.879 8.471 1.00 4.62 H new ATOM 0 HA ASN A 246 -1.096 -18.075 9.023 1.00 5.04 H new ATOM 0 HB2 ASN A 246 1.178 -19.254 9.146 1.00 6.23 H new ATOM 0 HB3 ASN A 246 1.511 -18.295 10.575 1.00 6.23 H new ATOM 0 HD21 ASN A 246 0.157 -21.561 11.735 1.00 8.34 H new ATOM 0 HD22 ASN A 246 1.573 -20.984 10.849 1.00 8.34 H new ATOM 2033 N THR A 247 0.332 -15.904 11.073 1.00 4.04 N ATOM 2034 CA THR A 247 0.064 -14.974 12.162 1.00 3.80 C ATOM 2035 C THR A 247 0.580 -13.578 11.832 1.00 3.42 C ATOM 2036 O THR A 247 0.748 -12.741 12.720 1.00 3.76 O ATOM 2037 CB THR A 247 0.709 -15.450 13.478 1.00 4.72 C ATOM 2038 OG1 THR A 247 1.935 -16.135 13.203 1.00 5.26 O ATOM 2039 CG2 THR A 247 -0.233 -16.370 14.240 1.00 5.03 C ATOM 0 H THR A 247 1.291 -15.882 10.726 1.00 4.04 H new ATOM 0 HA THR A 247 -1.018 -14.938 12.288 1.00 3.80 H new ATOM 0 HB THR A 247 0.914 -14.575 14.094 1.00 4.72 H new ATOM 0 HG1 THR A 247 2.339 -16.433 14.045 1.00 5.26 H new ATOM 0 HG21 THR A 247 0.244 -16.693 15.165 1.00 5.03 H new ATOM 0 HG22 THR A 247 -1.154 -15.835 14.474 1.00 5.03 H new ATOM 0 HG23 THR A 247 -0.465 -17.241 13.628 1.00 5.03 H new ATOM 2047 N PHE A 248 0.831 -13.332 10.551 1.00 3.04 N ATOM 2048 CA PHE A 248 1.328 -12.036 10.104 1.00 2.88 C ATOM 2049 C PHE A 248 2.608 -11.661 10.844 1.00 3.06 C ATOM 2050 O PHE A 248 3.189 -12.480 11.557 1.00 4.03 O ATOM 2051 CB PHE A 248 0.266 -10.957 10.318 1.00 3.59 C ATOM 2052 CG PHE A 248 -0.018 -10.142 9.089 1.00 3.53 C ATOM 2053 CD1 PHE A 248 -0.620 -10.720 7.982 1.00 3.82 C ATOM 2054 CD2 PHE A 248 0.316 -8.799 9.039 1.00 4.77 C ATOM 2055 CE1 PHE A 248 -0.883 -9.974 6.849 1.00 5.01 C ATOM 2056 CE2 PHE A 248 0.055 -8.047 7.909 1.00 5.70 C ATOM 2057 CZ PHE A 248 -0.544 -8.635 6.812 1.00 5.72 C ATOM 0 H PHE A 248 0.698 -14.013 9.804 1.00 3.04 H new ATOM 0 HA PHE A 248 1.552 -12.108 9.040 1.00 2.88 H new ATOM 0 HB2 PHE A 248 -0.658 -11.429 10.652 1.00 3.59 H new ATOM 0 HB3 PHE A 248 0.592 -10.292 11.118 1.00 3.59 H new ATOM 0 HD1 PHE A 248 -0.887 -11.766 8.005 1.00 3.82 H new ATOM 0 HD2 PHE A 248 0.786 -8.334 9.893 1.00 4.77 H new ATOM 0 HE1 PHE A 248 -1.353 -10.437 5.994 1.00 5.01 H new ATOM 0 HE2 PHE A 248 0.319 -7.000 7.884 1.00 5.70 H new ATOM 0 HZ PHE A 248 -0.747 -8.050 5.927 1.00 5.72 H new ATOM 2067 N ARG A 249 3.043 -10.417 10.669 1.00 2.63 N ATOM 2068 CA ARG A 249 4.254 -9.932 11.318 1.00 2.96 C ATOM 2069 C ARG A 249 4.489 -8.458 11.002 1.00 2.37 C ATOM 2070 O ARG A 249 3.983 -7.938 10.006 1.00 2.49 O ATOM 2071 CB ARG A 249 5.462 -10.759 10.874 1.00 3.89 C ATOM 2072 CG ARG A 249 6.201 -11.425 12.023 1.00 4.52 C ATOM 2073 CD ARG A 249 7.158 -12.496 11.523 1.00 5.14 C ATOM 2074 NE ARG A 249 8.518 -12.285 12.011 1.00 6.34 N ATOM 2075 CZ ARG A 249 8.888 -12.491 13.271 1.00 6.60 C ATOM 2076 NH1 ARG A 249 8.003 -12.910 14.164 1.00 5.91 N ATOM 2077 NH2 ARG A 249 10.145 -12.277 13.638 1.00 7.97 N ATOM 0 H ARG A 249 2.574 -9.727 10.083 1.00 2.63 H new ATOM 0 HA ARG A 249 4.125 -10.038 12.395 1.00 2.96 H new ATOM 0 HB2 ARG A 249 5.129 -11.526 10.175 1.00 3.89 H new ATOM 0 HB3 ARG A 249 6.154 -10.114 10.334 1.00 3.89 H new ATOM 0 HG2 ARG A 249 6.756 -10.673 12.585 1.00 4.52 H new ATOM 0 HG3 ARG A 249 5.482 -11.870 12.710 1.00 4.52 H new ATOM 0 HD2 ARG A 249 6.805 -13.476 11.844 1.00 5.14 H new ATOM 0 HD3 ARG A 249 7.160 -12.500 10.433 1.00 5.14 H new ATOM 0 HE ARG A 249 9.223 -11.962 11.348 1.00 6.34 H new ATOM 0 HH11 ARG A 249 7.036 -13.075 13.885 1.00 5.91 H new ATOM 0 HH12 ARG A 249 8.289 -13.067 15.130 1.00 5.91 H new ATOM 0 HH21 ARG A 249 10.828 -11.954 12.953 1.00 7.97 H new ATOM 0 HH22 ARG A 249 10.428 -12.435 14.605 1.00 7.97 H new ATOM 2091 N LEU A 250 5.258 -7.790 11.855 1.00 2.66 N ATOM 2092 CA LEU A 250 5.559 -6.375 11.666 1.00 2.28 C ATOM 2093 C LEU A 250 7.051 -6.108 11.841 1.00 2.47 C ATOM 2094 O LEU A 250 7.735 -6.812 12.583 1.00 2.95 O ATOM 2095 CB LEU A 250 4.759 -5.527 12.656 1.00 2.54 C ATOM 2096 CG LEU A 250 3.540 -6.202 13.286 1.00 3.60 C ATOM 2097 CD1 LEU A 250 3.952 -7.026 14.496 1.00 5.12 C ATOM 2098 CD2 LEU A 250 2.497 -5.164 13.676 1.00 4.39 C ATOM 0 H LEU A 250 5.684 -8.205 12.684 1.00 2.66 H new ATOM 0 HA LEU A 250 5.276 -6.101 10.650 1.00 2.28 H new ATOM 0 HB2 LEU A 250 5.428 -5.211 13.456 1.00 2.54 H new ATOM 0 HB3 LEU A 250 4.425 -4.624 12.144 1.00 2.54 H new ATOM 0 HG LEU A 250 3.099 -6.872 12.548 1.00 3.60 H new ATOM 0 HD11 LEU A 250 3.072 -7.499 14.931 1.00 5.12 H new ATOM 0 HD12 LEU A 250 4.662 -7.794 14.189 1.00 5.12 H new ATOM 0 HD13 LEU A 250 4.418 -6.377 15.237 1.00 5.12 H new ATOM 0 HD21 LEU A 250 1.637 -5.663 14.123 1.00 4.39 H new ATOM 0 HD22 LEU A 250 2.928 -4.468 14.396 1.00 4.39 H new ATOM 0 HD23 LEU A 250 2.179 -4.617 12.789 1.00 4.39 H new ATOM 2110 N SER A 251 7.548 -5.086 11.152 1.00 2.78 N ATOM 2111 CA SER A 251 8.959 -4.726 11.230 1.00 3.45 C ATOM 2112 C SER A 251 9.211 -3.757 12.381 1.00 3.13 C ATOM 2113 O SER A 251 8.458 -2.803 12.579 1.00 3.17 O ATOM 2114 CB SER A 251 9.421 -4.102 9.912 1.00 4.69 C ATOM 2115 OG SER A 251 10.377 -3.081 10.139 1.00 6.60 O ATOM 0 H SER A 251 6.995 -4.493 10.534 1.00 2.78 H new ATOM 0 HA SER A 251 9.531 -5.636 11.414 1.00 3.45 H new ATOM 0 HB2 SER A 251 9.852 -4.872 9.273 1.00 4.69 H new ATOM 0 HB3 SER A 251 8.563 -3.690 9.381 1.00 4.69 H new ATOM 0 HG SER A 251 10.658 -2.699 9.281 1.00 6.60 H new ATOM 2121 N ALA A 252 10.274 -4.009 13.137 1.00 3.14 N ATOM 2122 CA ALA A 252 10.627 -3.158 14.266 1.00 3.05 C ATOM 2123 C ALA A 252 10.863 -1.720 13.818 1.00 3.05 C ATOM 2124 O ALA A 252 10.189 -0.798 14.279 1.00 4.00 O ATOM 2125 CB ALA A 252 11.861 -3.702 14.972 1.00 3.67 C ATOM 0 H ALA A 252 10.906 -4.796 12.988 1.00 3.14 H new ATOM 0 HA ALA A 252 9.791 -3.160 14.965 1.00 3.05 H new ATOM 0 HB1 ALA A 252 12.113 -3.056 15.813 1.00 3.67 H new ATOM 0 HB2 ALA A 252 11.658 -4.709 15.336 1.00 3.67 H new ATOM 0 HB3 ALA A 252 12.697 -3.731 14.273 1.00 3.67 H new ATOM 2131 N ASP A 253 11.823 -1.535 12.919 1.00 2.98 N ATOM 2132 CA ASP A 253 12.148 -0.209 12.408 1.00 3.37 C ATOM 2133 C ASP A 253 10.895 0.499 11.900 1.00 3.07 C ATOM 2134 O ASP A 253 10.804 1.726 11.942 1.00 3.40 O ATOM 2135 CB ASP A 253 13.182 -0.309 11.286 1.00 3.99 C ATOM 2136 CG ASP A 253 14.556 0.161 11.721 1.00 4.67 C ATOM 2137 OD1 ASP A 253 15.000 -0.239 12.818 1.00 4.89 O ATOM 2138 OD2 ASP A 253 15.187 0.930 10.966 1.00 5.47 O ATOM 0 H ASP A 253 12.390 -2.288 12.529 1.00 2.98 H new ATOM 0 HA ASP A 253 12.568 0.375 13.227 1.00 3.37 H new ATOM 0 HB2 ASP A 253 13.246 -1.343 10.946 1.00 3.99 H new ATOM 0 HB3 ASP A 253 12.850 0.287 10.436 1.00 3.99 H new ATOM 2143 N ASP A 254 9.934 -0.282 11.419 1.00 2.84 N ATOM 2144 CA ASP A 254 8.687 0.270 10.903 1.00 2.79 C ATOM 2145 C ASP A 254 7.884 0.933 12.017 1.00 2.40 C ATOM 2146 O ASP A 254 7.237 1.959 11.803 1.00 2.35 O ATOM 2147 CB ASP A 254 7.854 -0.829 10.241 1.00 3.36 C ATOM 2148 CG ASP A 254 7.645 -0.583 8.759 1.00 3.89 C ATOM 2149 OD1 ASP A 254 8.514 -0.994 7.962 1.00 4.24 O ATOM 2150 OD2 ASP A 254 6.614 0.021 8.397 1.00 4.55 O ATOM 0 H ASP A 254 9.995 -1.299 11.376 1.00 2.84 H new ATOM 0 HA ASP A 254 8.934 1.027 10.158 1.00 2.79 H new ATOM 0 HB2 ASP A 254 8.349 -1.790 10.381 1.00 3.36 H new ATOM 0 HB3 ASP A 254 6.885 -0.894 10.736 1.00 3.36 H new ATOM 2155 N ILE A 255 7.929 0.340 13.205 1.00 2.67 N ATOM 2156 CA ILE A 255 7.205 0.874 14.353 1.00 3.16 C ATOM 2157 C ILE A 255 7.647 2.299 14.667 1.00 3.38 C ATOM 2158 O ILE A 255 6.904 3.071 15.273 1.00 3.80 O ATOM 2159 CB ILE A 255 7.407 -0.003 15.603 1.00 4.14 C ATOM 2160 CG1 ILE A 255 6.892 -1.421 15.347 1.00 4.39 C ATOM 2161 CG2 ILE A 255 6.702 0.614 16.802 1.00 5.07 C ATOM 2162 CD1 ILE A 255 7.070 -2.350 16.527 1.00 5.40 C ATOM 0 H ILE A 255 8.459 -0.510 13.398 1.00 2.67 H new ATOM 0 HA ILE A 255 6.148 0.875 14.088 1.00 3.16 H new ATOM 0 HB ILE A 255 8.473 -0.058 15.822 1.00 4.14 H new ATOM 0 HG12 ILE A 255 5.834 -1.374 15.088 1.00 4.39 H new ATOM 0 HG13 ILE A 255 7.413 -1.838 14.485 1.00 4.39 H new ATOM 0 HG21 ILE A 255 6.854 -0.017 17.678 1.00 5.07 H new ATOM 0 HG22 ILE A 255 7.111 1.606 16.994 1.00 5.07 H new ATOM 0 HG23 ILE A 255 5.635 0.696 16.594 1.00 5.07 H new ATOM 0 HD11 ILE A 255 6.683 -3.337 16.274 1.00 5.40 H new ATOM 0 HD12 ILE A 255 8.129 -2.427 16.773 1.00 5.40 H new ATOM 0 HD13 ILE A 255 6.526 -1.956 17.386 1.00 5.40 H new ATOM 2174 N ARG A 256 8.862 2.641 14.250 1.00 3.51 N ATOM 2175 CA ARG A 256 9.403 3.974 14.488 1.00 4.32 C ATOM 2176 C ARG A 256 9.148 4.885 13.291 1.00 4.37 C ATOM 2177 O ARG A 256 9.477 6.070 13.319 1.00 5.35 O ATOM 2178 CB ARG A 256 10.905 3.894 14.771 1.00 4.91 C ATOM 2179 CG ARG A 256 11.293 4.408 16.147 1.00 5.94 C ATOM 2180 CD ARG A 256 11.376 3.277 17.161 1.00 5.13 C ATOM 2181 NE ARG A 256 12.274 3.599 18.267 1.00 6.19 N ATOM 2182 CZ ARG A 256 12.480 2.794 19.304 1.00 6.23 C ATOM 2183 NH1 ARG A 256 11.856 1.627 19.375 1.00 5.64 N ATOM 2184 NH2 ARG A 256 13.312 3.157 20.272 1.00 7.42 N ATOM 0 H ARG A 256 9.490 2.014 13.746 1.00 3.51 H new ATOM 0 HA ARG A 256 8.898 4.395 15.357 1.00 4.32 H new ATOM 0 HB2 ARG A 256 11.230 2.858 14.675 1.00 4.91 H new ATOM 0 HB3 ARG A 256 11.440 4.468 14.014 1.00 4.91 H new ATOM 0 HG2 ARG A 256 12.255 4.917 16.089 1.00 5.94 H new ATOM 0 HG3 ARG A 256 10.562 5.145 16.481 1.00 5.94 H new ATOM 0 HD2 ARG A 256 10.380 3.067 17.552 1.00 5.13 H new ATOM 0 HD3 ARG A 256 11.722 2.370 16.665 1.00 5.13 H new ATOM 0 HE ARG A 256 12.770 4.490 18.242 1.00 6.19 H new ATOM 0 HH11 ARG A 256 11.216 1.345 18.633 1.00 5.64 H new ATOM 0 HH12 ARG A 256 12.016 1.011 20.172 1.00 5.64 H new ATOM 0 HH21 ARG A 256 13.794 4.055 20.220 1.00 7.42 H new ATOM 0 HH22 ARG A 256 13.470 2.539 21.068 1.00 7.42 H new ATOM 2198 N GLY A 257 8.560 4.322 12.239 1.00 3.64 N ATOM 2199 CA GLY A 257 8.271 5.098 11.047 1.00 4.17 C ATOM 2200 C GLY A 257 6.785 5.305 10.836 1.00 3.93 C ATOM 2201 O GLY A 257 6.363 6.337 10.314 1.00 5.31 O ATOM 0 H GLY A 257 8.279 3.343 12.191 1.00 3.64 H new ATOM 0 HA2 GLY A 257 8.763 6.068 11.121 1.00 4.17 H new ATOM 0 HA3 GLY A 257 8.691 4.593 10.178 1.00 4.17 H new ATOM 2205 N ILE A 258 5.989 4.320 11.240 1.00 2.93 N ATOM 2206 CA ILE A 258 4.541 4.400 11.092 1.00 3.43 C ATOM 2207 C ILE A 258 3.888 4.953 12.354 1.00 4.58 C ATOM 2208 O ILE A 258 2.771 4.574 12.703 1.00 5.83 O ATOM 2209 CB ILE A 258 3.932 3.021 10.774 1.00 2.84 C ATOM 2210 CG1 ILE A 258 4.770 2.300 9.717 1.00 2.43 C ATOM 2211 CG2 ILE A 258 2.493 3.174 10.304 1.00 3.23 C ATOM 2212 CD1 ILE A 258 4.780 2.996 8.375 1.00 2.61 C ATOM 0 H ILE A 258 6.322 3.458 11.672 1.00 2.93 H new ATOM 0 HA ILE A 258 4.346 5.076 10.260 1.00 3.43 H new ATOM 0 HB ILE A 258 3.935 2.420 11.683 1.00 2.84 H new ATOM 0 HG12 ILE A 258 5.795 2.209 10.078 1.00 2.43 H new ATOM 0 HG13 ILE A 258 4.386 1.288 9.589 1.00 2.43 H new ATOM 0 HG21 ILE A 258 2.076 2.191 10.083 1.00 3.23 H new ATOM 0 HG22 ILE A 258 1.903 3.651 11.087 1.00 3.23 H new ATOM 0 HG23 ILE A 258 2.467 3.790 9.405 1.00 3.23 H new ATOM 0 HD11 ILE A 258 5.394 2.429 7.675 1.00 2.61 H new ATOM 0 HD12 ILE A 258 3.762 3.063 7.992 1.00 2.61 H new ATOM 0 HD13 ILE A 258 5.192 3.999 8.488 1.00 2.61 H new