USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=28 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 136 LYS NZ :NH3+ 151:sc= 0.00921 (180deg=0) USER MOD Set 1.2: A 246 ASN : amide:sc= -0.565 K(o=-0.56,f=-2.5) USER MOD Set 2.1: A 222 HIS : no HE2:sc= -0.932 K(o=-1.3,f=-2.6!) USER MOD Set 2.2: A 223 SER OG : rot -150:sc= -0.374 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= -0.0833 K(o=-0.083,f=-1.8!) USER MOD Single : A 120 ASN : amide:sc= -0.221 X(o=-0.22,f=-0.26) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 105:sc= -0.172 USER MOD Single : A 125 MET CE :methyl 179:sc= 0 (180deg=-0.000248) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 142 SER OG : rot 153:sc= 0.00181 USER MOD Single : A 143 ASN : amide:sc= -0.0301 K(o=-0.03,f=-1.1) USER MOD Single : A 145 THR OG1 : rot -104:sc= -0.337 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= -0.423 USER MOD Single : A 151 LYS NZ :NH3+ 158:sc= -0.01 (180deg=-0.183) USER MOD Single : A 168 HIS : no HE2:sc= -1.83! C(o=-1.8!,f=-3.2!) USER MOD Single : A 172 HIS : no HE2:sc= 0.0908 K(o=0.091,f=-0.77) USER MOD Single : A 183 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 196 HIS : no HD1:sc= -0.535 X(o=-0.54,f=-0.54) USER MOD Single : A 204 THR OG1 : rot 180:sc= 0.00369 USER MOD Single : A 205 THR OG1 : rot 180:sc= 0 USER MOD Single : A 206 HIS : no HD1:sc= -1.78 X(o=-1.8,f=-1.6) USER MOD Single : A 207 SER OG : rot 180:sc= 0 USER MOD Single : A 210 THR OG1 : rot 100:sc= -0.768 USER MOD Single : A 211 ASN : amide:sc= -1.71 K(o=-1.7,f=-5.3!) USER MOD Single : A 215 THR OG1 : rot -147:sc= -0.579 USER MOD Single : A 218 HIS : no HE2:sc= -0.766 K(o=-0.77,f=-2.4) USER MOD Single : A 228 HIS : no HE2:sc= -0.765 X(o=-0.77,f=-1.1) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 236 MET CE :methyl -108:sc= -0.299 (180deg=-0.964) USER MOD Single : A 239 THR OG1 : rot 180:sc= 0 USER MOD Single : A 240 TYR OH : rot 180:sc= 0 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 247 THR OG1 : rot 180:sc= 0.08 USER MOD Single : A 251 SER OG : rot 59:sc= 0.146 USER MOD ----------------------------------------------------------------- ATOM 39 N ILE A 114 -5.060 11.653 11.150 1.00 3.29 N ATOM 40 CA ILE A 114 -5.163 11.321 9.735 1.00 2.83 C ATOM 41 C ILE A 114 -6.176 10.205 9.504 1.00 2.56 C ATOM 42 O ILE A 114 -6.393 9.358 10.372 1.00 3.04 O ATOM 43 CB ILE A 114 -3.801 10.890 9.158 1.00 3.06 C ATOM 44 CG1 ILE A 114 -2.714 11.890 9.557 1.00 3.98 C ATOM 45 CG2 ILE A 114 -3.884 10.766 7.644 1.00 3.17 C ATOM 46 CD1 ILE A 114 -2.017 11.538 10.853 1.00 4.85 C ATOM 0 HA ILE A 114 -5.497 12.223 9.223 1.00 2.83 H new ATOM 0 HB ILE A 114 -3.540 9.915 9.570 1.00 3.06 H new ATOM 0 HG12 ILE A 114 -1.973 11.947 8.759 1.00 3.98 H new ATOM 0 HG13 ILE A 114 -3.159 12.881 9.650 1.00 3.98 H new ATOM 0 HG21 ILE A 114 -2.914 10.461 7.250 1.00 3.17 H new ATOM 0 HG22 ILE A 114 -4.634 10.020 7.381 1.00 3.17 H new ATOM 0 HG23 ILE A 114 -4.163 11.728 7.215 1.00 3.17 H new ATOM 0 HD11 ILE A 114 -1.259 12.289 11.074 1.00 4.85 H new ATOM 0 HD12 ILE A 114 -2.747 11.509 11.662 1.00 4.85 H new ATOM 0 HD13 ILE A 114 -1.542 10.561 10.757 1.00 4.85 H new ATOM 58 N THR A 115 -6.795 10.209 8.327 1.00 2.27 N ATOM 59 CA THR A 115 -7.785 9.197 7.981 1.00 2.28 C ATOM 60 C THR A 115 -7.412 8.483 6.687 1.00 2.14 C ATOM 61 O THR A 115 -6.697 9.031 5.848 1.00 2.44 O ATOM 62 CB THR A 115 -9.188 9.814 7.828 1.00 2.80 C ATOM 63 OG1 THR A 115 -9.281 10.517 6.584 1.00 3.17 O ATOM 64 CG2 THR A 115 -9.490 10.764 8.977 1.00 3.80 C ATOM 0 H THR A 115 -6.628 10.902 7.598 1.00 2.27 H new ATOM 0 HA THR A 115 -7.800 8.476 8.799 1.00 2.28 H new ATOM 0 HB THR A 115 -9.920 9.006 7.844 1.00 2.80 H new ATOM 0 HG1 THR A 115 -10.176 10.905 6.494 1.00 3.17 H new ATOM 0 HG21 THR A 115 -10.486 11.187 8.847 1.00 3.80 H new ATOM 0 HG22 THR A 115 -9.447 10.219 9.920 1.00 3.80 H new ATOM 0 HG23 THR A 115 -8.753 11.567 8.988 1.00 3.80 H new ATOM 72 N TYR A 116 -7.901 7.258 6.531 1.00 2.44 N ATOM 73 CA TYR A 116 -7.617 6.468 5.339 1.00 2.70 C ATOM 74 C TYR A 116 -8.909 6.053 4.641 1.00 2.45 C ATOM 75 O TYR A 116 -9.809 5.487 5.261 1.00 3.07 O ATOM 76 CB TYR A 116 -6.801 5.227 5.706 1.00 4.02 C ATOM 77 CG TYR A 116 -7.324 4.497 6.922 1.00 4.99 C ATOM 78 CD1 TYR A 116 -6.925 4.863 8.202 1.00 5.85 C ATOM 79 CD2 TYR A 116 -8.217 3.441 6.792 1.00 5.74 C ATOM 80 CE1 TYR A 116 -7.399 4.198 9.316 1.00 7.18 C ATOM 81 CE2 TYR A 116 -8.698 2.771 7.901 1.00 6.98 C ATOM 82 CZ TYR A 116 -8.285 3.153 9.160 1.00 7.61 C ATOM 83 OH TYR A 116 -8.761 2.489 10.268 1.00 9.08 O ATOM 0 H TYR A 116 -8.496 6.790 7.215 1.00 2.44 H new ATOM 0 HA TYR A 116 -7.037 7.086 4.654 1.00 2.70 H new ATOM 0 HB2 TYR A 116 -6.794 4.543 4.857 1.00 4.02 H new ATOM 0 HB3 TYR A 116 -5.767 5.522 5.886 1.00 4.02 H new ATOM 0 HD1 TYR A 116 -6.232 5.682 8.328 1.00 5.85 H new ATOM 0 HD2 TYR A 116 -8.541 3.138 5.807 1.00 5.74 H new ATOM 0 HE1 TYR A 116 -7.078 4.495 10.303 1.00 7.18 H new ATOM 0 HE2 TYR A 116 -9.393 1.953 7.782 1.00 6.98 H new ATOM 0 HH TYR A 116 -9.376 1.780 9.985 1.00 9.08 H new ATOM 93 N ARG A 117 -8.991 6.338 3.345 1.00 2.11 N ATOM 94 CA ARG A 117 -10.172 5.995 2.561 1.00 2.07 C ATOM 95 C ARG A 117 -9.789 5.651 1.125 1.00 2.14 C ATOM 96 O ARG A 117 -8.650 5.863 0.708 1.00 2.77 O ATOM 97 CB ARG A 117 -11.170 7.154 2.570 1.00 2.35 C ATOM 98 CG ARG A 117 -12.617 6.711 2.711 1.00 3.13 C ATOM 99 CD ARG A 117 -13.369 6.839 1.395 1.00 3.61 C ATOM 100 NE ARG A 117 -14.520 5.942 1.334 1.00 4.58 N ATOM 101 CZ ARG A 117 -15.395 5.937 0.333 1.00 5.32 C ATOM 102 NH1 ARG A 117 -15.249 6.775 -0.683 1.00 5.43 N ATOM 103 NH2 ARG A 117 -16.417 5.090 0.349 1.00 6.42 N ATOM 0 H ARG A 117 -8.254 6.805 2.816 1.00 2.11 H new ATOM 0 HA ARG A 117 -10.638 5.120 3.015 1.00 2.07 H new ATOM 0 HB2 ARG A 117 -10.924 7.828 3.390 1.00 2.35 H new ATOM 0 HB3 ARG A 117 -11.061 7.723 1.647 1.00 2.35 H new ATOM 0 HG2 ARG A 117 -12.650 5.676 3.051 1.00 3.13 H new ATOM 0 HG3 ARG A 117 -13.111 7.313 3.474 1.00 3.13 H new ATOM 0 HD2 ARG A 117 -13.704 7.868 1.267 1.00 3.61 H new ATOM 0 HD3 ARG A 117 -12.693 6.619 0.568 1.00 3.61 H new ATOM 0 HE ARG A 117 -14.660 5.284 2.101 1.00 4.58 H new ATOM 0 HH11 ARG A 117 -14.464 7.426 -0.698 1.00 5.43 H new ATOM 0 HH12 ARG A 117 -15.922 6.769 -1.450 1.00 5.43 H new ATOM 0 HH21 ARG A 117 -16.531 4.443 1.129 1.00 6.42 H new ATOM 0 HH22 ARG A 117 -17.088 5.086 -0.419 1.00 6.42 H new ATOM 117 N ILE A 118 -10.747 5.118 0.374 1.00 2.29 N ATOM 118 CA ILE A 118 -10.511 4.745 -1.015 1.00 2.60 C ATOM 119 C ILE A 118 -11.595 5.308 -1.928 1.00 2.60 C ATOM 120 O ILE A 118 -12.730 5.518 -1.503 1.00 3.32 O ATOM 121 CB ILE A 118 -10.455 3.215 -1.185 1.00 3.68 C ATOM 122 CG1 ILE A 118 -11.763 2.580 -0.710 1.00 4.74 C ATOM 123 CG2 ILE A 118 -9.272 2.640 -0.420 1.00 4.76 C ATOM 124 CD1 ILE A 118 -11.778 2.259 0.768 1.00 5.47 C ATOM 0 H ILE A 118 -11.694 4.935 0.705 1.00 2.29 H new ATOM 0 HA ILE A 118 -9.547 5.169 -1.296 1.00 2.60 H new ATOM 0 HB ILE A 118 -10.324 2.986 -2.243 1.00 3.68 H new ATOM 0 HG12 ILE A 118 -12.588 3.256 -0.935 1.00 4.74 H new ATOM 0 HG13 ILE A 118 -11.938 1.664 -1.274 1.00 4.74 H new ATOM 0 HG21 ILE A 118 -9.246 1.558 -0.550 1.00 4.76 H new ATOM 0 HG22 ILE A 118 -8.347 3.074 -0.801 1.00 4.76 H new ATOM 0 HG23 ILE A 118 -9.374 2.876 0.639 1.00 4.76 H new ATOM 0 HD11 ILE A 118 -12.736 1.812 1.033 1.00 5.47 H new ATOM 0 HD12 ILE A 118 -10.975 1.559 0.996 1.00 5.47 H new ATOM 0 HD13 ILE A 118 -11.634 3.175 1.341 1.00 5.47 H new ATOM 136 N ASN A 119 -11.237 5.547 -3.185 1.00 3.17 N ATOM 137 CA ASN A 119 -12.179 6.085 -4.159 1.00 4.11 C ATOM 138 C ASN A 119 -12.612 5.007 -5.149 1.00 3.95 C ATOM 139 O ASN A 119 -13.678 5.099 -5.755 1.00 4.99 O ATOM 140 CB ASN A 119 -11.554 7.261 -4.911 1.00 5.47 C ATOM 141 CG ASN A 119 -12.591 8.259 -5.388 1.00 6.63 C ATOM 142 OD1 ASN A 119 -13.790 8.072 -5.182 1.00 7.02 O ATOM 143 ND2 ASN A 119 -12.132 9.327 -6.031 1.00 7.70 N ATOM 0 H ASN A 119 -10.301 5.377 -3.553 1.00 3.17 H new ATOM 0 HA ASN A 119 -13.059 6.435 -3.620 1.00 4.11 H new ATOM 0 HB2 ASN A 119 -10.840 7.766 -4.261 1.00 5.47 H new ATOM 0 HB3 ASN A 119 -10.995 6.885 -5.768 1.00 5.47 H new ATOM 0 HD21 ASN A 119 -12.782 10.033 -6.376 1.00 7.70 H new ATOM 0 HD22 ASN A 119 -11.129 9.441 -6.179 1.00 7.70 H new ATOM 150 N ASN A 120 -11.776 3.986 -5.306 1.00 3.05 N ATOM 151 CA ASN A 120 -12.072 2.890 -6.222 1.00 2.98 C ATOM 152 C ASN A 120 -11.225 1.664 -5.895 1.00 2.31 C ATOM 153 O ASN A 120 -10.340 1.718 -5.041 1.00 2.81 O ATOM 154 CB ASN A 120 -11.823 3.325 -7.668 1.00 3.93 C ATOM 155 CG ASN A 120 -13.087 3.810 -8.351 1.00 5.19 C ATOM 156 OD1 ASN A 120 -13.247 5.003 -8.610 1.00 5.96 O ATOM 157 ND2 ASN A 120 -13.992 2.885 -8.646 1.00 6.11 N ATOM 0 H ASN A 120 -10.889 3.894 -4.811 1.00 3.05 H new ATOM 0 HA ASN A 120 -13.123 2.625 -6.105 1.00 2.98 H new ATOM 0 HB2 ASN A 120 -11.078 4.120 -7.682 1.00 3.93 H new ATOM 0 HB3 ASN A 120 -11.408 2.488 -8.230 1.00 3.93 H new ATOM 0 HD21 ASN A 120 -14.862 3.152 -9.106 1.00 6.11 H new ATOM 0 HD22 ASN A 120 -13.817 1.908 -8.413 1.00 6.11 H new ATOM 164 N TYR A 121 -11.502 0.561 -6.581 1.00 1.82 N ATOM 165 CA TYR A 121 -10.767 -0.680 -6.362 1.00 1.67 C ATOM 166 C TYR A 121 -10.136 -1.175 -7.660 1.00 1.77 C ATOM 167 O TYR A 121 -10.830 -1.426 -8.647 1.00 1.72 O ATOM 168 CB TYR A 121 -11.694 -1.753 -5.791 1.00 2.01 C ATOM 169 CG TYR A 121 -12.974 -1.928 -6.577 1.00 2.45 C ATOM 170 CD1 TYR A 121 -14.062 -1.091 -6.367 1.00 2.87 C ATOM 171 CD2 TYR A 121 -13.094 -2.931 -7.531 1.00 3.71 C ATOM 172 CE1 TYR A 121 -15.233 -1.248 -7.082 1.00 3.84 C ATOM 173 CE2 TYR A 121 -14.261 -3.095 -8.253 1.00 4.73 C ATOM 174 CZ TYR A 121 -15.328 -2.251 -8.024 1.00 4.60 C ATOM 175 OH TYR A 121 -16.492 -2.410 -8.740 1.00 5.84 O ATOM 0 H TYR A 121 -12.230 0.500 -7.293 1.00 1.82 H new ATOM 0 HA TYR A 121 -9.971 -0.479 -5.645 1.00 1.67 H new ATOM 0 HB2 TYR A 121 -11.162 -2.704 -5.763 1.00 2.01 H new ATOM 0 HB3 TYR A 121 -11.942 -1.496 -4.761 1.00 2.01 H new ATOM 0 HD1 TYR A 121 -13.991 -0.303 -5.632 1.00 2.87 H new ATOM 0 HD2 TYR A 121 -12.261 -3.594 -7.711 1.00 3.71 H new ATOM 0 HE1 TYR A 121 -16.070 -0.589 -6.905 1.00 3.84 H new ATOM 0 HE2 TYR A 121 -14.337 -3.879 -8.992 1.00 4.73 H new ATOM 0 HH TYR A 121 -16.393 -3.160 -9.363 1.00 5.84 H new ATOM 185 N THR A 122 -8.814 -1.315 -7.653 1.00 2.36 N ATOM 186 CA THR A 122 -8.088 -1.779 -8.828 1.00 2.79 C ATOM 187 C THR A 122 -8.619 -3.126 -9.305 1.00 2.98 C ATOM 188 O THR A 122 -9.016 -3.980 -8.513 1.00 2.98 O ATOM 189 CB THR A 122 -6.580 -1.907 -8.542 1.00 3.23 C ATOM 190 OG1 THR A 122 -5.938 -2.617 -9.607 1.00 3.90 O ATOM 191 CG2 THR A 122 -6.337 -2.630 -7.226 1.00 3.11 C ATOM 0 H THR A 122 -8.224 -1.113 -6.846 1.00 2.36 H new ATOM 0 HA THR A 122 -8.240 -1.034 -9.609 1.00 2.79 H new ATOM 0 HB THR A 122 -6.161 -0.903 -8.469 1.00 3.23 H new ATOM 0 HG1 THR A 122 -5.437 -1.986 -10.165 1.00 3.90 H new ATOM 0 HG21 THR A 122 -5.265 -2.708 -7.046 1.00 3.11 H new ATOM 0 HG22 THR A 122 -6.802 -2.072 -6.413 1.00 3.11 H new ATOM 0 HG23 THR A 122 -6.770 -3.629 -7.274 1.00 3.11 H new ATOM 199 N PRO A 123 -8.626 -3.324 -10.632 1.00 3.29 N ATOM 200 CA PRO A 123 -9.105 -4.566 -11.245 1.00 3.68 C ATOM 201 C PRO A 123 -8.172 -5.742 -10.977 1.00 4.11 C ATOM 202 O PRO A 123 -6.969 -5.662 -11.227 1.00 5.09 O ATOM 203 CB PRO A 123 -9.134 -4.237 -12.740 1.00 3.96 C ATOM 204 CG PRO A 123 -8.127 -3.151 -12.907 1.00 3.90 C ATOM 205 CD PRO A 123 -8.167 -2.349 -11.636 1.00 3.42 C ATOM 0 HA PRO A 123 -10.071 -4.872 -10.843 1.00 3.68 H new ATOM 0 HB2 PRO A 123 -8.880 -5.109 -13.343 1.00 3.96 H new ATOM 0 HB3 PRO A 123 -10.125 -3.910 -13.055 1.00 3.96 H new ATOM 0 HG2 PRO A 123 -7.133 -3.564 -13.077 1.00 3.90 H new ATOM 0 HG3 PRO A 123 -8.365 -2.528 -13.769 1.00 3.90 H new ATOM 0 HD2 PRO A 123 -7.186 -1.945 -11.385 1.00 3.42 H new ATOM 0 HD3 PRO A 123 -8.850 -1.503 -11.716 1.00 3.42 H new ATOM 213 N ASP A 124 -8.733 -6.833 -10.467 1.00 3.68 N ATOM 214 CA ASP A 124 -7.951 -8.026 -10.166 1.00 4.06 C ATOM 215 C ASP A 124 -8.841 -9.133 -9.608 1.00 3.97 C ATOM 216 O ASP A 124 -9.031 -10.169 -10.244 1.00 4.57 O ATOM 217 CB ASP A 124 -6.841 -7.696 -9.167 1.00 4.06 C ATOM 218 CG ASP A 124 -7.242 -6.603 -8.196 1.00 4.67 C ATOM 219 OD1 ASP A 124 -7.932 -6.916 -7.203 1.00 4.87 O ATOM 220 OD2 ASP A 124 -6.867 -5.435 -8.429 1.00 5.85 O ATOM 0 H ASP A 124 -9.727 -6.916 -10.253 1.00 3.68 H new ATOM 0 HA ASP A 124 -7.501 -8.379 -11.094 1.00 4.06 H new ATOM 0 HB2 ASP A 124 -6.579 -8.595 -8.609 1.00 4.06 H new ATOM 0 HB3 ASP A 124 -5.948 -7.386 -9.710 1.00 4.06 H new ATOM 225 N MET A 125 -9.384 -8.905 -8.417 1.00 3.59 N ATOM 226 CA MET A 125 -10.254 -9.883 -7.774 1.00 3.56 C ATOM 227 C MET A 125 -11.654 -9.313 -7.568 1.00 3.48 C ATOM 228 O MET A 125 -11.976 -8.238 -8.072 1.00 3.50 O ATOM 229 CB MET A 125 -9.664 -10.317 -6.431 1.00 3.36 C ATOM 230 CG MET A 125 -9.487 -11.821 -6.303 1.00 3.54 C ATOM 231 SD MET A 125 -10.246 -12.485 -4.808 1.00 3.10 S ATOM 232 CE MET A 125 -10.348 -14.224 -5.225 1.00 3.24 C ATOM 0 H MET A 125 -9.237 -8.052 -7.878 1.00 3.59 H new ATOM 0 HA MET A 125 -10.328 -10.752 -8.428 1.00 3.56 H new ATOM 0 HB2 MET A 125 -8.697 -9.833 -6.295 1.00 3.36 H new ATOM 0 HB3 MET A 125 -10.312 -9.966 -5.628 1.00 3.36 H new ATOM 0 HG2 MET A 125 -9.922 -12.310 -7.175 1.00 3.54 H new ATOM 0 HG3 MET A 125 -8.423 -12.059 -6.302 1.00 3.54 H new ATOM 0 HE1 MET A 125 -10.782 -14.774 -4.390 1.00 3.24 H new ATOM 0 HE2 MET A 125 -10.976 -14.350 -6.107 1.00 3.24 H new ATOM 0 HE3 MET A 125 -9.349 -14.608 -5.432 1.00 3.24 H new ATOM 242 N ASN A 126 -12.481 -10.041 -6.825 1.00 3.53 N ATOM 243 CA ASN A 126 -13.846 -9.608 -6.553 1.00 3.60 C ATOM 244 C ASN A 126 -13.857 -8.366 -5.666 1.00 3.16 C ATOM 245 O ASN A 126 -13.021 -8.221 -4.774 1.00 2.94 O ATOM 246 CB ASN A 126 -14.637 -10.733 -5.883 1.00 3.89 C ATOM 247 CG ASN A 126 -15.288 -11.662 -6.891 1.00 4.83 C ATOM 248 OD1 ASN A 126 -14.610 -12.264 -7.724 1.00 6.12 O ATOM 249 ND2 ASN A 126 -16.608 -11.781 -6.819 1.00 4.65 N ATOM 0 H ASN A 126 -12.229 -10.934 -6.401 1.00 3.53 H new ATOM 0 HA ASN A 126 -14.317 -9.358 -7.504 1.00 3.60 H new ATOM 0 HB2 ASN A 126 -13.971 -11.308 -5.240 1.00 3.89 H new ATOM 0 HB3 ASN A 126 -15.405 -10.301 -5.242 1.00 3.89 H new ATOM 0 HD21 ASN A 126 -17.101 -12.391 -7.471 1.00 4.65 H new ATOM 0 HD22 ASN A 126 -17.129 -11.263 -6.112 1.00 4.65 H new ATOM 256 N ARG A 127 -14.809 -7.474 -5.918 1.00 3.13 N ATOM 257 CA ARG A 127 -14.928 -6.245 -5.144 1.00 2.85 C ATOM 258 C ARG A 127 -15.109 -6.552 -3.660 1.00 2.78 C ATOM 259 O ARG A 127 -14.619 -5.820 -2.801 1.00 2.53 O ATOM 260 CB ARG A 127 -16.106 -5.410 -5.650 1.00 3.05 C ATOM 261 CG ARG A 127 -17.456 -6.080 -5.453 1.00 3.29 C ATOM 262 CD ARG A 127 -18.523 -5.454 -6.337 1.00 3.77 C ATOM 263 NE ARG A 127 -19.805 -6.143 -6.221 1.00 4.52 N ATOM 264 CZ ARG A 127 -20.924 -5.717 -6.796 1.00 4.71 C ATOM 265 NH1 ARG A 127 -20.918 -4.609 -7.524 1.00 4.46 N ATOM 266 NH2 ARG A 127 -22.052 -6.400 -6.643 1.00 5.69 N ATOM 0 H ARG A 127 -15.509 -7.580 -6.652 1.00 3.13 H new ATOM 0 HA ARG A 127 -14.007 -5.676 -5.270 1.00 2.85 H new ATOM 0 HB2 ARG A 127 -16.108 -4.450 -5.134 1.00 3.05 H new ATOM 0 HB3 ARG A 127 -15.964 -5.202 -6.711 1.00 3.05 H new ATOM 0 HG2 ARG A 127 -17.372 -7.143 -5.679 1.00 3.29 H new ATOM 0 HG3 ARG A 127 -17.754 -5.999 -4.408 1.00 3.29 H new ATOM 0 HD2 ARG A 127 -18.649 -4.406 -6.065 1.00 3.77 H new ATOM 0 HD3 ARG A 127 -18.192 -5.477 -7.375 1.00 3.77 H new ATOM 0 HE ARG A 127 -19.843 -6.999 -5.668 1.00 4.52 H new ATOM 0 HH11 ARG A 127 -20.053 -4.082 -7.643 1.00 4.46 H new ATOM 0 HH12 ARG A 127 -21.778 -4.284 -7.965 1.00 4.46 H new ATOM 0 HH21 ARG A 127 -22.060 -7.253 -6.083 1.00 5.69 H new ATOM 0 HH22 ARG A 127 -22.911 -6.072 -7.085 1.00 5.69 H new ATOM 280 N GLU A 128 -15.816 -7.640 -3.368 1.00 3.12 N ATOM 281 CA GLU A 128 -16.062 -8.043 -1.989 1.00 3.18 C ATOM 282 C GLU A 128 -14.749 -8.303 -1.255 1.00 2.85 C ATOM 283 O GLU A 128 -14.588 -7.925 -0.095 1.00 2.68 O ATOM 284 CB GLU A 128 -16.939 -9.296 -1.949 1.00 3.81 C ATOM 285 CG GLU A 128 -18.302 -9.065 -1.319 1.00 4.00 C ATOM 286 CD GLU A 128 -18.935 -10.346 -0.811 1.00 4.65 C ATOM 287 OE1 GLU A 128 -18.264 -11.081 -0.056 1.00 4.81 O ATOM 288 OE2 GLU A 128 -20.101 -10.614 -1.167 1.00 5.61 O ATOM 0 H GLU A 128 -16.228 -8.257 -4.068 1.00 3.12 H new ATOM 0 HA GLU A 128 -16.583 -7.228 -1.487 1.00 3.18 H new ATOM 0 HB2 GLU A 128 -17.076 -9.666 -2.965 1.00 3.81 H new ATOM 0 HB3 GLU A 128 -16.419 -10.076 -1.393 1.00 3.81 H new ATOM 0 HG2 GLU A 128 -18.202 -8.361 -0.493 1.00 4.00 H new ATOM 0 HG3 GLU A 128 -18.963 -8.603 -2.052 1.00 4.00 H new ATOM 295 N ASP A 129 -13.815 -8.952 -1.941 1.00 2.91 N ATOM 296 CA ASP A 129 -12.516 -9.264 -1.356 1.00 2.86 C ATOM 297 C ASP A 129 -11.590 -8.052 -1.411 1.00 2.68 C ATOM 298 O ASP A 129 -10.956 -7.697 -0.417 1.00 2.65 O ATOM 299 CB ASP A 129 -11.874 -10.444 -2.086 1.00 3.19 C ATOM 300 CG ASP A 129 -10.975 -11.265 -1.182 1.00 3.93 C ATOM 301 OD1 ASP A 129 -11.502 -11.928 -0.265 1.00 3.83 O ATOM 302 OD2 ASP A 129 -9.743 -11.243 -1.391 1.00 5.17 O ATOM 0 H ASP A 129 -13.933 -9.272 -2.902 1.00 2.91 H new ATOM 0 HA ASP A 129 -12.671 -9.534 -0.311 1.00 2.86 H new ATOM 0 HB2 ASP A 129 -12.656 -11.084 -2.494 1.00 3.19 H new ATOM 0 HB3 ASP A 129 -11.293 -10.073 -2.930 1.00 3.19 H new ATOM 307 N VAL A 130 -11.518 -7.422 -2.579 1.00 2.73 N ATOM 308 CA VAL A 130 -10.670 -6.250 -2.764 1.00 2.72 C ATOM 309 C VAL A 130 -11.005 -5.163 -1.748 1.00 2.58 C ATOM 310 O VAL A 130 -10.115 -4.500 -1.216 1.00 2.70 O ATOM 311 CB VAL A 130 -10.815 -5.671 -4.184 1.00 2.82 C ATOM 312 CG1 VAL A 130 -9.874 -4.491 -4.378 1.00 3.15 C ATOM 313 CG2 VAL A 130 -10.555 -6.748 -5.226 1.00 3.19 C ATOM 0 H VAL A 130 -12.036 -7.703 -3.411 1.00 2.73 H new ATOM 0 HA VAL A 130 -9.641 -6.578 -2.616 1.00 2.72 H new ATOM 0 HB VAL A 130 -11.837 -5.314 -4.310 1.00 2.82 H new ATOM 0 HG11 VAL A 130 -9.990 -4.095 -5.387 1.00 3.15 H new ATOM 0 HG12 VAL A 130 -10.112 -3.713 -3.653 1.00 3.15 H new ATOM 0 HG13 VAL A 130 -8.845 -4.819 -4.233 1.00 3.15 H new ATOM 0 HG21 VAL A 130 -10.662 -6.322 -6.224 1.00 3.19 H new ATOM 0 HG22 VAL A 130 -9.544 -7.136 -5.103 1.00 3.19 H new ATOM 0 HG23 VAL A 130 -11.273 -7.558 -5.099 1.00 3.19 H new ATOM 323 N ASP A 131 -12.295 -4.987 -1.482 1.00 2.49 N ATOM 324 CA ASP A 131 -12.749 -3.982 -0.528 1.00 2.50 C ATOM 325 C ASP A 131 -12.018 -4.128 0.803 1.00 2.47 C ATOM 326 O ASP A 131 -11.558 -3.143 1.381 1.00 2.65 O ATOM 327 CB ASP A 131 -14.258 -4.099 -0.310 1.00 2.56 C ATOM 328 CG ASP A 131 -14.720 -3.377 0.940 1.00 2.46 C ATOM 329 OD1 ASP A 131 -14.404 -2.178 1.085 1.00 3.11 O ATOM 330 OD2 ASP A 131 -15.400 -4.012 1.774 1.00 3.35 O ATOM 0 H ASP A 131 -13.045 -5.527 -1.914 1.00 2.49 H new ATOM 0 HA ASP A 131 -12.525 -2.998 -0.940 1.00 2.50 H new ATOM 0 HB2 ASP A 131 -14.780 -3.691 -1.176 1.00 2.56 H new ATOM 0 HB3 ASP A 131 -14.531 -5.152 -0.240 1.00 2.56 H new ATOM 335 N TYR A 132 -11.916 -5.362 1.285 1.00 2.37 N ATOM 336 CA TYR A 132 -11.245 -5.636 2.549 1.00 2.47 C ATOM 337 C TYR A 132 -9.731 -5.684 2.364 1.00 2.66 C ATOM 338 O TYR A 132 -8.973 -5.302 3.255 1.00 2.74 O ATOM 339 CB TYR A 132 -11.740 -6.958 3.137 1.00 2.44 C ATOM 340 CG TYR A 132 -11.559 -7.061 4.635 1.00 2.82 C ATOM 341 CD1 TYR A 132 -10.301 -7.259 5.191 1.00 4.21 C ATOM 342 CD2 TYR A 132 -12.646 -6.958 5.494 1.00 2.73 C ATOM 343 CE1 TYR A 132 -10.131 -7.353 6.559 1.00 4.96 C ATOM 344 CE2 TYR A 132 -12.486 -7.050 6.863 1.00 3.26 C ATOM 345 CZ TYR A 132 -11.227 -7.248 7.391 1.00 4.24 C ATOM 346 OH TYR A 132 -11.062 -7.341 8.754 1.00 5.10 O ATOM 0 H TYR A 132 -12.290 -6.188 0.819 1.00 2.37 H new ATOM 0 HA TYR A 132 -11.483 -4.827 3.240 1.00 2.47 H new ATOM 0 HB2 TYR A 132 -12.797 -7.079 2.898 1.00 2.44 H new ATOM 0 HB3 TYR A 132 -11.209 -7.780 2.658 1.00 2.44 H new ATOM 0 HD1 TYR A 132 -9.441 -7.341 4.543 1.00 4.21 H new ATOM 0 HD2 TYR A 132 -13.633 -6.803 5.084 1.00 2.73 H new ATOM 0 HE1 TYR A 132 -9.146 -7.508 6.975 1.00 4.96 H new ATOM 0 HE2 TYR A 132 -13.342 -6.967 7.516 1.00 3.26 H new ATOM 0 HH TYR A 132 -11.931 -7.245 9.196 1.00 5.10 H new ATOM 356 N ALA A 133 -9.299 -6.155 1.199 1.00 2.77 N ATOM 357 CA ALA A 133 -7.877 -6.251 0.893 1.00 3.00 C ATOM 358 C ALA A 133 -7.199 -4.890 1.007 1.00 2.93 C ATOM 359 O ALA A 133 -6.137 -4.765 1.617 1.00 3.06 O ATOM 360 CB ALA A 133 -7.674 -6.829 -0.499 1.00 3.23 C ATOM 0 H ALA A 133 -9.914 -6.476 0.451 1.00 2.77 H new ATOM 0 HA ALA A 133 -7.418 -6.919 1.622 1.00 3.00 H new ATOM 0 HB1 ALA A 133 -6.607 -6.895 -0.714 1.00 3.23 H new ATOM 0 HB2 ALA A 133 -8.116 -7.824 -0.548 1.00 3.23 H new ATOM 0 HB3 ALA A 133 -8.153 -6.183 -1.235 1.00 3.23 H new ATOM 366 N ILE A 134 -7.818 -3.874 0.415 1.00 2.80 N ATOM 367 CA ILE A 134 -7.272 -2.523 0.451 1.00 2.83 C ATOM 368 C ILE A 134 -7.291 -1.960 1.868 1.00 2.69 C ATOM 369 O ILE A 134 -6.306 -1.385 2.332 1.00 2.62 O ATOM 370 CB ILE A 134 -8.056 -1.575 -0.476 1.00 2.85 C ATOM 371 CG1 ILE A 134 -8.010 -2.084 -1.918 1.00 3.01 C ATOM 372 CG2 ILE A 134 -7.494 -0.164 -0.388 1.00 3.41 C ATOM 373 CD1 ILE A 134 -6.607 -2.229 -2.463 1.00 2.67 C ATOM 0 H ILE A 134 -8.697 -3.961 -0.095 1.00 2.80 H new ATOM 0 HA ILE A 134 -6.241 -2.589 0.103 1.00 2.83 H new ATOM 0 HB ILE A 134 -9.096 -1.551 -0.152 1.00 2.85 H new ATOM 0 HG12 ILE A 134 -8.513 -3.050 -1.970 1.00 3.01 H new ATOM 0 HG13 ILE A 134 -8.569 -1.399 -2.555 1.00 3.01 H new ATOM 0 HG21 ILE A 134 -8.058 0.494 -1.049 1.00 3.41 H new ATOM 0 HG22 ILE A 134 -7.574 0.196 0.638 1.00 3.41 H new ATOM 0 HG23 ILE A 134 -6.447 -0.170 -0.690 1.00 3.41 H new ATOM 0 HD11 ILE A 134 -6.651 -2.594 -3.489 1.00 2.67 H new ATOM 0 HD12 ILE A 134 -6.107 -1.261 -2.443 1.00 2.67 H new ATOM 0 HD13 ILE A 134 -6.050 -2.937 -1.850 1.00 2.67 H new ATOM 385 N ARG A 135 -8.418 -2.131 2.552 1.00 2.70 N ATOM 386 CA ARG A 135 -8.565 -1.640 3.917 1.00 2.63 C ATOM 387 C ARG A 135 -7.412 -2.120 4.794 1.00 2.63 C ATOM 388 O ARG A 135 -6.960 -1.406 5.690 1.00 2.58 O ATOM 389 CB ARG A 135 -9.897 -2.106 4.508 1.00 2.65 C ATOM 390 CG ARG A 135 -10.516 -1.110 5.475 1.00 2.68 C ATOM 391 CD ARG A 135 -11.288 -1.812 6.581 1.00 2.54 C ATOM 392 NE ARG A 135 -12.585 -2.300 6.117 1.00 3.26 N ATOM 393 CZ ARG A 135 -13.439 -2.963 6.889 1.00 3.82 C ATOM 394 NH1 ARG A 135 -13.136 -3.215 8.155 1.00 3.90 N ATOM 395 NH2 ARG A 135 -14.600 -3.374 6.395 1.00 5.14 N ATOM 0 H ARG A 135 -9.242 -2.606 2.183 1.00 2.70 H new ATOM 0 HA ARG A 135 -8.549 -0.550 3.889 1.00 2.63 H new ATOM 0 HB2 ARG A 135 -10.599 -2.295 3.696 1.00 2.65 H new ATOM 0 HB3 ARG A 135 -9.744 -3.054 5.024 1.00 2.65 H new ATOM 0 HG2 ARG A 135 -9.732 -0.492 5.913 1.00 2.68 H new ATOM 0 HG3 ARG A 135 -11.184 -0.441 4.932 1.00 2.68 H new ATOM 0 HD2 ARG A 135 -10.700 -2.648 6.959 1.00 2.54 H new ATOM 0 HD3 ARG A 135 -11.436 -1.124 7.413 1.00 2.54 H new ATOM 0 HE ARG A 135 -12.849 -2.122 5.148 1.00 3.26 H new ATOM 0 HH11 ARG A 135 -12.245 -2.900 8.539 1.00 3.90 H new ATOM 0 HH12 ARG A 135 -13.794 -3.724 8.745 1.00 3.90 H new ATOM 0 HH21 ARG A 135 -14.837 -3.181 5.422 1.00 5.14 H new ATOM 0 HH22 ARG A 135 -15.255 -3.883 6.988 1.00 5.14 H new ATOM 409 N LYS A 136 -6.941 -3.334 4.532 1.00 2.73 N ATOM 410 CA LYS A 136 -5.840 -3.910 5.295 1.00 2.81 C ATOM 411 C LYS A 136 -4.577 -3.068 5.149 1.00 2.78 C ATOM 412 O LYS A 136 -3.846 -2.855 6.116 1.00 2.79 O ATOM 413 CB LYS A 136 -5.567 -5.343 4.833 1.00 3.05 C ATOM 414 CG LYS A 136 -6.314 -6.394 5.636 1.00 2.97 C ATOM 415 CD LYS A 136 -5.574 -6.750 6.914 1.00 3.34 C ATOM 416 CE LYS A 136 -6.535 -6.959 8.074 1.00 3.67 C ATOM 417 NZ LYS A 136 -6.689 -8.400 8.415 1.00 3.99 N ATOM 0 H LYS A 136 -7.305 -3.939 3.796 1.00 2.73 H new ATOM 0 HA LYS A 136 -6.127 -3.922 6.346 1.00 2.81 H new ATOM 0 HB2 LYS A 136 -5.843 -5.436 3.783 1.00 3.05 H new ATOM 0 HB3 LYS A 136 -4.497 -5.540 4.900 1.00 3.05 H new ATOM 0 HG2 LYS A 136 -7.310 -6.025 5.882 1.00 2.97 H new ATOM 0 HG3 LYS A 136 -6.447 -7.290 5.030 1.00 2.97 H new ATOM 0 HD2 LYS A 136 -4.989 -7.656 6.757 1.00 3.34 H new ATOM 0 HD3 LYS A 136 -4.870 -5.955 7.162 1.00 3.34 H new ATOM 0 HE2 LYS A 136 -6.173 -6.416 8.947 1.00 3.67 H new ATOM 0 HE3 LYS A 136 -7.508 -6.540 7.819 1.00 3.67 H new ATOM 0 HZ1 LYS A 136 -6.911 -8.496 9.426 1.00 3.99 H new ATOM 0 HZ2 LYS A 136 -7.461 -8.810 7.851 1.00 3.99 H new ATOM 0 HZ3 LYS A 136 -5.803 -8.903 8.206 1.00 3.99 H new ATOM 431 N ALA A 137 -4.327 -2.590 3.934 1.00 2.81 N ATOM 432 CA ALA A 137 -3.154 -1.768 3.663 1.00 2.88 C ATOM 433 C ALA A 137 -3.063 -0.602 4.641 1.00 2.64 C ATOM 434 O ALA A 137 -2.019 -0.369 5.249 1.00 2.60 O ATOM 435 CB ALA A 137 -3.188 -1.257 2.230 1.00 3.14 C ATOM 0 H ALA A 137 -4.921 -2.758 3.122 1.00 2.81 H new ATOM 0 HA ALA A 137 -2.267 -2.388 3.795 1.00 2.88 H new ATOM 0 HB1 ALA A 137 -2.306 -0.645 2.041 1.00 3.14 H new ATOM 0 HB2 ALA A 137 -3.197 -2.103 1.542 1.00 3.14 H new ATOM 0 HB3 ALA A 137 -4.086 -0.657 2.079 1.00 3.14 H new ATOM 441 N PHE A 138 -4.163 0.129 4.786 1.00 2.55 N ATOM 442 CA PHE A 138 -4.206 1.273 5.690 1.00 2.45 C ATOM 443 C PHE A 138 -4.083 0.824 7.143 1.00 2.27 C ATOM 444 O PHE A 138 -3.418 1.474 7.949 1.00 2.14 O ATOM 445 CB PHE A 138 -5.507 2.055 5.495 1.00 2.63 C ATOM 446 CG PHE A 138 -5.870 2.266 4.053 1.00 3.15 C ATOM 447 CD1 PHE A 138 -4.950 2.800 3.164 1.00 4.02 C ATOM 448 CD2 PHE A 138 -7.130 1.931 3.585 1.00 4.07 C ATOM 449 CE1 PHE A 138 -5.280 2.995 1.836 1.00 5.41 C ATOM 450 CE2 PHE A 138 -7.466 2.123 2.258 1.00 5.50 C ATOM 451 CZ PHE A 138 -6.540 2.656 1.383 1.00 6.07 C ATOM 0 H PHE A 138 -5.036 -0.050 4.290 1.00 2.55 H new ATOM 0 HA PHE A 138 -3.361 1.921 5.456 1.00 2.45 H new ATOM 0 HB2 PHE A 138 -6.319 1.523 5.992 1.00 2.63 H new ATOM 0 HB3 PHE A 138 -5.415 3.025 5.984 1.00 2.63 H new ATOM 0 HD1 PHE A 138 -3.964 3.067 3.513 1.00 4.02 H new ATOM 0 HD2 PHE A 138 -7.859 1.515 4.265 1.00 4.07 H new ATOM 0 HE1 PHE A 138 -4.554 3.412 1.154 1.00 5.41 H new ATOM 0 HE2 PHE A 138 -8.452 1.856 1.906 1.00 5.50 H new ATOM 0 HZ PHE A 138 -6.801 2.808 0.346 1.00 6.07 H new ATOM 461 N GLN A 139 -4.729 -0.291 7.468 1.00 2.37 N ATOM 462 CA GLN A 139 -4.692 -0.826 8.824 1.00 2.36 C ATOM 463 C GLN A 139 -3.268 -1.196 9.225 1.00 2.16 C ATOM 464 O GLN A 139 -2.956 -1.311 10.410 1.00 2.10 O ATOM 465 CB GLN A 139 -5.600 -2.052 8.935 1.00 2.74 C ATOM 466 CG GLN A 139 -6.940 -1.760 9.591 1.00 3.41 C ATOM 467 CD GLN A 139 -7.795 -3.001 9.751 1.00 4.16 C ATOM 468 OE1 GLN A 139 -7.887 -3.827 8.842 1.00 5.22 O ATOM 469 NE2 GLN A 139 -8.426 -3.140 10.911 1.00 4.22 N ATOM 0 H GLN A 139 -5.284 -0.841 6.812 1.00 2.37 H new ATOM 0 HA GLN A 139 -5.052 -0.053 9.503 1.00 2.36 H new ATOM 0 HB2 GLN A 139 -5.774 -2.457 7.938 1.00 2.74 H new ATOM 0 HB3 GLN A 139 -5.086 -2.824 9.507 1.00 2.74 H new ATOM 0 HG2 GLN A 139 -6.771 -1.312 10.570 1.00 3.41 H new ATOM 0 HG3 GLN A 139 -7.480 -1.026 8.993 1.00 3.41 H new ATOM 0 HE21 GLN A 139 -8.321 -2.431 11.637 1.00 4.22 H new ATOM 0 HE22 GLN A 139 -9.015 -3.956 11.076 1.00 4.22 H new ATOM 478 N VAL A 140 -2.407 -1.380 8.229 1.00 2.28 N ATOM 479 CA VAL A 140 -1.015 -1.736 8.478 1.00 2.25 C ATOM 480 C VAL A 140 -0.270 -0.594 9.161 1.00 1.79 C ATOM 481 O VAL A 140 0.354 -0.784 10.205 1.00 1.71 O ATOM 482 CB VAL A 140 -0.286 -2.101 7.171 1.00 2.60 C ATOM 483 CG1 VAL A 140 1.169 -2.443 7.449 1.00 2.00 C ATOM 484 CG2 VAL A 140 -0.990 -3.255 6.474 1.00 3.62 C ATOM 0 H VAL A 140 -2.649 -1.288 7.242 1.00 2.28 H new ATOM 0 HA VAL A 140 -1.023 -2.606 9.135 1.00 2.25 H new ATOM 0 HB VAL A 140 -0.310 -1.236 6.508 1.00 2.60 H new ATOM 0 HG11 VAL A 140 1.668 -2.698 6.514 1.00 2.00 H new ATOM 0 HG12 VAL A 140 1.664 -1.584 7.902 1.00 2.00 H new ATOM 0 HG13 VAL A 140 1.219 -3.292 8.131 1.00 2.00 H new ATOM 0 HG21 VAL A 140 -0.462 -3.500 5.552 1.00 3.62 H new ATOM 0 HG22 VAL A 140 -0.998 -4.126 7.130 1.00 3.62 H new ATOM 0 HG23 VAL A 140 -2.015 -2.968 6.239 1.00 3.62 H new ATOM 494 N TRP A 141 -0.340 0.590 8.565 1.00 1.68 N ATOM 495 CA TRP A 141 0.329 1.764 9.116 1.00 1.45 C ATOM 496 C TRP A 141 -0.524 2.418 10.197 1.00 1.38 C ATOM 497 O TRP A 141 -0.016 3.160 11.038 1.00 1.47 O ATOM 498 CB TRP A 141 0.630 2.773 8.006 1.00 1.72 C ATOM 499 CG TRP A 141 -0.572 3.557 7.575 1.00 3.16 C ATOM 500 CD1 TRP A 141 -1.493 3.194 6.634 1.00 3.85 C ATOM 501 CD2 TRP A 141 -0.982 4.838 8.066 1.00 5.30 C ATOM 502 NE1 TRP A 141 -2.451 4.172 6.511 1.00 6.03 N ATOM 503 CE2 TRP A 141 -2.160 5.191 7.380 1.00 6.87 C ATOM 504 CE3 TRP A 141 -0.469 5.720 9.021 1.00 6.42 C ATOM 505 CZ2 TRP A 141 -2.830 6.387 7.618 1.00 9.18 C ATOM 506 CZ3 TRP A 141 -1.136 6.908 9.257 1.00 8.68 C ATOM 507 CH2 TRP A 141 -2.306 7.232 8.558 1.00 9.96 C ATOM 0 H TRP A 141 -0.853 0.764 7.701 1.00 1.68 H new ATOM 0 HA TRP A 141 1.267 1.440 9.566 1.00 1.45 H new ATOM 0 HB2 TRP A 141 1.400 3.463 8.351 1.00 1.72 H new ATOM 0 HB3 TRP A 141 1.038 2.244 7.145 1.00 1.72 H new ATOM 0 HD1 TRP A 141 -1.472 2.274 6.069 1.00 3.85 H new ATOM 0 HE1 TRP A 141 -3.249 4.144 5.876 1.00 6.03 H new ATOM 0 HE3 TRP A 141 0.432 5.478 9.565 1.00 6.42 H new ATOM 0 HZ2 TRP A 141 -3.732 6.639 7.080 1.00 9.18 H new ATOM 0 HZ3 TRP A 141 -0.749 7.598 9.992 1.00 8.68 H new ATOM 0 HH2 TRP A 141 -2.804 8.167 8.765 1.00 9.96 H new ATOM 518 N SER A 142 -1.823 2.138 10.170 1.00 1.45 N ATOM 519 CA SER A 142 -2.747 2.703 11.147 1.00 1.54 C ATOM 520 C SER A 142 -2.664 1.951 12.472 1.00 1.68 C ATOM 521 O SER A 142 -2.894 2.521 13.537 1.00 1.85 O ATOM 522 CB SER A 142 -4.180 2.658 10.611 1.00 1.93 C ATOM 523 OG SER A 142 -5.121 2.692 11.670 1.00 2.27 O ATOM 0 H SER A 142 -2.259 1.524 9.483 1.00 1.45 H new ATOM 0 HA SER A 142 -2.464 3.741 11.320 1.00 1.54 H new ATOM 0 HB2 SER A 142 -4.349 3.503 9.943 1.00 1.93 H new ATOM 0 HB3 SER A 142 -4.323 1.752 10.022 1.00 1.93 H new ATOM 0 HG SER A 142 -5.958 3.089 11.351 1.00 2.27 H new ATOM 529 N ASN A 143 -2.334 0.666 12.396 1.00 1.88 N ATOM 530 CA ASN A 143 -2.220 -0.166 13.588 1.00 2.32 C ATOM 531 C ASN A 143 -0.879 0.056 14.281 1.00 2.32 C ATOM 532 O ASN A 143 -0.825 0.324 15.481 1.00 2.54 O ATOM 533 CB ASN A 143 -2.379 -1.643 13.222 1.00 2.83 C ATOM 534 CG ASN A 143 -2.308 -2.550 14.435 1.00 2.87 C ATOM 535 OD1 ASN A 143 -2.489 -2.106 15.568 1.00 2.79 O ATOM 536 ND2 ASN A 143 -2.042 -3.830 14.201 1.00 3.73 N ATOM 0 H ASN A 143 -2.141 0.178 11.521 1.00 1.88 H new ATOM 0 HA ASN A 143 -3.016 0.119 14.276 1.00 2.32 H new ATOM 0 HB2 ASN A 143 -3.334 -1.789 12.718 1.00 2.83 H new ATOM 0 HB3 ASN A 143 -1.599 -1.925 12.515 1.00 2.83 H new ATOM 0 HD21 ASN A 143 -1.981 -4.488 14.978 1.00 3.73 H new ATOM 0 HD22 ASN A 143 -1.899 -4.155 13.245 1.00 3.73 H new ATOM 543 N VAL A 144 0.202 -0.057 13.516 1.00 2.33 N ATOM 544 CA VAL A 144 1.543 0.133 14.054 1.00 2.67 C ATOM 545 C VAL A 144 1.677 1.493 14.729 1.00 2.72 C ATOM 546 O VAL A 144 2.365 1.633 15.741 1.00 3.36 O ATOM 547 CB VAL A 144 2.613 0.011 12.953 1.00 2.61 C ATOM 548 CG1 VAL A 144 2.627 -1.396 12.375 1.00 4.22 C ATOM 549 CG2 VAL A 144 2.373 1.043 11.861 1.00 2.18 C ATOM 0 H VAL A 144 0.175 -0.279 12.521 1.00 2.33 H new ATOM 0 HA VAL A 144 1.701 -0.653 14.792 1.00 2.67 H new ATOM 0 HB VAL A 144 3.590 0.205 13.396 1.00 2.61 H new ATOM 0 HG11 VAL A 144 3.389 -1.463 11.599 1.00 4.22 H new ATOM 0 HG12 VAL A 144 2.851 -2.112 13.166 1.00 4.22 H new ATOM 0 HG13 VAL A 144 1.651 -1.623 11.946 1.00 4.22 H new ATOM 0 HG21 VAL A 144 3.138 0.943 11.091 1.00 2.18 H new ATOM 0 HG22 VAL A 144 1.390 0.883 11.419 1.00 2.18 H new ATOM 0 HG23 VAL A 144 2.419 2.044 12.290 1.00 2.18 H new ATOM 559 N THR A 145 1.013 2.496 14.163 1.00 2.36 N ATOM 560 CA THR A 145 1.058 3.847 14.709 1.00 2.70 C ATOM 561 C THR A 145 -0.205 4.161 15.502 1.00 2.93 C ATOM 562 O THR A 145 -1.281 3.624 15.240 1.00 3.17 O ATOM 563 CB THR A 145 1.226 4.898 13.595 1.00 2.66 C ATOM 564 OG1 THR A 145 -0.014 5.079 12.902 1.00 3.04 O ATOM 565 CG2 THR A 145 2.306 4.475 12.611 1.00 2.93 C ATOM 0 H THR A 145 0.438 2.398 13.327 1.00 2.36 H new ATOM 0 HA THR A 145 1.921 3.891 15.373 1.00 2.70 H new ATOM 0 HB THR A 145 1.525 5.840 14.056 1.00 2.66 H new ATOM 0 HG1 THR A 145 0.025 4.620 12.037 1.00 3.04 H new ATOM 0 HG21 THR A 145 2.407 5.232 11.834 1.00 2.93 H new ATOM 0 HG22 THR A 145 3.255 4.366 13.137 1.00 2.93 H new ATOM 0 HG23 THR A 145 2.032 3.523 12.157 1.00 2.93 H new ATOM 573 N PRO A 146 -0.074 5.053 16.496 1.00 3.12 N ATOM 574 CA PRO A 146 -1.196 5.459 17.347 1.00 3.47 C ATOM 575 C PRO A 146 -2.219 6.302 16.594 1.00 3.50 C ATOM 576 O PRO A 146 -3.181 5.775 16.033 1.00 4.46 O ATOM 577 CB PRO A 146 -0.525 6.288 18.446 1.00 3.84 C ATOM 578 CG PRO A 146 0.728 6.799 17.823 1.00 3.75 C ATOM 579 CD PRO A 146 1.179 5.732 16.865 1.00 3.30 C ATOM 0 HA PRO A 146 -1.755 4.601 17.722 1.00 3.47 H new ATOM 0 HB2 PRO A 146 -1.167 7.106 18.773 1.00 3.84 H new ATOM 0 HB3 PRO A 146 -0.311 5.680 19.325 1.00 3.84 H new ATOM 0 HG2 PRO A 146 0.550 7.740 17.303 1.00 3.75 H new ATOM 0 HG3 PRO A 146 1.489 6.992 18.579 1.00 3.75 H new ATOM 0 HD2 PRO A 146 1.677 6.158 15.994 1.00 3.30 H new ATOM 0 HD3 PRO A 146 1.886 5.046 17.332 1.00 3.30 H new ATOM 587 N LEU A 147 -2.007 7.614 16.585 1.00 3.47 N ATOM 588 CA LEU A 147 -2.911 8.530 15.900 1.00 3.76 C ATOM 589 C LEU A 147 -4.360 8.263 16.295 1.00 3.92 C ATOM 590 O LEU A 147 -4.631 7.530 17.246 1.00 4.62 O ATOM 591 CB LEU A 147 -2.751 8.398 14.384 1.00 4.02 C ATOM 592 CG LEU A 147 -1.318 8.449 13.854 1.00 4.88 C ATOM 593 CD1 LEU A 147 -1.209 7.693 12.538 1.00 5.14 C ATOM 594 CD2 LEU A 147 -0.864 9.891 13.682 1.00 5.51 C ATOM 0 H LEU A 147 -1.217 8.067 17.045 1.00 3.47 H new ATOM 0 HA LEU A 147 -2.654 9.546 16.199 1.00 3.76 H new ATOM 0 HB2 LEU A 147 -3.199 7.455 14.072 1.00 4.02 H new ATOM 0 HB3 LEU A 147 -3.322 9.195 13.908 1.00 4.02 H new ATOM 0 HG LEU A 147 -0.664 7.968 14.581 1.00 4.88 H new ATOM 0 HD11 LEU A 147 -0.182 7.740 12.175 1.00 5.14 H new ATOM 0 HD12 LEU A 147 -1.492 6.652 12.692 1.00 5.14 H new ATOM 0 HD13 LEU A 147 -1.874 8.145 11.802 1.00 5.14 H new ATOM 0 HD21 LEU A 147 0.158 9.908 13.304 1.00 5.51 H new ATOM 0 HD22 LEU A 147 -1.521 10.397 12.975 1.00 5.51 H new ATOM 0 HD23 LEU A 147 -0.904 10.402 14.644 1.00 5.51 H new ATOM 606 N LYS A 148 -5.289 8.861 15.556 1.00 3.67 N ATOM 607 CA LYS A 148 -6.711 8.686 15.826 1.00 4.00 C ATOM 608 C LYS A 148 -7.409 8.011 14.649 1.00 3.78 C ATOM 609 O LYS A 148 -7.086 8.272 13.490 1.00 3.46 O ATOM 610 CB LYS A 148 -7.367 10.038 16.114 1.00 4.49 C ATOM 611 CG LYS A 148 -6.657 10.841 17.190 1.00 5.19 C ATOM 612 CD LYS A 148 -6.544 10.058 18.487 1.00 6.05 C ATOM 613 CE LYS A 148 -6.222 10.969 19.662 1.00 7.18 C ATOM 614 NZ LYS A 148 -7.454 11.521 20.290 1.00 7.99 N ATOM 0 H LYS A 148 -5.082 9.471 14.765 1.00 3.67 H new ATOM 0 HA LYS A 148 -6.813 8.046 16.702 1.00 4.00 H new ATOM 0 HB2 LYS A 148 -7.394 10.623 15.194 1.00 4.49 H new ATOM 0 HB3 LYS A 148 -8.401 9.874 16.418 1.00 4.49 H new ATOM 0 HG2 LYS A 148 -5.661 11.116 16.842 1.00 5.19 H new ATOM 0 HG3 LYS A 148 -7.200 11.769 17.370 1.00 5.19 H new ATOM 0 HD2 LYS A 148 -7.479 9.532 18.679 1.00 6.05 H new ATOM 0 HD3 LYS A 148 -5.767 9.300 18.389 1.00 6.05 H new ATOM 0 HE2 LYS A 148 -5.652 10.413 20.407 1.00 7.18 H new ATOM 0 HE3 LYS A 148 -5.589 11.789 19.323 1.00 7.18 H new ATOM 0 HZ1 LYS A 148 -7.192 12.136 21.086 1.00 7.99 H new ATOM 0 HZ2 LYS A 148 -7.985 12.073 19.586 1.00 7.99 H new ATOM 0 HZ3 LYS A 148 -8.047 10.740 20.637 1.00 7.99 H new ATOM 628 N PHE A 149 -8.368 7.142 14.955 1.00 4.29 N ATOM 629 CA PHE A 149 -9.112 6.430 13.922 1.00 4.31 C ATOM 630 C PHE A 149 -10.393 7.177 13.562 1.00 4.36 C ATOM 631 O PHE A 149 -11.170 7.557 14.438 1.00 4.93 O ATOM 632 CB PHE A 149 -9.448 5.014 14.391 1.00 5.14 C ATOM 633 CG PHE A 149 -10.424 4.976 15.533 1.00 5.57 C ATOM 634 CD1 PHE A 149 -9.981 5.070 16.842 1.00 6.61 C ATOM 635 CD2 PHE A 149 -11.783 4.848 15.296 1.00 5.70 C ATOM 636 CE1 PHE A 149 -10.877 5.034 17.894 1.00 7.25 C ATOM 637 CE2 PHE A 149 -12.683 4.812 16.344 1.00 6.57 C ATOM 638 CZ PHE A 149 -12.230 4.907 17.645 1.00 7.11 C ATOM 0 H PHE A 149 -8.648 6.914 15.909 1.00 4.29 H new ATOM 0 HA PHE A 149 -8.485 6.371 13.032 1.00 4.31 H new ATOM 0 HB2 PHE A 149 -9.859 4.450 13.553 1.00 5.14 H new ATOM 0 HB3 PHE A 149 -8.529 4.512 14.692 1.00 5.14 H new ATOM 0 HD1 PHE A 149 -8.925 5.172 17.043 1.00 6.61 H new ATOM 0 HD2 PHE A 149 -12.143 4.776 14.280 1.00 5.70 H new ATOM 0 HE1 PHE A 149 -10.519 5.105 18.911 1.00 7.25 H new ATOM 0 HE2 PHE A 149 -13.740 4.710 16.146 1.00 6.57 H new ATOM 0 HZ PHE A 149 -12.932 4.882 18.466 1.00 7.11 H new ATOM 648 N SER A 150 -10.606 7.384 12.267 1.00 3.99 N ATOM 649 CA SER A 150 -11.790 8.089 11.790 1.00 4.23 C ATOM 650 C SER A 150 -11.959 7.911 10.284 1.00 3.99 C ATOM 651 O SER A 150 -11.486 8.728 9.493 1.00 3.74 O ATOM 652 CB SER A 150 -11.696 9.577 12.132 1.00 4.31 C ATOM 653 OG SER A 150 -12.952 10.216 11.979 1.00 4.57 O ATOM 0 H SER A 150 -9.974 7.074 11.529 1.00 3.99 H new ATOM 0 HA SER A 150 -12.661 7.663 12.288 1.00 4.23 H new ATOM 0 HB2 SER A 150 -11.346 9.696 13.157 1.00 4.31 H new ATOM 0 HB3 SER A 150 -10.960 10.056 11.486 1.00 4.31 H new ATOM 0 HG SER A 150 -12.866 11.166 12.205 1.00 4.57 H new ATOM 659 N LYS A 151 -12.636 6.837 9.894 1.00 4.34 N ATOM 660 CA LYS A 151 -12.870 6.550 8.483 1.00 4.26 C ATOM 661 C LYS A 151 -14.297 6.909 8.084 1.00 4.26 C ATOM 662 O LYS A 151 -15.256 6.302 8.561 1.00 5.12 O ATOM 663 CB LYS A 151 -12.604 5.071 8.192 1.00 5.12 C ATOM 664 CG LYS A 151 -12.744 4.706 6.724 1.00 4.45 C ATOM 665 CD LYS A 151 -12.026 3.406 6.402 1.00 4.63 C ATOM 666 CE LYS A 151 -12.914 2.460 5.609 1.00 4.06 C ATOM 667 NZ LYS A 151 -13.400 3.082 4.347 1.00 3.79 N ATOM 0 H LYS A 151 -13.033 6.150 10.535 1.00 4.34 H new ATOM 0 HA LYS A 151 -12.184 7.159 7.895 1.00 4.26 H new ATOM 0 HB2 LYS A 151 -11.598 4.819 8.526 1.00 5.12 H new ATOM 0 HB3 LYS A 151 -13.296 4.464 8.776 1.00 5.12 H new ATOM 0 HG2 LYS A 151 -13.800 4.612 6.471 1.00 4.45 H new ATOM 0 HG3 LYS A 151 -12.339 5.509 6.108 1.00 4.45 H new ATOM 0 HD2 LYS A 151 -11.121 3.620 5.833 1.00 4.63 H new ATOM 0 HD3 LYS A 151 -11.713 2.923 7.328 1.00 4.63 H new ATOM 0 HE2 LYS A 151 -12.359 1.551 5.376 1.00 4.06 H new ATOM 0 HE3 LYS A 151 -13.767 2.165 6.220 1.00 4.06 H new ATOM 0 HZ1 LYS A 151 -13.671 2.336 3.675 1.00 3.79 H new ATOM 0 HZ2 LYS A 151 -14.225 3.681 4.551 1.00 3.79 H new ATOM 0 HZ3 LYS A 151 -12.644 3.663 3.933 1.00 3.79 H new ATOM 681 N ILE A 152 -14.430 7.898 7.207 1.00 3.74 N ATOM 682 CA ILE A 152 -15.741 8.336 6.742 1.00 4.28 C ATOM 683 C ILE A 152 -15.779 8.439 5.222 1.00 4.18 C ATOM 684 O ILE A 152 -14.809 8.862 4.594 1.00 3.73 O ATOM 685 CB ILE A 152 -16.127 9.698 7.348 1.00 4.66 C ATOM 686 CG1 ILE A 152 -15.905 9.689 8.862 1.00 5.01 C ATOM 687 CG2 ILE A 152 -17.575 10.031 7.022 1.00 6.01 C ATOM 688 CD1 ILE A 152 -14.764 10.575 9.310 1.00 4.90 C ATOM 0 H ILE A 152 -13.646 8.411 6.804 1.00 3.74 H new ATOM 0 HA ILE A 152 -16.459 7.585 7.070 1.00 4.28 H new ATOM 0 HB ILE A 152 -15.490 10.467 6.911 1.00 4.66 H new ATOM 0 HG12 ILE A 152 -16.821 10.011 9.357 1.00 5.01 H new ATOM 0 HG13 ILE A 152 -15.710 8.667 9.187 1.00 5.01 H new ATOM 0 HG21 ILE A 152 -17.833 10.997 7.457 1.00 6.01 H new ATOM 0 HG22 ILE A 152 -17.704 10.074 5.940 1.00 6.01 H new ATOM 0 HG23 ILE A 152 -18.227 9.261 7.435 1.00 6.01 H new ATOM 0 HD11 ILE A 152 -14.664 10.520 10.394 1.00 4.90 H new ATOM 0 HD12 ILE A 152 -13.838 10.240 8.843 1.00 4.90 H new ATOM 0 HD13 ILE A 152 -14.966 11.605 9.016 1.00 4.90 H new ATOM 752 N ALA A 157 -8.834 11.845 1.049 1.00 4.54 N ATOM 753 CA ALA A 157 -7.586 12.592 0.958 1.00 4.56 C ATOM 754 C ALA A 157 -6.454 11.858 1.669 1.00 4.06 C ATOM 755 O ALA A 157 -6.641 10.752 2.176 1.00 4.35 O ATOM 756 CB ALA A 157 -7.762 13.987 1.541 1.00 4.95 C ATOM 0 HA ALA A 157 -7.321 12.681 -0.095 1.00 4.56 H new ATOM 0 HB1 ALA A 157 -6.822 14.534 1.466 1.00 4.95 H new ATOM 0 HB2 ALA A 157 -8.536 14.518 0.987 1.00 4.95 H new ATOM 0 HB3 ALA A 157 -8.055 13.909 2.588 1.00 4.95 H new ATOM 762 N ASP A 158 -5.281 12.480 1.702 1.00 4.12 N ATOM 763 CA ASP A 158 -4.118 11.886 2.352 1.00 3.89 C ATOM 764 C ASP A 158 -3.621 10.673 1.572 1.00 3.08 C ATOM 765 O ASP A 158 -2.613 10.746 0.869 1.00 3.44 O ATOM 766 CB ASP A 158 -4.460 11.480 3.786 1.00 4.48 C ATOM 767 CG ASP A 158 -3.699 12.293 4.815 1.00 5.38 C ATOM 768 OD1 ASP A 158 -2.502 12.005 5.030 1.00 5.81 O ATOM 769 OD2 ASP A 158 -4.298 13.216 5.404 1.00 6.26 O ATOM 0 H ASP A 158 -5.110 13.396 1.286 1.00 4.12 H new ATOM 0 HA ASP A 158 -3.324 12.632 2.374 1.00 3.89 H new ATOM 0 HB2 ASP A 158 -5.531 11.603 3.950 1.00 4.48 H new ATOM 0 HB3 ASP A 158 -4.236 10.422 3.924 1.00 4.48 H new ATOM 774 N ILE A 159 -4.334 9.559 1.702 1.00 2.43 N ATOM 775 CA ILE A 159 -3.965 8.331 1.010 1.00 2.00 C ATOM 776 C ILE A 159 -5.125 7.802 0.172 1.00 2.21 C ATOM 777 O ILE A 159 -6.063 7.203 0.700 1.00 2.54 O ATOM 778 CB ILE A 159 -3.521 7.238 2.000 1.00 1.80 C ATOM 779 CG1 ILE A 159 -2.344 7.732 2.844 1.00 2.15 C ATOM 780 CG2 ILE A 159 -3.148 5.967 1.253 1.00 3.05 C ATOM 781 CD1 ILE A 159 -2.711 8.016 4.284 1.00 2.54 C ATOM 0 H ILE A 159 -5.171 9.482 2.280 1.00 2.43 H new ATOM 0 HA ILE A 159 -3.129 8.577 0.355 1.00 2.00 H new ATOM 0 HB ILE A 159 -4.353 7.013 2.667 1.00 1.80 H new ATOM 0 HG12 ILE A 159 -1.551 6.984 2.820 1.00 2.15 H new ATOM 0 HG13 ILE A 159 -1.940 8.639 2.395 1.00 2.15 H new ATOM 0 HG21 ILE A 159 -2.836 5.204 1.966 1.00 3.05 H new ATOM 0 HG22 ILE A 159 -4.011 5.608 0.692 1.00 3.05 H new ATOM 0 HG23 ILE A 159 -2.329 6.176 0.565 1.00 3.05 H new ATOM 0 HD11 ILE A 159 -1.829 8.362 4.823 1.00 2.54 H new ATOM 0 HD12 ILE A 159 -3.482 8.786 4.318 1.00 2.54 H new ATOM 0 HD13 ILE A 159 -3.087 7.105 4.750 1.00 2.54 H new ATOM 793 N LEU A 160 -5.053 8.026 -1.135 1.00 2.34 N ATOM 794 CA LEU A 160 -6.096 7.570 -2.047 1.00 2.74 C ATOM 795 C LEU A 160 -5.541 6.562 -3.049 1.00 2.50 C ATOM 796 O LEU A 160 -4.395 6.671 -3.485 1.00 2.25 O ATOM 797 CB LEU A 160 -6.708 8.760 -2.789 1.00 3.30 C ATOM 798 CG LEU A 160 -5.720 9.797 -3.324 1.00 2.47 C ATOM 799 CD1 LEU A 160 -6.005 10.100 -4.787 1.00 3.30 C ATOM 800 CD2 LEU A 160 -5.781 11.070 -2.493 1.00 3.23 C ATOM 0 H LEU A 160 -4.284 8.520 -1.587 1.00 2.34 H new ATOM 0 HA LEU A 160 -6.871 7.080 -1.458 1.00 2.74 H new ATOM 0 HB2 LEU A 160 -7.293 8.379 -3.626 1.00 3.30 H new ATOM 0 HB3 LEU A 160 -7.404 9.263 -2.117 1.00 3.30 H new ATOM 0 HG LEU A 160 -4.714 9.385 -3.248 1.00 2.47 H new ATOM 0 HD11 LEU A 160 -5.292 10.840 -5.151 1.00 3.30 H new ATOM 0 HD12 LEU A 160 -5.910 9.186 -5.373 1.00 3.30 H new ATOM 0 HD13 LEU A 160 -7.017 10.492 -4.887 1.00 3.30 H new ATOM 0 HD21 LEU A 160 -5.071 11.797 -2.888 1.00 3.23 H new ATOM 0 HD22 LEU A 160 -6.788 11.485 -2.537 1.00 3.23 H new ATOM 0 HD23 LEU A 160 -5.528 10.841 -1.458 1.00 3.23 H new ATOM 812 N VAL A 161 -6.363 5.582 -3.412 1.00 2.74 N ATOM 813 CA VAL A 161 -5.956 4.557 -4.365 1.00 2.60 C ATOM 814 C VAL A 161 -5.875 5.121 -5.779 1.00 2.57 C ATOM 815 O VAL A 161 -6.872 5.588 -6.330 1.00 2.84 O ATOM 816 CB VAL A 161 -6.930 3.364 -4.356 1.00 2.89 C ATOM 817 CG1 VAL A 161 -6.808 2.584 -3.055 1.00 4.02 C ATOM 818 CG2 VAL A 161 -8.359 3.841 -4.568 1.00 2.95 C ATOM 0 H VAL A 161 -7.315 5.477 -3.060 1.00 2.74 H new ATOM 0 HA VAL A 161 -4.968 4.214 -4.057 1.00 2.60 H new ATOM 0 HB VAL A 161 -6.668 2.698 -5.178 1.00 2.89 H new ATOM 0 HG11 VAL A 161 -7.504 1.745 -3.067 1.00 4.02 H new ATOM 0 HG12 VAL A 161 -5.790 2.209 -2.949 1.00 4.02 H new ATOM 0 HG13 VAL A 161 -7.043 3.238 -2.215 1.00 4.02 H new ATOM 0 HG21 VAL A 161 -9.034 2.985 -4.559 1.00 2.95 H new ATOM 0 HG22 VAL A 161 -8.635 4.529 -3.769 1.00 2.95 H new ATOM 0 HG23 VAL A 161 -8.434 4.351 -5.528 1.00 2.95 H new ATOM 828 N VAL A 162 -4.681 5.075 -6.361 1.00 2.33 N ATOM 829 CA VAL A 162 -4.469 5.581 -7.712 1.00 2.39 C ATOM 830 C VAL A 162 -4.259 4.439 -8.700 1.00 2.35 C ATOM 831 O VAL A 162 -3.253 3.731 -8.641 1.00 2.20 O ATOM 832 CB VAL A 162 -3.257 6.528 -7.773 1.00 2.34 C ATOM 833 CG1 VAL A 162 -3.052 7.044 -9.190 1.00 2.55 C ATOM 834 CG2 VAL A 162 -3.432 7.682 -6.797 1.00 2.49 C ATOM 0 H VAL A 162 -3.846 4.692 -5.918 1.00 2.33 H new ATOM 0 HA VAL A 162 -5.367 6.135 -7.987 1.00 2.39 H new ATOM 0 HB VAL A 162 -2.367 5.969 -7.483 1.00 2.34 H new ATOM 0 HG11 VAL A 162 -2.191 7.712 -9.213 1.00 2.55 H new ATOM 0 HG12 VAL A 162 -2.877 6.203 -9.862 1.00 2.55 H new ATOM 0 HG13 VAL A 162 -3.941 7.587 -9.512 1.00 2.55 H new ATOM 0 HG21 VAL A 162 -2.566 8.341 -6.854 1.00 2.49 H new ATOM 0 HG22 VAL A 162 -4.331 8.242 -7.053 1.00 2.49 H new ATOM 0 HG23 VAL A 162 -3.524 7.291 -5.784 1.00 2.49 H new ATOM 844 N PHE A 163 -5.214 4.265 -9.607 1.00 2.66 N ATOM 845 CA PHE A 163 -5.133 3.207 -10.608 1.00 2.73 C ATOM 846 C PHE A 163 -4.718 3.772 -11.963 1.00 2.81 C ATOM 847 O PHE A 163 -5.501 4.444 -12.634 1.00 3.33 O ATOM 848 CB PHE A 163 -6.479 2.490 -10.733 1.00 3.06 C ATOM 849 CG PHE A 163 -6.548 1.542 -11.895 1.00 3.75 C ATOM 850 CD1 PHE A 163 -5.502 0.673 -12.160 1.00 4.58 C ATOM 851 CD2 PHE A 163 -7.658 1.520 -12.724 1.00 4.63 C ATOM 852 CE1 PHE A 163 -5.562 -0.202 -13.229 1.00 5.83 C ATOM 853 CE2 PHE A 163 -7.724 0.648 -13.794 1.00 5.67 C ATOM 854 CZ PHE A 163 -6.674 -0.213 -14.048 1.00 6.15 C ATOM 0 H PHE A 163 -6.053 4.842 -9.670 1.00 2.66 H new ATOM 0 HA PHE A 163 -4.377 2.492 -10.284 1.00 2.73 H new ATOM 0 HB2 PHE A 163 -6.675 1.939 -9.813 1.00 3.06 H new ATOM 0 HB3 PHE A 163 -7.270 3.234 -10.834 1.00 3.06 H new ATOM 0 HD1 PHE A 163 -4.629 0.679 -11.524 1.00 4.58 H new ATOM 0 HD2 PHE A 163 -8.481 2.192 -12.532 1.00 4.63 H new ATOM 0 HE1 PHE A 163 -4.741 -0.876 -13.423 1.00 5.83 H new ATOM 0 HE2 PHE A 163 -8.596 0.640 -14.431 1.00 5.67 H new ATOM 0 HZ PHE A 163 -6.723 -0.893 -14.885 1.00 6.15 H new ATOM 864 N ALA A 164 -3.480 3.495 -12.359 1.00 2.39 N ATOM 865 CA ALA A 164 -2.960 3.974 -13.634 1.00 2.50 C ATOM 866 C ALA A 164 -2.064 2.928 -14.289 1.00 2.17 C ATOM 867 O ALA A 164 -0.937 2.700 -13.849 1.00 1.95 O ATOM 868 CB ALA A 164 -2.198 5.276 -13.438 1.00 2.75 C ATOM 0 H ALA A 164 -2.818 2.941 -11.815 1.00 2.39 H new ATOM 0 HA ALA A 164 -3.805 4.157 -14.297 1.00 2.50 H new ATOM 0 HB1 ALA A 164 -1.815 5.622 -14.398 1.00 2.75 H new ATOM 0 HB2 ALA A 164 -2.866 6.029 -13.021 1.00 2.75 H new ATOM 0 HB3 ALA A 164 -1.366 5.111 -12.754 1.00 2.75 H new ATOM 874 N ARG A 165 -2.572 2.295 -15.341 1.00 2.42 N ATOM 875 CA ARG A 165 -1.818 1.272 -16.055 1.00 2.41 C ATOM 876 C ARG A 165 -2.109 1.327 -17.552 1.00 2.85 C ATOM 877 O ARG A 165 -3.095 1.924 -17.981 1.00 3.35 O ATOM 878 CB ARG A 165 -2.158 -0.117 -15.509 1.00 2.73 C ATOM 879 CG ARG A 165 -1.151 -1.187 -15.897 1.00 3.36 C ATOM 880 CD ARG A 165 0.250 -0.829 -15.428 1.00 4.42 C ATOM 881 NE ARG A 165 1.094 -0.366 -16.527 1.00 5.82 N ATOM 882 CZ ARG A 165 1.675 -1.181 -17.400 1.00 7.12 C ATOM 883 NH1 ARG A 165 1.504 -2.492 -17.305 1.00 7.26 N ATOM 884 NH2 ARG A 165 2.428 -0.683 -18.373 1.00 8.65 N ATOM 0 H ARG A 165 -3.503 2.473 -15.718 1.00 2.42 H new ATOM 0 HA ARG A 165 -0.756 1.466 -15.902 1.00 2.41 H new ATOM 0 HB2 ARG A 165 -2.220 -0.066 -14.422 1.00 2.73 H new ATOM 0 HB3 ARG A 165 -3.144 -0.409 -15.871 1.00 2.73 H new ATOM 0 HG2 ARG A 165 -1.448 -2.142 -15.464 1.00 3.36 H new ATOM 0 HG3 ARG A 165 -1.152 -1.314 -16.980 1.00 3.36 H new ATOM 0 HD2 ARG A 165 0.190 -0.052 -14.665 1.00 4.42 H new ATOM 0 HD3 ARG A 165 0.709 -1.700 -14.960 1.00 4.42 H new ATOM 0 HE ARG A 165 1.245 0.638 -16.629 1.00 5.82 H new ATOM 0 HH11 ARG A 165 0.925 -2.878 -16.560 1.00 7.26 H new ATOM 0 HH12 ARG A 165 1.952 -3.115 -17.977 1.00 7.26 H new ATOM 0 HH21 ARG A 165 2.560 0.325 -18.450 1.00 8.65 H new ATOM 0 HH22 ARG A 165 2.874 -1.309 -19.044 1.00 8.65 H new ATOM 898 N GLY A 166 -1.242 0.700 -18.341 1.00 2.95 N ATOM 899 CA GLY A 166 -1.423 0.691 -19.781 1.00 3.41 C ATOM 900 C GLY A 166 -1.550 2.086 -20.359 1.00 3.38 C ATOM 901 O GLY A 166 -0.552 2.779 -20.551 1.00 3.32 O ATOM 0 H GLY A 166 -0.418 0.198 -18.009 1.00 2.95 H new ATOM 0 HA2 GLY A 166 -0.578 0.184 -20.247 1.00 3.41 H new ATOM 0 HA3 GLY A 166 -2.316 0.116 -20.028 1.00 3.41 H new ATOM 905 N ALA A 167 -2.782 2.500 -20.637 1.00 3.77 N ATOM 906 CA ALA A 167 -3.037 3.822 -21.196 1.00 4.11 C ATOM 907 C ALA A 167 -2.784 4.913 -20.161 1.00 3.88 C ATOM 908 O ALA A 167 -3.220 4.808 -19.014 1.00 3.67 O ATOM 909 CB ALA A 167 -4.462 3.908 -21.720 1.00 4.91 C ATOM 0 H ALA A 167 -3.620 1.938 -20.484 1.00 3.77 H new ATOM 0 HA ALA A 167 -2.348 3.978 -22.026 1.00 4.11 H new ATOM 0 HB1 ALA A 167 -4.638 4.901 -22.134 1.00 4.91 H new ATOM 0 HB2 ALA A 167 -4.609 3.159 -22.498 1.00 4.91 H new ATOM 0 HB3 ALA A 167 -5.161 3.726 -20.904 1.00 4.91 H new ATOM 915 N HIS A 168 -2.077 5.961 -20.573 1.00 4.06 N ATOM 916 CA HIS A 168 -1.767 7.072 -19.680 1.00 4.12 C ATOM 917 C HIS A 168 -3.010 7.521 -18.918 1.00 4.41 C ATOM 918 O HIS A 168 -3.885 8.183 -19.474 1.00 5.16 O ATOM 919 CB HIS A 168 -1.189 8.245 -20.473 1.00 4.67 C ATOM 920 CG HIS A 168 0.151 7.958 -21.076 1.00 4.48 C ATOM 921 ND1 HIS A 168 0.729 8.756 -22.040 1.00 5.14 N ATOM 922 CD2 HIS A 168 1.030 6.954 -20.845 1.00 4.70 C ATOM 923 CE1 HIS A 168 1.904 8.255 -22.378 1.00 5.45 C ATOM 924 NE2 HIS A 168 2.110 7.161 -21.667 1.00 5.29 N ATOM 0 H HIS A 168 -1.708 6.064 -21.518 1.00 4.06 H new ATOM 0 HA HIS A 168 -1.025 6.730 -18.959 1.00 4.12 H new ATOM 0 HB2 HIS A 168 -1.885 8.514 -21.267 1.00 4.67 H new ATOM 0 HB3 HIS A 168 -1.105 9.111 -19.816 1.00 4.67 H new ATOM 0 HD1 HIS A 168 0.314 9.602 -22.431 1.00 5.14 H new ATOM 0 HD2 HIS A 168 0.905 6.142 -20.144 1.00 4.70 H new ATOM 0 HE1 HIS A 168 2.581 8.669 -23.111 1.00 5.45 H new ATOM 932 N GLY A 169 -3.081 7.154 -17.642 1.00 3.99 N ATOM 933 CA GLY A 169 -4.221 7.527 -16.825 1.00 4.43 C ATOM 934 C GLY A 169 -4.418 9.028 -16.755 1.00 4.87 C ATOM 935 O GLY A 169 -5.537 9.506 -16.570 1.00 5.66 O ATOM 0 H GLY A 169 -2.369 6.605 -17.160 1.00 3.99 H new ATOM 0 HA2 GLY A 169 -5.121 7.064 -17.230 1.00 4.43 H new ATOM 0 HA3 GLY A 169 -4.086 7.134 -15.817 1.00 4.43 H new ATOM 939 N ASP A 170 -3.328 9.774 -16.902 1.00 4.77 N ATOM 940 CA ASP A 170 -3.385 11.230 -16.853 1.00 5.53 C ATOM 941 C ASP A 170 -2.040 11.840 -17.232 1.00 5.57 C ATOM 942 O ASP A 170 -1.548 12.748 -16.563 1.00 6.22 O ATOM 943 CB ASP A 170 -3.797 11.699 -15.457 1.00 6.41 C ATOM 944 CG ASP A 170 -4.668 12.940 -15.496 1.00 7.50 C ATOM 945 OD1 ASP A 170 -5.898 12.795 -15.651 1.00 8.52 O ATOM 946 OD2 ASP A 170 -4.119 14.055 -15.374 1.00 7.91 O ATOM 0 H ASP A 170 -2.394 9.394 -17.056 1.00 4.77 H new ATOM 0 HA ASP A 170 -4.131 11.564 -17.575 1.00 5.53 H new ATOM 0 HB2 ASP A 170 -4.335 10.897 -14.952 1.00 6.41 H new ATOM 0 HB3 ASP A 170 -2.903 11.904 -14.868 1.00 6.41 H new ATOM 951 N ASP A 171 -1.449 11.334 -18.309 1.00 5.38 N ATOM 952 CA ASP A 171 -0.160 11.829 -18.778 1.00 5.59 C ATOM 953 C ASP A 171 0.916 11.633 -17.715 1.00 5.55 C ATOM 954 O ASP A 171 1.166 12.521 -16.898 1.00 6.41 O ATOM 955 CB ASP A 171 -0.262 13.308 -19.151 1.00 6.55 C ATOM 956 CG ASP A 171 -1.542 13.630 -19.898 1.00 7.54 C ATOM 957 OD1 ASP A 171 -1.583 13.410 -21.127 1.00 7.76 O ATOM 958 OD2 ASP A 171 -2.502 14.100 -19.254 1.00 8.62 O ATOM 0 H ASP A 171 -1.842 10.581 -18.874 1.00 5.38 H new ATOM 0 HA ASP A 171 0.120 11.258 -19.663 1.00 5.59 H new ATOM 0 HB2 ASP A 171 -0.211 13.912 -18.245 1.00 6.55 H new ATOM 0 HB3 ASP A 171 0.594 13.584 -19.767 1.00 6.55 H new ATOM 963 N HIS A 172 1.551 10.465 -17.730 1.00 5.21 N ATOM 964 CA HIS A 172 2.600 10.152 -16.766 1.00 5.36 C ATOM 965 C HIS A 172 3.646 9.228 -17.382 1.00 4.40 C ATOM 966 O HIS A 172 4.778 9.639 -17.638 1.00 4.76 O ATOM 967 CB HIS A 172 2.000 9.503 -15.519 1.00 6.59 C ATOM 968 CG HIS A 172 1.998 10.398 -14.319 1.00 7.86 C ATOM 969 ND1 HIS A 172 1.186 11.507 -14.209 1.00 8.75 N ATOM 970 CD2 HIS A 172 2.714 10.343 -13.172 1.00 8.81 C ATOM 971 CE1 HIS A 172 1.404 12.096 -13.046 1.00 10.03 C ATOM 972 NE2 HIS A 172 2.327 11.409 -12.398 1.00 10.10 N ATOM 0 H HIS A 172 1.357 9.720 -18.399 1.00 5.21 H new ATOM 0 HA HIS A 172 3.087 11.085 -16.482 1.00 5.36 H new ATOM 0 HB2 HIS A 172 0.976 9.197 -15.736 1.00 6.59 H new ATOM 0 HB3 HIS A 172 2.560 8.598 -15.286 1.00 6.59 H new ATOM 0 HD1 HIS A 172 0.521 11.823 -14.915 1.00 8.75 H new ATOM 0 HD2 HIS A 172 3.453 9.599 -12.913 1.00 8.81 H new ATOM 0 HE1 HIS A 172 0.911 12.987 -12.687 1.00 10.03 H new ATOM 980 N ALA A 173 3.259 7.978 -17.618 1.00 4.02 N ATOM 981 CA ALA A 173 4.163 6.997 -18.205 1.00 3.61 C ATOM 982 C ALA A 173 5.346 6.720 -17.284 1.00 3.44 C ATOM 983 O ALA A 173 6.423 6.334 -17.739 1.00 4.13 O ATOM 984 CB ALA A 173 4.650 7.475 -19.564 1.00 4.18 C ATOM 0 H ALA A 173 2.326 7.622 -17.412 1.00 4.02 H new ATOM 0 HA ALA A 173 3.613 6.065 -18.336 1.00 3.61 H new ATOM 0 HB1 ALA A 173 5.324 6.732 -19.991 1.00 4.18 H new ATOM 0 HB2 ALA A 173 3.797 7.614 -20.228 1.00 4.18 H new ATOM 0 HB3 ALA A 173 5.178 8.421 -19.449 1.00 4.18 H new ATOM 990 N PHE A 174 5.140 6.920 -15.986 1.00 3.29 N ATOM 991 CA PHE A 174 6.190 6.693 -15.001 1.00 3.77 C ATOM 992 C PHE A 174 6.343 5.205 -14.701 1.00 3.39 C ATOM 993 O PHE A 174 7.425 4.637 -14.855 1.00 4.00 O ATOM 994 CB PHE A 174 5.882 7.456 -13.711 1.00 4.71 C ATOM 995 CG PHE A 174 6.582 8.782 -13.617 1.00 5.69 C ATOM 996 CD1 PHE A 174 6.169 9.855 -14.390 1.00 6.18 C ATOM 997 CD2 PHE A 174 7.653 8.956 -12.754 1.00 6.81 C ATOM 998 CE1 PHE A 174 6.812 11.075 -14.306 1.00 7.44 C ATOM 999 CE2 PHE A 174 8.299 10.174 -12.666 1.00 8.03 C ATOM 1000 CZ PHE A 174 7.877 11.236 -13.442 1.00 8.23 C ATOM 0 H PHE A 174 4.255 7.239 -15.592 1.00 3.29 H new ATOM 0 HA PHE A 174 7.129 7.060 -15.417 1.00 3.77 H new ATOM 0 HB2 PHE A 174 4.806 7.616 -13.641 1.00 4.71 H new ATOM 0 HB3 PHE A 174 6.169 6.842 -12.858 1.00 4.71 H new ATOM 0 HD1 PHE A 174 5.335 9.736 -15.066 1.00 6.18 H new ATOM 0 HD2 PHE A 174 7.986 8.130 -12.143 1.00 6.81 H new ATOM 0 HE1 PHE A 174 6.482 11.903 -14.916 1.00 7.44 H new ATOM 0 HE2 PHE A 174 9.133 10.296 -11.991 1.00 8.03 H new ATOM 0 HZ PHE A 174 8.379 12.190 -13.373 1.00 8.23 H new ATOM 1084 N LEU A 181 8.412 0.538 -8.550 1.00 3.75 N ATOM 1085 CA LEU A 181 7.032 0.562 -8.079 1.00 3.73 C ATOM 1086 C LEU A 181 6.896 1.432 -6.834 1.00 3.53 C ATOM 1087 O LEU A 181 5.843 2.019 -6.587 1.00 3.70 O ATOM 1088 CB LEU A 181 6.551 -0.859 -7.776 1.00 4.06 C ATOM 1089 CG LEU A 181 7.316 -1.608 -6.685 1.00 4.04 C ATOM 1090 CD1 LEU A 181 6.497 -1.670 -5.405 1.00 4.93 C ATOM 1091 CD2 LEU A 181 7.681 -3.009 -7.155 1.00 4.31 C ATOM 0 HA LEU A 181 6.413 0.989 -8.868 1.00 3.73 H new ATOM 0 HB2 LEU A 181 5.501 -0.812 -7.488 1.00 4.06 H new ATOM 0 HB3 LEU A 181 6.604 -1.443 -8.695 1.00 4.06 H new ATOM 0 HG LEU A 181 8.238 -1.065 -6.476 1.00 4.04 H new ATOM 0 HD11 LEU A 181 7.058 -2.207 -4.640 1.00 4.93 H new ATOM 0 HD12 LEU A 181 6.287 -0.658 -5.058 1.00 4.93 H new ATOM 0 HD13 LEU A 181 5.558 -2.189 -5.598 1.00 4.93 H new ATOM 0 HD21 LEU A 181 8.225 -3.527 -6.366 1.00 4.31 H new ATOM 0 HD22 LEU A 181 6.772 -3.562 -7.392 1.00 4.31 H new ATOM 0 HD23 LEU A 181 8.308 -2.943 -8.044 1.00 4.31 H new ATOM 1103 N ALA A 182 7.970 1.514 -6.055 1.00 3.65 N ATOM 1104 CA ALA A 182 7.972 2.316 -4.839 1.00 3.79 C ATOM 1105 C ALA A 182 8.865 3.543 -4.992 1.00 4.47 C ATOM 1106 O ALA A 182 10.044 3.427 -5.325 1.00 5.01 O ATOM 1107 CB ALA A 182 8.424 1.477 -3.653 1.00 3.82 C ATOM 0 H ALA A 182 8.850 1.034 -6.245 1.00 3.65 H new ATOM 0 HA ALA A 182 6.953 2.660 -4.659 1.00 3.79 H new ATOM 0 HB1 ALA A 182 8.420 2.090 -2.751 1.00 3.82 H new ATOM 0 HB2 ALA A 182 7.744 0.635 -3.522 1.00 3.82 H new ATOM 0 HB3 ALA A 182 9.432 1.104 -3.834 1.00 3.82 H new ATOM 1113 N HIS A 183 8.295 4.719 -4.747 1.00 4.66 N ATOM 1114 CA HIS A 183 9.040 5.968 -4.858 1.00 5.42 C ATOM 1115 C HIS A 183 9.444 6.483 -3.480 1.00 5.82 C ATOM 1116 O HIS A 183 9.141 5.863 -2.461 1.00 6.09 O ATOM 1117 CB HIS A 183 8.204 7.022 -5.585 1.00 5.89 C ATOM 1118 CG HIS A 183 8.778 7.434 -6.906 1.00 6.69 C ATOM 1119 ND1 HIS A 183 9.837 8.309 -7.027 1.00 7.84 N ATOM 1120 CD2 HIS A 183 8.435 7.084 -8.168 1.00 7.04 C ATOM 1121 CE1 HIS A 183 10.119 8.481 -8.306 1.00 8.54 C ATOM 1122 NE2 HIS A 183 9.283 7.748 -9.019 1.00 8.13 N ATOM 0 H HIS A 183 7.320 4.833 -4.470 1.00 4.66 H new ATOM 0 HA HIS A 183 9.945 5.773 -5.433 1.00 5.42 H new ATOM 0 HB2 HIS A 183 7.198 6.632 -5.741 1.00 5.89 H new ATOM 0 HB3 HIS A 183 8.110 7.902 -4.949 1.00 5.89 H new ATOM 0 HD2 HIS A 183 7.642 6.408 -8.452 1.00 7.04 H new ATOM 0 HE1 HIS A 183 10.900 9.113 -8.701 1.00 8.54 H new ATOM 0 HE2 HIS A 183 9.270 7.685 -10.037 1.00 8.13 H new ATOM 1130 N ALA A 184 10.130 7.621 -3.457 1.00 6.18 N ATOM 1131 CA ALA A 184 10.575 8.221 -2.205 1.00 6.71 C ATOM 1132 C ALA A 184 9.944 9.594 -2.000 1.00 6.32 C ATOM 1133 O ALA A 184 10.386 10.585 -2.581 1.00 6.62 O ATOM 1134 CB ALA A 184 12.092 8.326 -2.180 1.00 7.92 C ATOM 0 H ALA A 184 10.390 8.146 -4.292 1.00 6.18 H new ATOM 0 HA ALA A 184 10.253 7.576 -1.387 1.00 6.71 H new ATOM 0 HB1 ALA A 184 12.410 8.776 -1.239 1.00 7.92 H new ATOM 0 HB2 ALA A 184 12.527 7.331 -2.272 1.00 7.92 H new ATOM 0 HB3 ALA A 184 12.427 8.947 -3.011 1.00 7.92 H new ATOM 1140 N PHE A 185 8.908 9.645 -1.169 1.00 6.03 N ATOM 1141 CA PHE A 185 8.215 10.897 -0.888 1.00 5.81 C ATOM 1142 C PHE A 185 7.808 10.976 0.580 1.00 5.37 C ATOM 1143 O PHE A 185 8.295 11.824 1.326 1.00 6.04 O ATOM 1144 CB PHE A 185 6.979 11.032 -1.780 1.00 6.04 C ATOM 1145 CG PHE A 185 7.304 11.347 -3.212 1.00 6.72 C ATOM 1146 CD1 PHE A 185 8.085 12.446 -3.533 1.00 7.33 C ATOM 1147 CD2 PHE A 185 6.830 10.544 -4.237 1.00 7.28 C ATOM 1148 CE1 PHE A 185 8.385 12.738 -4.850 1.00 8.14 C ATOM 1149 CE2 PHE A 185 7.127 10.831 -5.556 1.00 8.20 C ATOM 1150 CZ PHE A 185 7.906 11.929 -5.863 1.00 8.49 C ATOM 0 H PHE A 185 8.530 8.834 -0.679 1.00 6.03 H new ATOM 0 HA PHE A 185 8.900 11.718 -1.101 1.00 5.81 H new ATOM 0 HB2 PHE A 185 6.410 10.103 -1.741 1.00 6.04 H new ATOM 0 HB3 PHE A 185 6.337 11.817 -1.381 1.00 6.04 H new ATOM 0 HD1 PHE A 185 8.463 13.081 -2.745 1.00 7.33 H new ATOM 0 HD2 PHE A 185 6.221 9.683 -4.002 1.00 7.28 H new ATOM 0 HE1 PHE A 185 8.994 13.598 -5.088 1.00 8.14 H new ATOM 0 HE2 PHE A 185 6.750 10.197 -6.345 1.00 8.20 H new ATOM 0 HZ PHE A 185 8.141 12.155 -6.893 1.00 8.49 H new ATOM 1160 N GLY A 186 6.910 10.084 0.988 1.00 4.81 N ATOM 1161 CA GLY A 186 6.451 10.070 2.365 1.00 4.37 C ATOM 1162 C GLY A 186 5.224 10.935 2.576 1.00 4.10 C ATOM 1163 O GLY A 186 4.857 11.747 1.727 1.00 4.47 O ATOM 0 H GLY A 186 6.492 9.371 0.390 1.00 4.81 H new ATOM 0 HA2 GLY A 186 6.224 9.045 2.659 1.00 4.37 H new ATOM 0 HA3 GLY A 186 7.253 10.418 3.016 1.00 4.37 H new ATOM 1167 N PRO A 187 4.568 10.765 3.733 1.00 3.73 N ATOM 1168 CA PRO A 187 3.365 11.527 4.080 1.00 3.88 C ATOM 1169 C PRO A 187 3.669 12.996 4.357 1.00 4.37 C ATOM 1170 O PRO A 187 3.741 13.419 5.509 1.00 4.66 O ATOM 1171 CB PRO A 187 2.862 10.837 5.351 1.00 3.69 C ATOM 1172 CG PRO A 187 4.075 10.214 5.949 1.00 3.52 C ATOM 1173 CD PRO A 187 4.949 9.815 4.792 1.00 3.53 C ATOM 0 HA PRO A 187 2.639 11.535 3.267 1.00 3.88 H new ATOM 0 HB2 PRO A 187 2.406 11.552 6.036 1.00 3.69 H new ATOM 0 HB3 PRO A 187 2.104 10.088 5.121 1.00 3.69 H new ATOM 0 HG2 PRO A 187 4.591 10.916 6.604 1.00 3.52 H new ATOM 0 HG3 PRO A 187 3.810 9.348 6.555 1.00 3.52 H new ATOM 0 HD2 PRO A 187 6.007 9.895 5.042 1.00 3.53 H new ATOM 0 HD3 PRO A 187 4.769 8.783 4.490 1.00 3.53 H new ATOM 1251 N ALA A 195 -0.664 5.159 -3.244 1.00 1.18 N ATOM 1252 CA ALA A 195 -0.048 3.869 -3.531 1.00 1.70 C ATOM 1253 C ALA A 195 -0.632 3.250 -4.796 1.00 1.38 C ATOM 1254 O ALA A 195 -1.817 2.916 -4.845 1.00 2.00 O ATOM 1255 CB ALA A 195 -0.224 2.926 -2.349 1.00 2.99 C ATOM 0 HA ALA A 195 1.017 4.032 -3.697 1.00 1.70 H new ATOM 0 HB1 ALA A 195 0.241 1.967 -2.577 1.00 2.99 H new ATOM 0 HB2 ALA A 195 0.248 3.357 -1.466 1.00 2.99 H new ATOM 0 HB3 ALA A 195 -1.287 2.778 -2.157 1.00 2.99 H new ATOM 1261 N HIS A 196 0.205 3.101 -5.817 1.00 1.04 N ATOM 1262 CA HIS A 196 -0.230 2.522 -7.084 1.00 0.89 C ATOM 1263 C HIS A 196 0.308 1.104 -7.246 1.00 0.89 C ATOM 1264 O HIS A 196 1.515 0.897 -7.372 1.00 1.25 O ATOM 1265 CB HIS A 196 0.233 3.392 -8.252 1.00 0.99 C ATOM 1266 CG HIS A 196 1.680 3.771 -8.180 1.00 1.49 C ATOM 1267 ND1 HIS A 196 2.133 4.891 -7.516 1.00 3.03 N ATOM 1268 CD2 HIS A 196 2.779 3.169 -8.693 1.00 1.99 C ATOM 1269 CE1 HIS A 196 3.448 4.963 -7.624 1.00 3.67 C ATOM 1270 NE2 HIS A 196 3.865 3.930 -8.334 1.00 2.93 N ATOM 0 H HIS A 196 1.188 3.373 -5.793 1.00 1.04 H new ATOM 0 HA HIS A 196 -1.319 2.480 -7.081 1.00 0.89 H new ATOM 0 HB2 HIS A 196 0.052 2.859 -9.185 1.00 0.99 H new ATOM 0 HB3 HIS A 196 -0.371 4.299 -8.280 1.00 0.99 H new ATOM 0 HD2 HIS A 196 2.798 2.260 -9.276 1.00 1.99 H new ATOM 0 HE1 HIS A 196 4.075 5.735 -7.203 1.00 3.67 H new ATOM 0 HE2 HIS A 196 4.835 3.730 -8.576 1.00 2.93 H new ATOM 1278 N PHE A 197 -0.596 0.129 -7.240 1.00 1.33 N ATOM 1279 CA PHE A 197 -0.212 -1.270 -7.385 1.00 1.41 C ATOM 1280 C PHE A 197 -0.995 -1.935 -8.513 1.00 2.38 C ATOM 1281 O PHE A 197 -2.118 -2.399 -8.314 1.00 3.53 O ATOM 1282 CB PHE A 197 -0.446 -2.023 -6.073 1.00 2.19 C ATOM 1283 CG PHE A 197 -1.688 -1.591 -5.347 1.00 2.30 C ATOM 1284 CD1 PHE A 197 -1.656 -0.517 -4.472 1.00 3.22 C ATOM 1285 CD2 PHE A 197 -2.887 -2.258 -5.540 1.00 3.05 C ATOM 1286 CE1 PHE A 197 -2.797 -0.118 -3.802 1.00 3.93 C ATOM 1287 CE2 PHE A 197 -4.031 -1.863 -4.873 1.00 4.03 C ATOM 1288 CZ PHE A 197 -3.987 -0.791 -4.004 1.00 4.16 C ATOM 0 H PHE A 197 -1.599 0.283 -7.136 1.00 1.33 H new ATOM 0 HA PHE A 197 0.849 -1.306 -7.633 1.00 1.41 H new ATOM 0 HB2 PHE A 197 -0.510 -3.091 -6.283 1.00 2.19 H new ATOM 0 HB3 PHE A 197 0.415 -1.877 -5.421 1.00 2.19 H new ATOM 0 HD1 PHE A 197 -0.729 0.014 -4.312 1.00 3.22 H new ATOM 0 HD2 PHE A 197 -2.928 -3.096 -6.220 1.00 3.05 H new ATOM 0 HE1 PHE A 197 -2.759 0.719 -3.121 1.00 3.93 H new ATOM 0 HE2 PHE A 197 -4.959 -2.392 -5.031 1.00 4.03 H new ATOM 0 HZ PHE A 197 -4.880 -0.479 -3.483 1.00 4.16 H new ATOM 1298 N ASP A 198 -0.394 -1.977 -9.697 1.00 2.74 N ATOM 1299 CA ASP A 198 -1.034 -2.586 -10.858 1.00 3.93 C ATOM 1300 C ASP A 198 -0.080 -2.621 -12.048 1.00 3.28 C ATOM 1301 O ASP A 198 -0.505 -2.522 -13.198 1.00 3.83 O ATOM 1302 CB ASP A 198 -2.303 -1.817 -11.228 1.00 5.74 C ATOM 1303 CG ASP A 198 -3.301 -2.676 -11.981 1.00 7.35 C ATOM 1304 OD1 ASP A 198 -2.864 -3.539 -12.771 1.00 7.90 O ATOM 1305 OD2 ASP A 198 -4.518 -2.485 -11.780 1.00 8.55 O ATOM 0 H ASP A 198 0.535 -1.597 -9.878 1.00 2.74 H new ATOM 0 HA ASP A 198 -1.301 -3.611 -10.600 1.00 3.93 H new ATOM 0 HB2 ASP A 198 -2.770 -1.433 -10.321 1.00 5.74 H new ATOM 0 HB3 ASP A 198 -2.037 -0.954 -11.839 1.00 5.74 H new ATOM 1310 N GLU A 199 1.211 -2.762 -11.761 1.00 3.34 N ATOM 1311 CA GLU A 199 2.224 -2.808 -12.808 1.00 3.67 C ATOM 1312 C GLU A 199 3.212 -3.944 -12.560 1.00 3.83 C ATOM 1313 O GLU A 199 3.245 -4.926 -13.302 1.00 4.36 O ATOM 1314 CB GLU A 199 2.972 -1.475 -12.884 1.00 4.61 C ATOM 1315 CG GLU A 199 2.060 -0.261 -12.822 1.00 5.82 C ATOM 1316 CD GLU A 199 2.155 0.473 -11.499 1.00 7.16 C ATOM 1317 OE1 GLU A 199 2.501 -0.172 -10.487 1.00 7.60 O ATOM 1318 OE2 GLU A 199 1.883 1.691 -11.475 1.00 8.33 O ATOM 0 H GLU A 199 1.579 -2.846 -10.813 1.00 3.34 H new ATOM 0 HA GLU A 199 1.720 -2.989 -13.757 1.00 3.67 H new ATOM 0 HB2 GLU A 199 3.689 -1.423 -12.064 1.00 4.61 H new ATOM 0 HB3 GLU A 199 3.545 -1.442 -13.811 1.00 4.61 H new ATOM 0 HG2 GLU A 199 2.316 0.423 -13.632 1.00 5.82 H new ATOM 0 HG3 GLU A 199 1.030 -0.577 -12.985 1.00 5.82 H new ATOM 1325 N ASP A 200 4.016 -3.802 -11.512 1.00 4.62 N ATOM 1326 CA ASP A 200 5.005 -4.816 -11.164 1.00 5.88 C ATOM 1327 C ASP A 200 4.694 -5.435 -9.804 1.00 6.13 C ATOM 1328 O ASP A 200 4.382 -4.727 -8.847 1.00 6.81 O ATOM 1329 CB ASP A 200 6.408 -4.208 -11.153 1.00 7.27 C ATOM 1330 CG ASP A 200 7.496 -5.263 -11.124 1.00 8.16 C ATOM 1331 OD1 ASP A 200 7.322 -6.312 -11.778 1.00 8.14 O ATOM 1332 OD2 ASP A 200 8.522 -5.040 -10.448 1.00 9.24 O ATOM 0 H ASP A 200 4.002 -2.995 -10.889 1.00 4.62 H new ATOM 0 HA ASP A 200 4.964 -5.602 -11.918 1.00 5.88 H new ATOM 0 HB2 ASP A 200 6.536 -3.582 -12.036 1.00 7.27 H new ATOM 0 HB3 ASP A 200 6.513 -3.558 -10.284 1.00 7.27 H new ATOM 1337 N GLU A 201 4.781 -6.759 -9.729 1.00 6.08 N ATOM 1338 CA GLU A 201 4.507 -7.472 -8.486 1.00 6.48 C ATOM 1339 C GLU A 201 3.050 -7.295 -8.067 1.00 5.96 C ATOM 1340 O GLU A 201 2.762 -6.868 -6.949 1.00 6.87 O ATOM 1341 CB GLU A 201 5.433 -6.977 -7.373 1.00 7.85 C ATOM 1342 CG GLU A 201 5.737 -8.030 -6.321 1.00 8.81 C ATOM 1343 CD GLU A 201 6.247 -7.430 -5.026 1.00 10.18 C ATOM 1344 OE1 GLU A 201 7.355 -6.853 -5.034 1.00 10.93 O ATOM 1345 OE2 GLU A 201 5.538 -7.536 -4.003 1.00 10.86 O ATOM 0 H GLU A 201 5.039 -7.359 -10.512 1.00 6.08 H new ATOM 0 HA GLU A 201 4.692 -8.533 -8.657 1.00 6.48 H new ATOM 0 HB2 GLU A 201 6.369 -6.637 -7.815 1.00 7.85 H new ATOM 0 HB3 GLU A 201 4.976 -6.113 -6.889 1.00 7.85 H new ATOM 0 HG2 GLU A 201 4.835 -8.607 -6.119 1.00 8.81 H new ATOM 0 HG3 GLU A 201 6.480 -8.725 -6.712 1.00 8.81 H new ATOM 1352 N PHE A 202 2.136 -7.625 -8.973 1.00 5.00 N ATOM 1353 CA PHE A 202 0.709 -7.501 -8.699 1.00 4.86 C ATOM 1354 C PHE A 202 -0.117 -8.052 -9.858 1.00 3.45 C ATOM 1355 O PHE A 202 0.073 -7.661 -11.010 1.00 4.01 O ATOM 1356 CB PHE A 202 0.341 -6.038 -8.447 1.00 5.89 C ATOM 1357 CG PHE A 202 -1.108 -5.833 -8.112 1.00 7.07 C ATOM 1358 CD1 PHE A 202 -2.038 -5.601 -9.113 1.00 7.27 C ATOM 1359 CD2 PHE A 202 -1.542 -5.871 -6.797 1.00 8.53 C ATOM 1360 CE1 PHE A 202 -3.373 -5.413 -8.809 1.00 8.82 C ATOM 1361 CE2 PHE A 202 -2.875 -5.683 -6.486 1.00 9.94 C ATOM 1362 CZ PHE A 202 -3.792 -5.453 -7.494 1.00 10.06 C ATOM 0 H PHE A 202 2.358 -7.980 -9.903 1.00 5.00 H new ATOM 0 HA PHE A 202 0.484 -8.084 -7.806 1.00 4.86 H new ATOM 0 HB2 PHE A 202 0.952 -5.654 -7.630 1.00 5.89 H new ATOM 0 HB3 PHE A 202 0.587 -5.452 -9.333 1.00 5.89 H new ATOM 0 HD1 PHE A 202 -1.716 -5.567 -10.143 1.00 7.27 H new ATOM 0 HD2 PHE A 202 -0.830 -6.050 -6.005 1.00 8.53 H new ATOM 0 HE1 PHE A 202 -4.088 -5.235 -9.599 1.00 8.82 H new ATOM 0 HE2 PHE A 202 -3.200 -5.716 -5.457 1.00 9.94 H new ATOM 0 HZ PHE A 202 -4.834 -5.305 -7.254 1.00 10.06 H new ATOM 1372 N TRP A 203 -1.033 -8.960 -9.544 1.00 2.95 N ATOM 1373 CA TRP A 203 -1.888 -9.565 -10.559 1.00 2.86 C ATOM 1374 C TRP A 203 -2.843 -10.576 -9.934 1.00 2.35 C ATOM 1375 O TRP A 203 -4.054 -10.355 -9.886 1.00 2.55 O ATOM 1376 CB TRP A 203 -1.037 -10.245 -11.633 1.00 4.93 C ATOM 1377 CG TRP A 203 -1.319 -9.747 -13.018 1.00 5.57 C ATOM 1378 CD1 TRP A 203 -1.494 -8.448 -13.402 1.00 5.99 C ATOM 1379 CD2 TRP A 203 -1.462 -10.540 -14.202 1.00 6.55 C ATOM 1380 NE1 TRP A 203 -1.736 -8.385 -14.753 1.00 6.92 N ATOM 1381 CE2 TRP A 203 -1.720 -9.655 -15.267 1.00 7.20 C ATOM 1382 CE3 TRP A 203 -1.393 -11.910 -14.466 1.00 7.45 C ATOM 1383 CZ2 TRP A 203 -1.911 -10.099 -16.573 1.00 8.38 C ATOM 1384 CZ3 TRP A 203 -1.584 -12.349 -15.763 1.00 8.73 C ATOM 1385 CH2 TRP A 203 -1.839 -11.446 -16.803 1.00 9.06 C ATOM 0 H TRP A 203 -1.203 -9.294 -8.595 1.00 2.95 H new ATOM 0 HA TRP A 203 -2.478 -8.773 -11.020 1.00 2.86 H new ATOM 0 HB2 TRP A 203 0.017 -10.087 -11.405 1.00 4.93 H new ATOM 0 HB3 TRP A 203 -1.212 -11.320 -11.599 1.00 4.93 H new ATOM 0 HD1 TRP A 203 -1.449 -7.595 -12.741 1.00 5.99 H new ATOM 0 HE1 TRP A 203 -1.901 -7.531 -15.287 1.00 6.92 H new ATOM 0 HE3 TRP A 203 -1.194 -12.614 -13.671 1.00 7.45 H new ATOM 0 HZ2 TRP A 203 -2.109 -9.405 -17.376 1.00 8.38 H new ATOM 0 HZ3 TRP A 203 -1.536 -13.406 -15.978 1.00 8.73 H new ATOM 0 HH2 TRP A 203 -1.982 -11.820 -17.806 1.00 9.06 H new ATOM 1396 N THR A 204 -2.292 -11.688 -9.456 1.00 2.68 N ATOM 1397 CA THR A 204 -3.095 -12.733 -8.835 1.00 2.55 C ATOM 1398 C THR A 204 -3.080 -12.609 -7.316 1.00 2.00 C ATOM 1399 O THR A 204 -2.555 -11.640 -6.766 1.00 2.57 O ATOM 1400 CB THR A 204 -2.595 -14.135 -9.229 1.00 3.92 C ATOM 1401 OG1 THR A 204 -1.555 -14.027 -10.208 1.00 4.87 O ATOM 1402 CG2 THR A 204 -3.732 -14.981 -9.782 1.00 4.35 C ATOM 0 H THR A 204 -1.292 -11.887 -9.488 1.00 2.68 H new ATOM 0 HA THR A 204 -4.115 -12.604 -9.197 1.00 2.55 H new ATOM 0 HB THR A 204 -2.204 -14.621 -8.335 1.00 3.92 H new ATOM 0 HG1 THR A 204 -1.241 -14.923 -10.452 1.00 4.87 H new ATOM 0 HG21 THR A 204 -3.354 -15.967 -10.053 1.00 4.35 H new ATOM 0 HG22 THR A 204 -4.509 -15.086 -9.025 1.00 4.35 H new ATOM 0 HG23 THR A 204 -4.149 -14.497 -10.665 1.00 4.35 H new ATOM 1410 N THR A 205 -3.658 -13.597 -6.640 1.00 2.03 N ATOM 1411 CA THR A 205 -3.711 -13.598 -5.183 1.00 2.30 C ATOM 1412 C THR A 205 -2.448 -14.211 -4.588 1.00 1.97 C ATOM 1413 O THR A 205 -1.483 -14.484 -5.301 1.00 2.24 O ATOM 1414 CB THR A 205 -4.937 -14.373 -4.666 1.00 3.49 C ATOM 1415 OG1 THR A 205 -4.736 -15.780 -4.840 1.00 3.71 O ATOM 1416 CG2 THR A 205 -6.198 -13.941 -5.399 1.00 4.54 C ATOM 0 H THR A 205 -4.096 -14.407 -7.078 1.00 2.03 H new ATOM 0 HA THR A 205 -3.790 -12.557 -4.869 1.00 2.30 H new ATOM 0 HB THR A 205 -5.059 -14.152 -3.605 1.00 3.49 H new ATOM 0 HG1 THR A 205 -5.519 -16.266 -4.507 1.00 3.71 H new ATOM 0 HG21 THR A 205 -7.051 -14.502 -5.017 1.00 4.54 H new ATOM 0 HG22 THR A 205 -6.364 -12.875 -5.241 1.00 4.54 H new ATOM 0 HG23 THR A 205 -6.084 -14.136 -6.465 1.00 4.54 H new ATOM 1424 N HIS A 206 -2.462 -14.425 -3.276 1.00 2.34 N ATOM 1425 CA HIS A 206 -1.317 -15.008 -2.585 1.00 2.46 C ATOM 1426 C HIS A 206 -0.921 -16.338 -3.216 1.00 2.19 C ATOM 1427 O HIS A 206 0.253 -16.576 -3.502 1.00 2.83 O ATOM 1428 CB HIS A 206 -1.638 -15.209 -1.103 1.00 3.21 C ATOM 1429 CG HIS A 206 -0.586 -15.975 -0.361 1.00 4.04 C ATOM 1430 ND1 HIS A 206 0.329 -15.377 0.479 1.00 5.25 N ATOM 1431 CD2 HIS A 206 -0.309 -17.300 -0.336 1.00 4.73 C ATOM 1432 CE1 HIS A 206 1.125 -16.300 0.988 1.00 6.22 C ATOM 1433 NE2 HIS A 206 0.759 -17.476 0.509 1.00 5.95 N ATOM 0 H HIS A 206 -3.253 -14.204 -2.671 1.00 2.34 H new ATOM 0 HA HIS A 206 -0.478 -14.318 -2.678 1.00 2.46 H new ATOM 0 HB2 HIS A 206 -1.766 -14.234 -0.632 1.00 3.21 H new ATOM 0 HB3 HIS A 206 -2.589 -15.734 -1.014 1.00 3.21 H new ATOM 0 HD2 HIS A 206 -0.831 -18.074 -0.879 1.00 4.73 H new ATOM 0 HE1 HIS A 206 1.937 -16.124 1.678 1.00 6.22 H new ATOM 0 HE2 HIS A 206 1.198 -18.369 0.731 1.00 5.95 H new ATOM 1441 N SER A 207 -1.907 -17.204 -3.431 1.00 2.45 N ATOM 1442 CA SER A 207 -1.660 -18.512 -4.024 1.00 3.36 C ATOM 1443 C SER A 207 -1.012 -18.372 -5.399 1.00 3.97 C ATOM 1444 O SER A 207 -0.218 -19.216 -5.812 1.00 4.95 O ATOM 1445 CB SER A 207 -2.968 -19.297 -4.142 1.00 4.16 C ATOM 1446 OG SER A 207 -3.016 -20.029 -5.355 1.00 4.87 O ATOM 0 H SER A 207 -2.884 -17.022 -3.203 1.00 2.45 H new ATOM 0 HA SER A 207 -0.976 -19.055 -3.373 1.00 3.36 H new ATOM 0 HB2 SER A 207 -3.064 -19.980 -3.298 1.00 4.16 H new ATOM 0 HB3 SER A 207 -3.813 -18.611 -4.094 1.00 4.16 H new ATOM 0 HG SER A 207 -3.861 -20.523 -5.406 1.00 4.87 H new ATOM 1452 N GLY A 208 -1.358 -17.298 -6.102 1.00 3.68 N ATOM 1453 CA GLY A 208 -0.803 -17.066 -7.423 1.00 4.40 C ATOM 1454 C GLY A 208 0.545 -16.373 -7.371 1.00 4.48 C ATOM 1455 O GLY A 208 1.580 -16.997 -7.598 1.00 5.49 O ATOM 0 H GLY A 208 -2.012 -16.585 -5.781 1.00 3.68 H new ATOM 0 HA2 GLY A 208 -0.699 -18.019 -7.943 1.00 4.40 H new ATOM 0 HA3 GLY A 208 -1.498 -16.460 -8.005 1.00 4.40 H new ATOM 1459 N GLY A 209 0.532 -15.077 -7.072 1.00 4.22 N ATOM 1460 CA GLY A 209 1.768 -14.321 -6.999 1.00 4.70 C ATOM 1461 C GLY A 209 1.744 -13.278 -5.899 1.00 4.25 C ATOM 1462 O GLY A 209 2.021 -13.582 -4.738 1.00 4.65 O ATOM 0 H GLY A 209 -0.312 -14.538 -6.879 1.00 4.22 H new ATOM 0 HA2 GLY A 209 2.599 -15.005 -6.829 1.00 4.70 H new ATOM 0 HA3 GLY A 209 1.948 -13.832 -7.956 1.00 4.70 H new ATOM 1466 N THR A 210 1.415 -12.042 -6.263 1.00 3.80 N ATOM 1467 CA THR A 210 1.360 -10.950 -5.300 1.00 3.60 C ATOM 1468 C THR A 210 -0.082 -10.569 -4.984 1.00 2.48 C ATOM 1469 O THR A 210 -0.748 -9.910 -5.780 1.00 2.13 O ATOM 1470 CB THR A 210 2.107 -9.706 -5.817 1.00 4.25 C ATOM 1471 OG1 THR A 210 3.202 -10.104 -6.650 1.00 5.39 O ATOM 1472 CG2 THR A 210 2.623 -8.865 -4.659 1.00 5.11 C ATOM 0 H THR A 210 1.183 -11.773 -7.219 1.00 3.80 H new ATOM 0 HA THR A 210 1.847 -11.304 -4.392 1.00 3.60 H new ATOM 0 HB THR A 210 1.408 -9.105 -6.399 1.00 4.25 H new ATOM 0 HG1 THR A 210 2.945 -10.018 -7.592 1.00 5.39 H new ATOM 0 HG21 THR A 210 3.147 -7.992 -5.048 1.00 5.11 H new ATOM 0 HG22 THR A 210 1.784 -8.540 -4.043 1.00 5.11 H new ATOM 0 HG23 THR A 210 3.308 -9.460 -4.054 1.00 5.11 H new ATOM 1480 N ASN A 211 -0.557 -10.987 -3.815 1.00 3.15 N ATOM 1481 CA ASN A 211 -1.921 -10.688 -3.393 1.00 3.30 C ATOM 1482 C ASN A 211 -2.088 -9.198 -3.110 1.00 2.39 C ATOM 1483 O ASN A 211 -1.122 -8.502 -2.797 1.00 3.03 O ATOM 1484 CB ASN A 211 -2.281 -11.499 -2.147 1.00 4.92 C ATOM 1485 CG ASN A 211 -3.748 -11.881 -2.110 1.00 6.94 C ATOM 1486 OD1 ASN A 211 -4.544 -11.410 -2.922 1.00 7.88 O ATOM 1487 ND2 ASN A 211 -4.112 -12.739 -1.164 1.00 8.10 N ATOM 0 H ASN A 211 -0.018 -11.534 -3.143 1.00 3.15 H new ATOM 0 HA ASN A 211 -2.595 -10.964 -4.204 1.00 3.30 H new ATOM 0 HB2 ASN A 211 -1.672 -12.403 -2.117 1.00 4.92 H new ATOM 0 HB3 ASN A 211 -2.037 -10.920 -1.257 1.00 4.92 H new ATOM 0 HD21 ASN A 211 -5.086 -13.033 -1.089 1.00 8.10 H new ATOM 0 HD22 ASN A 211 -3.418 -13.104 -0.512 1.00 8.10 H new ATOM 1494 N LEU A 212 -3.321 -8.715 -3.223 1.00 2.44 N ATOM 1495 CA LEU A 212 -3.617 -7.308 -2.978 1.00 2.73 C ATOM 1496 C LEU A 212 -3.112 -6.876 -1.605 1.00 2.12 C ATOM 1497 O LEU A 212 -2.607 -5.766 -1.439 1.00 2.27 O ATOM 1498 CB LEU A 212 -5.122 -7.057 -3.084 1.00 4.43 C ATOM 1499 CG LEU A 212 -5.654 -6.745 -4.483 1.00 5.59 C ATOM 1500 CD1 LEU A 212 -5.396 -7.911 -5.424 1.00 5.57 C ATOM 1501 CD2 LEU A 212 -7.140 -6.420 -4.428 1.00 7.07 C ATOM 0 H LEU A 212 -4.131 -9.277 -3.483 1.00 2.44 H new ATOM 0 HA LEU A 212 -3.103 -6.717 -3.736 1.00 2.73 H new ATOM 0 HB2 LEU A 212 -5.644 -7.936 -2.706 1.00 4.43 H new ATOM 0 HB3 LEU A 212 -5.379 -6.227 -2.426 1.00 4.43 H new ATOM 0 HG LEU A 212 -5.125 -5.872 -4.866 1.00 5.59 H new ATOM 0 HD11 LEU A 212 -5.781 -7.671 -6.415 1.00 5.57 H new ATOM 0 HD12 LEU A 212 -4.324 -8.097 -5.487 1.00 5.57 H new ATOM 0 HD13 LEU A 212 -5.898 -8.802 -5.046 1.00 5.57 H new ATOM 0 HD21 LEU A 212 -7.502 -6.200 -5.432 1.00 7.07 H new ATOM 0 HD22 LEU A 212 -7.684 -7.274 -4.025 1.00 7.07 H new ATOM 0 HD23 LEU A 212 -7.299 -5.553 -3.787 1.00 7.07 H new ATOM 1513 N PHE A 213 -3.251 -7.762 -0.624 1.00 1.74 N ATOM 1514 CA PHE A 213 -2.809 -7.473 0.735 1.00 1.72 C ATOM 1515 C PHE A 213 -1.288 -7.546 0.839 1.00 1.54 C ATOM 1516 O PHE A 213 -0.688 -6.970 1.748 1.00 1.77 O ATOM 1517 CB PHE A 213 -3.446 -8.454 1.721 1.00 2.13 C ATOM 1518 CG PHE A 213 -2.881 -8.360 3.109 1.00 3.42 C ATOM 1519 CD1 PHE A 213 -2.821 -7.142 3.767 1.00 4.86 C ATOM 1520 CD2 PHE A 213 -2.410 -9.491 3.757 1.00 4.27 C ATOM 1521 CE1 PHE A 213 -2.300 -7.054 5.044 1.00 6.53 C ATOM 1522 CE2 PHE A 213 -1.889 -9.409 5.035 1.00 5.87 C ATOM 1523 CZ PHE A 213 -1.835 -8.189 5.679 1.00 6.87 C ATOM 0 H PHE A 213 -3.666 -8.686 -0.745 1.00 1.74 H new ATOM 0 HA PHE A 213 -3.125 -6.460 0.985 1.00 1.72 H new ATOM 0 HB2 PHE A 213 -4.520 -8.271 1.761 1.00 2.13 H new ATOM 0 HB3 PHE A 213 -3.310 -9.470 1.350 1.00 2.13 H new ATOM 0 HD1 PHE A 213 -3.185 -6.252 3.276 1.00 4.86 H new ATOM 0 HD2 PHE A 213 -2.450 -10.448 3.258 1.00 4.27 H new ATOM 0 HE1 PHE A 213 -2.256 -6.098 5.545 1.00 6.53 H new ATOM 0 HE2 PHE A 213 -1.525 -10.298 5.529 1.00 5.87 H new ATOM 0 HZ PHE A 213 -1.430 -8.122 6.678 1.00 6.87 H new ATOM 1533 N LEU A 214 -0.671 -8.257 -0.098 1.00 1.64 N ATOM 1534 CA LEU A 214 0.780 -8.407 -0.113 1.00 2.02 C ATOM 1535 C LEU A 214 1.462 -7.076 -0.413 1.00 1.81 C ATOM 1536 O LEU A 214 2.239 -6.567 0.396 1.00 1.80 O ATOM 1537 CB LEU A 214 1.194 -9.451 -1.151 1.00 2.64 C ATOM 1538 CG LEU A 214 2.058 -10.603 -0.638 1.00 3.13 C ATOM 1539 CD1 LEU A 214 1.233 -11.875 -0.513 1.00 3.70 C ATOM 1540 CD2 LEU A 214 3.250 -10.827 -1.557 1.00 4.44 C ATOM 0 H LEU A 214 -1.153 -8.739 -0.857 1.00 1.64 H new ATOM 0 HA LEU A 214 1.096 -8.741 0.875 1.00 2.02 H new ATOM 0 HB2 LEU A 214 0.291 -9.870 -1.595 1.00 2.64 H new ATOM 0 HB3 LEU A 214 1.736 -8.945 -1.950 1.00 2.64 H new ATOM 0 HG LEU A 214 2.432 -10.338 0.351 1.00 3.13 H new ATOM 0 HD11 LEU A 214 1.865 -12.684 -0.147 1.00 3.70 H new ATOM 0 HD12 LEU A 214 0.413 -11.710 0.186 1.00 3.70 H new ATOM 0 HD13 LEU A 214 0.829 -12.144 -1.489 1.00 3.70 H new ATOM 0 HD21 LEU A 214 3.854 -11.651 -1.176 1.00 4.44 H new ATOM 0 HD22 LEU A 214 2.896 -11.070 -2.559 1.00 4.44 H new ATOM 0 HD23 LEU A 214 3.855 -9.921 -1.595 1.00 4.44 H new ATOM 1552 N THR A 215 1.165 -6.515 -1.581 1.00 1.81 N ATOM 1553 CA THR A 215 1.748 -5.243 -1.988 1.00 1.79 C ATOM 1554 C THR A 215 1.181 -4.091 -1.167 1.00 1.47 C ATOM 1555 O THR A 215 1.820 -3.050 -1.017 1.00 1.48 O ATOM 1556 CB THR A 215 1.501 -4.964 -3.483 1.00 2.06 C ATOM 1557 OG1 THR A 215 1.684 -6.165 -4.242 1.00 2.38 O ATOM 1558 CG2 THR A 215 2.443 -3.885 -3.995 1.00 2.04 C ATOM 0 H THR A 215 0.524 -6.922 -2.262 1.00 1.81 H new ATOM 0 HA THR A 215 2.821 -5.317 -1.813 1.00 1.79 H new ATOM 0 HB THR A 215 0.476 -4.614 -3.600 1.00 2.06 H new ATOM 0 HG1 THR A 215 2.036 -5.941 -5.129 1.00 2.38 H new ATOM 0 HG21 THR A 215 2.250 -3.705 -5.053 1.00 2.04 H new ATOM 0 HG22 THR A 215 2.280 -2.964 -3.435 1.00 2.04 H new ATOM 0 HG23 THR A 215 3.475 -4.211 -3.865 1.00 2.04 H new ATOM 1566 N ALA A 216 -0.023 -4.284 -0.638 1.00 1.28 N ATOM 1567 CA ALA A 216 -0.675 -3.261 0.170 1.00 1.14 C ATOM 1568 C ALA A 216 0.244 -2.774 1.286 1.00 0.97 C ATOM 1569 O ALA A 216 0.245 -1.593 1.633 1.00 1.00 O ATOM 1570 CB ALA A 216 -1.975 -3.796 0.751 1.00 1.20 C ATOM 0 H ALA A 216 -0.566 -5.139 -0.755 1.00 1.28 H new ATOM 0 HA ALA A 216 -0.900 -2.413 -0.476 1.00 1.14 H new ATOM 0 HB1 ALA A 216 -2.451 -3.021 1.352 1.00 1.20 H new ATOM 0 HB2 ALA A 216 -2.643 -4.088 -0.059 1.00 1.20 H new ATOM 0 HB3 ALA A 216 -1.764 -4.663 1.377 1.00 1.20 H new ATOM 1576 N VAL A 217 1.025 -3.693 1.846 1.00 1.04 N ATOM 1577 CA VAL A 217 1.949 -3.357 2.922 1.00 1.07 C ATOM 1578 C VAL A 217 3.197 -2.669 2.381 1.00 1.11 C ATOM 1579 O VAL A 217 3.729 -1.747 3.000 1.00 1.14 O ATOM 1580 CB VAL A 217 2.369 -4.611 3.713 1.00 1.20 C ATOM 1581 CG1 VAL A 217 3.406 -4.255 4.767 1.00 1.36 C ATOM 1582 CG2 VAL A 217 1.155 -5.271 4.349 1.00 1.23 C ATOM 0 H VAL A 217 1.036 -4.675 1.572 1.00 1.04 H new ATOM 0 HA VAL A 217 1.423 -2.675 3.589 1.00 1.07 H new ATOM 0 HB VAL A 217 2.819 -5.322 3.021 1.00 1.20 H new ATOM 0 HG11 VAL A 217 3.690 -5.153 5.315 1.00 1.36 H new ATOM 0 HG12 VAL A 217 4.286 -3.831 4.283 1.00 1.36 H new ATOM 0 HG13 VAL A 217 2.986 -3.525 5.459 1.00 1.36 H new ATOM 0 HG21 VAL A 217 1.470 -6.155 4.904 1.00 1.23 H new ATOM 0 HG22 VAL A 217 0.673 -4.568 5.029 1.00 1.23 H new ATOM 0 HG23 VAL A 217 0.450 -5.563 3.571 1.00 1.23 H new ATOM 1592 N HIS A 218 3.661 -3.124 1.221 1.00 1.32 N ATOM 1593 CA HIS A 218 4.847 -2.552 0.595 1.00 1.48 C ATOM 1594 C HIS A 218 4.571 -1.134 0.102 1.00 1.25 C ATOM 1595 O HIS A 218 5.230 -0.183 0.521 1.00 1.13 O ATOM 1596 CB HIS A 218 5.308 -3.428 -0.570 1.00 1.92 C ATOM 1597 CG HIS A 218 6.745 -3.225 -0.941 1.00 2.86 C ATOM 1598 ND1 HIS A 218 7.140 -2.629 -2.120 1.00 4.48 N ATOM 1599 CD2 HIS A 218 7.883 -3.539 -0.280 1.00 3.18 C ATOM 1600 CE1 HIS A 218 8.460 -2.588 -2.169 1.00 5.26 C ATOM 1601 NE2 HIS A 218 8.935 -3.134 -1.064 1.00 4.54 N ATOM 0 H HIS A 218 3.233 -3.887 0.696 1.00 1.32 H new ATOM 0 HA HIS A 218 5.638 -2.510 1.344 1.00 1.48 H new ATOM 0 HB2 HIS A 218 5.153 -4.475 -0.310 1.00 1.92 H new ATOM 0 HB3 HIS A 218 4.684 -3.220 -1.439 1.00 1.92 H new ATOM 0 HD1 HIS A 218 6.512 -2.275 -2.841 1.00 4.48 H new ATOM 0 HD2 HIS A 218 7.951 -4.019 0.685 1.00 3.18 H new ATOM 0 HE1 HIS A 218 9.050 -2.178 -2.975 1.00 5.26 H new ATOM 1609 N GLU A 219 3.593 -1.003 -0.789 1.00 1.36 N ATOM 1610 CA GLU A 219 3.233 0.299 -1.339 1.00 1.37 C ATOM 1611 C GLU A 219 3.004 1.316 -0.224 1.00 1.16 C ATOM 1612 O GLU A 219 3.682 2.342 -0.158 1.00 1.25 O ATOM 1613 CB GLU A 219 1.975 0.181 -2.202 1.00 1.60 C ATOM 1614 CG GLU A 219 2.045 0.981 -3.492 1.00 2.30 C ATOM 1615 CD GLU A 219 2.896 0.307 -4.551 1.00 2.22 C ATOM 1616 OE1 GLU A 219 2.864 -0.939 -4.631 1.00 2.71 O ATOM 1617 OE2 GLU A 219 3.593 1.024 -5.299 1.00 3.29 O ATOM 0 H GLU A 219 3.037 -1.781 -1.145 1.00 1.36 H new ATOM 0 HA GLU A 219 4.060 0.645 -1.959 1.00 1.37 H new ATOM 0 HB2 GLU A 219 1.808 -0.869 -2.444 1.00 1.60 H new ATOM 0 HB3 GLU A 219 1.114 0.516 -1.623 1.00 1.60 H new ATOM 0 HG2 GLU A 219 1.037 1.127 -3.880 1.00 2.30 H new ATOM 0 HG3 GLU A 219 2.451 1.970 -3.280 1.00 2.30 H new ATOM 1624 N ILE A 220 2.046 1.024 0.648 1.00 1.04 N ATOM 1625 CA ILE A 220 1.729 1.912 1.760 1.00 1.05 C ATOM 1626 C ILE A 220 2.977 2.247 2.569 1.00 1.07 C ATOM 1627 O ILE A 220 3.053 3.297 3.206 1.00 1.19 O ATOM 1628 CB ILE A 220 0.675 1.289 2.695 1.00 1.15 C ATOM 1629 CG1 ILE A 220 -0.661 1.138 1.965 1.00 1.71 C ATOM 1630 CG2 ILE A 220 0.509 2.139 3.945 1.00 1.85 C ATOM 1631 CD1 ILE A 220 -1.302 2.459 1.598 1.00 2.31 C ATOM 0 H ILE A 220 1.475 0.180 0.606 1.00 1.04 H new ATOM 0 HA ILE A 220 1.323 2.827 1.328 1.00 1.05 H new ATOM 0 HB ILE A 220 1.017 0.298 2.995 1.00 1.15 H new ATOM 0 HG12 ILE A 220 -0.506 0.554 1.058 1.00 1.71 H new ATOM 0 HG13 ILE A 220 -1.348 0.573 2.595 1.00 1.71 H new ATOM 0 HG21 ILE A 220 -0.239 1.686 4.596 1.00 1.85 H new ATOM 0 HG22 ILE A 220 1.461 2.200 4.473 1.00 1.85 H new ATOM 0 HG23 ILE A 220 0.186 3.141 3.663 1.00 1.85 H new ATOM 0 HD11 ILE A 220 -2.245 2.275 1.084 1.00 2.31 H new ATOM 0 HD12 ILE A 220 -1.489 3.037 2.503 1.00 2.31 H new ATOM 0 HD13 ILE A 220 -0.634 3.018 0.943 1.00 2.31 H new ATOM 1643 N GLY A 221 3.955 1.347 2.539 1.00 1.10 N ATOM 1644 CA GLY A 221 5.188 1.565 3.272 1.00 1.26 C ATOM 1645 C GLY A 221 5.959 2.768 2.765 1.00 1.26 C ATOM 1646 O GLY A 221 6.311 3.659 3.537 1.00 1.30 O ATOM 0 H GLY A 221 3.915 0.470 2.020 1.00 1.10 H new ATOM 0 HA2 GLY A 221 4.959 1.703 4.329 1.00 1.26 H new ATOM 0 HA3 GLY A 221 5.815 0.677 3.195 1.00 1.26 H new ATOM 1650 N HIS A 222 6.223 2.793 1.462 1.00 1.33 N ATOM 1651 CA HIS A 222 6.959 3.895 0.853 1.00 1.47 C ATOM 1652 C HIS A 222 6.165 5.194 0.943 1.00 1.46 C ATOM 1653 O HIS A 222 6.739 6.281 1.007 1.00 1.62 O ATOM 1654 CB HIS A 222 7.275 3.577 -0.609 1.00 1.66 C ATOM 1655 CG HIS A 222 6.298 4.171 -1.576 1.00 2.99 C ATOM 1656 ND1 HIS A 222 6.362 5.480 -2.003 1.00 4.42 N ATOM 1657 CD2 HIS A 222 5.228 3.625 -2.201 1.00 4.44 C ATOM 1658 CE1 HIS A 222 5.374 5.715 -2.848 1.00 6.09 C ATOM 1659 NE2 HIS A 222 4.671 4.605 -2.985 1.00 6.17 N ATOM 0 H HIS A 222 5.938 2.063 0.809 1.00 1.33 H new ATOM 0 HA HIS A 222 7.893 4.023 1.400 1.00 1.47 H new ATOM 0 HB2 HIS A 222 8.274 3.943 -0.844 1.00 1.66 H new ATOM 0 HB3 HIS A 222 7.293 2.495 -0.741 1.00 1.66 H new ATOM 0 HD1 HIS A 222 7.063 6.161 -1.712 1.00 4.42 H new ATOM 0 HD2 HIS A 222 4.878 2.608 -2.101 1.00 4.44 H new ATOM 0 HE1 HIS A 222 5.175 6.654 -3.342 1.00 6.09 H new ATOM 1667 N SER A 223 4.841 5.074 0.947 1.00 1.40 N ATOM 1668 CA SER A 223 3.968 6.239 1.025 1.00 1.53 C ATOM 1669 C SER A 223 3.909 6.780 2.451 1.00 1.55 C ATOM 1670 O SER A 223 3.632 7.960 2.669 1.00 1.82 O ATOM 1671 CB SER A 223 2.560 5.881 0.545 1.00 1.56 C ATOM 1672 OG SER A 223 2.569 4.684 -0.212 1.00 1.94 O ATOM 0 H SER A 223 4.350 4.182 0.897 1.00 1.40 H new ATOM 0 HA SER A 223 4.379 7.014 0.378 1.00 1.53 H new ATOM 0 HB2 SER A 223 1.898 5.767 1.403 1.00 1.56 H new ATOM 0 HB3 SER A 223 2.161 6.695 -0.060 1.00 1.56 H new ATOM 0 HG SER A 223 1.849 4.711 -0.876 1.00 1.94 H new ATOM 1678 N LEU A 224 4.172 5.908 3.418 1.00 1.68 N ATOM 1679 CA LEU A 224 4.150 6.296 4.825 1.00 1.91 C ATOM 1680 C LEU A 224 5.564 6.523 5.349 1.00 2.18 C ATOM 1681 O LEU A 224 5.788 6.571 6.558 1.00 2.54 O ATOM 1682 CB LEU A 224 3.450 5.222 5.659 1.00 1.96 C ATOM 1683 CG LEU A 224 1.942 5.393 5.845 1.00 1.92 C ATOM 1684 CD1 LEU A 224 1.648 6.546 6.792 1.00 3.02 C ATOM 1685 CD2 LEU A 224 1.261 5.616 4.502 1.00 2.36 C ATOM 0 H LEU A 224 4.403 4.928 3.254 1.00 1.68 H new ATOM 0 HA LEU A 224 3.597 7.231 4.911 1.00 1.91 H new ATOM 0 HB2 LEU A 224 3.631 4.253 5.193 1.00 1.96 H new ATOM 0 HB3 LEU A 224 3.916 5.194 6.644 1.00 1.96 H new ATOM 0 HG LEU A 224 1.543 4.479 6.285 1.00 1.92 H new ATOM 0 HD11 LEU A 224 0.570 6.652 6.912 1.00 3.02 H new ATOM 0 HD12 LEU A 224 2.103 6.345 7.762 1.00 3.02 H new ATOM 0 HD13 LEU A 224 2.060 7.468 6.382 1.00 3.02 H new ATOM 0 HD21 LEU A 224 0.188 5.736 4.653 1.00 2.36 H new ATOM 0 HD22 LEU A 224 1.664 6.514 4.034 1.00 2.36 H new ATOM 0 HD23 LEU A 224 1.443 4.758 3.855 1.00 2.36 H new ATOM 1697 N GLY A 225 6.515 6.665 4.431 1.00 2.50 N ATOM 1698 CA GLY A 225 7.895 6.888 4.820 1.00 2.87 C ATOM 1699 C GLY A 225 8.730 5.625 4.745 1.00 2.29 C ATOM 1700 O GLY A 225 9.187 5.237 3.669 1.00 3.24 O ATOM 0 H GLY A 225 6.354 6.630 3.424 1.00 2.50 H new ATOM 0 HA2 GLY A 225 8.333 7.648 4.173 1.00 2.87 H new ATOM 0 HA3 GLY A 225 7.924 7.279 5.837 1.00 2.87 H new ATOM 1704 N LEU A 226 8.931 4.982 5.890 1.00 1.97 N ATOM 1705 CA LEU A 226 9.719 3.756 5.950 1.00 2.30 C ATOM 1706 C LEU A 226 9.025 2.626 5.196 1.00 2.30 C ATOM 1707 O LEU A 226 8.226 1.884 5.766 1.00 3.43 O ATOM 1708 CB LEU A 226 9.950 3.346 7.406 1.00 4.22 C ATOM 1709 CG LEU A 226 11.255 3.829 8.039 1.00 5.30 C ATOM 1710 CD1 LEU A 226 11.247 5.342 8.190 1.00 5.94 C ATOM 1711 CD2 LEU A 226 11.474 3.158 9.388 1.00 7.20 C ATOM 0 H LEU A 226 8.559 5.289 6.789 1.00 1.97 H new ATOM 0 HA LEU A 226 10.681 3.948 5.476 1.00 2.30 H new ATOM 0 HB2 LEU A 226 9.119 3.720 8.004 1.00 4.22 H new ATOM 0 HB3 LEU A 226 9.921 2.258 7.465 1.00 4.22 H new ATOM 0 HG LEU A 226 12.079 3.554 7.381 1.00 5.30 H new ATOM 0 HD11 LEU A 226 12.184 5.667 8.642 1.00 5.94 H new ATOM 0 HD12 LEU A 226 11.137 5.805 7.209 1.00 5.94 H new ATOM 0 HD13 LEU A 226 10.414 5.640 8.827 1.00 5.94 H new ATOM 0 HD21 LEU A 226 12.408 3.514 9.824 1.00 7.20 H new ATOM 0 HD22 LEU A 226 10.646 3.402 10.054 1.00 7.20 H new ATOM 0 HD23 LEU A 226 11.525 2.078 9.253 1.00 7.20 H new ATOM 1723 N GLY A 227 9.338 2.500 3.910 1.00 2.94 N ATOM 1724 CA GLY A 227 8.738 1.456 3.099 1.00 4.65 C ATOM 1725 C GLY A 227 9.670 0.280 2.884 1.00 4.55 C ATOM 1726 O GLY A 227 9.321 -0.861 3.188 1.00 5.16 O ATOM 0 H GLY A 227 9.996 3.102 3.415 1.00 2.94 H new ATOM 0 HA2 GLY A 227 7.824 1.108 3.579 1.00 4.65 H new ATOM 0 HA3 GLY A 227 8.452 1.870 2.132 1.00 4.65 H new ATOM 1730 N HIS A 228 10.859 0.558 2.359 1.00 4.31 N ATOM 1731 CA HIS A 228 11.844 -0.487 2.102 1.00 4.50 C ATOM 1732 C HIS A 228 12.731 -0.709 3.324 1.00 3.91 C ATOM 1733 O HIS A 228 13.957 -0.739 3.216 1.00 4.27 O ATOM 1734 CB HIS A 228 12.704 -0.121 0.893 1.00 4.97 C ATOM 1735 CG HIS A 228 13.361 1.220 1.009 1.00 4.87 C ATOM 1736 ND1 HIS A 228 14.626 1.396 1.530 1.00 5.43 N ATOM 1737 CD2 HIS A 228 12.922 2.454 0.667 1.00 5.63 C ATOM 1738 CE1 HIS A 228 14.936 2.680 1.504 1.00 6.32 C ATOM 1739 NE2 HIS A 228 13.919 3.343 0.984 1.00 6.36 N ATOM 0 H HIS A 228 11.164 1.497 2.103 1.00 4.31 H new ATOM 0 HA HIS A 228 11.309 -1.412 1.890 1.00 4.50 H new ATOM 0 HB2 HIS A 228 13.472 -0.883 0.760 1.00 4.97 H new ATOM 0 HB3 HIS A 228 12.083 -0.136 -0.002 1.00 4.97 H new ATOM 0 HD1 HIS A 228 15.228 0.651 1.881 1.00 5.43 H new ATOM 0 HD2 HIS A 228 11.966 2.694 0.227 1.00 5.63 H new ATOM 0 HE1 HIS A 228 15.863 3.114 1.849 1.00 6.32 H new ATOM 1795 N LYS A 233 14.285 -11.560 5.963 1.00 3.54 N ATOM 1796 CA LYS A 233 13.659 -12.713 6.600 1.00 3.86 C ATOM 1797 C LYS A 233 12.205 -12.418 6.951 1.00 3.68 C ATOM 1798 O LYS A 233 11.637 -13.032 7.854 1.00 4.22 O ATOM 1799 CB LYS A 233 14.430 -13.105 7.862 1.00 4.34 C ATOM 1800 CG LYS A 233 14.991 -14.516 7.819 1.00 5.41 C ATOM 1801 CD LYS A 233 16.229 -14.597 6.941 1.00 6.17 C ATOM 1802 CE LYS A 233 16.285 -15.910 6.176 1.00 7.77 C ATOM 1803 NZ LYS A 233 16.792 -17.025 7.024 1.00 7.99 N ATOM 0 HA LYS A 233 13.682 -13.544 5.894 1.00 3.86 H new ATOM 0 HB2 LYS A 233 15.249 -12.402 8.010 1.00 4.34 H new ATOM 0 HB3 LYS A 233 13.770 -13.012 8.724 1.00 4.34 H new ATOM 0 HG2 LYS A 233 15.238 -14.841 8.830 1.00 5.41 H new ATOM 0 HG3 LYS A 233 14.231 -15.200 7.441 1.00 5.41 H new ATOM 0 HD2 LYS A 233 16.232 -13.764 6.237 1.00 6.17 H new ATOM 0 HD3 LYS A 233 17.122 -14.496 7.559 1.00 6.17 H new ATOM 0 HE2 LYS A 233 15.290 -16.158 5.807 1.00 7.77 H new ATOM 0 HE3 LYS A 233 16.929 -15.795 5.304 1.00 7.77 H new ATOM 0 HZ1 LYS A 233 16.815 -17.902 6.466 1.00 7.99 H new ATOM 0 HZ2 LYS A 233 17.752 -16.800 7.356 1.00 7.99 H new ATOM 0 HZ3 LYS A 233 16.164 -17.152 7.843 1.00 7.99 H new ATOM 1817 N ALA A 234 11.606 -11.475 6.230 1.00 3.50 N ATOM 1818 CA ALA A 234 10.217 -11.101 6.464 1.00 3.45 C ATOM 1819 C ALA A 234 9.609 -10.448 5.227 1.00 3.13 C ATOM 1820 O ALA A 234 10.202 -10.465 4.149 1.00 2.97 O ATOM 1821 CB ALA A 234 10.115 -10.168 7.661 1.00 3.60 C ATOM 0 H ALA A 234 12.062 -10.956 5.479 1.00 3.50 H new ATOM 0 HA ALA A 234 9.653 -12.009 6.678 1.00 3.45 H new ATOM 0 HB1 ALA A 234 9.072 -9.897 7.823 1.00 3.60 H new ATOM 0 HB2 ALA A 234 10.502 -10.670 8.548 1.00 3.60 H new ATOM 0 HB3 ALA A 234 10.698 -9.267 7.471 1.00 3.60 H new ATOM 1827 N VAL A 235 8.422 -9.872 5.391 1.00 3.24 N ATOM 1828 CA VAL A 235 7.734 -9.212 4.288 1.00 3.17 C ATOM 1829 C VAL A 235 8.438 -7.918 3.896 1.00 3.06 C ATOM 1830 O VAL A 235 8.231 -7.394 2.802 1.00 3.15 O ATOM 1831 CB VAL A 235 6.269 -8.898 4.648 1.00 3.70 C ATOM 1832 CG1 VAL A 235 5.504 -10.180 4.937 1.00 4.90 C ATOM 1833 CG2 VAL A 235 6.204 -7.949 5.835 1.00 3.88 C ATOM 0 H VAL A 235 7.917 -9.849 6.277 1.00 3.24 H new ATOM 0 HA VAL A 235 7.754 -9.902 3.445 1.00 3.17 H new ATOM 0 HB VAL A 235 5.800 -8.408 3.795 1.00 3.70 H new ATOM 0 HG11 VAL A 235 4.471 -9.939 5.189 1.00 4.90 H new ATOM 0 HG12 VAL A 235 5.522 -10.821 4.055 1.00 4.90 H new ATOM 0 HG13 VAL A 235 5.970 -10.701 5.774 1.00 4.90 H new ATOM 0 HG21 VAL A 235 5.162 -7.738 6.076 1.00 3.88 H new ATOM 0 HG22 VAL A 235 6.689 -8.409 6.696 1.00 3.88 H new ATOM 0 HG23 VAL A 235 6.714 -7.019 5.585 1.00 3.88 H new ATOM 1843 N MET A 236 9.272 -7.409 4.797 1.00 3.13 N ATOM 1844 CA MET A 236 10.009 -6.176 4.545 1.00 3.27 C ATOM 1845 C MET A 236 10.936 -6.333 3.343 1.00 3.03 C ATOM 1846 O MET A 236 10.820 -7.290 2.578 1.00 3.52 O ATOM 1847 CB MET A 236 10.819 -5.778 5.780 1.00 3.60 C ATOM 1848 CG MET A 236 10.578 -4.347 6.230 1.00 4.78 C ATOM 1849 SD MET A 236 8.892 -4.075 6.811 1.00 6.89 S ATOM 1850 CE MET A 236 8.222 -3.105 5.463 1.00 8.31 C ATOM 0 H MET A 236 9.454 -7.831 5.708 1.00 3.13 H new ATOM 0 HA MET A 236 9.287 -5.390 4.325 1.00 3.27 H new ATOM 0 HB2 MET A 236 10.573 -6.454 6.599 1.00 3.60 H new ATOM 0 HB3 MET A 236 11.880 -5.909 5.566 1.00 3.60 H new ATOM 0 HG2 MET A 236 11.278 -4.099 7.028 1.00 4.78 H new ATOM 0 HG3 MET A 236 10.786 -3.670 5.402 1.00 4.78 H new ATOM 0 HE1 MET A 236 8.093 -2.072 5.787 1.00 8.31 H new ATOM 0 HE2 MET A 236 8.907 -3.137 4.616 1.00 8.31 H new ATOM 0 HE3 MET A 236 7.257 -3.515 5.164 1.00 8.31 H new ATOM 1860 N PHE A 237 11.855 -5.387 3.183 1.00 2.97 N ATOM 1861 CA PHE A 237 12.801 -5.420 2.074 1.00 2.94 C ATOM 1862 C PHE A 237 12.082 -5.241 0.740 1.00 2.60 C ATOM 1863 O PHE A 237 10.876 -5.460 0.622 1.00 2.36 O ATOM 1864 CB PHE A 237 13.575 -6.740 2.076 1.00 3.18 C ATOM 1865 CG PHE A 237 15.009 -6.593 2.500 1.00 3.75 C ATOM 1866 CD1 PHE A 237 15.333 -5.934 3.675 1.00 4.53 C ATOM 1867 CD2 PHE A 237 16.031 -7.115 1.725 1.00 4.27 C ATOM 1868 CE1 PHE A 237 16.651 -5.797 4.068 1.00 5.30 C ATOM 1869 CE2 PHE A 237 17.351 -6.982 2.113 1.00 4.95 C ATOM 1870 CZ PHE A 237 17.661 -6.323 3.287 1.00 5.28 C ATOM 0 H PHE A 237 11.965 -4.588 3.807 1.00 2.97 H new ATOM 0 HA PHE A 237 13.502 -4.595 2.202 1.00 2.94 H new ATOM 0 HB2 PHE A 237 13.077 -7.443 2.744 1.00 3.18 H new ATOM 0 HB3 PHE A 237 13.543 -7.173 1.076 1.00 3.18 H new ATOM 0 HD1 PHE A 237 14.547 -5.523 4.291 1.00 4.53 H new ATOM 0 HD2 PHE A 237 15.794 -7.632 0.807 1.00 4.27 H new ATOM 0 HE1 PHE A 237 16.891 -5.279 4.985 1.00 5.30 H new ATOM 0 HE2 PHE A 237 18.139 -7.393 1.499 1.00 4.95 H new ATOM 0 HZ PHE A 237 18.691 -6.219 3.593 1.00 5.28 H new ATOM 1880 N PRO A 238 12.838 -4.832 -0.289 1.00 2.84 N ATOM 1881 CA PRO A 238 12.295 -4.614 -1.633 1.00 2.87 C ATOM 1882 C PRO A 238 11.897 -5.918 -2.316 1.00 2.78 C ATOM 1883 O PRO A 238 11.279 -5.910 -3.381 1.00 3.00 O ATOM 1884 CB PRO A 238 13.454 -3.950 -2.381 1.00 3.39 C ATOM 1885 CG PRO A 238 14.678 -4.406 -1.664 1.00 3.59 C ATOM 1886 CD PRO A 238 14.282 -4.551 -0.220 1.00 3.34 C ATOM 0 HA PRO A 238 11.385 -4.015 -1.612 1.00 2.87 H new ATOM 0 HB2 PRO A 238 13.473 -4.251 -3.428 1.00 3.39 H new ATOM 0 HB3 PRO A 238 13.366 -2.864 -2.363 1.00 3.39 H new ATOM 0 HG2 PRO A 238 15.037 -5.353 -2.067 1.00 3.59 H new ATOM 0 HG3 PRO A 238 15.488 -3.685 -1.776 1.00 3.59 H new ATOM 0 HD2 PRO A 238 14.826 -5.360 0.267 1.00 3.34 H new ATOM 0 HD3 PRO A 238 14.488 -3.643 0.346 1.00 3.34 H new ATOM 1894 N THR A 239 12.256 -7.038 -1.697 1.00 2.84 N ATOM 1895 CA THR A 239 11.938 -8.350 -2.246 1.00 2.92 C ATOM 1896 C THR A 239 10.558 -8.815 -1.794 1.00 2.50 C ATOM 1897 O THR A 239 10.197 -8.675 -0.625 1.00 2.44 O ATOM 1898 CB THR A 239 12.983 -9.402 -1.829 1.00 3.37 C ATOM 1899 OG1 THR A 239 14.271 -8.790 -1.703 1.00 3.75 O ATOM 1900 CG2 THR A 239 13.049 -10.531 -2.847 1.00 3.91 C ATOM 0 H THR A 239 12.767 -7.063 -0.815 1.00 2.84 H new ATOM 0 HA THR A 239 11.948 -8.249 -3.331 1.00 2.92 H new ATOM 0 HB THR A 239 12.684 -9.818 -0.867 1.00 3.37 H new ATOM 0 HG1 THR A 239 14.929 -9.465 -1.436 1.00 3.75 H new ATOM 0 HG21 THR A 239 13.794 -11.262 -2.532 1.00 3.91 H new ATOM 0 HG22 THR A 239 12.074 -11.014 -2.919 1.00 3.91 H new ATOM 0 HG23 THR A 239 13.327 -10.127 -3.821 1.00 3.91 H new ATOM 1908 N TYR A 240 9.790 -9.368 -2.726 1.00 2.55 N ATOM 1909 CA TYR A 240 8.449 -9.852 -2.424 1.00 2.44 C ATOM 1910 C TYR A 240 8.503 -11.073 -1.509 1.00 2.23 C ATOM 1911 O TYR A 240 9.187 -12.053 -1.802 1.00 2.54 O ATOM 1912 CB TYR A 240 7.706 -10.201 -3.715 1.00 3.08 C ATOM 1913 CG TYR A 240 8.313 -11.365 -4.466 1.00 3.91 C ATOM 1914 CD1 TYR A 240 9.365 -11.173 -5.352 1.00 4.80 C ATOM 1915 CD2 TYR A 240 7.833 -12.657 -4.289 1.00 4.69 C ATOM 1916 CE1 TYR A 240 9.922 -12.233 -6.041 1.00 5.76 C ATOM 1917 CE2 TYR A 240 8.384 -13.723 -4.973 1.00 5.65 C ATOM 1918 CZ TYR A 240 9.428 -13.506 -5.848 1.00 5.95 C ATOM 1919 OH TYR A 240 9.980 -14.565 -6.532 1.00 7.06 O ATOM 0 H TYR A 240 10.074 -9.492 -3.698 1.00 2.55 H new ATOM 0 HA TYR A 240 7.912 -9.057 -1.907 1.00 2.44 H new ATOM 0 HB2 TYR A 240 6.669 -10.435 -3.476 1.00 3.08 H new ATOM 0 HB3 TYR A 240 7.694 -9.326 -4.365 1.00 3.08 H new ATOM 0 HD1 TYR A 240 9.755 -10.177 -5.505 1.00 4.80 H new ATOM 0 HD2 TYR A 240 7.015 -12.831 -3.605 1.00 4.69 H new ATOM 0 HE1 TYR A 240 10.739 -12.066 -6.727 1.00 5.76 H new ATOM 0 HE2 TYR A 240 7.999 -14.721 -4.824 1.00 5.65 H new ATOM 0 HH TYR A 240 9.518 -15.392 -6.282 1.00 7.06 H new ATOM 1929 N LYS A 241 7.776 -11.005 -0.400 1.00 2.15 N ATOM 1930 CA LYS A 241 7.737 -12.103 0.559 1.00 2.30 C ATOM 1931 C LYS A 241 6.310 -12.366 1.028 1.00 2.21 C ATOM 1932 O LYS A 241 5.941 -12.020 2.150 1.00 2.48 O ATOM 1933 CB LYS A 241 8.630 -11.789 1.761 1.00 2.68 C ATOM 1934 CG LYS A 241 10.047 -12.319 1.621 1.00 2.82 C ATOM 1935 CD LYS A 241 10.095 -13.830 1.773 1.00 3.42 C ATOM 1936 CE LYS A 241 10.553 -14.505 0.489 1.00 4.03 C ATOM 1937 NZ LYS A 241 10.043 -15.899 0.382 1.00 5.22 N ATOM 0 H LYS A 241 7.205 -10.200 -0.142 1.00 2.15 H new ATOM 0 HA LYS A 241 8.108 -12.999 0.062 1.00 2.30 H new ATOM 0 HB2 LYS A 241 8.667 -10.709 1.903 1.00 2.68 H new ATOM 0 HB3 LYS A 241 8.179 -12.213 2.658 1.00 2.68 H new ATOM 0 HG2 LYS A 241 10.447 -12.038 0.647 1.00 2.82 H new ATOM 0 HG3 LYS A 241 10.685 -11.856 2.374 1.00 2.82 H new ATOM 0 HD2 LYS A 241 10.772 -14.094 2.585 1.00 3.42 H new ATOM 0 HD3 LYS A 241 9.108 -14.201 2.048 1.00 3.42 H new ATOM 0 HE2 LYS A 241 10.209 -13.926 -0.368 1.00 4.03 H new ATOM 0 HE3 LYS A 241 11.642 -14.513 0.452 1.00 4.03 H new ATOM 0 HZ1 LYS A 241 10.377 -16.324 -0.507 1.00 5.22 H new ATOM 0 HZ2 LYS A 241 10.392 -16.459 1.186 1.00 5.22 H new ATOM 0 HZ3 LYS A 241 9.003 -15.890 0.392 1.00 5.22 H new ATOM 1951 N TYR A 242 5.512 -12.981 0.162 1.00 2.26 N ATOM 1952 CA TYR A 242 4.124 -13.290 0.488 1.00 2.44 C ATOM 1953 C TYR A 242 4.029 -14.031 1.818 1.00 2.31 C ATOM 1954 O TYR A 242 4.923 -14.794 2.183 1.00 2.62 O ATOM 1955 CB TYR A 242 3.493 -14.131 -0.623 1.00 3.15 C ATOM 1956 CG TYR A 242 4.350 -15.296 -1.063 1.00 3.26 C ATOM 1957 CD1 TYR A 242 4.516 -16.408 -0.247 1.00 4.21 C ATOM 1958 CD2 TYR A 242 4.996 -15.284 -2.293 1.00 3.69 C ATOM 1959 CE1 TYR A 242 5.299 -17.475 -0.645 1.00 5.13 C ATOM 1960 CE2 TYR A 242 5.780 -16.346 -2.699 1.00 4.42 C ATOM 1961 CZ TYR A 242 5.928 -17.439 -1.871 1.00 5.01 C ATOM 1962 OH TYR A 242 6.709 -18.499 -2.272 1.00 6.21 O ATOM 0 H TYR A 242 5.802 -13.275 -0.771 1.00 2.26 H new ATOM 0 HA TYR A 242 3.580 -12.350 0.577 1.00 2.44 H new ATOM 0 HB2 TYR A 242 2.530 -14.509 -0.279 1.00 3.15 H new ATOM 0 HB3 TYR A 242 3.295 -13.491 -1.483 1.00 3.15 H new ATOM 0 HD1 TYR A 242 4.025 -16.439 0.714 1.00 4.21 H new ATOM 0 HD2 TYR A 242 4.883 -14.429 -2.943 1.00 3.69 H new ATOM 0 HE1 TYR A 242 5.417 -18.332 0.001 1.00 5.13 H new ATOM 0 HE2 TYR A 242 6.274 -16.321 -3.659 1.00 4.42 H new ATOM 0 HH TYR A 242 7.079 -18.315 -3.161 1.00 6.21 H new ATOM 1972 N VAL A 243 2.936 -13.800 2.539 1.00 2.24 N ATOM 1973 CA VAL A 243 2.721 -14.446 3.828 1.00 2.44 C ATOM 1974 C VAL A 243 1.233 -14.608 4.120 1.00 2.43 C ATOM 1975 O VAL A 243 0.387 -14.252 3.300 1.00 2.26 O ATOM 1976 CB VAL A 243 3.373 -13.647 4.972 1.00 2.69 C ATOM 1977 CG1 VAL A 243 4.889 -13.704 4.867 1.00 3.07 C ATOM 1978 CG2 VAL A 243 2.883 -12.207 4.962 1.00 3.10 C ATOM 0 H VAL A 243 2.186 -13.171 2.252 1.00 2.24 H new ATOM 0 HA VAL A 243 3.187 -15.430 3.771 1.00 2.44 H new ATOM 0 HB VAL A 243 3.082 -14.099 5.920 1.00 2.69 H new ATOM 0 HG11 VAL A 243 5.332 -13.134 5.684 1.00 3.07 H new ATOM 0 HG12 VAL A 243 5.219 -14.741 4.928 1.00 3.07 H new ATOM 0 HG13 VAL A 243 5.204 -13.278 3.914 1.00 3.07 H new ATOM 0 HG21 VAL A 243 3.354 -11.657 5.777 1.00 3.10 H new ATOM 0 HG22 VAL A 243 3.143 -11.741 4.012 1.00 3.10 H new ATOM 0 HG23 VAL A 243 1.801 -12.190 5.090 1.00 3.10 H new ATOM 1988 N ASP A 244 0.921 -15.148 5.293 1.00 2.88 N ATOM 1989 CA ASP A 244 -0.465 -15.356 5.695 1.00 3.02 C ATOM 1990 C ASP A 244 -1.272 -14.070 5.550 1.00 2.71 C ATOM 1991 O ASP A 244 -0.707 -12.980 5.444 1.00 2.94 O ATOM 1992 CB ASP A 244 -0.530 -15.854 7.139 1.00 3.85 C ATOM 1993 CG ASP A 244 -1.156 -17.231 7.249 1.00 4.54 C ATOM 1994 OD1 ASP A 244 -2.101 -17.516 6.483 1.00 4.88 O ATOM 1995 OD2 ASP A 244 -0.701 -18.023 8.101 1.00 5.29 O ATOM 0 H ASP A 244 1.610 -15.450 5.982 1.00 2.88 H new ATOM 0 HA ASP A 244 -0.898 -16.111 5.039 1.00 3.02 H new ATOM 0 HB2 ASP A 244 0.476 -15.881 7.557 1.00 3.85 H new ATOM 0 HB3 ASP A 244 -1.105 -15.148 7.738 1.00 3.85 H new ATOM 2000 N ILE A 245 -2.594 -14.204 5.546 1.00 2.75 N ATOM 2001 CA ILE A 245 -3.477 -13.052 5.414 1.00 2.78 C ATOM 2002 C ILE A 245 -3.634 -12.324 6.745 1.00 3.45 C ATOM 2003 O ILE A 245 -3.097 -11.233 6.934 1.00 3.98 O ATOM 2004 CB ILE A 245 -4.869 -13.466 4.902 1.00 3.17 C ATOM 2005 CG1 ILE A 245 -4.751 -14.164 3.546 1.00 2.86 C ATOM 2006 CG2 ILE A 245 -5.779 -12.251 4.801 1.00 4.84 C ATOM 2007 CD1 ILE A 245 -4.119 -13.302 2.476 1.00 3.60 C ATOM 0 H ILE A 245 -3.077 -15.098 5.633 1.00 2.75 H new ATOM 0 HA ILE A 245 -3.016 -12.382 4.688 1.00 2.78 H new ATOM 0 HB ILE A 245 -5.308 -14.166 5.613 1.00 3.17 H new ATOM 0 HG12 ILE A 245 -4.161 -15.073 3.664 1.00 2.86 H new ATOM 0 HG13 ILE A 245 -5.744 -14.469 3.216 1.00 2.86 H new ATOM 0 HG21 ILE A 245 -6.759 -12.560 4.438 1.00 4.84 H new ATOM 0 HG22 ILE A 245 -5.884 -11.793 5.784 1.00 4.84 H new ATOM 0 HG23 ILE A 245 -5.346 -11.529 4.108 1.00 4.84 H new ATOM 0 HD11 ILE A 245 -4.067 -13.861 1.542 1.00 3.60 H new ATOM 0 HD12 ILE A 245 -4.720 -12.405 2.329 1.00 3.60 H new ATOM 0 HD13 ILE A 245 -3.113 -13.018 2.785 1.00 3.60 H new ATOM 2019 N ASN A 246 -4.370 -12.937 7.666 1.00 4.15 N ATOM 2020 CA ASN A 246 -4.596 -12.348 8.981 1.00 5.09 C ATOM 2021 C ASN A 246 -3.733 -13.030 10.038 1.00 4.19 C ATOM 2022 O ASN A 246 -3.405 -12.436 11.065 1.00 4.61 O ATOM 2023 CB ASN A 246 -6.073 -12.457 9.364 1.00 6.77 C ATOM 2024 CG ASN A 246 -6.414 -11.636 10.593 1.00 8.14 C ATOM 2025 OD1 ASN A 246 -6.961 -10.538 10.487 1.00 8.94 O ATOM 2026 ND2 ASN A 246 -6.091 -12.166 11.767 1.00 8.83 N ATOM 0 H ASN A 246 -4.820 -13.842 7.526 1.00 4.15 H new ATOM 0 HA ASN A 246 -4.317 -11.296 8.933 1.00 5.09 H new ATOM 0 HB2 ASN A 246 -6.688 -12.126 8.527 1.00 6.77 H new ATOM 0 HB3 ASN A 246 -6.322 -13.502 9.548 1.00 6.77 H new ATOM 0 HD21 ASN A 246 -6.295 -11.660 12.629 1.00 8.83 H new ATOM 0 HD22 ASN A 246 -5.639 -13.079 11.807 1.00 8.83 H new ATOM 2033 N THR A 247 -3.367 -14.281 9.778 1.00 3.60 N ATOM 2034 CA THR A 247 -2.542 -15.044 10.707 1.00 3.50 C ATOM 2035 C THR A 247 -1.160 -14.419 10.856 1.00 3.15 C ATOM 2036 O THR A 247 -0.470 -14.645 11.850 1.00 3.78 O ATOM 2037 CB THR A 247 -2.385 -16.506 10.247 1.00 4.21 C ATOM 2038 OG1 THR A 247 -3.400 -16.831 9.291 1.00 5.11 O ATOM 2039 CG2 THR A 247 -2.473 -17.458 11.431 1.00 4.91 C ATOM 0 H THR A 247 -3.629 -14.787 8.932 1.00 3.60 H new ATOM 0 HA THR A 247 -3.051 -15.026 11.671 1.00 3.50 H new ATOM 0 HB THR A 247 -1.404 -16.615 9.785 1.00 4.21 H new ATOM 0 HG1 THR A 247 -3.292 -17.761 9.003 1.00 5.11 H new ATOM 0 HG21 THR A 247 -2.359 -18.484 11.082 1.00 4.91 H new ATOM 0 HG22 THR A 247 -1.681 -17.227 12.143 1.00 4.91 H new ATOM 0 HG23 THR A 247 -3.442 -17.345 11.917 1.00 4.91 H new ATOM 2047 N PHE A 248 -0.762 -13.632 9.862 1.00 2.60 N ATOM 2048 CA PHE A 248 0.540 -12.974 9.883 1.00 2.84 C ATOM 2049 C PHE A 248 0.406 -11.519 10.325 1.00 2.33 C ATOM 2050 O PHE A 248 -0.673 -11.074 10.716 1.00 2.76 O ATOM 2051 CB PHE A 248 1.192 -13.041 8.501 1.00 3.78 C ATOM 2052 CG PHE A 248 2.533 -13.717 8.503 1.00 5.60 C ATOM 2053 CD1 PHE A 248 2.645 -15.062 8.815 1.00 6.96 C ATOM 2054 CD2 PHE A 248 3.682 -13.007 8.194 1.00 6.76 C ATOM 2055 CE1 PHE A 248 3.878 -15.688 8.817 1.00 8.97 C ATOM 2056 CE2 PHE A 248 4.917 -13.626 8.195 1.00 8.88 C ATOM 2057 CZ PHE A 248 5.015 -14.968 8.508 1.00 9.83 C ATOM 0 H PHE A 248 -1.322 -13.434 9.032 1.00 2.60 H new ATOM 0 HA PHE A 248 1.172 -13.497 10.600 1.00 2.84 H new ATOM 0 HB2 PHE A 248 0.527 -13.572 7.820 1.00 3.78 H new ATOM 0 HB3 PHE A 248 1.305 -12.029 8.112 1.00 3.78 H new ATOM 0 HD1 PHE A 248 1.759 -15.629 9.060 1.00 6.96 H new ATOM 0 HD2 PHE A 248 3.611 -11.957 7.950 1.00 6.76 H new ATOM 0 HE1 PHE A 248 3.952 -16.738 9.060 1.00 8.97 H new ATOM 0 HE2 PHE A 248 5.805 -13.061 7.951 1.00 8.88 H new ATOM 0 HZ PHE A 248 5.980 -15.453 8.511 1.00 9.83 H new ATOM 2067 N ARG A 249 1.511 -10.783 10.259 1.00 2.25 N ATOM 2068 CA ARG A 249 1.519 -9.380 10.652 1.00 2.52 C ATOM 2069 C ARG A 249 2.904 -8.769 10.461 1.00 2.13 C ATOM 2070 O ARG A 249 3.912 -9.476 10.467 1.00 2.49 O ATOM 2071 CB ARG A 249 1.083 -9.235 12.112 1.00 3.96 C ATOM 2072 CG ARG A 249 1.746 -10.233 13.047 1.00 4.06 C ATOM 2073 CD ARG A 249 1.775 -9.721 14.479 1.00 5.01 C ATOM 2074 NE ARG A 249 3.123 -9.741 15.039 1.00 5.08 N ATOM 2075 CZ ARG A 249 3.398 -9.437 16.303 1.00 5.92 C ATOM 2076 NH1 ARG A 249 2.423 -9.093 17.133 1.00 6.78 N ATOM 2077 NH2 ARG A 249 4.650 -9.478 16.739 1.00 6.48 N ATOM 0 H ARG A 249 2.412 -11.136 9.937 1.00 2.25 H new ATOM 0 HA ARG A 249 0.814 -8.846 10.014 1.00 2.52 H new ATOM 0 HB2 ARG A 249 1.311 -8.225 12.452 1.00 3.96 H new ATOM 0 HB3 ARG A 249 0.001 -9.356 12.173 1.00 3.96 H new ATOM 0 HG2 ARG A 249 1.209 -11.181 13.009 1.00 4.06 H new ATOM 0 HG3 ARG A 249 2.763 -10.429 12.709 1.00 4.06 H new ATOM 0 HD2 ARG A 249 1.385 -8.704 14.508 1.00 5.01 H new ATOM 0 HD3 ARG A 249 1.117 -10.332 15.096 1.00 5.01 H new ATOM 0 HE ARG A 249 3.896 -10.003 14.427 1.00 5.08 H new ATOM 0 HH11 ARG A 249 1.459 -9.061 16.802 1.00 6.78 H new ATOM 0 HH12 ARG A 249 2.637 -8.860 18.103 1.00 6.78 H new ATOM 0 HH21 ARG A 249 5.403 -9.743 16.104 1.00 6.48 H new ATOM 0 HH22 ARG A 249 4.860 -9.244 17.709 1.00 6.48 H new ATOM 2091 N LEU A 250 2.945 -7.452 10.290 1.00 2.31 N ATOM 2092 CA LEU A 250 4.207 -6.745 10.096 1.00 2.08 C ATOM 2093 C LEU A 250 5.135 -6.950 11.290 1.00 2.06 C ATOM 2094 O LEU A 250 5.007 -6.274 12.311 1.00 2.52 O ATOM 2095 CB LEU A 250 3.950 -5.252 9.885 1.00 2.31 C ATOM 2096 CG LEU A 250 3.716 -4.809 8.441 1.00 3.58 C ATOM 2097 CD1 LEU A 250 4.949 -5.079 7.593 1.00 4.90 C ATOM 2098 CD2 LEU A 250 2.500 -5.514 7.857 1.00 4.59 C ATOM 0 H LEU A 250 2.120 -6.852 10.282 1.00 2.31 H new ATOM 0 HA LEU A 250 4.692 -7.153 9.209 1.00 2.08 H new ATOM 0 HB2 LEU A 250 3.081 -4.966 10.477 1.00 2.31 H new ATOM 0 HB3 LEU A 250 4.801 -4.698 10.281 1.00 2.31 H new ATOM 0 HG LEU A 250 3.526 -3.736 8.437 1.00 3.58 H new ATOM 0 HD11 LEU A 250 4.763 -4.757 6.568 1.00 4.90 H new ATOM 0 HD12 LEU A 250 5.797 -4.528 7.999 1.00 4.90 H new ATOM 0 HD13 LEU A 250 5.171 -6.146 7.603 1.00 4.90 H new ATOM 0 HD21 LEU A 250 2.349 -5.186 6.828 1.00 4.59 H new ATOM 0 HD22 LEU A 250 2.661 -6.592 7.875 1.00 4.59 H new ATOM 0 HD23 LEU A 250 1.618 -5.269 8.449 1.00 4.59 H new ATOM 2110 N SER A 251 6.070 -7.884 11.152 1.00 2.40 N ATOM 2111 CA SER A 251 7.019 -8.179 12.220 1.00 2.67 C ATOM 2112 C SER A 251 8.335 -7.441 11.995 1.00 2.77 C ATOM 2113 O SER A 251 9.183 -7.883 11.221 1.00 4.05 O ATOM 2114 CB SER A 251 7.273 -9.685 12.303 1.00 3.92 C ATOM 2115 OG SER A 251 6.074 -10.391 12.572 1.00 5.17 O ATOM 0 H SER A 251 6.191 -8.450 10.312 1.00 2.40 H new ATOM 0 HA SER A 251 6.588 -7.838 13.161 1.00 2.67 H new ATOM 0 HB2 SER A 251 7.703 -10.037 11.365 1.00 3.92 H new ATOM 0 HB3 SER A 251 8.003 -9.891 13.085 1.00 3.92 H new ATOM 0 HG SER A 251 5.420 -10.207 11.865 1.00 5.17 H new ATOM 2121 N ALA A 252 8.497 -6.313 12.679 1.00 2.63 N ATOM 2122 CA ALA A 252 9.710 -5.513 12.556 1.00 3.03 C ATOM 2123 C ALA A 252 9.625 -4.253 13.410 1.00 2.30 C ATOM 2124 O ALA A 252 8.591 -3.969 14.014 1.00 2.97 O ATOM 2125 CB ALA A 252 9.959 -5.151 11.100 1.00 4.70 C ATOM 0 H ALA A 252 7.804 -5.933 13.324 1.00 2.63 H new ATOM 0 HA ALA A 252 10.547 -6.110 12.918 1.00 3.03 H new ATOM 0 HB1 ALA A 252 10.868 -4.554 11.024 1.00 4.70 H new ATOM 0 HB2 ALA A 252 10.073 -6.062 10.513 1.00 4.70 H new ATOM 0 HB3 ALA A 252 9.115 -4.577 10.718 1.00 4.70 H new ATOM 2131 N ASP A 253 10.719 -3.500 13.456 1.00 2.13 N ATOM 2132 CA ASP A 253 10.768 -2.269 14.236 1.00 2.09 C ATOM 2133 C ASP A 253 9.742 -1.262 13.726 1.00 2.07 C ATOM 2134 O ASP A 253 9.388 -0.313 14.426 1.00 2.27 O ATOM 2135 CB ASP A 253 12.170 -1.660 14.180 1.00 2.59 C ATOM 2136 CG ASP A 253 12.739 -1.389 15.559 1.00 3.46 C ATOM 2137 OD1 ASP A 253 12.594 -2.260 16.442 1.00 4.41 O ATOM 2138 OD2 ASP A 253 13.328 -0.306 15.756 1.00 3.79 O ATOM 0 H ASP A 253 11.584 -3.721 12.962 1.00 2.13 H new ATOM 0 HA ASP A 253 10.528 -2.514 15.271 1.00 2.09 H new ATOM 0 HB2 ASP A 253 12.835 -2.335 13.642 1.00 2.59 H new ATOM 0 HB3 ASP A 253 12.136 -0.729 13.615 1.00 2.59 H new ATOM 2143 N ASP A 254 9.269 -1.474 12.503 1.00 2.36 N ATOM 2144 CA ASP A 254 8.283 -0.585 11.899 1.00 2.53 C ATOM 2145 C ASP A 254 7.091 -0.384 12.830 1.00 2.21 C ATOM 2146 O ASP A 254 6.478 0.684 12.845 1.00 2.21 O ATOM 2147 CB ASP A 254 7.810 -1.149 10.559 1.00 3.33 C ATOM 2148 CG ASP A 254 8.835 -0.961 9.457 1.00 3.66 C ATOM 2149 OD1 ASP A 254 10.034 -0.832 9.779 1.00 4.19 O ATOM 2150 OD2 ASP A 254 8.437 -0.942 8.273 1.00 4.16 O ATOM 0 H ASP A 254 9.552 -2.254 11.910 1.00 2.36 H new ATOM 0 HA ASP A 254 8.757 0.382 11.730 1.00 2.53 H new ATOM 0 HB2 ASP A 254 7.593 -2.211 10.672 1.00 3.33 H new ATOM 0 HB3 ASP A 254 6.878 -0.662 10.272 1.00 3.33 H new ATOM 2155 N ILE A 255 6.769 -1.415 13.602 1.00 2.46 N ATOM 2156 CA ILE A 255 5.651 -1.351 14.535 1.00 2.87 C ATOM 2157 C ILE A 255 5.733 -0.102 15.406 1.00 2.82 C ATOM 2158 O ILE A 255 4.723 0.551 15.669 1.00 3.08 O ATOM 2159 CB ILE A 255 5.602 -2.594 15.443 1.00 3.78 C ATOM 2160 CG1 ILE A 255 5.458 -3.863 14.600 1.00 4.59 C ATOM 2161 CG2 ILE A 255 4.457 -2.479 16.437 1.00 4.88 C ATOM 2162 CD1 ILE A 255 4.191 -3.899 13.774 1.00 4.91 C ATOM 0 H ILE A 255 7.266 -2.305 13.600 1.00 2.46 H new ATOM 0 HA ILE A 255 4.742 -1.314 13.935 1.00 2.87 H new ATOM 0 HB ILE A 255 6.536 -2.655 16.001 1.00 3.78 H new ATOM 0 HG12 ILE A 255 6.318 -3.948 13.935 1.00 4.59 H new ATOM 0 HG13 ILE A 255 5.478 -4.731 15.259 1.00 4.59 H new ATOM 0 HG21 ILE A 255 4.436 -3.365 17.071 1.00 4.88 H new ATOM 0 HG22 ILE A 255 4.600 -1.593 17.056 1.00 4.88 H new ATOM 0 HG23 ILE A 255 3.514 -2.396 15.897 1.00 4.88 H new ATOM 0 HD11 ILE A 255 4.156 -4.826 13.202 1.00 4.91 H new ATOM 0 HD12 ILE A 255 3.325 -3.846 14.434 1.00 4.91 H new ATOM 0 HD13 ILE A 255 4.178 -3.050 13.090 1.00 4.91 H new ATOM 2174 N ARG A 256 6.942 0.225 15.849 1.00 2.83 N ATOM 2175 CA ARG A 256 7.157 1.396 16.691 1.00 3.43 C ATOM 2176 C ARG A 256 7.735 2.551 15.878 1.00 3.40 C ATOM 2177 O ARG A 256 8.289 3.498 16.433 1.00 4.24 O ATOM 2178 CB ARG A 256 8.095 1.054 17.849 1.00 3.91 C ATOM 2179 CG ARG A 256 9.477 0.607 17.401 1.00 3.82 C ATOM 2180 CD ARG A 256 9.623 -0.905 17.468 1.00 3.90 C ATOM 2181 NE ARG A 256 9.480 -1.409 18.831 1.00 4.60 N ATOM 2182 CZ ARG A 256 9.370 -2.699 19.129 1.00 5.56 C ATOM 2183 NH1 ARG A 256 9.386 -3.610 18.166 1.00 6.29 N ATOM 2184 NH2 ARG A 256 9.244 -3.080 20.394 1.00 6.40 N ATOM 0 H ARG A 256 7.788 -0.304 15.639 1.00 2.83 H new ATOM 0 HA ARG A 256 6.192 1.704 17.094 1.00 3.43 H new ATOM 0 HB2 ARG A 256 8.196 1.927 18.494 1.00 3.91 H new ATOM 0 HB3 ARG A 256 7.644 0.264 18.450 1.00 3.91 H new ATOM 0 HG2 ARG A 256 9.657 0.946 16.381 1.00 3.82 H new ATOM 0 HG3 ARG A 256 10.234 1.075 18.031 1.00 3.82 H new ATOM 0 HD2 ARG A 256 8.872 -1.370 16.829 1.00 3.90 H new ATOM 0 HD3 ARG A 256 10.598 -1.193 17.076 1.00 3.90 H new ATOM 0 HE ARG A 256 9.464 -0.734 19.596 1.00 4.60 H new ATOM 0 HH11 ARG A 256 9.483 -3.321 17.193 1.00 6.29 H new ATOM 0 HH12 ARG A 256 9.301 -4.600 18.399 1.00 6.29 H new ATOM 0 HH21 ARG A 256 9.232 -2.382 21.138 1.00 6.40 H new ATOM 0 HH22 ARG A 256 9.160 -4.071 20.622 1.00 6.40 H new ATOM 2198 N GLY A 257 7.602 2.464 14.557 1.00 2.84 N ATOM 2199 CA GLY A 257 8.117 3.507 13.689 1.00 3.35 C ATOM 2200 C GLY A 257 7.586 3.398 12.274 1.00 3.13 C ATOM 2201 O GLY A 257 7.998 2.520 11.515 1.00 3.78 O ATOM 0 H GLY A 257 7.147 1.690 14.073 1.00 2.84 H new ATOM 0 HA2 GLY A 257 7.851 4.481 14.099 1.00 3.35 H new ATOM 0 HA3 GLY A 257 9.206 3.455 13.670 1.00 3.35 H new ATOM 2205 N ILE A 258 6.667 4.290 11.918 1.00 2.95 N ATOM 2206 CA ILE A 258 6.079 4.289 10.585 1.00 3.07 C ATOM 2207 C ILE A 258 5.685 5.699 10.157 1.00 4.10 C ATOM 2208 O ILE A 258 6.101 6.176 9.102 1.00 4.95 O ATOM 2209 CB ILE A 258 4.838 3.379 10.517 1.00 2.61 C ATOM 2210 CG1 ILE A 258 5.247 1.949 10.159 1.00 2.64 C ATOM 2211 CG2 ILE A 258 3.840 3.919 9.505 1.00 2.84 C ATOM 2212 CD1 ILE A 258 5.794 1.810 8.756 1.00 2.56 C ATOM 0 H ILE A 258 6.314 5.022 12.534 1.00 2.95 H new ATOM 0 HA ILE A 258 6.839 3.904 9.905 1.00 3.07 H new ATOM 0 HB ILE A 258 4.361 3.366 11.497 1.00 2.61 H new ATOM 0 HG12 ILE A 258 6.000 1.607 10.869 1.00 2.64 H new ATOM 0 HG13 ILE A 258 4.383 1.294 10.270 1.00 2.64 H new ATOM 0 HG21 ILE A 258 2.969 3.265 9.469 1.00 2.84 H new ATOM 0 HG22 ILE A 258 3.529 4.921 9.800 1.00 2.84 H new ATOM 0 HG23 ILE A 258 4.306 3.958 8.520 1.00 2.84 H new ATOM 0 HD11 ILE A 258 6.063 0.770 8.572 1.00 2.56 H new ATOM 0 HD12 ILE A 258 5.036 2.121 8.037 1.00 2.56 H new ATOM 0 HD13 ILE A 258 6.678 2.438 8.646 1.00 2.56 H new