USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 822 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 215 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 218 GLN : amide:sc= -0.435 X(o=-0.43,f=0) USER MOD Set 2.1: A 128 MET CE :methyl -160:sc= -1.46 (180deg=-3.28!) USER MOD Set 2.2: A 162 TYR OH : rot 30:sc= 0.911 USER MOD Set 2.3: A 212 MET CE :methyl -147:sc= -11.1! (180deg=-14.3!) USER MOD Set 2.4: A 216 GLN : amide:sc= -2.92! C(o=-15!,f=-24!) USER MOD Set 2.5: A 219 GLN : amide:sc= -0.178 K(o=-15,f=-21!) USER MOD Set 3.1: A 161 TYR OH : rot 0:sc= 0.729 USER MOD Set 3.2: A 185 GLN : amide:sc= -0.423 X(o=-5.4,f=-5.5) USER MOD Set 3.3: A 186 HIS : no HE2:sc= -5.7! K(o=-5.4!,f=-4.2) USER MOD Set 4.1: A 167 GLN : amide:sc= -1.83! K(o=-1.3!,f=1.4) USER MOD Set 4.2: A 221 SER OG : rot -59:sc= 0.539 USER MOD Set 5.1: A 152 ASN : amide:sc= -25.2! C(o=-35!,f=-36!) USER MOD Set 5.2: A 153 MET CE :methyl -158:sc= -9.48! (180deg=-9.64!) USER MOD Single : A 127 TYR OH : rot -114:sc= 1.15 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -140:sc= -7.54! (180deg=-10.1!) USER MOD Single : A 134 SER OG : rot -41:sc= 0.251 USER MOD Single : A 139 HIS : no HD1:sc= 0.457 K(o=0.46,f=-2.5!) USER MOD Single : A 142 ASN : amide:sc= 1.2 K(o=1.2,f=-0.39) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot -116:sc= 1.15 USER MOD Single : A 149 TYR OH : rot -138:sc= 1.21 USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot 46:sc= 1.18 USER MOD Single : A 158 ASN : amide:sc= -1.15 X(o=-1.2,f=-0.67) USER MOD Single : A 159 GLN : amide:sc= -0.889 K(o=-0.89,f=0) USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 SER OG : rot -40:sc= 0.205 USER MOD Single : A 170 ASN : amide:sc= -0.149 X(o=-0.15,f=-0.25) USER MOD Single : A 171 GLN : amide:sc= -4.36! C(o=-4.4!,f=-7.4!) USER MOD Single : A 172 ASN : amide:sc= -3.59! K(o=-3.6!,f=-1.4) USER MOD Single : A 173 ASN : amide:sc=-0.00444 X(o=-0.0044,f=0) USER MOD Single : A 176 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 180 ASN : amide:sc= -2.8! K(o=-2.8!,f=-0.98) USER MOD Single : A 182 THR OG1 : rot -102:sc= -4.4! USER MOD Single : A 184 LYS NZ :NH3+ 152:sc= -0.0533 (180deg=-0.453) USER MOD Single : A 187 THR OG1 : rot -42:sc= 0.677 USER MOD Single : A 189 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 86:sc= 1.27 USER MOD Single : A 191 THR OG1 : rot 170:sc= -0.145 USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD Single : A 193 LYS NZ :NH3+ 179:sc= 1.12 (180deg=1.04) USER MOD Single : A 196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 THR OG1 : rot 180:sc= 0 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ -107:sc= 1.29 (180deg=-0.46) USER MOD Single : A 205 MET CE :methyl -153:sc= -10.5! (180deg=-13.9!) USER MOD Single : A 211 GLN : amide:sc= -0.0568 K(o=-0.057,f=-0.63) USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 222 GLN : amide:sc= -0.418 K(o=-0.42,f=-1.3) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -1.6! K(o=-1.6!,f=-0.3) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 124 5.399 -12.578 1.336 1.00 1.95 N ATOM 2 CA LEU A 124 4.676 -11.876 2.419 1.00 1.27 C ATOM 3 C LEU A 124 5.003 -12.511 3.764 1.00 1.45 C ATOM 4 O LEU A 124 4.774 -11.911 4.813 1.00 2.10 O ATOM 5 CB LEU A 124 3.176 -11.904 2.138 1.00 1.02 C ATOM 6 CG LEU A 124 2.787 -11.207 0.836 1.00 1.01 C ATOM 7 CD1 LEU A 124 1.294 -11.272 0.603 1.00 1.54 C ATOM 8 CD2 LEU A 124 3.255 -9.766 0.856 1.00 1.39 C ATOM 0 HA LEU A 124 4.996 -10.835 2.457 1.00 1.27 H new ATOM 0 HB2 LEU A 124 2.841 -12.940 2.100 1.00 1.02 H new ATOM 0 HB3 LEU A 124 2.650 -11.429 2.966 1.00 1.02 H new ATOM 0 HG LEU A 124 3.276 -11.729 0.014 1.00 1.01 H new ATOM 0 HD11 LEU A 124 1.049 -10.767 -0.332 1.00 1.54 H new ATOM 0 HD12 LEU A 124 0.980 -12.314 0.546 1.00 1.54 H new ATOM 0 HD13 LEU A 124 0.775 -10.782 1.427 1.00 1.54 H new ATOM 0 HD21 LEU A 124 2.972 -9.279 -0.077 1.00 1.39 H new ATOM 0 HD22 LEU A 124 2.791 -9.244 1.693 1.00 1.39 H new ATOM 0 HD23 LEU A 124 4.339 -9.737 0.967 1.00 1.39 H new ATOM 20 N GLY A 125 5.520 -13.739 3.727 1.00 1.53 N ATOM 21 CA GLY A 125 6.191 -14.285 4.888 1.00 1.74 C ATOM 22 C GLY A 125 7.454 -13.495 5.147 1.00 1.74 C ATOM 23 O GLY A 125 7.823 -13.230 6.292 1.00 2.56 O ATOM 0 H GLY A 125 5.485 -14.359 2.918 1.00 1.53 H new ATOM 0 HA2 GLY A 125 5.535 -14.240 5.757 1.00 1.74 H new ATOM 0 HA3 GLY A 125 6.432 -15.335 4.724 1.00 1.74 H new ATOM 27 N GLY A 126 8.114 -13.133 4.051 1.00 1.12 N ATOM 28 CA GLY A 126 9.156 -12.141 4.080 1.00 1.08 C ATOM 29 C GLY A 126 8.639 -10.850 3.485 1.00 0.96 C ATOM 30 O GLY A 126 7.425 -10.646 3.445 1.00 1.39 O ATOM 0 H GLY A 126 7.934 -13.524 3.126 1.00 1.12 H new ATOM 0 HA2 GLY A 126 9.486 -11.975 5.105 1.00 1.08 H new ATOM 0 HA3 GLY A 126 10.022 -12.491 3.519 1.00 1.08 H new ATOM 34 N TYR A 127 9.540 -9.997 3.008 1.00 0.57 N ATOM 35 CA TYR A 127 9.175 -8.688 2.490 1.00 0.44 C ATOM 36 C TYR A 127 8.771 -7.825 3.644 1.00 0.40 C ATOM 37 O TYR A 127 7.633 -7.873 4.115 1.00 0.60 O ATOM 38 CB TYR A 127 8.043 -8.721 1.453 1.00 0.46 C ATOM 39 CG TYR A 127 8.464 -8.842 0.004 1.00 0.65 C ATOM 40 CD1 TYR A 127 9.590 -8.194 -0.483 1.00 1.09 C ATOM 41 CD2 TYR A 127 7.695 -9.580 -0.887 1.00 1.10 C ATOM 42 CE1 TYR A 127 9.942 -8.285 -1.817 1.00 1.30 C ATOM 43 CE2 TYR A 127 8.036 -9.668 -2.222 1.00 1.26 C ATOM 44 CZ TYR A 127 9.159 -9.020 -2.682 1.00 1.17 C ATOM 45 OH TYR A 127 9.495 -9.101 -4.014 1.00 1.41 O ATOM 0 H TYR A 127 10.540 -10.195 2.971 1.00 0.57 H new ATOM 0 HA TYR A 127 10.046 -8.291 1.969 1.00 0.44 H new ATOM 0 HB2 TYR A 127 7.387 -9.558 1.690 1.00 0.46 H new ATOM 0 HB3 TYR A 127 7.452 -7.812 1.563 1.00 0.46 H new ATOM 0 HD1 TYR A 127 10.200 -7.610 0.190 1.00 1.09 H new ATOM 0 HD2 TYR A 127 6.815 -10.094 -0.529 1.00 1.10 H new ATOM 0 HE1 TYR A 127 10.826 -7.783 -2.180 1.00 1.30 H new ATOM 0 HE2 TYR A 127 7.424 -10.243 -2.902 1.00 1.26 H new ATOM 0 HH TYR A 127 8.809 -8.654 -4.552 1.00 1.41 H new ATOM 55 N MET A 128 9.751 -7.094 4.114 1.00 0.42 N ATOM 56 CA MET A 128 9.591 -6.119 5.159 1.00 0.37 C ATOM 57 C MET A 128 8.257 -5.411 5.061 1.00 0.31 C ATOM 58 O MET A 128 7.984 -4.698 4.092 1.00 0.30 O ATOM 59 CB MET A 128 10.724 -5.125 5.042 1.00 0.45 C ATOM 60 CG MET A 128 11.235 -4.662 6.375 1.00 0.90 C ATOM 61 SD MET A 128 10.204 -3.396 7.135 1.00 1.18 S ATOM 62 CE MET A 128 9.836 -2.361 5.719 1.00 0.45 C ATOM 0 H MET A 128 10.708 -7.164 3.769 1.00 0.42 H new ATOM 0 HA MET A 128 9.614 -6.618 6.128 1.00 0.37 H new ATOM 0 HB2 MET A 128 11.542 -5.579 4.483 1.00 0.45 H new ATOM 0 HB3 MET A 128 10.386 -4.262 4.469 1.00 0.45 H new ATOM 0 HG2 MET A 128 11.302 -5.517 7.047 1.00 0.90 H new ATOM 0 HG3 MET A 128 12.246 -4.272 6.253 1.00 0.90 H new ATOM 0 HE1 MET A 128 9.523 -1.375 6.061 1.00 0.45 H new ATOM 0 HE2 MET A 128 10.727 -2.264 5.098 1.00 0.45 H new ATOM 0 HE3 MET A 128 9.034 -2.814 5.136 1.00 0.45 H new ATOM 72 N LEU A 129 7.409 -5.668 6.044 1.00 0.32 N ATOM 73 CA LEU A 129 6.172 -4.938 6.166 1.00 0.28 C ATOM 74 C LEU A 129 6.519 -3.471 6.218 1.00 0.26 C ATOM 75 O LEU A 129 7.181 -3.035 7.154 1.00 0.30 O ATOM 76 CB LEU A 129 5.405 -5.364 7.439 1.00 0.33 C ATOM 77 CG LEU A 129 4.037 -4.711 7.681 1.00 0.35 C ATOM 78 CD1 LEU A 129 4.189 -3.292 8.189 1.00 0.87 C ATOM 79 CD2 LEU A 129 3.181 -4.753 6.428 1.00 0.80 C ATOM 0 H LEU A 129 7.560 -6.375 6.763 1.00 0.32 H new ATOM 0 HA LEU A 129 5.522 -5.147 5.317 1.00 0.28 H new ATOM 0 HB2 LEU A 129 5.263 -6.444 7.403 1.00 0.33 H new ATOM 0 HB3 LEU A 129 6.038 -5.154 8.302 1.00 0.33 H new ATOM 0 HG LEU A 129 3.527 -5.287 8.453 1.00 0.35 H new ATOM 0 HD11 LEU A 129 3.203 -2.856 8.351 1.00 0.87 H new ATOM 0 HD12 LEU A 129 4.741 -3.299 9.129 1.00 0.87 H new ATOM 0 HD13 LEU A 129 4.732 -2.698 7.453 1.00 0.87 H new ATOM 0 HD21 LEU A 129 2.218 -4.283 6.629 1.00 0.80 H new ATOM 0 HD22 LEU A 129 3.686 -4.216 5.625 1.00 0.80 H new ATOM 0 HD23 LEU A 129 3.024 -5.789 6.129 1.00 0.80 H new ATOM 91 N GLY A 130 6.124 -2.738 5.189 1.00 0.23 N ATOM 92 CA GLY A 130 6.250 -1.305 5.195 1.00 0.25 C ATOM 93 C GLY A 130 5.486 -0.732 6.344 1.00 0.21 C ATOM 94 O GLY A 130 4.303 -0.407 6.200 1.00 0.20 O ATOM 0 H GLY A 130 5.712 -3.123 4.339 1.00 0.23 H new ATOM 0 HA2 GLY A 130 7.301 -1.024 5.269 1.00 0.25 H new ATOM 0 HA3 GLY A 130 5.876 -0.894 4.257 1.00 0.25 H new ATOM 98 N SER A 131 6.175 -0.754 7.482 1.00 0.26 N ATOM 99 CA SER A 131 5.696 -0.315 8.799 1.00 0.31 C ATOM 100 C SER A 131 4.588 0.723 8.726 1.00 0.23 C ATOM 101 O SER A 131 4.839 1.925 8.812 1.00 0.29 O ATOM 102 CB SER A 131 6.872 0.224 9.621 1.00 0.53 C ATOM 103 OG SER A 131 6.486 0.516 10.951 1.00 1.41 O ATOM 0 H SER A 131 7.135 -1.096 7.517 1.00 0.26 H new ATOM 0 HA SER A 131 5.263 -1.189 9.285 1.00 0.31 H new ATOM 0 HB2 SER A 131 7.678 -0.509 9.628 1.00 0.53 H new ATOM 0 HB3 SER A 131 7.264 1.125 9.149 1.00 0.53 H new ATOM 0 HG SER A 131 7.259 0.856 11.449 1.00 1.41 H new ATOM 109 N ALA A 132 3.366 0.223 8.554 1.00 0.23 N ATOM 110 CA ALA A 132 2.163 1.043 8.479 1.00 0.24 C ATOM 111 C ALA A 132 2.330 2.245 7.550 1.00 0.21 C ATOM 112 O ALA A 132 1.659 3.270 7.721 1.00 0.31 O ATOM 113 CB ALA A 132 1.734 1.478 9.869 1.00 0.33 C ATOM 0 H ALA A 132 3.183 -0.776 8.462 1.00 0.23 H new ATOM 0 HA ALA A 132 1.376 0.426 8.045 1.00 0.24 H new ATOM 0 HB1 ALA A 132 0.835 2.090 9.797 1.00 0.33 H new ATOM 0 HB2 ALA A 132 1.527 0.598 10.478 1.00 0.33 H new ATOM 0 HB3 ALA A 132 2.532 2.059 10.331 1.00 0.33 H new ATOM 119 N MET A 133 3.167 2.068 6.526 1.00 0.16 N ATOM 120 CA MET A 133 3.341 3.057 5.465 1.00 0.21 C ATOM 121 C MET A 133 3.544 4.455 6.032 1.00 0.29 C ATOM 122 O MET A 133 4.054 4.622 7.140 1.00 0.55 O ATOM 123 CB MET A 133 2.129 3.006 4.514 1.00 0.20 C ATOM 124 CG MET A 133 2.162 1.788 3.600 1.00 0.26 C ATOM 125 SD MET A 133 0.563 1.328 2.881 1.00 0.41 S ATOM 126 CE MET A 133 0.090 2.787 1.976 1.00 0.22 C ATOM 0 H MET A 133 3.743 1.234 6.411 1.00 0.16 H new ATOM 0 HA MET A 133 4.242 2.814 4.902 1.00 0.21 H new ATOM 0 HB2 MET A 133 1.210 2.993 5.100 1.00 0.20 H new ATOM 0 HB3 MET A 133 2.107 3.912 3.908 1.00 0.20 H new ATOM 0 HG2 MET A 133 2.866 1.979 2.790 1.00 0.26 H new ATOM 0 HG3 MET A 133 2.548 0.939 4.164 1.00 0.26 H new ATOM 0 HE1 MET A 133 -0.979 2.962 2.100 1.00 0.22 H new ATOM 0 HE2 MET A 133 0.644 3.646 2.355 1.00 0.22 H new ATOM 0 HE3 MET A 133 0.314 2.648 0.918 1.00 0.22 H new ATOM 136 N SER A 134 3.181 5.458 5.264 1.00 0.47 N ATOM 137 CA SER A 134 3.245 6.821 5.742 1.00 0.56 C ATOM 138 C SER A 134 1.838 7.306 6.103 1.00 0.61 C ATOM 139 O SER A 134 1.634 8.489 6.366 1.00 0.74 O ATOM 140 CB SER A 134 3.876 7.719 4.667 1.00 0.65 C ATOM 141 OG SER A 134 4.217 8.996 5.186 1.00 1.52 O ATOM 0 H SER A 134 2.839 5.356 4.308 1.00 0.47 H new ATOM 0 HA SER A 134 3.867 6.868 6.636 1.00 0.56 H new ATOM 0 HB2 SER A 134 4.769 7.238 4.268 1.00 0.65 H new ATOM 0 HB3 SER A 134 3.180 7.837 3.837 1.00 0.65 H new ATOM 0 HG SER A 134 3.504 9.308 5.782 1.00 1.52 H new ATOM 147 N ARG A 135 0.879 6.365 6.149 1.00 0.61 N ATOM 148 CA ARG A 135 -0.536 6.711 6.335 1.00 0.76 C ATOM 149 C ARG A 135 -0.963 7.728 5.299 1.00 0.75 C ATOM 150 O ARG A 135 -1.160 8.904 5.606 1.00 1.14 O ATOM 151 CB ARG A 135 -0.781 7.276 7.721 1.00 1.01 C ATOM 152 CG ARG A 135 -1.326 6.261 8.702 1.00 0.98 C ATOM 153 CD ARG A 135 -2.626 5.661 8.193 1.00 1.57 C ATOM 154 NE ARG A 135 -3.331 4.941 9.255 1.00 2.57 N ATOM 155 CZ ARG A 135 -4.651 4.949 9.437 1.00 3.27 C ATOM 156 NH1 ARG A 135 -5.432 5.696 8.678 1.00 3.37 N ATOM 157 NH2 ARG A 135 -5.184 4.223 10.406 1.00 4.17 N ATOM 0 H ARG A 135 1.059 5.365 6.060 1.00 0.61 H new ATOM 0 HA ARG A 135 -1.122 5.799 6.219 1.00 0.76 H new ATOM 0 HB2 ARG A 135 0.154 7.679 8.110 1.00 1.01 H new ATOM 0 HB3 ARG A 135 -1.481 8.109 7.646 1.00 1.01 H new ATOM 0 HG2 ARG A 135 -0.592 5.470 8.859 1.00 0.98 H new ATOM 0 HG3 ARG A 135 -1.494 6.737 9.668 1.00 0.98 H new ATOM 0 HD2 ARG A 135 -3.265 6.452 7.801 1.00 1.57 H new ATOM 0 HD3 ARG A 135 -2.417 4.981 7.367 1.00 1.57 H new ATOM 0 HE ARG A 135 -2.769 4.391 9.905 1.00 2.57 H new ATOM 0 HH11 ARG A 135 -5.026 6.275 7.943 1.00 3.37 H new ATOM 0 HH12 ARG A 135 -6.441 5.694 8.827 1.00 3.37 H new ATOM 0 HH21 ARG A 135 -4.585 3.660 11.010 1.00 4.17 H new ATOM 0 HH22 ARG A 135 -6.194 4.226 10.549 1.00 4.17 H new ATOM 171 N PRO A 136 -1.068 7.291 4.049 1.00 0.54 N ATOM 172 CA PRO A 136 -1.390 8.168 2.927 1.00 0.50 C ATOM 173 C PRO A 136 -2.711 8.846 3.100 1.00 0.51 C ATOM 174 O PRO A 136 -2.786 10.074 3.144 1.00 0.57 O ATOM 175 CB PRO A 136 -1.437 7.212 1.749 1.00 0.55 C ATOM 176 CG PRO A 136 -0.528 6.145 2.174 1.00 0.62 C ATOM 177 CD PRO A 136 -0.852 5.911 3.600 1.00 0.59 C ATOM 0 HA PRO A 136 -0.668 8.977 2.815 1.00 0.50 H new ATOM 0 HB2 PRO A 136 -2.445 6.839 1.568 1.00 0.55 H new ATOM 0 HB3 PRO A 136 -1.103 7.687 0.827 1.00 0.55 H new ATOM 0 HG2 PRO A 136 -0.676 5.242 1.582 1.00 0.62 H new ATOM 0 HG3 PRO A 136 0.514 6.441 2.049 1.00 0.62 H new ATOM 0 HD2 PRO A 136 -1.738 5.289 3.728 1.00 0.59 H new ATOM 0 HD3 PRO A 136 -0.039 5.422 4.136 1.00 0.59 H new ATOM 185 N LEU A 137 -3.745 8.029 3.211 1.00 0.50 N ATOM 186 CA LEU A 137 -5.073 8.523 3.414 1.00 0.54 C ATOM 187 C LEU A 137 -5.410 9.512 2.327 1.00 0.58 C ATOM 188 O LEU A 137 -5.633 10.700 2.562 1.00 0.99 O ATOM 189 CB LEU A 137 -5.154 9.129 4.800 1.00 0.59 C ATOM 190 CG LEU A 137 -4.856 8.112 5.883 1.00 0.64 C ATOM 191 CD1 LEU A 137 -4.471 8.793 7.178 1.00 0.97 C ATOM 192 CD2 LEU A 137 -6.056 7.202 6.049 1.00 0.90 C ATOM 0 H LEU A 137 -3.676 7.013 3.162 1.00 0.50 H new ATOM 0 HA LEU A 137 -5.808 7.720 3.355 1.00 0.54 H new ATOM 0 HB2 LEU A 137 -4.448 9.956 4.876 1.00 0.59 H new ATOM 0 HB3 LEU A 137 -6.150 9.544 4.957 1.00 0.59 H new ATOM 0 HG LEU A 137 -4.000 7.505 5.590 1.00 0.64 H new ATOM 0 HD11 LEU A 137 -4.263 8.039 7.937 1.00 0.97 H new ATOM 0 HD12 LEU A 137 -3.582 9.403 7.018 1.00 0.97 H new ATOM 0 HD13 LEU A 137 -5.291 9.428 7.513 1.00 0.97 H new ATOM 0 HD21 LEU A 137 -5.850 6.467 6.827 1.00 0.90 H new ATOM 0 HD22 LEU A 137 -6.926 7.795 6.331 1.00 0.90 H new ATOM 0 HD23 LEU A 137 -6.256 6.689 5.108 1.00 0.90 H new ATOM 204 N ILE A 138 -5.401 9.003 1.120 1.00 0.55 N ATOM 205 CA ILE A 138 -5.575 9.828 -0.036 1.00 0.64 C ATOM 206 C ILE A 138 -7.038 9.866 -0.419 1.00 0.61 C ATOM 207 O ILE A 138 -7.555 9.023 -1.142 1.00 1.10 O ATOM 208 CB ILE A 138 -4.679 9.366 -1.182 1.00 0.91 C ATOM 209 CG1 ILE A 138 -3.550 8.503 -0.619 1.00 1.07 C ATOM 210 CG2 ILE A 138 -4.109 10.575 -1.906 1.00 1.17 C ATOM 211 CD1 ILE A 138 -2.419 8.291 -1.573 1.00 0.63 C ATOM 0 H ILE A 138 -5.273 8.011 0.918 1.00 0.55 H new ATOM 0 HA ILE A 138 -5.267 10.847 0.198 1.00 0.64 H new ATOM 0 HB ILE A 138 -5.260 8.777 -1.892 1.00 0.91 H new ATOM 0 HG12 ILE A 138 -3.166 8.970 0.287 1.00 1.07 H new ATOM 0 HG13 ILE A 138 -3.956 7.534 -0.330 1.00 1.07 H new ATOM 0 HG21 ILE A 138 -3.470 10.242 -2.724 1.00 1.17 H new ATOM 0 HG22 ILE A 138 -4.925 11.178 -2.306 1.00 1.17 H new ATOM 0 HG23 ILE A 138 -3.523 11.174 -1.209 1.00 1.17 H new ATOM 0 HD11 ILE A 138 -1.657 7.670 -1.102 1.00 0.63 H new ATOM 0 HD12 ILE A 138 -2.788 7.795 -2.470 1.00 0.63 H new ATOM 0 HD13 ILE A 138 -1.986 9.254 -1.843 1.00 0.63 H new ATOM 223 N HIS A 139 -7.657 10.853 0.182 1.00 0.40 N ATOM 224 CA HIS A 139 -9.086 11.183 0.151 1.00 0.41 C ATOM 225 C HIS A 139 -9.756 11.131 -1.219 1.00 0.46 C ATOM 226 O HIS A 139 -10.973 11.295 -1.297 1.00 0.82 O ATOM 227 CB HIS A 139 -9.252 12.569 0.787 1.00 0.53 C ATOM 228 CG HIS A 139 -7.997 13.389 0.681 1.00 0.65 C ATOM 229 ND1 HIS A 139 -6.985 13.299 1.613 1.00 0.86 N ATOM 230 CD2 HIS A 139 -7.529 14.187 -0.303 1.00 1.13 C ATOM 231 CE1 HIS A 139 -5.949 13.997 1.203 1.00 1.07 C ATOM 232 NE2 HIS A 139 -6.245 14.548 0.040 1.00 1.28 N ATOM 0 H HIS A 139 -7.138 11.513 0.761 1.00 0.40 H new ATOM 0 HA HIS A 139 -9.603 10.403 0.710 1.00 0.41 H new ATOM 0 HB2 HIS A 139 -10.072 13.096 0.300 1.00 0.53 H new ATOM 0 HB3 HIS A 139 -9.524 12.456 1.836 1.00 0.53 H new ATOM 0 HD2 HIS A 139 -8.062 14.486 -1.193 1.00 1.13 H new ATOM 0 HE1 HIS A 139 -5.012 14.102 1.730 1.00 1.07 H new ATOM 0 HE2 HIS A 139 -5.626 15.142 -0.512 1.00 1.28 H new ATOM 241 N PHE A 140 -8.984 10.945 -2.289 1.00 0.45 N ATOM 242 CA PHE A 140 -9.543 10.689 -3.624 1.00 0.41 C ATOM 243 C PHE A 140 -10.126 11.945 -4.250 1.00 0.46 C ATOM 244 O PHE A 140 -10.259 12.036 -5.468 1.00 0.64 O ATOM 245 CB PHE A 140 -10.640 9.613 -3.566 1.00 0.38 C ATOM 246 CG PHE A 140 -10.140 8.221 -3.345 1.00 0.70 C ATOM 247 CD1 PHE A 140 -9.803 7.415 -4.416 1.00 0.74 C ATOM 248 CD2 PHE A 140 -9.980 7.730 -2.065 1.00 1.23 C ATOM 249 CE1 PHE A 140 -9.313 6.144 -4.214 1.00 1.19 C ATOM 250 CE2 PHE A 140 -9.496 6.458 -1.855 1.00 1.74 C ATOM 251 CZ PHE A 140 -9.273 5.624 -2.941 1.00 1.70 C ATOM 0 H PHE A 140 -7.965 10.966 -2.261 1.00 0.45 H new ATOM 0 HA PHE A 140 -8.715 10.341 -4.241 1.00 0.41 H new ATOM 0 HB2 PHE A 140 -11.336 9.866 -2.766 1.00 0.38 H new ATOM 0 HB3 PHE A 140 -11.204 9.638 -4.498 1.00 0.38 H new ATOM 0 HD1 PHE A 140 -9.925 7.786 -5.423 1.00 0.74 H new ATOM 0 HD2 PHE A 140 -10.237 8.350 -1.219 1.00 1.23 H new ATOM 0 HE1 PHE A 140 -8.962 5.558 -5.051 1.00 1.19 H new ATOM 0 HE2 PHE A 140 -9.292 6.112 -0.852 1.00 1.74 H new ATOM 0 HZ PHE A 140 -9.070 4.574 -2.788 1.00 1.70 H new ATOM 261 N GLY A 141 -10.463 12.909 -3.416 1.00 0.47 N ATOM 262 CA GLY A 141 -11.256 14.019 -3.865 1.00 0.53 C ATOM 263 C GLY A 141 -12.722 13.709 -3.683 1.00 0.48 C ATOM 264 O GLY A 141 -13.592 14.501 -4.049 1.00 0.54 O ATOM 0 H GLY A 141 -10.199 12.940 -2.431 1.00 0.47 H new ATOM 0 HA2 GLY A 141 -10.993 14.916 -3.304 1.00 0.53 H new ATOM 0 HA3 GLY A 141 -11.047 14.226 -4.914 1.00 0.53 H new ATOM 268 N ASN A 142 -12.995 12.545 -3.088 1.00 0.41 N ATOM 269 CA ASN A 142 -14.355 12.096 -2.873 1.00 0.45 C ATOM 270 C ASN A 142 -14.475 11.634 -1.447 1.00 0.47 C ATOM 271 O ASN A 142 -14.003 10.564 -1.129 1.00 0.46 O ATOM 272 CB ASN A 142 -14.710 10.927 -3.802 1.00 0.48 C ATOM 273 CG ASN A 142 -14.671 11.283 -5.273 1.00 1.22 C ATOM 274 OD1 ASN A 142 -15.035 12.389 -5.671 1.00 1.71 O ATOM 275 ND2 ASN A 142 -14.209 10.346 -6.084 1.00 1.88 N ATOM 0 H ASN A 142 -12.282 11.900 -2.748 1.00 0.41 H new ATOM 0 HA ASN A 142 -15.037 12.920 -3.084 1.00 0.45 H new ATOM 0 HB2 ASN A 142 -14.018 10.105 -3.618 1.00 0.48 H new ATOM 0 HB3 ASN A 142 -15.707 10.566 -3.551 1.00 0.48 H new ATOM 0 HD21 ASN A 142 -14.143 10.526 -7.086 1.00 1.88 H new ATOM 0 HD22 ASN A 142 -13.919 9.443 -5.708 1.00 1.88 H new ATOM 282 N ASP A 143 -15.070 12.442 -0.588 1.00 0.54 N ATOM 283 CA ASP A 143 -15.183 12.111 0.831 1.00 0.57 C ATOM 284 C ASP A 143 -15.900 10.786 1.047 1.00 0.52 C ATOM 285 O ASP A 143 -15.687 10.116 2.054 1.00 0.52 O ATOM 286 CB ASP A 143 -15.903 13.203 1.603 1.00 0.72 C ATOM 287 CG ASP A 143 -17.406 13.179 1.423 1.00 1.04 C ATOM 288 OD1 ASP A 143 -17.902 13.802 0.460 1.00 1.14 O ATOM 289 OD2 ASP A 143 -18.098 12.551 2.245 1.00 1.39 O ATOM 0 H ASP A 143 -15.486 13.337 -0.845 1.00 0.54 H new ATOM 0 HA ASP A 143 -14.164 12.023 1.208 1.00 0.57 H new ATOM 0 HB2 ASP A 143 -15.670 13.101 2.663 1.00 0.72 H new ATOM 0 HB3 ASP A 143 -15.522 14.173 1.285 1.00 0.72 H new ATOM 294 N TYR A 144 -16.746 10.419 0.100 1.00 0.53 N ATOM 295 CA TYR A 144 -17.392 9.121 0.114 1.00 0.55 C ATOM 296 C TYR A 144 -16.328 8.037 0.091 1.00 0.45 C ATOM 297 O TYR A 144 -16.402 7.036 0.796 1.00 0.47 O ATOM 298 CB TYR A 144 -18.305 9.005 -1.100 1.00 0.63 C ATOM 299 CG TYR A 144 -18.867 7.615 -1.323 1.00 0.82 C ATOM 300 CD1 TYR A 144 -19.930 7.155 -0.555 1.00 1.15 C ATOM 301 CD2 TYR A 144 -18.355 6.775 -2.303 1.00 0.90 C ATOM 302 CE1 TYR A 144 -20.466 5.898 -0.755 1.00 1.41 C ATOM 303 CE2 TYR A 144 -18.886 5.513 -2.508 1.00 1.19 C ATOM 304 CZ TYR A 144 -19.859 5.048 -1.736 1.00 1.40 C ATOM 305 OH TYR A 144 -20.476 3.825 -1.935 1.00 1.70 O ATOM 0 H TYR A 144 -17.002 11.007 -0.693 1.00 0.53 H new ATOM 0 HA TYR A 144 -17.992 9.005 1.016 1.00 0.55 H new ATOM 0 HB2 TYR A 144 -19.132 9.706 -0.987 1.00 0.63 H new ATOM 0 HB3 TYR A 144 -17.750 9.307 -1.988 1.00 0.63 H new ATOM 0 HD1 TYR A 144 -20.344 7.792 0.212 1.00 1.15 H new ATOM 0 HD2 TYR A 144 -17.530 7.111 -2.914 1.00 0.90 H new ATOM 0 HE1 TYR A 144 -21.321 5.564 -0.186 1.00 1.41 H new ATOM 0 HE2 TYR A 144 -18.502 4.898 -3.309 1.00 1.19 H new ATOM 0 HH TYR A 144 -19.990 3.321 -2.621 1.00 1.70 H new ATOM 315 N GLU A 145 -15.322 8.289 -0.711 1.00 0.39 N ATOM 316 CA GLU A 145 -14.189 7.406 -0.831 1.00 0.34 C ATOM 317 C GLU A 145 -13.144 7.718 0.201 1.00 0.33 C ATOM 318 O GLU A 145 -12.397 6.839 0.625 1.00 0.34 O ATOM 319 CB GLU A 145 -13.594 7.536 -2.191 1.00 0.34 C ATOM 320 CG GLU A 145 -14.459 6.897 -3.245 1.00 0.43 C ATOM 321 CD GLU A 145 -13.922 7.012 -4.661 1.00 1.12 C ATOM 322 OE1 GLU A 145 -13.271 8.024 -4.983 1.00 1.23 O ATOM 323 OE2 GLU A 145 -14.164 6.086 -5.468 1.00 2.20 O ATOM 0 H GLU A 145 -15.267 9.118 -1.302 1.00 0.39 H new ATOM 0 HA GLU A 145 -14.537 6.385 -0.671 1.00 0.34 H new ATOM 0 HB2 GLU A 145 -13.454 8.591 -2.427 1.00 0.34 H new ATOM 0 HB3 GLU A 145 -12.607 7.073 -2.201 1.00 0.34 H new ATOM 0 HG2 GLU A 145 -14.584 5.842 -3.003 1.00 0.43 H new ATOM 0 HG3 GLU A 145 -15.449 7.352 -3.208 1.00 0.43 H new ATOM 330 N ASP A 146 -13.091 8.976 0.591 1.00 0.37 N ATOM 331 CA ASP A 146 -12.203 9.398 1.635 1.00 0.45 C ATOM 332 C ASP A 146 -12.476 8.571 2.854 1.00 0.45 C ATOM 333 O ASP A 146 -11.590 8.055 3.526 1.00 0.49 O ATOM 334 CB ASP A 146 -12.395 10.873 1.969 1.00 0.56 C ATOM 335 CG ASP A 146 -11.714 11.291 3.262 1.00 1.11 C ATOM 336 OD1 ASP A 146 -10.502 11.570 3.240 1.00 1.44 O ATOM 337 OD2 ASP A 146 -12.398 11.358 4.309 1.00 1.40 O ATOM 0 H ASP A 146 -13.660 9.722 0.192 1.00 0.37 H new ATOM 0 HA ASP A 146 -11.175 9.264 1.297 1.00 0.45 H new ATOM 0 HB2 ASP A 146 -12.006 11.477 1.150 1.00 0.56 H new ATOM 0 HB3 ASP A 146 -13.461 11.086 2.043 1.00 0.56 H new ATOM 342 N ARG A 147 -13.743 8.428 3.084 1.00 0.47 N ATOM 343 CA ARG A 147 -14.248 7.627 4.155 1.00 0.52 C ATOM 344 C ARG A 147 -14.084 6.159 3.840 1.00 0.50 C ATOM 345 O ARG A 147 -13.806 5.348 4.718 1.00 0.54 O ATOM 346 CB ARG A 147 -15.716 8.010 4.370 1.00 0.57 C ATOM 347 CG ARG A 147 -16.631 6.856 4.775 1.00 0.66 C ATOM 348 CD ARG A 147 -17.130 6.102 3.552 1.00 0.69 C ATOM 349 NE ARG A 147 -17.515 4.722 3.851 1.00 1.11 N ATOM 350 CZ ARG A 147 -18.582 4.108 3.333 1.00 1.15 C ATOM 351 NH1 ARG A 147 -19.475 4.786 2.621 1.00 1.34 N ATOM 352 NH2 ARG A 147 -18.763 2.815 3.560 1.00 1.94 N ATOM 0 H ARG A 147 -14.469 8.873 2.523 1.00 0.47 H new ATOM 0 HA ARG A 147 -13.690 7.809 5.074 1.00 0.52 H new ATOM 0 HB2 ARG A 147 -15.766 8.781 5.139 1.00 0.57 H new ATOM 0 HB3 ARG A 147 -16.099 8.452 3.450 1.00 0.57 H new ATOM 0 HG2 ARG A 147 -16.093 6.174 5.433 1.00 0.66 H new ATOM 0 HG3 ARG A 147 -17.479 7.241 5.341 1.00 0.66 H new ATOM 0 HD2 ARG A 147 -17.986 6.629 3.131 1.00 0.69 H new ATOM 0 HD3 ARG A 147 -16.351 6.099 2.790 1.00 0.69 H new ATOM 0 HE ARG A 147 -16.929 4.194 4.498 1.00 1.11 H new ATOM 0 HH11 ARG A 147 -19.350 5.786 2.465 1.00 1.34 H new ATOM 0 HH12 ARG A 147 -20.286 4.306 2.230 1.00 1.34 H new ATOM 0 HH21 ARG A 147 -18.091 2.298 4.126 1.00 1.94 H new ATOM 0 HH22 ARG A 147 -19.575 2.337 3.169 1.00 1.94 H new ATOM 366 N TYR A 148 -14.236 5.834 2.576 1.00 0.45 N ATOM 367 CA TYR A 148 -14.214 4.460 2.137 1.00 0.46 C ATOM 368 C TYR A 148 -12.858 3.824 2.382 1.00 0.44 C ATOM 369 O TYR A 148 -12.745 2.612 2.466 1.00 0.57 O ATOM 370 CB TYR A 148 -14.607 4.395 0.661 1.00 0.47 C ATOM 371 CG TYR A 148 -14.909 3.011 0.156 1.00 0.49 C ATOM 372 CD1 TYR A 148 -15.852 2.210 0.788 1.00 0.71 C ATOM 373 CD2 TYR A 148 -14.255 2.509 -0.955 1.00 0.38 C ATOM 374 CE1 TYR A 148 -16.129 0.941 0.324 1.00 0.77 C ATOM 375 CE2 TYR A 148 -14.526 1.244 -1.427 1.00 0.43 C ATOM 376 CZ TYR A 148 -15.466 0.462 -0.784 1.00 0.60 C ATOM 377 OH TYR A 148 -15.735 -0.807 -1.247 1.00 0.68 O ATOM 0 H TYR A 148 -14.378 6.512 1.828 1.00 0.45 H new ATOM 0 HA TYR A 148 -14.937 3.889 2.719 1.00 0.46 H new ATOM 0 HB2 TYR A 148 -15.483 5.025 0.503 1.00 0.47 H new ATOM 0 HB3 TYR A 148 -13.799 4.818 0.064 1.00 0.47 H new ATOM 0 HD1 TYR A 148 -16.375 2.586 1.655 1.00 0.71 H new ATOM 0 HD2 TYR A 148 -13.520 3.119 -1.460 1.00 0.38 H new ATOM 0 HE1 TYR A 148 -16.861 0.327 0.827 1.00 0.77 H new ATOM 0 HE2 TYR A 148 -14.007 0.865 -2.295 1.00 0.43 H new ATOM 0 HH TYR A 148 -14.932 -1.363 -1.164 1.00 0.68 H new ATOM 387 N TYR A 149 -11.837 4.653 2.476 1.00 0.41 N ATOM 388 CA TYR A 149 -10.496 4.204 2.769 1.00 0.43 C ATOM 389 C TYR A 149 -10.149 4.437 4.207 1.00 0.41 C ATOM 390 O TYR A 149 -9.308 3.764 4.776 1.00 0.40 O ATOM 391 CB TYR A 149 -9.518 4.906 1.866 1.00 0.54 C ATOM 392 CG TYR A 149 -9.152 6.305 2.248 1.00 0.67 C ATOM 393 CD1 TYR A 149 -8.502 6.598 3.429 1.00 0.97 C ATOM 394 CD2 TYR A 149 -9.490 7.331 1.406 1.00 1.40 C ATOM 395 CE1 TYR A 149 -8.218 7.897 3.775 1.00 1.54 C ATOM 396 CE2 TYR A 149 -9.202 8.633 1.733 1.00 2.09 C ATOM 397 CZ TYR A 149 -8.567 8.915 2.924 1.00 2.08 C ATOM 398 OH TYR A 149 -8.299 10.221 3.268 1.00 2.82 O ATOM 0 H TYR A 149 -11.918 5.662 2.350 1.00 0.41 H new ATOM 0 HA TYR A 149 -10.442 3.130 2.588 1.00 0.43 H new ATOM 0 HB2 TYR A 149 -8.605 4.313 1.823 1.00 0.54 H new ATOM 0 HB3 TYR A 149 -9.934 4.924 0.859 1.00 0.54 H new ATOM 0 HD1 TYR A 149 -8.212 5.795 4.091 1.00 0.97 H new ATOM 0 HD2 TYR A 149 -9.989 7.113 0.473 1.00 1.40 H new ATOM 0 HE1 TYR A 149 -7.724 8.115 4.710 1.00 1.54 H new ATOM 0 HE2 TYR A 149 -9.472 9.433 1.060 1.00 2.09 H new ATOM 0 HH TYR A 149 -9.065 10.785 3.032 1.00 2.82 H new ATOM 408 N ARG A 150 -10.767 5.433 4.786 1.00 0.45 N ATOM 409 CA ARG A 150 -10.439 5.819 6.129 1.00 0.48 C ATOM 410 C ARG A 150 -11.049 4.802 7.056 1.00 0.50 C ATOM 411 O ARG A 150 -10.703 4.682 8.232 1.00 0.60 O ATOM 412 CB ARG A 150 -10.912 7.254 6.345 1.00 0.56 C ATOM 413 CG ARG A 150 -12.345 7.425 6.852 1.00 0.59 C ATOM 414 CD ARG A 150 -12.471 7.172 8.350 1.00 1.15 C ATOM 415 NE ARG A 150 -11.471 7.903 9.128 1.00 1.83 N ATOM 416 CZ ARG A 150 -10.956 7.464 10.278 1.00 2.65 C ATOM 417 NH1 ARG A 150 -11.329 6.288 10.769 1.00 2.97 N ATOM 418 NH2 ARG A 150 -10.056 8.194 10.923 1.00 3.59 N ATOM 0 H ARG A 150 -11.500 5.990 4.347 1.00 0.45 H new ATOM 0 HA ARG A 150 -9.368 5.824 6.331 1.00 0.48 H new ATOM 0 HB2 ARG A 150 -10.238 7.733 7.055 1.00 0.56 H new ATOM 0 HB3 ARG A 150 -10.816 7.792 5.402 1.00 0.56 H new ATOM 0 HG2 ARG A 150 -12.688 8.435 6.628 1.00 0.59 H new ATOM 0 HG3 ARG A 150 -13.001 6.739 6.315 1.00 0.59 H new ATOM 0 HD2 ARG A 150 -13.468 7.462 8.682 1.00 1.15 H new ATOM 0 HD3 ARG A 150 -12.369 6.104 8.545 1.00 1.15 H new ATOM 0 HE ARG A 150 -11.148 8.802 8.770 1.00 1.83 H new ATOM 0 HH11 ARG A 150 -12.010 5.719 10.267 1.00 2.97 H new ATOM 0 HH12 ARG A 150 -10.934 5.954 11.648 1.00 2.97 H new ATOM 0 HH21 ARG A 150 -9.758 9.091 10.540 1.00 3.59 H new ATOM 0 HH22 ARG A 150 -9.662 7.858 11.802 1.00 3.59 H new ATOM 432 N GLU A 151 -11.920 4.036 6.450 1.00 0.44 N ATOM 433 CA GLU A 151 -12.530 2.900 7.059 1.00 0.48 C ATOM 434 C GLU A 151 -11.730 1.704 6.623 1.00 0.44 C ATOM 435 O GLU A 151 -11.733 0.646 7.254 1.00 0.50 O ATOM 436 CB GLU A 151 -13.984 2.797 6.574 1.00 0.54 C ATOM 437 CG GLU A 151 -14.164 1.980 5.304 1.00 0.49 C ATOM 438 CD GLU A 151 -15.610 1.621 5.048 1.00 0.60 C ATOM 439 OE1 GLU A 151 -16.449 2.541 5.003 1.00 0.73 O ATOM 440 OE2 GLU A 151 -15.916 0.419 4.920 1.00 0.83 O ATOM 0 H GLU A 151 -12.228 4.197 5.491 1.00 0.44 H new ATOM 0 HA GLU A 151 -12.544 2.969 8.147 1.00 0.48 H new ATOM 0 HB2 GLU A 151 -14.588 2.354 7.366 1.00 0.54 H new ATOM 0 HB3 GLU A 151 -14.370 3.802 6.403 1.00 0.54 H new ATOM 0 HG2 GLU A 151 -13.777 2.544 4.455 1.00 0.49 H new ATOM 0 HG3 GLU A 151 -13.573 1.067 5.376 1.00 0.49 H new ATOM 447 N ASN A 152 -11.012 1.904 5.527 1.00 0.40 N ATOM 448 CA ASN A 152 -10.439 0.810 4.834 1.00 0.43 C ATOM 449 C ASN A 152 -8.969 0.632 5.117 1.00 0.37 C ATOM 450 O ASN A 152 -8.382 -0.359 4.690 1.00 0.36 O ATOM 451 CB ASN A 152 -10.756 0.836 3.332 1.00 0.62 C ATOM 452 CG ASN A 152 -9.655 1.316 2.398 1.00 0.67 C ATOM 453 OD1 ASN A 152 -8.479 1.217 2.653 1.00 1.69 O ATOM 454 ND2 ASN A 152 -10.059 1.801 1.255 1.00 0.48 N ATOM 0 H ASN A 152 -10.825 2.819 5.117 1.00 0.40 H new ATOM 0 HA ASN A 152 -10.922 -0.081 5.234 1.00 0.43 H new ATOM 0 HB2 ASN A 152 -11.041 -0.172 3.029 1.00 0.62 H new ATOM 0 HB3 ASN A 152 -11.628 1.472 3.182 1.00 0.62 H new ATOM 0 HD21 ASN A 152 -9.377 2.104 0.560 1.00 0.48 H new ATOM 0 HD22 ASN A 152 -11.057 1.877 1.057 1.00 0.48 H new ATOM 461 N MET A 153 -8.360 1.567 5.824 1.00 0.35 N ATOM 462 CA MET A 153 -6.910 1.583 5.904 1.00 0.34 C ATOM 463 C MET A 153 -6.351 0.357 6.602 1.00 0.33 C ATOM 464 O MET A 153 -5.146 0.222 6.775 1.00 0.36 O ATOM 465 CB MET A 153 -6.338 2.852 6.544 1.00 0.36 C ATOM 466 CG MET A 153 -5.196 3.433 5.753 1.00 0.69 C ATOM 467 SD MET A 153 -5.722 4.399 4.326 1.00 0.61 S ATOM 468 CE MET A 153 -6.591 3.148 3.395 1.00 0.34 C ATOM 0 H MET A 153 -8.833 2.309 6.340 1.00 0.35 H new ATOM 0 HA MET A 153 -6.585 1.571 4.864 1.00 0.34 H new ATOM 0 HB2 MET A 153 -7.128 3.597 6.635 1.00 0.36 H new ATOM 0 HB3 MET A 153 -5.997 2.624 7.554 1.00 0.36 H new ATOM 0 HG2 MET A 153 -4.597 4.065 6.408 1.00 0.69 H new ATOM 0 HG3 MET A 153 -4.551 2.623 5.414 1.00 0.69 H new ATOM 0 HE1 MET A 153 -6.640 3.443 2.347 1.00 0.34 H new ATOM 0 HE2 MET A 153 -6.063 2.198 3.481 1.00 0.34 H new ATOM 0 HE3 MET A 153 -7.602 3.038 3.788 1.00 0.34 H new ATOM 478 N TYR A 154 -7.230 -0.511 7.028 1.00 0.33 N ATOM 479 CA TYR A 154 -6.832 -1.747 7.639 1.00 0.36 C ATOM 480 C TYR A 154 -7.149 -2.925 6.721 1.00 0.34 C ATOM 481 O TYR A 154 -7.248 -4.066 7.170 1.00 0.39 O ATOM 482 CB TYR A 154 -7.545 -1.874 8.980 1.00 0.47 C ATOM 483 CG TYR A 154 -7.271 -0.707 9.911 1.00 0.60 C ATOM 484 CD1 TYR A 154 -6.199 -0.738 10.802 1.00 0.76 C ATOM 485 CD2 TYR A 154 -8.086 0.418 9.910 1.00 0.68 C ATOM 486 CE1 TYR A 154 -5.951 0.315 11.659 1.00 0.92 C ATOM 487 CE2 TYR A 154 -7.844 1.476 10.767 1.00 0.83 C ATOM 488 CZ TYR A 154 -6.763 1.447 11.601 1.00 0.95 C ATOM 489 OH TYR A 154 -6.533 2.470 12.494 1.00 1.10 O ATOM 0 H TYR A 154 -8.239 -0.380 6.961 1.00 0.33 H new ATOM 0 HA TYR A 154 -5.755 -1.754 7.805 1.00 0.36 H new ATOM 0 HB2 TYR A 154 -8.619 -1.950 8.808 1.00 0.47 H new ATOM 0 HB3 TYR A 154 -7.233 -2.799 9.465 1.00 0.47 H new ATOM 0 HD1 TYR A 154 -5.551 -1.602 10.822 1.00 0.76 H new ATOM 0 HD2 TYR A 154 -8.922 0.467 9.229 1.00 0.68 H new ATOM 0 HE1 TYR A 154 -5.137 0.263 12.367 1.00 0.92 H new ATOM 0 HE2 TYR A 154 -8.510 2.326 10.777 1.00 0.83 H new ATOM 0 HH TYR A 154 -7.175 3.193 12.335 1.00 1.10 H new ATOM 499 N ARG A 155 -7.282 -2.647 5.421 1.00 0.30 N ATOM 500 CA ARG A 155 -7.600 -3.686 4.450 1.00 0.31 C ATOM 501 C ARG A 155 -7.221 -3.279 3.014 1.00 0.25 C ATOM 502 O ARG A 155 -6.683 -4.082 2.265 1.00 0.26 O ATOM 503 CB ARG A 155 -9.069 -4.054 4.570 1.00 0.41 C ATOM 504 CG ARG A 155 -10.003 -3.157 3.811 1.00 0.60 C ATOM 505 CD ARG A 155 -10.670 -2.144 4.713 1.00 0.43 C ATOM 506 NE ARG A 155 -11.340 -2.735 5.859 1.00 0.95 N ATOM 507 CZ ARG A 155 -12.503 -3.395 5.797 1.00 1.23 C ATOM 508 NH1 ARG A 155 -13.067 -3.669 4.622 1.00 1.36 N ATOM 509 NH2 ARG A 155 -13.099 -3.791 6.911 1.00 1.92 N ATOM 0 H ARG A 155 -7.174 -1.714 5.022 1.00 0.30 H new ATOM 0 HA ARG A 155 -6.998 -4.567 4.674 1.00 0.31 H new ATOM 0 HB2 ARG A 155 -9.203 -5.077 4.219 1.00 0.41 H new ATOM 0 HB3 ARG A 155 -9.349 -4.039 5.623 1.00 0.41 H new ATOM 0 HG2 ARG A 155 -9.451 -2.638 3.028 1.00 0.60 H new ATOM 0 HG3 ARG A 155 -10.765 -3.761 3.317 1.00 0.60 H new ATOM 0 HD2 ARG A 155 -9.920 -1.436 5.067 1.00 0.43 H new ATOM 0 HD3 ARG A 155 -11.396 -1.576 4.132 1.00 0.43 H new ATOM 0 HE ARG A 155 -10.894 -2.641 6.772 1.00 0.95 H new ATOM 0 HH11 ARG A 155 -12.613 -3.375 3.757 1.00 1.36 H new ATOM 0 HH12 ARG A 155 -13.953 -4.173 4.587 1.00 1.36 H new ATOM 0 HH21 ARG A 155 -12.672 -3.593 7.816 1.00 1.92 H new ATOM 0 HH22 ARG A 155 -13.985 -4.294 6.864 1.00 1.92 H new ATOM 523 N TYR A 156 -7.500 -2.041 2.631 1.00 0.26 N ATOM 524 CA TYR A 156 -6.992 -1.483 1.374 1.00 0.24 C ATOM 525 C TYR A 156 -6.045 -0.386 1.798 1.00 0.24 C ATOM 526 O TYR A 156 -6.160 0.771 1.410 1.00 0.29 O ATOM 527 CB TYR A 156 -8.145 -0.940 0.524 1.00 0.28 C ATOM 528 CG TYR A 156 -9.398 -1.788 0.591 1.00 0.33 C ATOM 529 CD1 TYR A 156 -9.356 -3.156 0.374 1.00 0.53 C ATOM 530 CD2 TYR A 156 -10.619 -1.216 0.891 1.00 0.43 C ATOM 531 CE1 TYR A 156 -10.501 -3.924 0.461 1.00 0.62 C ATOM 532 CE2 TYR A 156 -11.766 -1.971 0.977 1.00 0.49 C ATOM 533 CZ TYR A 156 -11.705 -3.325 0.762 1.00 0.56 C ATOM 534 OH TYR A 156 -12.845 -4.085 0.870 1.00 0.65 O ATOM 0 H TYR A 156 -8.078 -1.397 3.172 1.00 0.26 H new ATOM 0 HA TYR A 156 -6.491 -2.227 0.755 1.00 0.24 H new ATOM 0 HB2 TYR A 156 -8.383 0.072 0.853 1.00 0.28 H new ATOM 0 HB3 TYR A 156 -7.819 -0.870 -0.514 1.00 0.28 H new ATOM 0 HD1 TYR A 156 -8.415 -3.628 0.134 1.00 0.53 H new ATOM 0 HD2 TYR A 156 -10.675 -0.151 1.062 1.00 0.43 H new ATOM 0 HE1 TYR A 156 -10.453 -4.990 0.294 1.00 0.62 H new ATOM 0 HE2 TYR A 156 -12.709 -1.501 1.212 1.00 0.49 H new ATOM 0 HH TYR A 156 -12.658 -4.879 1.413 1.00 0.65 H new ATOM 544 N PRO A 157 -5.038 -0.803 2.559 1.00 0.21 N ATOM 545 CA PRO A 157 -4.699 -0.177 3.806 1.00 0.22 C ATOM 546 C PRO A 157 -3.501 0.750 3.814 1.00 0.23 C ATOM 547 O PRO A 157 -3.007 1.200 2.781 1.00 0.25 O ATOM 548 CB PRO A 157 -4.375 -1.445 4.568 1.00 0.21 C ATOM 549 CG PRO A 157 -3.471 -2.146 3.622 1.00 0.21 C ATOM 550 CD PRO A 157 -4.071 -1.884 2.262 1.00 0.22 C ATOM 0 HA PRO A 157 -5.478 0.493 4.171 1.00 0.22 H new ATOM 0 HB2 PRO A 157 -3.888 -1.236 5.520 1.00 0.21 H new ATOM 0 HB3 PRO A 157 -5.269 -2.029 4.788 1.00 0.21 H new ATOM 0 HG2 PRO A 157 -2.453 -1.762 3.687 1.00 0.21 H new ATOM 0 HG3 PRO A 157 -3.423 -3.214 3.836 1.00 0.21 H new ATOM 0 HD2 PRO A 157 -3.319 -1.572 1.537 1.00 0.22 H new ATOM 0 HD3 PRO A 157 -4.560 -2.769 1.854 1.00 0.22 H new ATOM 558 N ASN A 158 -3.050 1.018 5.033 1.00 0.24 N ATOM 559 CA ASN A 158 -1.877 1.823 5.268 1.00 0.27 C ATOM 560 C ASN A 158 -0.696 0.946 5.584 1.00 0.32 C ATOM 561 O ASN A 158 0.238 1.388 6.203 1.00 0.57 O ATOM 562 CB ASN A 158 -2.098 2.819 6.412 1.00 0.29 C ATOM 563 CG ASN A 158 -2.263 2.153 7.772 1.00 1.07 C ATOM 564 OD1 ASN A 158 -3.361 1.763 8.153 1.00 1.56 O ATOM 565 ND2 ASN A 158 -1.181 2.050 8.521 1.00 1.86 N ATOM 0 H ASN A 158 -3.496 0.677 5.885 1.00 0.24 H new ATOM 0 HA ASN A 158 -1.679 2.387 4.357 1.00 0.27 H new ATOM 0 HB2 ASN A 158 -1.253 3.507 6.453 1.00 0.29 H new ATOM 0 HB3 ASN A 158 -2.985 3.415 6.198 1.00 0.29 H new ATOM 0 HD21 ASN A 158 -1.242 1.635 9.451 1.00 1.86 H new ATOM 0 HD22 ASN A 158 -0.284 2.386 8.170 1.00 1.86 H new ATOM 572 N GLN A 159 -0.718 -0.286 5.144 1.00 0.22 N ATOM 573 CA GLN A 159 0.471 -1.110 5.245 1.00 0.23 C ATOM 574 C GLN A 159 0.723 -1.896 3.976 1.00 0.21 C ATOM 575 O GLN A 159 -0.209 -2.268 3.261 1.00 0.24 O ATOM 576 CB GLN A 159 0.422 -2.041 6.439 1.00 0.25 C ATOM 577 CG GLN A 159 -0.770 -2.985 6.466 1.00 0.25 C ATOM 578 CD GLN A 159 -0.662 -4.007 7.581 1.00 0.42 C ATOM 579 OE1 GLN A 159 -1.182 -5.115 7.476 1.00 0.87 O ATOM 580 NE2 GLN A 159 0.013 -3.636 8.660 1.00 0.63 N ATOM 0 H GLN A 159 -1.527 -0.739 4.719 1.00 0.22 H new ATOM 0 HA GLN A 159 1.304 -0.423 5.390 1.00 0.23 H new ATOM 0 HB2 GLN A 159 1.337 -2.633 6.457 1.00 0.25 H new ATOM 0 HB3 GLN A 159 0.413 -1.441 7.349 1.00 0.25 H new ATOM 0 HG2 GLN A 159 -1.686 -2.408 6.591 1.00 0.25 H new ATOM 0 HG3 GLN A 159 -0.846 -3.500 5.508 1.00 0.25 H new ATOM 0 HE21 GLN A 159 0.429 -2.706 8.706 1.00 0.63 H new ATOM 0 HE22 GLN A 159 0.116 -4.281 9.444 1.00 0.63 H new ATOM 589 N VAL A 160 1.997 -2.153 3.711 1.00 0.20 N ATOM 590 CA VAL A 160 2.405 -2.828 2.503 1.00 0.18 C ATOM 591 C VAL A 160 3.612 -3.666 2.775 1.00 0.20 C ATOM 592 O VAL A 160 4.210 -3.560 3.824 1.00 0.26 O ATOM 593 CB VAL A 160 2.726 -1.880 1.340 1.00 0.20 C ATOM 594 CG1 VAL A 160 1.471 -1.553 0.580 1.00 0.22 C ATOM 595 CG2 VAL A 160 3.400 -0.612 1.818 1.00 0.23 C ATOM 0 H VAL A 160 2.767 -1.898 4.329 1.00 0.20 H new ATOM 0 HA VAL A 160 1.553 -3.437 2.200 1.00 0.18 H new ATOM 0 HB VAL A 160 3.425 -2.390 0.677 1.00 0.20 H new ATOM 0 HG11 VAL A 160 1.709 -0.880 -0.243 1.00 0.22 H new ATOM 0 HG12 VAL A 160 1.036 -2.471 0.184 1.00 0.22 H new ATOM 0 HG13 VAL A 160 0.757 -1.071 1.247 1.00 0.22 H new ATOM 0 HG21 VAL A 160 3.611 0.032 0.964 1.00 0.23 H new ATOM 0 HG22 VAL A 160 2.742 -0.090 2.513 1.00 0.23 H new ATOM 0 HG23 VAL A 160 4.333 -0.864 2.321 1.00 0.23 H new ATOM 605 N TYR A 161 3.945 -4.519 1.853 1.00 0.20 N ATOM 606 CA TYR A 161 5.112 -5.348 2.002 1.00 0.24 C ATOM 607 C TYR A 161 6.077 -5.073 0.873 1.00 0.31 C ATOM 608 O TYR A 161 5.687 -4.891 -0.277 1.00 0.62 O ATOM 609 CB TYR A 161 4.714 -6.808 1.998 1.00 0.26 C ATOM 610 CG TYR A 161 3.703 -7.182 3.055 1.00 0.60 C ATOM 611 CD1 TYR A 161 2.363 -6.881 2.874 1.00 1.05 C ATOM 612 CD2 TYR A 161 4.081 -7.834 4.220 1.00 0.71 C ATOM 613 CE1 TYR A 161 1.424 -7.214 3.819 1.00 1.60 C ATOM 614 CE2 TYR A 161 3.143 -8.174 5.177 1.00 1.25 C ATOM 615 CZ TYR A 161 1.815 -7.861 4.971 1.00 1.70 C ATOM 616 OH TYR A 161 0.875 -8.190 5.923 1.00 2.25 O ATOM 0 H TYR A 161 3.426 -4.662 0.986 1.00 0.20 H new ATOM 0 HA TYR A 161 5.596 -5.118 2.951 1.00 0.24 H new ATOM 0 HB2 TYR A 161 4.307 -7.058 1.018 1.00 0.26 H new ATOM 0 HB3 TYR A 161 5.608 -7.416 2.136 1.00 0.26 H new ATOM 0 HD1 TYR A 161 2.051 -6.375 1.972 1.00 1.05 H new ATOM 0 HD2 TYR A 161 5.120 -8.079 4.381 1.00 0.71 H new ATOM 0 HE1 TYR A 161 0.384 -6.970 3.660 1.00 1.60 H new ATOM 0 HE2 TYR A 161 3.448 -8.681 6.080 1.00 1.25 H new ATOM 0 HH TYR A 161 -0.010 -7.894 5.625 1.00 2.25 H new ATOM 626 N TYR A 162 7.323 -5.020 1.216 1.00 0.27 N ATOM 627 CA TYR A 162 8.370 -4.721 0.277 1.00 0.35 C ATOM 628 C TYR A 162 9.677 -5.060 0.915 1.00 0.41 C ATOM 629 O TYR A 162 9.736 -5.371 2.090 1.00 0.46 O ATOM 630 CB TYR A 162 8.340 -3.248 -0.177 1.00 0.41 C ATOM 631 CG TYR A 162 8.497 -2.243 0.945 1.00 0.47 C ATOM 632 CD1 TYR A 162 9.707 -2.086 1.605 1.00 0.79 C ATOM 633 CD2 TYR A 162 7.433 -1.449 1.338 1.00 0.62 C ATOM 634 CE1 TYR A 162 9.843 -1.165 2.624 1.00 0.92 C ATOM 635 CE2 TYR A 162 7.559 -0.527 2.346 1.00 0.78 C ATOM 636 CZ TYR A 162 8.805 -0.423 3.017 1.00 0.83 C ATOM 637 OH TYR A 162 8.895 0.547 3.993 1.00 1.03 O ATOM 0 H TYR A 162 7.653 -5.184 2.167 1.00 0.27 H new ATOM 0 HA TYR A 162 8.224 -5.317 -0.624 1.00 0.35 H new ATOM 0 HB2 TYR A 162 9.136 -3.089 -0.905 1.00 0.41 H new ATOM 0 HB3 TYR A 162 7.397 -3.058 -0.689 1.00 0.41 H new ATOM 0 HD1 TYR A 162 10.553 -2.692 1.318 1.00 0.79 H new ATOM 0 HD2 TYR A 162 6.481 -1.558 0.839 1.00 0.62 H new ATOM 0 HE1 TYR A 162 10.800 -1.043 3.109 1.00 0.92 H new ATOM 0 HE2 TYR A 162 6.728 0.106 2.623 1.00 0.78 H new ATOM 0 HH TYR A 162 9.798 0.928 3.993 1.00 1.03 H new ATOM 647 N ARG A 163 10.713 -5.011 0.155 1.00 0.49 N ATOM 648 CA ARG A 163 12.014 -5.254 0.709 1.00 0.56 C ATOM 649 C ARG A 163 12.618 -3.910 1.070 1.00 0.60 C ATOM 650 O ARG A 163 12.229 -2.902 0.485 1.00 0.68 O ATOM 651 CB ARG A 163 12.888 -5.968 -0.313 1.00 0.71 C ATOM 652 CG ARG A 163 13.704 -7.051 0.323 1.00 0.89 C ATOM 653 CD ARG A 163 12.863 -8.293 0.553 1.00 1.18 C ATOM 654 NE ARG A 163 13.617 -9.392 1.146 1.00 1.82 N ATOM 655 CZ ARG A 163 13.380 -10.675 0.871 1.00 2.23 C ATOM 656 NH1 ARG A 163 12.546 -10.999 -0.115 1.00 2.21 N ATOM 657 NH2 ARG A 163 14.005 -11.630 1.543 1.00 3.01 N ATOM 0 H ARG A 163 10.695 -4.807 -0.844 1.00 0.49 H new ATOM 0 HA ARG A 163 11.943 -5.887 1.594 1.00 0.56 H new ATOM 0 HB2 ARG A 163 12.260 -6.396 -1.095 1.00 0.71 H new ATOM 0 HB3 ARG A 163 13.550 -5.248 -0.794 1.00 0.71 H new ATOM 0 HG2 ARG A 163 14.554 -7.294 -0.315 1.00 0.89 H new ATOM 0 HG3 ARG A 163 14.108 -6.699 1.272 1.00 0.89 H new ATOM 0 HD2 ARG A 163 12.025 -8.042 1.204 1.00 1.18 H new ATOM 0 HD3 ARG A 163 12.441 -8.620 -0.397 1.00 1.18 H new ATOM 0 HE ARG A 163 14.363 -9.168 1.804 1.00 1.82 H new ATOM 0 HH11 ARG A 163 12.090 -10.266 -0.658 1.00 2.21 H new ATOM 0 HH12 ARG A 163 12.363 -11.980 -0.327 1.00 2.21 H new ATOM 0 HH21 ARG A 163 14.672 -11.386 2.275 1.00 3.01 H new ATOM 0 HH22 ARG A 163 13.820 -12.610 1.328 1.00 3.01 H new ATOM 671 N PRO A 164 13.596 -3.844 1.987 1.00 0.61 N ATOM 672 CA PRO A 164 14.041 -2.573 2.512 1.00 0.66 C ATOM 673 C PRO A 164 15.122 -2.038 1.630 1.00 0.65 C ATOM 674 O PRO A 164 16.269 -2.502 1.604 1.00 0.73 O ATOM 675 CB PRO A 164 14.603 -2.912 3.895 1.00 0.72 C ATOM 676 CG PRO A 164 14.468 -4.399 4.038 1.00 0.71 C ATOM 677 CD PRO A 164 14.285 -4.946 2.650 1.00 0.62 C ATOM 0 HA PRO A 164 13.251 -1.823 2.563 1.00 0.66 H new ATOM 0 HB2 PRO A 164 15.645 -2.604 3.980 1.00 0.72 H new ATOM 0 HB3 PRO A 164 14.052 -2.392 4.679 1.00 0.72 H new ATOM 0 HG2 PRO A 164 15.353 -4.825 4.509 1.00 0.71 H new ATOM 0 HG3 PRO A 164 13.617 -4.652 4.670 1.00 0.71 H new ATOM 0 HD2 PRO A 164 15.237 -5.180 2.173 1.00 0.62 H new ATOM 0 HD3 PRO A 164 13.693 -5.861 2.645 1.00 0.62 H new ATOM 685 N VAL A 165 14.689 -1.071 0.873 1.00 0.60 N ATOM 686 CA VAL A 165 15.342 -0.647 -0.304 1.00 0.63 C ATOM 687 C VAL A 165 15.984 0.712 -0.124 1.00 0.59 C ATOM 688 O VAL A 165 15.373 1.637 0.394 1.00 0.62 O ATOM 689 CB VAL A 165 14.290 -0.577 -1.412 1.00 0.72 C ATOM 690 CG1 VAL A 165 13.102 0.259 -0.970 1.00 0.63 C ATOM 691 CG2 VAL A 165 14.881 0.008 -2.636 1.00 0.82 C ATOM 0 H VAL A 165 13.839 -0.545 1.078 1.00 0.60 H new ATOM 0 HA VAL A 165 16.136 -1.350 -0.554 1.00 0.63 H new ATOM 0 HB VAL A 165 13.947 -1.590 -1.624 1.00 0.72 H new ATOM 0 HG11 VAL A 165 12.365 0.297 -1.772 1.00 0.63 H new ATOM 0 HG12 VAL A 165 12.652 -0.189 -0.084 1.00 0.63 H new ATOM 0 HG13 VAL A 165 13.435 1.270 -0.736 1.00 0.63 H new ATOM 0 HG21 VAL A 165 14.124 0.054 -3.419 1.00 0.82 H new ATOM 0 HG22 VAL A 165 15.242 1.014 -2.421 1.00 0.82 H new ATOM 0 HG23 VAL A 165 15.713 -0.612 -2.971 1.00 0.82 H new ATOM 701 N ASP A 166 17.200 0.857 -0.587 1.00 0.68 N ATOM 702 CA ASP A 166 17.827 2.163 -0.638 1.00 0.72 C ATOM 703 C ASP A 166 17.258 2.913 -1.830 1.00 0.94 C ATOM 704 O ASP A 166 17.973 3.517 -2.625 1.00 1.54 O ATOM 705 CB ASP A 166 19.323 1.981 -0.741 1.00 1.14 C ATOM 706 CG ASP A 166 20.094 3.281 -0.607 1.00 1.67 C ATOM 707 OD1 ASP A 166 19.544 4.259 -0.063 1.00 2.37 O ATOM 708 OD2 ASP A 166 21.263 3.329 -1.052 1.00 2.09 O ATOM 0 H ASP A 166 17.778 0.092 -0.934 1.00 0.68 H new ATOM 0 HA ASP A 166 17.625 2.744 0.262 1.00 0.72 H new ATOM 0 HB2 ASP A 166 19.653 1.289 0.034 1.00 1.14 H new ATOM 0 HB3 ASP A 166 19.561 1.522 -1.700 1.00 1.14 H new ATOM 713 N GLN A 167 15.934 2.804 -1.923 1.00 1.12 N ATOM 714 CA GLN A 167 15.111 3.299 -3.008 1.00 1.74 C ATOM 715 C GLN A 167 15.435 2.616 -4.342 1.00 1.81 C ATOM 716 O GLN A 167 14.701 2.785 -5.314 1.00 2.58 O ATOM 717 CB GLN A 167 15.194 4.803 -3.092 1.00 2.18 C ATOM 718 CG GLN A 167 16.194 5.312 -4.119 1.00 2.69 C ATOM 719 CD GLN A 167 16.091 6.803 -4.392 1.00 3.47 C ATOM 720 OE1 GLN A 167 16.348 7.251 -5.506 1.00 4.04 O ATOM 721 NE2 GLN A 167 15.723 7.586 -3.391 1.00 3.91 N ATOM 0 H GLN A 167 15.383 2.341 -1.200 1.00 1.12 H new ATOM 0 HA GLN A 167 14.076 3.039 -2.788 1.00 1.74 H new ATOM 0 HB2 GLN A 167 14.207 5.198 -3.334 1.00 2.18 H new ATOM 0 HB3 GLN A 167 15.463 5.197 -2.112 1.00 2.18 H new ATOM 0 HG2 GLN A 167 17.202 5.085 -3.773 1.00 2.69 H new ATOM 0 HG3 GLN A 167 16.048 4.770 -5.054 1.00 2.69 H new ATOM 0 HE21 GLN A 167 15.516 7.183 -2.477 1.00 3.91 H new ATOM 0 HE22 GLN A 167 15.646 8.593 -3.533 1.00 3.91 H new ATOM 730 N TYR A 168 16.521 1.826 -4.359 1.00 1.22 N ATOM 731 CA TYR A 168 16.873 0.944 -5.488 1.00 1.24 C ATOM 732 C TYR A 168 17.096 1.726 -6.787 1.00 1.21 C ATOM 733 O TYR A 168 17.366 1.136 -7.831 1.00 1.69 O ATOM 734 CB TYR A 168 15.738 -0.072 -5.682 1.00 1.31 C ATOM 735 CG TYR A 168 16.145 -1.432 -6.203 1.00 1.32 C ATOM 736 CD1 TYR A 168 16.364 -1.658 -7.556 1.00 1.80 C ATOM 737 CD2 TYR A 168 16.272 -2.504 -5.331 1.00 1.79 C ATOM 738 CE1 TYR A 168 16.701 -2.914 -8.023 1.00 2.42 C ATOM 739 CE2 TYR A 168 16.615 -3.761 -5.789 1.00 2.41 C ATOM 740 CZ TYR A 168 16.826 -3.961 -7.135 1.00 2.62 C ATOM 741 OH TYR A 168 17.152 -5.214 -7.598 1.00 3.47 O ATOM 0 H TYR A 168 17.185 1.780 -3.586 1.00 1.22 H new ATOM 0 HA TYR A 168 17.811 0.441 -5.253 1.00 1.24 H new ATOM 0 HB2 TYR A 168 15.232 -0.208 -4.726 1.00 1.31 H new ATOM 0 HB3 TYR A 168 15.009 0.355 -6.371 1.00 1.31 H new ATOM 0 HD1 TYR A 168 16.269 -0.839 -8.254 1.00 1.80 H new ATOM 0 HD2 TYR A 168 16.100 -2.353 -4.276 1.00 1.79 H new ATOM 0 HE1 TYR A 168 16.866 -3.075 -9.078 1.00 2.42 H new ATOM 0 HE2 TYR A 168 16.717 -4.582 -5.095 1.00 2.41 H new ATOM 0 HH TYR A 168 17.202 -5.838 -6.844 1.00 3.47 H new ATOM 751 N SER A 169 16.978 3.053 -6.707 1.00 1.36 N ATOM 752 CA SER A 169 16.869 3.909 -7.884 1.00 1.47 C ATOM 753 C SER A 169 15.590 3.555 -8.662 1.00 1.09 C ATOM 754 O SER A 169 15.281 4.159 -9.689 1.00 1.13 O ATOM 755 CB SER A 169 18.119 3.777 -8.770 1.00 1.88 C ATOM 756 OG SER A 169 18.138 4.749 -9.805 1.00 2.77 O ATOM 0 H SER A 169 16.956 3.562 -5.823 1.00 1.36 H new ATOM 0 HA SER A 169 16.804 4.950 -7.566 1.00 1.47 H new ATOM 0 HB2 SER A 169 19.013 3.883 -8.155 1.00 1.88 H new ATOM 0 HB3 SER A 169 18.150 2.779 -9.208 1.00 1.88 H new ATOM 0 HG SER A 169 17.233 4.863 -10.163 1.00 2.77 H new ATOM 762 N ASN A 170 14.818 2.605 -8.116 1.00 0.82 N ATOM 763 CA ASN A 170 13.658 2.038 -8.798 1.00 0.65 C ATOM 764 C ASN A 170 12.713 1.332 -7.824 1.00 0.56 C ATOM 765 O ASN A 170 12.166 0.286 -8.165 1.00 0.77 O ATOM 766 CB ASN A 170 14.090 1.006 -9.856 1.00 0.84 C ATOM 767 CG ASN A 170 14.577 1.615 -11.156 1.00 1.23 C ATOM 768 OD1 ASN A 170 15.771 1.850 -11.340 1.00 1.94 O ATOM 769 ND2 ASN A 170 13.658 1.856 -12.075 1.00 1.70 N ATOM 0 H ASN A 170 14.984 2.212 -7.190 1.00 0.82 H new ATOM 0 HA ASN A 170 13.143 2.876 -9.268 1.00 0.65 H new ATOM 0 HB2 ASN A 170 14.883 0.385 -9.439 1.00 0.84 H new ATOM 0 HB3 ASN A 170 13.248 0.347 -10.069 1.00 0.84 H new ATOM 0 HD21 ASN A 170 13.929 2.251 -12.976 1.00 1.70 H new ATOM 0 HD22 ASN A 170 12.678 1.647 -11.884 1.00 1.70 H new ATOM 776 N GLN A 171 12.480 1.886 -6.629 1.00 0.41 N ATOM 777 CA GLN A 171 11.534 1.273 -5.716 1.00 0.37 C ATOM 778 C GLN A 171 10.157 1.342 -6.330 1.00 0.29 C ATOM 779 O GLN A 171 9.346 0.470 -6.101 1.00 0.34 O ATOM 780 CB GLN A 171 11.583 1.937 -4.341 1.00 0.57 C ATOM 781 CG GLN A 171 10.434 1.558 -3.414 1.00 1.32 C ATOM 782 CD GLN A 171 10.331 0.069 -3.154 1.00 2.56 C ATOM 783 OE1 GLN A 171 11.320 -0.655 -3.200 1.00 3.22 O ATOM 784 NE2 GLN A 171 9.126 -0.396 -2.869 1.00 3.29 N ATOM 0 H GLN A 171 12.926 2.737 -6.285 1.00 0.41 H new ATOM 0 HA GLN A 171 11.798 0.227 -5.558 1.00 0.37 H new ATOM 0 HB2 GLN A 171 12.524 1.674 -3.858 1.00 0.57 H new ATOM 0 HB3 GLN A 171 11.584 3.019 -4.474 1.00 0.57 H new ATOM 0 HG2 GLN A 171 10.559 2.077 -2.463 1.00 1.32 H new ATOM 0 HG3 GLN A 171 9.497 1.908 -3.848 1.00 1.32 H new ATOM 0 HE21 GLN A 171 8.328 0.239 -2.840 1.00 3.29 H new ATOM 0 HE22 GLN A 171 8.995 -1.389 -2.678 1.00 3.29 H new ATOM 793 N ASN A 172 9.940 2.366 -7.156 1.00 0.35 N ATOM 794 CA ASN A 172 8.750 2.476 -8.010 1.00 0.42 C ATOM 795 C ASN A 172 8.417 1.140 -8.681 1.00 0.42 C ATOM 796 O ASN A 172 7.250 0.792 -8.886 1.00 0.48 O ATOM 797 CB ASN A 172 8.987 3.565 -9.069 1.00 0.47 C ATOM 798 CG ASN A 172 8.205 3.345 -10.354 1.00 0.54 C ATOM 799 OD1 ASN A 172 8.703 2.728 -11.298 1.00 1.24 O ATOM 800 ND2 ASN A 172 6.987 3.857 -10.406 1.00 1.02 N ATOM 0 H ASN A 172 10.587 3.149 -7.254 1.00 0.35 H new ATOM 0 HA ASN A 172 7.898 2.748 -7.388 1.00 0.42 H new ATOM 0 HB2 ASN A 172 8.715 4.533 -8.649 1.00 0.47 H new ATOM 0 HB3 ASN A 172 10.051 3.607 -9.303 1.00 0.47 H new ATOM 0 HD21 ASN A 172 6.423 3.748 -11.249 1.00 1.02 H new ATOM 0 HD22 ASN A 172 6.611 4.361 -9.603 1.00 1.02 H new ATOM 807 N ASN A 173 9.449 0.373 -8.953 1.00 0.40 N ATOM 808 CA ASN A 173 9.277 -0.912 -9.629 1.00 0.50 C ATOM 809 C ASN A 173 8.918 -1.980 -8.607 1.00 0.44 C ATOM 810 O ASN A 173 8.032 -2.821 -8.823 1.00 0.46 O ATOM 811 CB ASN A 173 10.546 -1.305 -10.386 1.00 0.63 C ATOM 812 CG ASN A 173 10.346 -2.533 -11.254 1.00 0.77 C ATOM 813 OD1 ASN A 173 9.933 -2.426 -12.407 1.00 1.33 O ATOM 814 ND2 ASN A 173 10.646 -3.708 -10.719 1.00 1.44 N ATOM 0 H ASN A 173 10.415 0.607 -8.722 1.00 0.40 H new ATOM 0 HA ASN A 173 8.469 -0.821 -10.355 1.00 0.50 H new ATOM 0 HB2 ASN A 173 10.866 -0.471 -11.010 1.00 0.63 H new ATOM 0 HB3 ASN A 173 11.347 -1.495 -9.672 1.00 0.63 H new ATOM 0 HD21 ASN A 173 10.537 -4.561 -11.268 1.00 1.44 H new ATOM 0 HD22 ASN A 173 10.986 -3.759 -9.759 1.00 1.44 H new ATOM 821 N PHE A 174 9.565 -1.893 -7.453 1.00 0.42 N ATOM 822 CA PHE A 174 9.292 -2.792 -6.353 1.00 0.42 C ATOM 823 C PHE A 174 7.918 -2.465 -5.798 1.00 0.33 C ATOM 824 O PHE A 174 7.363 -3.201 -4.999 1.00 0.34 O ATOM 825 CB PHE A 174 10.353 -2.623 -5.269 1.00 0.49 C ATOM 826 CG PHE A 174 10.999 -3.902 -4.819 1.00 0.60 C ATOM 827 CD1 PHE A 174 10.408 -5.119 -5.113 1.00 1.56 C ATOM 828 CD2 PHE A 174 12.187 -3.893 -4.106 1.00 1.03 C ATOM 829 CE1 PHE A 174 10.988 -6.303 -4.709 1.00 1.90 C ATOM 830 CE2 PHE A 174 12.772 -5.075 -3.699 1.00 1.38 C ATOM 831 CZ PHE A 174 12.213 -6.251 -3.970 1.00 1.53 C ATOM 0 H PHE A 174 10.288 -1.200 -7.259 1.00 0.42 H new ATOM 0 HA PHE A 174 9.315 -3.826 -6.697 1.00 0.42 H new ATOM 0 HB2 PHE A 174 11.127 -1.951 -5.639 1.00 0.49 H new ATOM 0 HB3 PHE A 174 9.897 -2.139 -4.406 1.00 0.49 H new ATOM 0 HD1 PHE A 174 9.481 -5.141 -5.666 1.00 1.56 H new ATOM 0 HD2 PHE A 174 12.660 -2.952 -3.866 1.00 1.03 H new ATOM 0 HE1 PHE A 174 10.527 -7.251 -4.945 1.00 1.90 H new ATOM 0 HE2 PHE A 174 13.702 -5.044 -3.150 1.00 1.38 H new ATOM 0 HZ PHE A 174 12.682 -7.164 -3.634 1.00 1.53 H new ATOM 841 N VAL A 175 7.392 -1.323 -6.236 1.00 0.29 N ATOM 842 CA VAL A 175 6.050 -0.894 -5.902 1.00 0.25 C ATOM 843 C VAL A 175 5.039 -1.681 -6.659 1.00 0.25 C ATOM 844 O VAL A 175 4.145 -2.243 -6.072 1.00 0.28 O ATOM 845 CB VAL A 175 5.805 0.555 -6.255 1.00 0.26 C ATOM 846 CG1 VAL A 175 4.381 0.947 -5.893 1.00 0.26 C ATOM 847 CG2 VAL A 175 6.809 1.419 -5.568 1.00 0.33 C ATOM 0 H VAL A 175 7.895 -0.670 -6.837 1.00 0.29 H new ATOM 0 HA VAL A 175 5.956 -1.042 -4.826 1.00 0.25 H new ATOM 0 HB VAL A 175 5.922 0.696 -7.330 1.00 0.26 H new ATOM 0 HG11 VAL A 175 4.215 1.993 -6.151 1.00 0.26 H new ATOM 0 HG12 VAL A 175 3.680 0.321 -6.445 1.00 0.26 H new ATOM 0 HG13 VAL A 175 4.226 0.809 -4.823 1.00 0.26 H new ATOM 0 HG21 VAL A 175 6.628 2.463 -5.826 1.00 0.33 H new ATOM 0 HG22 VAL A 175 6.721 1.291 -4.489 1.00 0.33 H new ATOM 0 HG23 VAL A 175 7.812 1.135 -5.887 1.00 0.33 H new ATOM 857 N HIS A 176 5.158 -1.657 -7.977 1.00 0.27 N ATOM 858 CA HIS A 176 4.341 -2.498 -8.839 1.00 0.33 C ATOM 859 C HIS A 176 4.212 -3.892 -8.226 1.00 0.28 C ATOM 860 O HIS A 176 3.151 -4.495 -8.254 1.00 0.29 O ATOM 861 CB HIS A 176 4.975 -2.580 -10.228 1.00 0.41 C ATOM 862 CG HIS A 176 4.126 -3.268 -11.249 1.00 1.16 C ATOM 863 ND1 HIS A 176 4.426 -4.511 -11.759 1.00 2.23 N ATOM 864 CD2 HIS A 176 2.988 -2.874 -11.863 1.00 1.62 C ATOM 865 CE1 HIS A 176 3.511 -4.849 -12.647 1.00 2.89 C ATOM 866 NE2 HIS A 176 2.627 -3.875 -12.727 1.00 2.52 N ATOM 0 H HIS A 176 5.817 -1.060 -8.476 1.00 0.27 H new ATOM 0 HA HIS A 176 3.345 -2.065 -8.934 1.00 0.33 H new ATOM 0 HB2 HIS A 176 5.195 -1.570 -10.575 1.00 0.41 H new ATOM 0 HB3 HIS A 176 5.927 -3.105 -10.150 1.00 0.41 H new ATOM 0 HD2 HIS A 176 2.462 -1.945 -11.703 1.00 1.62 H new ATOM 0 HE1 HIS A 176 3.490 -5.769 -13.213 1.00 2.89 H new ATOM 0 HE2 HIS A 176 1.807 -3.867 -13.334 1.00 2.52 H new ATOM 875 N ASP A 177 5.297 -4.348 -7.611 1.00 0.26 N ATOM 876 CA ASP A 177 5.334 -5.651 -6.943 1.00 0.27 C ATOM 877 C ASP A 177 4.831 -5.552 -5.493 1.00 0.24 C ATOM 878 O ASP A 177 4.318 -6.512 -4.930 1.00 0.31 O ATOM 879 CB ASP A 177 6.759 -6.217 -6.978 1.00 0.36 C ATOM 880 CG ASP A 177 6.843 -7.655 -6.499 1.00 0.49 C ATOM 881 OD1 ASP A 177 6.082 -8.506 -7.006 1.00 0.66 O ATOM 882 OD2 ASP A 177 7.638 -7.931 -5.572 1.00 0.64 O ATOM 0 H ASP A 177 6.174 -3.830 -7.559 1.00 0.26 H new ATOM 0 HA ASP A 177 4.668 -6.327 -7.479 1.00 0.27 H new ATOM 0 HB2 ASP A 177 7.142 -6.157 -7.997 1.00 0.36 H new ATOM 0 HB3 ASP A 177 7.405 -5.596 -6.358 1.00 0.36 H new ATOM 887 N CYS A 178 4.969 -4.370 -4.922 1.00 0.26 N ATOM 888 CA CYS A 178 4.504 -4.057 -3.569 1.00 0.29 C ATOM 889 C CYS A 178 2.983 -3.989 -3.529 1.00 0.27 C ATOM 890 O CYS A 178 2.346 -4.486 -2.617 1.00 0.32 O ATOM 891 CB CYS A 178 5.105 -2.720 -3.124 1.00 0.41 C ATOM 892 SG CYS A 178 4.549 -2.075 -1.516 1.00 0.64 S ATOM 0 H CYS A 178 5.415 -3.580 -5.388 1.00 0.26 H new ATOM 0 HA CYS A 178 4.827 -4.845 -2.889 1.00 0.29 H new ATOM 0 HB2 CYS A 178 6.189 -2.827 -3.092 1.00 0.41 H new ATOM 0 HB3 CYS A 178 4.881 -1.974 -3.887 1.00 0.41 H new ATOM 897 N VAL A 179 2.387 -3.369 -4.522 1.00 0.23 N ATOM 898 CA VAL A 179 0.952 -3.431 -4.646 1.00 0.20 C ATOM 899 C VAL A 179 0.582 -4.861 -5.001 1.00 0.21 C ATOM 900 O VAL A 179 -0.368 -5.422 -4.466 1.00 0.28 O ATOM 901 CB VAL A 179 0.385 -2.448 -5.714 1.00 0.19 C ATOM 902 CG1 VAL A 179 -0.635 -1.522 -5.111 1.00 0.67 C ATOM 903 CG2 VAL A 179 1.451 -1.590 -6.346 1.00 0.57 C ATOM 0 H VAL A 179 2.864 -2.826 -5.242 1.00 0.23 H new ATOM 0 HA VAL A 179 0.510 -3.126 -3.697 1.00 0.20 H new ATOM 0 HB VAL A 179 -0.065 -3.083 -6.478 1.00 0.19 H new ATOM 0 HG11 VAL A 179 -1.013 -0.848 -5.879 1.00 0.67 H new ATOM 0 HG12 VAL A 179 -1.460 -2.106 -4.702 1.00 0.67 H new ATOM 0 HG13 VAL A 179 -0.172 -0.941 -4.314 1.00 0.67 H new ATOM 0 HG21 VAL A 179 0.996 -0.926 -7.081 1.00 0.57 H new ATOM 0 HG22 VAL A 179 1.943 -0.996 -5.576 1.00 0.57 H new ATOM 0 HG23 VAL A 179 2.186 -2.227 -6.838 1.00 0.57 H new ATOM 913 N ASN A 180 1.394 -5.479 -5.841 1.00 0.23 N ATOM 914 CA ASN A 180 1.163 -6.860 -6.227 1.00 0.24 C ATOM 915 C ASN A 180 1.157 -7.797 -5.037 1.00 0.25 C ATOM 916 O ASN A 180 0.496 -8.828 -5.070 1.00 0.26 O ATOM 917 CB ASN A 180 2.213 -7.353 -7.214 1.00 0.25 C ATOM 918 CG ASN A 180 1.911 -7.030 -8.670 1.00 0.48 C ATOM 919 OD1 ASN A 180 2.817 -6.987 -9.502 1.00 1.17 O ATOM 920 ND2 ASN A 180 0.651 -6.778 -8.989 1.00 1.33 N ATOM 0 H ASN A 180 2.215 -5.049 -6.267 1.00 0.23 H new ATOM 0 HA ASN A 180 0.179 -6.870 -6.697 1.00 0.24 H new ATOM 0 HB2 ASN A 180 3.176 -6.915 -6.950 1.00 0.25 H new ATOM 0 HB3 ASN A 180 2.314 -8.433 -7.108 1.00 0.25 H new ATOM 0 HD21 ASN A 180 0.406 -6.539 -9.950 1.00 1.33 H new ATOM 0 HD22 ASN A 180 -0.075 -6.823 -8.274 1.00 1.33 H new ATOM 927 N ILE A 181 1.897 -7.475 -3.997 1.00 0.28 N ATOM 928 CA ILE A 181 1.895 -8.327 -2.830 1.00 0.29 C ATOM 929 C ILE A 181 0.832 -7.912 -1.834 1.00 0.27 C ATOM 930 O ILE A 181 0.273 -8.749 -1.161 1.00 0.36 O ATOM 931 CB ILE A 181 3.264 -8.418 -2.107 1.00 0.34 C ATOM 932 CG1 ILE A 181 3.895 -7.068 -1.771 1.00 0.42 C ATOM 933 CG2 ILE A 181 4.246 -9.261 -2.891 1.00 0.52 C ATOM 934 CD1 ILE A 181 3.163 -6.308 -0.700 1.00 0.77 C ATOM 0 H ILE A 181 2.494 -6.650 -3.936 1.00 0.28 H new ATOM 0 HA ILE A 181 1.670 -9.320 -3.220 1.00 0.29 H new ATOM 0 HB ILE A 181 3.041 -8.898 -1.154 1.00 0.34 H new ATOM 0 HG12 ILE A 181 4.925 -7.228 -1.451 1.00 0.42 H new ATOM 0 HG13 ILE A 181 3.933 -6.460 -2.675 1.00 0.42 H new ATOM 0 HG21 ILE A 181 5.195 -9.305 -2.357 1.00 0.52 H new ATOM 0 HG22 ILE A 181 3.848 -10.269 -3.007 1.00 0.52 H new ATOM 0 HG23 ILE A 181 4.403 -8.817 -3.874 1.00 0.52 H new ATOM 0 HD11 ILE A 181 3.669 -5.360 -0.516 1.00 0.77 H new ATOM 0 HD12 ILE A 181 2.140 -6.116 -1.025 1.00 0.77 H new ATOM 0 HD13 ILE A 181 3.148 -6.896 0.218 1.00 0.77 H new ATOM 946 N THR A 182 0.560 -6.624 -1.756 1.00 0.27 N ATOM 947 CA THR A 182 -0.200 -6.059 -0.652 1.00 0.24 C ATOM 948 C THR A 182 -1.675 -6.012 -0.904 1.00 0.26 C ATOM 949 O THR A 182 -2.487 -6.202 0.004 1.00 0.30 O ATOM 950 CB THR A 182 0.324 -4.656 -0.358 1.00 0.22 C ATOM 951 OG1 THR A 182 0.649 -4.540 1.029 1.00 0.46 O ATOM 952 CG2 THR A 182 -0.691 -3.601 -0.749 1.00 0.30 C ATOM 0 H THR A 182 0.857 -5.940 -2.452 1.00 0.27 H new ATOM 0 HA THR A 182 -0.060 -6.716 0.207 1.00 0.24 H new ATOM 0 HB THR A 182 1.223 -4.494 -0.953 1.00 0.22 H new ATOM 0 HG1 THR A 182 -0.064 -4.052 1.492 1.00 0.46 H new ATOM 0 HG21 THR A 182 -0.291 -2.611 -0.528 1.00 0.30 H new ATOM 0 HG22 THR A 182 -0.903 -3.677 -1.816 1.00 0.30 H new ATOM 0 HG23 THR A 182 -1.611 -3.754 -0.185 1.00 0.30 H new ATOM 960 N VAL A 183 -2.036 -5.752 -2.118 1.00 0.26 N ATOM 961 CA VAL A 183 -3.413 -5.681 -2.439 1.00 0.28 C ATOM 962 C VAL A 183 -3.865 -7.114 -2.490 1.00 0.29 C ATOM 963 O VAL A 183 -4.911 -7.476 -1.988 1.00 0.32 O ATOM 964 CB VAL A 183 -3.594 -4.926 -3.761 1.00 0.28 C ATOM 965 CG1 VAL A 183 -2.603 -3.807 -3.820 1.00 0.26 C ATOM 966 CG2 VAL A 183 -3.432 -5.837 -4.946 1.00 0.29 C ATOM 0 H VAL A 183 -1.397 -5.587 -2.896 1.00 0.26 H new ATOM 0 HA VAL A 183 -4.012 -5.129 -1.715 1.00 0.28 H new ATOM 0 HB VAL A 183 -4.607 -4.526 -3.801 1.00 0.28 H new ATOM 0 HG11 VAL A 183 -2.723 -3.263 -4.757 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -2.770 -3.129 -2.983 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -1.593 -4.212 -3.763 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -3.567 -5.266 -5.865 1.00 0.29 H new ATOM 0 HG22 VAL A 183 -2.434 -6.275 -4.934 1.00 0.29 H new ATOM 0 HG23 VAL A 183 -4.177 -6.631 -4.899 1.00 0.29 H new ATOM 976 N LYS A 184 -2.937 -7.929 -2.964 1.00 0.30 N ATOM 977 CA LYS A 184 -3.080 -9.360 -3.027 1.00 0.32 C ATOM 978 C LYS A 184 -3.086 -9.964 -1.649 1.00 0.32 C ATOM 979 O LYS A 184 -3.894 -10.829 -1.336 1.00 0.38 O ATOM 980 CB LYS A 184 -1.924 -9.914 -3.812 1.00 0.34 C ATOM 981 CG LYS A 184 -2.295 -10.238 -5.229 1.00 0.37 C ATOM 982 CD LYS A 184 -2.819 -9.017 -5.937 1.00 1.01 C ATOM 983 CE LYS A 184 -1.905 -8.594 -7.075 1.00 1.37 C ATOM 984 NZ LYS A 184 -1.771 -9.657 -8.107 1.00 2.14 N ATOM 0 H LYS A 184 -2.042 -7.597 -3.323 1.00 0.30 H new ATOM 0 HA LYS A 184 -4.028 -9.606 -3.506 1.00 0.32 H new ATOM 0 HB2 LYS A 184 -1.108 -9.192 -3.810 1.00 0.34 H new ATOM 0 HB3 LYS A 184 -1.554 -10.814 -3.322 1.00 0.34 H new ATOM 0 HG2 LYS A 184 -1.424 -10.625 -5.758 1.00 0.37 H new ATOM 0 HG3 LYS A 184 -3.051 -11.023 -5.241 1.00 0.37 H new ATOM 0 HD2 LYS A 184 -3.816 -9.222 -6.327 1.00 1.01 H new ATOM 0 HD3 LYS A 184 -2.918 -8.197 -5.225 1.00 1.01 H new ATOM 0 HE2 LYS A 184 -2.297 -7.688 -7.537 1.00 1.37 H new ATOM 0 HE3 LYS A 184 -0.920 -8.349 -6.677 1.00 1.37 H new ATOM 0 HZ1 LYS A 184 -1.571 -9.222 -9.030 1.00 2.14 H new ATOM 0 HZ2 LYS A 184 -0.991 -10.295 -7.849 1.00 2.14 H new ATOM 0 HZ3 LYS A 184 -2.657 -10.199 -8.164 1.00 2.14 H new ATOM 998 N GLN A 185 -2.163 -9.500 -0.834 1.00 0.31 N ATOM 999 CA GLN A 185 -2.102 -9.855 0.566 1.00 0.39 C ATOM 1000 C GLN A 185 -3.502 -9.811 1.159 1.00 0.38 C ATOM 1001 O GLN A 185 -3.881 -10.655 1.963 1.00 0.44 O ATOM 1002 CB GLN A 185 -1.169 -8.858 1.275 1.00 0.56 C ATOM 1003 CG GLN A 185 -1.852 -7.959 2.283 1.00 1.32 C ATOM 1004 CD GLN A 185 -1.656 -8.412 3.722 1.00 1.75 C ATOM 1005 OE1 GLN A 185 -1.640 -7.599 4.639 1.00 2.11 O ATOM 1006 NE2 GLN A 185 -1.508 -9.713 3.929 1.00 2.02 N ATOM 0 H GLN A 185 -1.426 -8.859 -1.129 1.00 0.31 H new ATOM 0 HA GLN A 185 -1.712 -10.865 0.695 1.00 0.39 H new ATOM 0 HB2 GLN A 185 -0.381 -9.416 1.781 1.00 0.56 H new ATOM 0 HB3 GLN A 185 -0.686 -8.235 0.522 1.00 0.56 H new ATOM 0 HG2 GLN A 185 -1.469 -6.944 2.173 1.00 1.32 H new ATOM 0 HG3 GLN A 185 -2.919 -7.922 2.063 1.00 1.32 H new ATOM 0 HE21 GLN A 185 -1.527 -10.360 3.141 1.00 2.02 H new ATOM 0 HE22 GLN A 185 -1.375 -10.067 4.876 1.00 2.02 H new ATOM 1015 N HIS A 186 -4.257 -8.822 0.709 1.00 0.36 N ATOM 1016 CA HIS A 186 -5.585 -8.553 1.204 1.00 0.44 C ATOM 1017 C HIS A 186 -6.694 -9.133 0.327 1.00 0.51 C ATOM 1018 O HIS A 186 -7.821 -9.297 0.775 1.00 0.67 O ATOM 1019 CB HIS A 186 -5.741 -7.055 1.331 1.00 0.49 C ATOM 1020 CG HIS A 186 -5.248 -6.535 2.639 1.00 0.55 C ATOM 1021 ND1 HIS A 186 -4.121 -5.756 2.756 1.00 0.73 N ATOM 1022 CD2 HIS A 186 -5.720 -6.705 3.895 1.00 1.09 C ATOM 1023 CE1 HIS A 186 -3.917 -5.473 4.030 1.00 0.65 C ATOM 1024 NE2 HIS A 186 -4.876 -6.038 4.743 1.00 0.91 N ATOM 0 H HIS A 186 -3.954 -8.178 -0.021 1.00 0.36 H new ATOM 0 HA HIS A 186 -5.691 -9.046 2.170 1.00 0.44 H new ATOM 0 HB2 HIS A 186 -5.197 -6.567 0.522 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -6.792 -6.792 1.213 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -3.535 -5.446 1.981 1.00 0.73 H new ATOM 0 HD2 HIS A 186 -6.600 -7.264 4.177 1.00 1.09 H new ATOM 0 HE1 HIS A 186 -3.104 -4.880 4.423 1.00 0.65 H new ATOM 1033 N THR A 187 -6.378 -9.467 -0.903 1.00 0.48 N ATOM 1034 CA THR A 187 -7.405 -9.885 -1.844 1.00 0.59 C ATOM 1035 C THR A 187 -7.151 -11.297 -2.321 1.00 0.62 C ATOM 1036 O THR A 187 -7.780 -11.770 -3.268 1.00 0.80 O ATOM 1037 CB THR A 187 -7.512 -8.931 -3.063 1.00 0.72 C ATOM 1038 OG1 THR A 187 -8.666 -9.253 -3.851 1.00 0.89 O ATOM 1039 CG2 THR A 187 -6.273 -8.995 -3.943 1.00 0.75 C ATOM 0 H THR A 187 -5.429 -9.460 -1.278 1.00 0.48 H new ATOM 0 HA THR A 187 -8.354 -9.848 -1.309 1.00 0.59 H new ATOM 0 HB THR A 187 -7.602 -7.918 -2.670 1.00 0.72 H new ATOM 0 HG1 THR A 187 -8.745 -10.226 -3.934 1.00 0.89 H new ATOM 0 HG21 THR A 187 -6.389 -8.312 -4.785 1.00 0.75 H new ATOM 0 HG22 THR A 187 -5.398 -8.708 -3.360 1.00 0.75 H new ATOM 0 HG23 THR A 187 -6.143 -10.011 -4.315 1.00 0.75 H new ATOM 1047 N VAL A 188 -6.219 -11.985 -1.669 1.00 0.55 N ATOM 1048 CA VAL A 188 -5.916 -13.352 -2.061 1.00 0.63 C ATOM 1049 C VAL A 188 -5.553 -14.206 -0.853 1.00 0.66 C ATOM 1050 O VAL A 188 -5.999 -15.346 -0.728 1.00 0.78 O ATOM 1051 CB VAL A 188 -4.809 -13.443 -3.160 1.00 0.69 C ATOM 1052 CG1 VAL A 188 -4.846 -12.225 -4.066 1.00 0.66 C ATOM 1053 CG2 VAL A 188 -3.413 -13.628 -2.580 1.00 0.84 C ATOM 0 H VAL A 188 -5.673 -11.627 -0.885 1.00 0.55 H new ATOM 0 HA VAL A 188 -6.829 -13.749 -2.505 1.00 0.63 H new ATOM 0 HB VAL A 188 -5.031 -14.334 -3.748 1.00 0.69 H new ATOM 0 HG11 VAL A 188 -4.066 -12.311 -4.823 1.00 0.66 H new ATOM 0 HG12 VAL A 188 -5.819 -12.163 -4.553 1.00 0.66 H new ATOM 0 HG13 VAL A 188 -4.679 -11.326 -3.473 1.00 0.66 H new ATOM 0 HG21 VAL A 188 -2.687 -13.685 -3.391 1.00 0.84 H new ATOM 0 HG22 VAL A 188 -3.172 -12.783 -1.935 1.00 0.84 H new ATOM 0 HG23 VAL A 188 -3.380 -14.549 -1.998 1.00 0.84 H new ATOM 1063 N THR A 189 -4.762 -13.649 0.043 1.00 0.65 N ATOM 1064 CA THR A 189 -4.454 -14.317 1.286 1.00 0.79 C ATOM 1065 C THR A 189 -5.385 -13.778 2.352 1.00 0.83 C ATOM 1066 O THR A 189 -5.292 -14.123 3.530 1.00 1.04 O ATOM 1067 CB THR A 189 -2.988 -14.075 1.698 1.00 0.88 C ATOM 1068 OG1 THR A 189 -2.171 -13.953 0.527 1.00 0.90 O ATOM 1069 CG2 THR A 189 -2.470 -15.223 2.555 1.00 1.12 C ATOM 0 H THR A 189 -4.322 -12.735 -0.069 1.00 0.65 H new ATOM 0 HA THR A 189 -4.589 -15.392 1.164 1.00 0.79 H new ATOM 0 HB THR A 189 -2.943 -13.154 2.280 1.00 0.88 H new ATOM 0 HG1 THR A 189 -1.240 -13.798 0.792 1.00 0.90 H new ATOM 0 HG21 THR A 189 -1.434 -15.030 2.834 1.00 1.12 H new ATOM 0 HG22 THR A 189 -3.078 -15.308 3.456 1.00 1.12 H new ATOM 0 HG23 THR A 189 -2.527 -16.153 1.990 1.00 1.12 H new ATOM 1077 N THR A 190 -6.306 -12.927 1.913 1.00 0.73 N ATOM 1078 CA THR A 190 -7.177 -12.237 2.825 1.00 0.76 C ATOM 1079 C THR A 190 -8.633 -12.181 2.340 1.00 0.80 C ATOM 1080 O THR A 190 -9.546 -11.942 3.132 1.00 1.06 O ATOM 1081 CB THR A 190 -6.621 -10.829 3.135 1.00 0.90 C ATOM 1082 OG1 THR A 190 -5.474 -10.931 3.986 1.00 1.00 O ATOM 1083 CG2 THR A 190 -7.651 -9.919 3.773 1.00 0.93 C ATOM 0 H THR A 190 -6.460 -12.706 0.929 1.00 0.73 H new ATOM 0 HA THR A 190 -7.199 -12.814 3.750 1.00 0.76 H new ATOM 0 HB THR A 190 -6.342 -10.382 2.181 1.00 0.90 H new ATOM 0 HG1 THR A 190 -4.672 -11.065 3.439 1.00 1.00 H new ATOM 0 HG21 THR A 190 -7.204 -8.944 3.968 1.00 0.93 H new ATOM 0 HG22 THR A 190 -8.499 -9.801 3.099 1.00 0.93 H new ATOM 0 HG23 THR A 190 -7.991 -10.356 4.712 1.00 0.93 H new ATOM 1091 N THR A 191 -8.862 -12.471 1.065 1.00 0.99 N ATOM 1092 CA THR A 191 -10.209 -12.414 0.498 1.00 1.23 C ATOM 1093 C THR A 191 -11.181 -13.293 1.273 1.00 1.92 C ATOM 1094 O THR A 191 -12.382 -13.029 1.353 1.00 2.15 O ATOM 1095 CB THR A 191 -10.193 -12.855 -0.967 1.00 1.39 C ATOM 1096 OG1 THR A 191 -8.921 -13.443 -1.264 1.00 1.97 O ATOM 1097 CG2 THR A 191 -10.468 -11.682 -1.894 1.00 1.11 C ATOM 0 H THR A 191 -8.136 -12.748 0.404 1.00 0.99 H new ATOM 0 HA THR A 191 -10.544 -11.379 0.568 1.00 1.23 H new ATOM 0 HB THR A 191 -10.982 -13.590 -1.126 1.00 1.39 H new ATOM 0 HG1 THR A 191 -8.956 -13.871 -2.145 1.00 1.97 H new ATOM 0 HG21 THR A 191 -10.451 -12.024 -2.929 1.00 1.11 H new ATOM 0 HG22 THR A 191 -11.448 -11.261 -1.667 1.00 1.11 H new ATOM 0 HG23 THR A 191 -9.703 -10.919 -1.751 1.00 1.11 H new ATOM 1105 N THR A 192 -10.613 -14.293 1.900 1.00 2.28 N ATOM 1106 CA THR A 192 -11.361 -15.347 2.557 1.00 3.04 C ATOM 1107 C THR A 192 -11.940 -14.899 3.902 1.00 2.58 C ATOM 1108 O THR A 192 -12.888 -15.505 4.404 1.00 3.13 O ATOM 1109 CB THR A 192 -10.457 -16.576 2.750 1.00 3.85 C ATOM 1110 OG1 THR A 192 -11.229 -17.722 3.139 1.00 4.36 O ATOM 1111 CG2 THR A 192 -9.374 -16.308 3.788 1.00 3.79 C ATOM 0 H THR A 192 -9.602 -14.403 1.972 1.00 2.28 H new ATOM 0 HA THR A 192 -12.205 -15.603 1.917 1.00 3.04 H new ATOM 0 HB THR A 192 -9.977 -16.781 1.793 1.00 3.85 H new ATOM 0 HG1 THR A 192 -10.635 -18.493 3.255 1.00 4.36 H new ATOM 0 HG21 THR A 192 -8.752 -17.196 3.902 1.00 3.79 H new ATOM 0 HG22 THR A 192 -8.757 -15.471 3.462 1.00 3.79 H new ATOM 0 HG23 THR A 192 -9.838 -16.065 4.744 1.00 3.79 H new ATOM 1119 N LYS A 193 -11.396 -13.831 4.486 1.00 1.64 N ATOM 1120 CA LYS A 193 -11.913 -13.344 5.762 1.00 1.28 C ATOM 1121 C LYS A 193 -13.242 -12.648 5.523 1.00 0.90 C ATOM 1122 O LYS A 193 -14.037 -12.440 6.437 1.00 0.99 O ATOM 1123 CB LYS A 193 -10.908 -12.399 6.455 1.00 1.60 C ATOM 1124 CG LYS A 193 -10.735 -11.026 5.799 1.00 1.66 C ATOM 1125 CD LYS A 193 -11.817 -10.041 6.230 1.00 1.62 C ATOM 1126 CE LYS A 193 -11.662 -8.693 5.554 1.00 1.60 C ATOM 1127 NZ LYS A 193 -10.449 -7.957 5.999 1.00 2.07 N ATOM 0 H LYS A 193 -10.615 -13.297 4.105 1.00 1.64 H new ATOM 0 HA LYS A 193 -12.063 -14.191 6.431 1.00 1.28 H new ATOM 0 HB2 LYS A 193 -11.226 -12.252 7.487 1.00 1.60 H new ATOM 0 HB3 LYS A 193 -9.936 -12.892 6.488 1.00 1.60 H new ATOM 0 HG2 LYS A 193 -9.756 -10.623 6.057 1.00 1.66 H new ATOM 0 HG3 LYS A 193 -10.759 -11.138 4.715 1.00 1.66 H new ATOM 0 HD2 LYS A 193 -12.798 -10.454 5.994 1.00 1.62 H new ATOM 0 HD3 LYS A 193 -11.778 -9.911 7.311 1.00 1.62 H new ATOM 0 HE2 LYS A 193 -11.618 -8.837 4.474 1.00 1.60 H new ATOM 0 HE3 LYS A 193 -12.544 -8.086 5.759 1.00 1.60 H new ATOM 0 HZ1 LYS A 193 -10.387 -7.051 5.491 1.00 2.07 H new ATOM 0 HZ2 LYS A 193 -10.508 -7.777 7.022 1.00 2.07 H new ATOM 0 HZ3 LYS A 193 -9.603 -8.527 5.796 1.00 2.07 H new ATOM 1141 N GLY A 194 -13.461 -12.302 4.267 1.00 0.89 N ATOM 1142 CA GLY A 194 -14.622 -11.545 3.885 1.00 0.84 C ATOM 1143 C GLY A 194 -14.203 -10.271 3.208 1.00 0.70 C ATOM 1144 O GLY A 194 -14.854 -9.237 3.333 1.00 0.98 O ATOM 0 H GLY A 194 -12.839 -12.540 3.494 1.00 0.89 H new ATOM 0 HA2 GLY A 194 -15.247 -12.135 3.214 1.00 0.84 H new ATOM 0 HA3 GLY A 194 -15.224 -11.318 4.765 1.00 0.84 H new ATOM 1148 N GLU A 195 -13.092 -10.351 2.491 1.00 0.54 N ATOM 1149 CA GLU A 195 -12.527 -9.175 1.862 1.00 0.62 C ATOM 1150 C GLU A 195 -12.815 -9.208 0.369 1.00 0.62 C ATOM 1151 O GLU A 195 -12.664 -10.243 -0.278 1.00 0.88 O ATOM 1152 CB GLU A 195 -11.017 -9.091 2.126 1.00 0.91 C ATOM 1153 CG GLU A 195 -10.435 -7.729 1.859 1.00 1.17 C ATOM 1154 CD GLU A 195 -11.058 -6.679 2.745 1.00 1.69 C ATOM 1155 OE1 GLU A 195 -12.081 -6.097 2.339 1.00 1.98 O ATOM 1156 OE2 GLU A 195 -10.508 -6.405 3.832 1.00 2.30 O ATOM 0 H GLU A 195 -12.570 -11.213 2.333 1.00 0.54 H new ATOM 0 HA GLU A 195 -12.989 -8.285 2.291 1.00 0.62 H new ATOM 0 HB2 GLU A 195 -10.822 -9.364 3.163 1.00 0.91 H new ATOM 0 HB3 GLU A 195 -10.506 -9.824 1.502 1.00 0.91 H new ATOM 0 HG2 GLU A 195 -9.358 -7.754 2.024 1.00 1.17 H new ATOM 0 HG3 GLU A 195 -10.591 -7.464 0.813 1.00 1.17 H new ATOM 1163 N ASN A 196 -13.263 -8.083 -0.160 1.00 0.61 N ATOM 1164 CA ASN A 196 -13.604 -7.983 -1.573 1.00 0.66 C ATOM 1165 C ASN A 196 -13.046 -6.711 -2.149 1.00 0.54 C ATOM 1166 O ASN A 196 -13.163 -5.647 -1.548 1.00 0.57 O ATOM 1167 CB ASN A 196 -15.112 -7.975 -1.801 1.00 0.92 C ATOM 1168 CG ASN A 196 -15.800 -9.244 -1.337 1.00 1.42 C ATOM 1169 OD1 ASN A 196 -15.934 -10.212 -2.090 1.00 2.09 O ATOM 1170 ND2 ASN A 196 -16.258 -9.241 -0.095 1.00 2.16 N ATOM 0 H ASN A 196 -13.400 -7.221 0.368 1.00 0.61 H new ATOM 0 HA ASN A 196 -13.175 -8.858 -2.062 1.00 0.66 H new ATOM 0 HB2 ASN A 196 -15.546 -7.123 -1.277 1.00 0.92 H new ATOM 0 HB3 ASN A 196 -15.310 -7.831 -2.863 1.00 0.92 H new ATOM 0 HD21 ASN A 196 -16.743 -10.060 0.272 1.00 2.16 H new ATOM 0 HD22 ASN A 196 -16.126 -8.420 0.495 1.00 2.16 H new ATOM 1177 N PHE A 197 -12.431 -6.816 -3.306 1.00 0.51 N ATOM 1178 CA PHE A 197 -11.866 -5.668 -3.951 1.00 0.42 C ATOM 1179 C PHE A 197 -12.627 -5.325 -5.216 1.00 0.43 C ATOM 1180 O PHE A 197 -12.826 -6.173 -6.083 1.00 0.47 O ATOM 1181 CB PHE A 197 -10.418 -5.944 -4.313 1.00 0.55 C ATOM 1182 CG PHE A 197 -9.476 -6.015 -3.147 1.00 1.16 C ATOM 1183 CD1 PHE A 197 -9.908 -6.395 -1.888 1.00 1.81 C ATOM 1184 CD2 PHE A 197 -8.144 -5.714 -3.319 1.00 2.03 C ATOM 1185 CE1 PHE A 197 -9.031 -6.465 -0.831 1.00 2.73 C ATOM 1186 CE2 PHE A 197 -7.262 -5.786 -2.267 1.00 2.99 C ATOM 1187 CZ PHE A 197 -7.707 -6.161 -1.022 1.00 3.21 C ATOM 0 H PHE A 197 -12.313 -7.692 -3.816 1.00 0.51 H new ATOM 0 HA PHE A 197 -11.930 -4.828 -3.259 1.00 0.42 H new ATOM 0 HB2 PHE A 197 -10.369 -6.886 -4.859 1.00 0.55 H new ATOM 0 HB3 PHE A 197 -10.074 -5.164 -4.992 1.00 0.55 H new ATOM 0 HD1 PHE A 197 -10.948 -6.640 -1.734 1.00 1.81 H new ATOM 0 HD2 PHE A 197 -7.787 -5.417 -4.294 1.00 2.03 H new ATOM 0 HE1 PHE A 197 -9.384 -6.758 0.147 1.00 2.73 H new ATOM 0 HE2 PHE A 197 -6.220 -5.548 -2.419 1.00 2.99 H new ATOM 0 HZ PHE A 197 -7.015 -6.216 -0.195 1.00 3.21 H new ATOM 1197 N THR A 198 -13.046 -4.084 -5.314 1.00 0.47 N ATOM 1198 CA THR A 198 -13.512 -3.554 -6.568 1.00 0.50 C ATOM 1199 C THR A 198 -12.398 -2.700 -7.144 1.00 0.48 C ATOM 1200 O THR A 198 -11.450 -2.402 -6.439 1.00 0.45 O ATOM 1201 CB THR A 198 -14.816 -2.732 -6.410 1.00 0.54 C ATOM 1202 OG1 THR A 198 -15.365 -2.419 -7.695 1.00 0.61 O ATOM 1203 CG2 THR A 198 -14.574 -1.439 -5.639 1.00 0.49 C ATOM 0 H THR A 198 -13.072 -3.424 -4.537 1.00 0.47 H new ATOM 0 HA THR A 198 -13.757 -4.376 -7.241 1.00 0.50 H new ATOM 0 HB THR A 198 -15.520 -3.344 -5.846 1.00 0.54 H new ATOM 0 HG1 THR A 198 -16.189 -1.901 -7.581 1.00 0.61 H new ATOM 0 HG21 THR A 198 -15.511 -0.889 -5.548 1.00 0.49 H new ATOM 0 HG22 THR A 198 -14.193 -1.674 -4.645 1.00 0.49 H new ATOM 0 HG23 THR A 198 -13.845 -0.829 -6.172 1.00 0.49 H new ATOM 1211 N GLU A 199 -12.463 -2.341 -8.416 1.00 0.51 N ATOM 1212 CA GLU A 199 -11.422 -1.510 -9.007 1.00 0.50 C ATOM 1213 C GLU A 199 -11.392 -0.132 -8.363 1.00 0.44 C ATOM 1214 O GLU A 199 -10.548 0.669 -8.686 1.00 0.43 O ATOM 1215 CB GLU A 199 -11.587 -1.345 -10.508 1.00 0.53 C ATOM 1216 CG GLU A 199 -10.275 -1.029 -11.202 1.00 0.54 C ATOM 1217 CD GLU A 199 -10.455 -0.616 -12.642 1.00 0.58 C ATOM 1218 OE1 GLU A 199 -10.710 -1.493 -13.493 1.00 0.76 O ATOM 1219 OE2 GLU A 199 -10.334 0.592 -12.932 1.00 0.62 O ATOM 0 H GLU A 199 -13.214 -2.607 -9.053 1.00 0.51 H new ATOM 0 HA GLU A 199 -10.482 -2.030 -8.821 1.00 0.50 H new ATOM 0 HB2 GLU A 199 -12.006 -2.260 -10.928 1.00 0.53 H new ATOM 0 HB3 GLU A 199 -12.302 -0.546 -10.707 1.00 0.53 H new ATOM 0 HG2 GLU A 199 -9.767 -0.230 -10.661 1.00 0.54 H new ATOM 0 HG3 GLU A 199 -9.627 -1.905 -11.159 1.00 0.54 H new ATOM 1226 N THR A 200 -12.352 0.148 -7.502 1.00 0.44 N ATOM 1227 CA THR A 200 -12.281 1.284 -6.612 1.00 0.38 C ATOM 1228 C THR A 200 -11.480 0.896 -5.393 1.00 0.33 C ATOM 1229 O THR A 200 -10.568 1.596 -5.019 1.00 0.28 O ATOM 1230 CB THR A 200 -13.665 1.775 -6.148 1.00 0.42 C ATOM 1231 OG1 THR A 200 -14.361 2.413 -7.227 1.00 0.51 O ATOM 1232 CG2 THR A 200 -13.529 2.724 -4.965 1.00 0.45 C ATOM 0 H THR A 200 -13.202 -0.408 -7.402 1.00 0.44 H new ATOM 0 HA THR A 200 -11.813 2.098 -7.166 1.00 0.38 H new ATOM 0 HB THR A 200 -14.245 0.910 -5.828 1.00 0.42 H new ATOM 0 HG1 THR A 200 -15.239 2.717 -6.915 1.00 0.51 H new ATOM 0 HG21 THR A 200 -14.518 3.060 -4.652 1.00 0.45 H new ATOM 0 HG22 THR A 200 -13.043 2.207 -4.138 1.00 0.45 H new ATOM 0 HG23 THR A 200 -12.929 3.586 -5.257 1.00 0.45 H new ATOM 1240 N ASP A 201 -11.780 -0.271 -4.827 1.00 0.37 N ATOM 1241 CA ASP A 201 -11.102 -0.735 -3.619 1.00 0.34 C ATOM 1242 C ASP A 201 -9.669 -0.909 -3.969 1.00 0.31 C ATOM 1243 O ASP A 201 -8.747 -0.701 -3.184 1.00 0.28 O ATOM 1244 CB ASP A 201 -11.614 -2.084 -3.114 1.00 0.37 C ATOM 1245 CG ASP A 201 -13.009 -2.042 -2.549 1.00 0.41 C ATOM 1246 OD1 ASP A 201 -13.224 -1.352 -1.544 1.00 0.56 O ATOM 1247 OD2 ASP A 201 -13.889 -2.727 -3.098 1.00 0.50 O ATOM 0 H ASP A 201 -12.488 -0.912 -5.185 1.00 0.37 H new ATOM 0 HA ASP A 201 -11.280 -0.002 -2.832 1.00 0.34 H new ATOM 0 HB2 ASP A 201 -11.588 -2.800 -3.935 1.00 0.37 H new ATOM 0 HB3 ASP A 201 -10.934 -2.454 -2.347 1.00 0.37 H new ATOM 1252 N ILE A 202 -9.517 -1.295 -5.195 1.00 0.35 N ATOM 1253 CA ILE A 202 -8.253 -1.542 -5.750 1.00 0.36 C ATOM 1254 C ILE A 202 -7.628 -0.289 -6.189 1.00 0.33 C ATOM 1255 O ILE A 202 -6.431 -0.110 -6.021 1.00 0.34 O ATOM 1256 CB ILE A 202 -8.373 -2.497 -6.935 1.00 0.44 C ATOM 1257 CG1 ILE A 202 -7.403 -3.621 -6.780 1.00 0.50 C ATOM 1258 CG2 ILE A 202 -8.091 -1.803 -8.259 1.00 0.48 C ATOM 1259 CD1 ILE A 202 -6.817 -3.679 -5.408 1.00 0.59 C ATOM 0 H ILE A 202 -10.292 -1.446 -5.840 1.00 0.35 H new ATOM 0 HA ILE A 202 -7.628 -1.999 -4.983 1.00 0.36 H new ATOM 0 HB ILE A 202 -9.399 -2.866 -6.946 1.00 0.44 H new ATOM 0 HG12 ILE A 202 -7.905 -4.564 -6.998 1.00 0.50 H new ATOM 0 HG13 ILE A 202 -6.602 -3.510 -7.510 1.00 0.50 H new ATOM 0 HG21 ILE A 202 -8.188 -2.521 -9.074 1.00 0.48 H new ATOM 0 HG22 ILE A 202 -8.804 -0.991 -8.404 1.00 0.48 H new ATOM 0 HG23 ILE A 202 -7.079 -1.399 -8.250 1.00 0.48 H new ATOM 0 HD11 ILE A 202 -6.118 -4.513 -5.346 1.00 0.59 H new ATOM 0 HD12 ILE A 202 -6.291 -2.748 -5.198 1.00 0.59 H new ATOM 0 HD13 ILE A 202 -7.614 -3.818 -4.678 1.00 0.59 H new ATOM 1271 N LYS A 203 -8.435 0.599 -6.731 1.00 0.33 N ATOM 1272 CA LYS A 203 -7.883 1.801 -7.220 1.00 0.33 C ATOM 1273 C LYS A 203 -7.285 2.519 -6.048 1.00 0.28 C ATOM 1274 O LYS A 203 -6.389 3.321 -6.183 1.00 0.32 O ATOM 1275 CB LYS A 203 -8.892 2.665 -7.937 1.00 0.33 C ATOM 1276 CG LYS A 203 -9.785 3.467 -7.024 1.00 0.29 C ATOM 1277 CD LYS A 203 -10.745 4.340 -7.806 1.00 0.34 C ATOM 1278 CE LYS A 203 -11.375 5.389 -6.905 1.00 1.13 C ATOM 1279 NZ LYS A 203 -12.446 6.158 -7.583 1.00 1.93 N ATOM 0 H LYS A 203 -9.445 0.498 -6.833 1.00 0.33 H new ATOM 0 HA LYS A 203 -7.125 1.573 -7.970 1.00 0.33 H new ATOM 0 HB2 LYS A 203 -8.361 3.349 -8.599 1.00 0.33 H new ATOM 0 HB3 LYS A 203 -9.514 2.029 -8.567 1.00 0.33 H new ATOM 0 HG2 LYS A 203 -10.349 2.791 -6.381 1.00 0.29 H new ATOM 0 HG3 LYS A 203 -9.173 4.091 -6.373 1.00 0.29 H new ATOM 0 HD2 LYS A 203 -10.216 4.828 -8.625 1.00 0.34 H new ATOM 0 HD3 LYS A 203 -11.524 3.722 -8.253 1.00 0.34 H new ATOM 0 HE2 LYS A 203 -11.787 4.902 -6.021 1.00 1.13 H new ATOM 0 HE3 LYS A 203 -10.603 6.076 -6.560 1.00 1.13 H new ATOM 0 HZ1 LYS A 203 -12.105 7.118 -7.791 1.00 1.93 H new ATOM 0 HZ2 LYS A 203 -12.706 5.683 -8.471 1.00 1.93 H new ATOM 0 HZ3 LYS A 203 -13.279 6.213 -6.963 1.00 1.93 H new ATOM 1293 N ILE A 204 -7.794 2.121 -4.888 1.00 0.24 N ATOM 1294 CA ILE A 204 -7.327 2.552 -3.607 1.00 0.22 C ATOM 1295 C ILE A 204 -5.938 2.043 -3.411 1.00 0.22 C ATOM 1296 O ILE A 204 -5.024 2.815 -3.365 1.00 0.25 O ATOM 1297 CB ILE A 204 -8.191 2.002 -2.484 1.00 0.24 C ATOM 1298 CG1 ILE A 204 -9.627 2.452 -2.648 1.00 0.27 C ATOM 1299 CG2 ILE A 204 -7.640 2.403 -1.145 1.00 0.32 C ATOM 1300 CD1 ILE A 204 -10.548 1.981 -1.567 1.00 0.30 C ATOM 0 H ILE A 204 -8.572 1.464 -4.829 1.00 0.24 H new ATOM 0 HA ILE A 204 -7.366 3.641 -3.579 1.00 0.22 H new ATOM 0 HB ILE A 204 -8.175 0.913 -2.536 1.00 0.24 H new ATOM 0 HG12 ILE A 204 -9.652 3.541 -2.682 1.00 0.27 H new ATOM 0 HG13 ILE A 204 -10.000 2.095 -3.608 1.00 0.27 H new ATOM 0 HG21 ILE A 204 -8.273 1.999 -0.355 1.00 0.32 H new ATOM 0 HG22 ILE A 204 -6.629 2.011 -1.035 1.00 0.32 H new ATOM 0 HG23 ILE A 204 -7.618 3.490 -1.072 1.00 0.32 H new ATOM 0 HD11 ILE A 204 -11.556 2.348 -1.762 1.00 0.30 H new ATOM 0 HD12 ILE A 204 -10.557 0.891 -1.545 1.00 0.30 H new ATOM 0 HD13 ILE A 204 -10.204 2.360 -0.605 1.00 0.30 H new ATOM 1312 N MET A 205 -5.769 0.731 -3.364 1.00 0.21 N ATOM 1313 CA MET A 205 -4.451 0.155 -3.165 1.00 0.21 C ATOM 1314 C MET A 205 -3.514 0.574 -4.256 1.00 0.22 C ATOM 1315 O MET A 205 -2.318 0.517 -4.116 1.00 0.26 O ATOM 1316 CB MET A 205 -4.503 -1.355 -3.044 1.00 0.22 C ATOM 1317 CG MET A 205 -4.360 -1.788 -1.602 1.00 0.27 C ATOM 1318 SD MET A 205 -5.325 -3.255 -1.232 1.00 0.32 S ATOM 1319 CE MET A 205 -6.901 -2.744 -1.902 1.00 0.42 C ATOM 0 H MET A 205 -6.522 0.050 -3.460 1.00 0.21 H new ATOM 0 HA MET A 205 -4.070 0.540 -2.219 1.00 0.21 H new ATOM 0 HB2 MET A 205 -5.447 -1.723 -3.446 1.00 0.22 H new ATOM 0 HB3 MET A 205 -3.707 -1.799 -3.642 1.00 0.22 H new ATOM 0 HG2 MET A 205 -3.310 -1.983 -1.386 1.00 0.27 H new ATOM 0 HG3 MET A 205 -4.674 -0.975 -0.948 1.00 0.27 H new ATOM 0 HE1 MET A 205 -7.704 -3.260 -1.377 1.00 0.42 H new ATOM 0 HE2 MET A 205 -7.018 -1.668 -1.776 1.00 0.42 H new ATOM 0 HE3 MET A 205 -6.943 -2.992 -2.963 1.00 0.42 H new ATOM 1329 N GLU A 206 -4.053 1.085 -5.307 1.00 0.23 N ATOM 1330 CA GLU A 206 -3.233 1.511 -6.378 1.00 0.28 C ATOM 1331 C GLU A 206 -2.914 2.964 -6.163 1.00 0.30 C ATOM 1332 O GLU A 206 -1.866 3.459 -6.524 1.00 0.38 O ATOM 1333 CB GLU A 206 -3.901 1.244 -7.704 1.00 0.32 C ATOM 1334 CG GLU A 206 -4.172 -0.230 -7.861 1.00 0.34 C ATOM 1335 CD GLU A 206 -4.648 -0.606 -9.249 1.00 0.49 C ATOM 1336 OE1 GLU A 206 -5.706 -0.093 -9.671 1.00 0.54 O ATOM 1337 OE2 GLU A 206 -3.984 -1.422 -9.914 1.00 0.90 O ATOM 0 H GLU A 206 -5.055 1.217 -5.445 1.00 0.23 H new ATOM 0 HA GLU A 206 -2.300 0.948 -6.402 1.00 0.28 H new ATOM 0 HB2 GLU A 206 -4.835 1.802 -7.768 1.00 0.32 H new ATOM 0 HB3 GLU A 206 -3.265 1.593 -8.517 1.00 0.32 H new ATOM 0 HG2 GLU A 206 -3.263 -0.786 -7.633 1.00 0.34 H new ATOM 0 HG3 GLU A 206 -4.923 -0.534 -7.132 1.00 0.34 H new ATOM 1344 N ARG A 207 -3.799 3.624 -5.467 1.00 0.26 N ATOM 1345 CA ARG A 207 -3.652 5.028 -5.238 1.00 0.30 C ATOM 1346 C ARG A 207 -2.983 5.300 -3.895 1.00 0.31 C ATOM 1347 O ARG A 207 -2.340 6.325 -3.734 1.00 0.40 O ATOM 1348 CB ARG A 207 -5.019 5.720 -5.372 1.00 0.33 C ATOM 1349 CG ARG A 207 -6.048 5.349 -4.309 1.00 0.38 C ATOM 1350 CD ARG A 207 -5.943 6.200 -3.061 1.00 0.84 C ATOM 1351 NE ARG A 207 -6.499 7.545 -3.279 1.00 1.28 N ATOM 1352 CZ ARG A 207 -5.903 8.536 -3.963 1.00 1.93 C ATOM 1353 NH1 ARG A 207 -4.635 8.440 -4.349 1.00 2.42 N ATOM 1354 NH2 ARG A 207 -6.569 9.655 -4.209 1.00 2.55 N ATOM 0 H ARG A 207 -4.631 3.207 -5.049 1.00 0.26 H new ATOM 0 HA ARG A 207 -2.991 5.450 -5.995 1.00 0.30 H new ATOM 0 HB2 ARG A 207 -4.865 6.799 -5.344 1.00 0.33 H new ATOM 0 HB3 ARG A 207 -5.433 5.483 -6.352 1.00 0.33 H new ATOM 0 HG2 ARG A 207 -7.049 5.451 -4.729 1.00 0.38 H new ATOM 0 HG3 ARG A 207 -5.921 4.301 -4.039 1.00 0.38 H new ATOM 0 HD2 ARG A 207 -6.473 5.714 -2.242 1.00 0.84 H new ATOM 0 HD3 ARG A 207 -4.898 6.281 -2.761 1.00 0.84 H new ATOM 0 HE ARG A 207 -7.415 7.742 -2.876 1.00 1.28 H new ATOM 0 HH11 ARG A 207 -4.096 7.603 -4.127 1.00 2.42 H new ATOM 0 HH12 ARG A 207 -4.201 9.203 -4.868 1.00 2.42 H new ATOM 0 HH21 ARG A 207 -7.529 9.760 -3.880 1.00 2.55 H new ATOM 0 HH22 ARG A 207 -6.122 10.411 -4.728 1.00 2.55 H new ATOM 1368 N VAL A 208 -3.130 4.388 -2.938 1.00 0.29 N ATOM 1369 CA VAL A 208 -2.381 4.488 -1.699 1.00 0.31 C ATOM 1370 C VAL A 208 -1.054 3.828 -1.850 1.00 0.34 C ATOM 1371 O VAL A 208 -0.036 4.421 -1.602 1.00 0.50 O ATOM 1372 CB VAL A 208 -3.040 3.849 -0.448 1.00 0.44 C ATOM 1373 CG1 VAL A 208 -3.590 4.883 0.512 1.00 0.30 C ATOM 1374 CG2 VAL A 208 -4.109 2.878 -0.818 1.00 0.80 C ATOM 0 H VAL A 208 -3.754 3.583 -2.999 1.00 0.29 H new ATOM 0 HA VAL A 208 -2.323 5.563 -1.526 1.00 0.31 H new ATOM 0 HB VAL A 208 -2.243 3.310 0.063 1.00 0.44 H new ATOM 0 HG11 VAL A 208 -4.040 4.381 1.369 1.00 0.30 H new ATOM 0 HG12 VAL A 208 -2.781 5.529 0.853 1.00 0.30 H new ATOM 0 HG13 VAL A 208 -4.346 5.484 0.006 1.00 0.30 H new ATOM 0 HG21 VAL A 208 -4.544 2.454 0.087 1.00 0.80 H new ATOM 0 HG22 VAL A 208 -4.884 3.390 -1.388 1.00 0.80 H new ATOM 0 HG23 VAL A 208 -3.681 2.079 -1.424 1.00 0.80 H new ATOM 1384 N VAL A 209 -1.107 2.613 -2.312 1.00 0.28 N ATOM 1385 CA VAL A 209 -0.010 1.690 -2.246 1.00 0.31 C ATOM 1386 C VAL A 209 0.915 1.842 -3.439 1.00 0.29 C ATOM 1387 O VAL A 209 2.131 1.815 -3.271 1.00 0.30 O ATOM 1388 CB VAL A 209 -0.551 0.258 -2.155 1.00 0.38 C ATOM 1389 CG1 VAL A 209 0.538 -0.761 -2.322 1.00 0.89 C ATOM 1390 CG2 VAL A 209 -1.308 0.052 -0.855 1.00 0.88 C ATOM 0 H VAL A 209 -1.938 2.225 -2.758 1.00 0.28 H new ATOM 0 HA VAL A 209 0.576 1.910 -1.354 1.00 0.31 H new ATOM 0 HB VAL A 209 -1.249 0.115 -2.980 1.00 0.38 H new ATOM 0 HG11 VAL A 209 0.113 -1.762 -2.251 1.00 0.89 H new ATOM 0 HG12 VAL A 209 1.008 -0.635 -3.297 1.00 0.89 H new ATOM 0 HG13 VAL A 209 1.285 -0.627 -1.539 1.00 0.89 H new ATOM 0 HG21 VAL A 209 -1.683 -0.970 -0.811 1.00 0.88 H new ATOM 0 HG22 VAL A 209 -0.640 0.230 -0.013 1.00 0.88 H new ATOM 0 HG23 VAL A 209 -2.145 0.748 -0.807 1.00 0.88 H new ATOM 1400 N GLU A 210 0.374 2.036 -4.645 1.00 0.28 N ATOM 1401 CA GLU A 210 1.252 2.278 -5.773 1.00 0.29 C ATOM 1402 C GLU A 210 1.963 3.586 -5.527 1.00 0.24 C ATOM 1403 O GLU A 210 3.147 3.743 -5.802 1.00 0.25 O ATOM 1404 CB GLU A 210 0.504 2.317 -7.098 1.00 0.34 C ATOM 1405 CG GLU A 210 1.407 2.448 -8.314 1.00 0.63 C ATOM 1406 CD GLU A 210 0.635 2.642 -9.605 1.00 0.87 C ATOM 1407 OE1 GLU A 210 -0.302 3.471 -9.625 1.00 1.16 O ATOM 1408 OE2 GLU A 210 0.941 1.948 -10.601 1.00 1.62 O ATOM 0 H GLU A 210 -0.625 2.030 -4.853 1.00 0.28 H new ATOM 0 HA GLU A 210 1.962 1.455 -5.853 1.00 0.29 H new ATOM 0 HB2 GLU A 210 -0.090 1.408 -7.195 1.00 0.34 H new ATOM 0 HB3 GLU A 210 -0.194 3.154 -7.085 1.00 0.34 H new ATOM 0 HG2 GLU A 210 2.082 3.292 -8.170 1.00 0.63 H new ATOM 0 HG3 GLU A 210 2.027 1.555 -8.398 1.00 0.63 H new ATOM 1415 N GLN A 211 1.230 4.505 -4.935 1.00 0.23 N ATOM 1416 CA GLN A 211 1.784 5.782 -4.583 1.00 0.23 C ATOM 1417 C GLN A 211 2.709 5.653 -3.389 1.00 0.22 C ATOM 1418 O GLN A 211 3.723 6.330 -3.303 1.00 0.25 O ATOM 1419 CB GLN A 211 0.677 6.763 -4.232 1.00 0.29 C ATOM 1420 CG GLN A 211 1.169 8.165 -3.899 1.00 0.34 C ATOM 1421 CD GLN A 211 1.880 8.830 -5.062 1.00 0.79 C ATOM 1422 OE1 GLN A 211 1.569 8.575 -6.224 1.00 1.49 O ATOM 1423 NE2 GLN A 211 2.841 9.688 -4.755 1.00 1.68 N ATOM 0 H GLN A 211 0.247 4.385 -4.690 1.00 0.23 H new ATOM 0 HA GLN A 211 2.344 6.148 -5.443 1.00 0.23 H new ATOM 0 HB2 GLN A 211 -0.019 6.823 -5.069 1.00 0.29 H new ATOM 0 HB3 GLN A 211 0.118 6.374 -3.381 1.00 0.29 H new ATOM 0 HG2 GLN A 211 0.321 8.780 -3.597 1.00 0.34 H new ATOM 0 HG3 GLN A 211 1.846 8.115 -3.046 1.00 0.34 H new ATOM 0 HE21 GLN A 211 3.068 9.871 -3.778 1.00 1.68 H new ATOM 0 HE22 GLN A 211 3.354 10.166 -5.496 1.00 1.68 H new ATOM 1432 N MET A 212 2.354 4.784 -2.460 1.00 0.27 N ATOM 1433 CA MET A 212 3.063 4.728 -1.206 1.00 0.32 C ATOM 1434 C MET A 212 4.344 3.953 -1.325 1.00 0.25 C ATOM 1435 O MET A 212 5.373 4.374 -0.826 1.00 0.22 O ATOM 1436 CB MET A 212 2.227 4.165 -0.083 1.00 0.48 C ATOM 1437 CG MET A 212 2.112 5.121 1.092 1.00 1.72 C ATOM 1438 SD MET A 212 3.621 5.273 2.050 1.00 1.89 S ATOM 1439 CE MET A 212 4.257 3.617 1.873 1.00 0.30 C ATOM 0 H MET A 212 1.588 4.117 -2.553 1.00 0.27 H new ATOM 0 HA MET A 212 3.298 5.763 -0.957 1.00 0.32 H new ATOM 0 HB2 MET A 212 1.230 3.933 -0.458 1.00 0.48 H new ATOM 0 HB3 MET A 212 2.666 3.227 0.257 1.00 0.48 H new ATOM 0 HG2 MET A 212 1.827 6.106 0.721 1.00 1.72 H new ATOM 0 HG3 MET A 212 1.309 4.783 1.747 1.00 1.72 H new ATOM 0 HE1 MET A 212 4.793 3.334 2.779 1.00 0.30 H new ATOM 0 HE2 MET A 212 3.431 2.925 1.709 1.00 0.30 H new ATOM 0 HE3 MET A 212 4.937 3.577 1.022 1.00 0.30 H new ATOM 1449 N CYS A 213 4.299 2.816 -1.969 1.00 0.27 N ATOM 1450 CA CYS A 213 5.518 2.089 -2.180 1.00 0.24 C ATOM 1451 C CYS A 213 6.418 2.947 -3.086 1.00 0.23 C ATOM 1452 O CYS A 213 7.642 2.888 -2.992 1.00 0.25 O ATOM 1453 CB CYS A 213 5.227 0.692 -2.758 1.00 0.27 C ATOM 1454 SG CYS A 213 3.867 -0.194 -1.909 1.00 0.68 S ATOM 0 H CYS A 213 3.455 2.384 -2.346 1.00 0.27 H new ATOM 0 HA CYS A 213 6.040 1.908 -1.240 1.00 0.24 H new ATOM 0 HB2 CYS A 213 4.979 0.791 -3.815 1.00 0.27 H new ATOM 0 HB3 CYS A 213 6.133 0.089 -2.699 1.00 0.27 H new ATOM 1459 N ILE A 214 5.793 3.766 -3.963 1.00 0.23 N ATOM 1460 CA ILE A 214 6.523 4.788 -4.733 1.00 0.24 C ATOM 1461 C ILE A 214 7.104 5.807 -3.786 1.00 0.25 C ATOM 1462 O ILE A 214 8.211 6.303 -3.977 1.00 0.30 O ATOM 1463 CB ILE A 214 5.607 5.535 -5.745 1.00 0.24 C ATOM 1464 CG1 ILE A 214 5.929 5.157 -7.185 1.00 0.30 C ATOM 1465 CG2 ILE A 214 5.741 7.041 -5.600 1.00 0.26 C ATOM 1466 CD1 ILE A 214 5.676 3.717 -7.494 1.00 0.34 C ATOM 0 H ILE A 214 4.791 3.736 -4.151 1.00 0.23 H new ATOM 0 HA ILE A 214 7.303 4.272 -5.292 1.00 0.24 H new ATOM 0 HB ILE A 214 4.585 5.232 -5.516 1.00 0.24 H new ATOM 0 HG12 ILE A 214 5.333 5.775 -7.856 1.00 0.30 H new ATOM 0 HG13 ILE A 214 6.976 5.385 -7.387 1.00 0.30 H new ATOM 0 HG21 ILE A 214 5.089 7.535 -6.320 1.00 0.26 H new ATOM 0 HG22 ILE A 214 5.456 7.336 -4.590 1.00 0.26 H new ATOM 0 HG23 ILE A 214 6.774 7.334 -5.785 1.00 0.26 H new ATOM 0 HD11 ILE A 214 5.927 3.519 -8.536 1.00 0.34 H new ATOM 0 HD12 ILE A 214 6.292 3.092 -6.847 1.00 0.34 H new ATOM 0 HD13 ILE A 214 4.624 3.488 -7.324 1.00 0.34 H new ATOM 1478 N THR A 215 6.328 6.142 -2.782 1.00 0.25 N ATOM 1479 CA THR A 215 6.779 7.037 -1.770 1.00 0.27 C ATOM 1480 C THR A 215 8.041 6.459 -1.140 1.00 0.26 C ATOM 1481 O THR A 215 8.984 7.177 -0.925 1.00 0.33 O ATOM 1482 CB THR A 215 5.676 7.306 -0.727 1.00 0.29 C ATOM 1483 OG1 THR A 215 5.374 8.707 -0.669 1.00 0.37 O ATOM 1484 CG2 THR A 215 6.094 6.816 0.635 1.00 0.31 C ATOM 0 H THR A 215 5.376 5.799 -2.654 1.00 0.25 H new ATOM 0 HA THR A 215 7.016 8.005 -2.211 1.00 0.27 H new ATOM 0 HB THR A 215 4.783 6.761 -1.033 1.00 0.29 H new ATOM 0 HG1 THR A 215 4.671 8.863 -0.004 1.00 0.37 H new ATOM 0 HG21 THR A 215 5.299 7.017 1.354 1.00 0.31 H new ATOM 0 HG22 THR A 215 6.283 5.743 0.594 1.00 0.31 H new ATOM 0 HG23 THR A 215 7.002 7.333 0.945 1.00 0.31 H new ATOM 1492 N GLN A 216 8.059 5.152 -0.860 1.00 0.23 N ATOM 1493 CA GLN A 216 9.298 4.479 -0.464 1.00 0.25 C ATOM 1494 C GLN A 216 10.419 4.714 -1.467 1.00 0.31 C ATOM 1495 O GLN A 216 11.571 4.873 -1.086 1.00 0.39 O ATOM 1496 CB GLN A 216 9.159 2.975 -0.327 1.00 0.25 C ATOM 1497 CG GLN A 216 7.962 2.515 0.486 1.00 0.28 C ATOM 1498 CD GLN A 216 7.814 3.291 1.781 1.00 0.88 C ATOM 1499 OE1 GLN A 216 7.078 4.261 1.839 1.00 1.69 O ATOM 1500 NE2 GLN A 216 8.536 2.904 2.809 1.00 1.58 N ATOM 0 H GLN A 216 7.240 4.546 -0.900 1.00 0.23 H new ATOM 0 HA GLN A 216 9.531 4.916 0.507 1.00 0.25 H new ATOM 0 HB2 GLN A 216 9.092 2.539 -1.324 1.00 0.25 H new ATOM 0 HB3 GLN A 216 10.065 2.581 0.133 1.00 0.25 H new ATOM 0 HG2 GLN A 216 7.056 2.629 -0.109 1.00 0.28 H new ATOM 0 HG3 GLN A 216 8.064 1.453 0.711 1.00 0.28 H new ATOM 0 HE21 GLN A 216 9.142 2.088 2.728 1.00 1.58 H new ATOM 0 HE22 GLN A 216 8.490 3.420 3.688 1.00 1.58 H new ATOM 1509 N TYR A 217 10.098 4.711 -2.752 1.00 0.38 N ATOM 1510 CA TYR A 217 11.113 4.947 -3.774 1.00 0.49 C ATOM 1511 C TYR A 217 11.877 6.233 -3.450 1.00 0.49 C ATOM 1512 O TYR A 217 13.030 6.396 -3.817 1.00 0.57 O ATOM 1513 CB TYR A 217 10.473 5.026 -5.173 1.00 0.73 C ATOM 1514 CG TYR A 217 11.311 5.754 -6.205 1.00 0.85 C ATOM 1515 CD1 TYR A 217 12.446 5.156 -6.743 1.00 0.97 C ATOM 1516 CD2 TYR A 217 10.967 7.025 -6.649 1.00 1.07 C ATOM 1517 CE1 TYR A 217 13.208 5.804 -7.696 1.00 1.18 C ATOM 1518 CE2 TYR A 217 11.727 7.678 -7.600 1.00 1.29 C ATOM 1519 CZ TYR A 217 12.850 7.116 -8.078 1.00 1.31 C ATOM 1520 OH TYR A 217 13.600 7.700 -9.076 1.00 1.56 O ATOM 0 H TYR A 217 9.157 4.550 -3.111 1.00 0.38 H new ATOM 0 HA TYR A 217 11.813 4.112 -3.778 1.00 0.49 H new ATOM 0 HB2 TYR A 217 10.280 4.014 -5.528 1.00 0.73 H new ATOM 0 HB3 TYR A 217 9.507 5.525 -5.090 1.00 0.73 H new ATOM 0 HD1 TYR A 217 12.736 4.170 -6.411 1.00 0.97 H new ATOM 0 HD2 TYR A 217 10.091 7.510 -6.244 1.00 1.07 H new ATOM 0 HE1 TYR A 217 14.062 5.316 -8.141 1.00 1.18 H new ATOM 0 HE2 TYR A 217 11.416 8.647 -7.962 1.00 1.29 H new ATOM 0 HH TYR A 217 13.261 8.602 -9.255 1.00 1.56 H new ATOM 1530 N GLN A 218 11.197 7.169 -2.815 1.00 0.46 N ATOM 1531 CA GLN A 218 11.868 8.340 -2.245 1.00 0.51 C ATOM 1532 C GLN A 218 12.107 8.243 -0.725 1.00 0.50 C ATOM 1533 O GLN A 218 13.058 8.830 -0.212 1.00 0.61 O ATOM 1534 CB GLN A 218 11.088 9.614 -2.582 1.00 0.53 C ATOM 1535 CG GLN A 218 9.580 9.443 -2.553 1.00 0.48 C ATOM 1536 CD GLN A 218 8.833 10.762 -2.516 1.00 0.72 C ATOM 1537 OE1 GLN A 218 7.751 10.859 -1.941 1.00 1.31 O ATOM 1538 NE2 GLN A 218 9.400 11.785 -3.134 1.00 1.52 N ATOM 0 H GLN A 218 10.187 7.149 -2.677 1.00 0.46 H new ATOM 0 HA GLN A 218 12.856 8.377 -2.703 1.00 0.51 H new ATOM 0 HB2 GLN A 218 11.368 10.396 -1.876 1.00 0.53 H new ATOM 0 HB3 GLN A 218 11.385 9.958 -3.573 1.00 0.53 H new ATOM 0 HG2 GLN A 218 9.267 8.880 -3.432 1.00 0.48 H new ATOM 0 HG3 GLN A 218 9.304 8.851 -1.680 1.00 0.48 H new ATOM 0 HE21 GLN A 218 10.299 11.665 -3.600 1.00 1.52 H new ATOM 0 HE22 GLN A 218 8.938 12.694 -3.144 1.00 1.52 H new ATOM 1547 N GLN A 219 11.247 7.524 -0.011 1.00 0.40 N ATOM 1548 CA GLN A 219 11.215 7.602 1.445 1.00 0.41 C ATOM 1549 C GLN A 219 11.933 6.444 2.094 1.00 0.39 C ATOM 1550 O GLN A 219 12.390 6.528 3.228 1.00 0.46 O ATOM 1551 CB GLN A 219 9.795 7.738 2.002 1.00 0.45 C ATOM 1552 CG GLN A 219 9.109 6.426 2.315 1.00 0.44 C ATOM 1553 CD GLN A 219 8.246 6.522 3.564 1.00 0.81 C ATOM 1554 OE1 GLN A 219 7.071 6.878 3.506 1.00 1.64 O ATOM 1555 NE2 GLN A 219 8.830 6.206 4.712 1.00 1.26 N ATOM 0 H GLN A 219 10.565 6.883 -0.415 1.00 0.40 H new ATOM 0 HA GLN A 219 11.751 8.516 1.700 1.00 0.41 H new ATOM 0 HB2 GLN A 219 9.832 8.339 2.911 1.00 0.45 H new ATOM 0 HB3 GLN A 219 9.188 8.287 1.282 1.00 0.45 H new ATOM 0 HG2 GLN A 219 8.491 6.128 1.468 1.00 0.44 H new ATOM 0 HG3 GLN A 219 9.859 5.647 2.451 1.00 0.44 H new ATOM 0 HE21 GLN A 219 9.807 5.914 4.724 1.00 1.26 H new ATOM 0 HE22 GLN A 219 8.302 6.255 5.583 1.00 1.26 H new ATOM 1564 N GLU A 220 12.026 5.364 1.371 1.00 0.35 N ATOM 1565 CA GLU A 220 12.707 4.195 1.843 1.00 0.39 C ATOM 1566 C GLU A 220 14.185 4.374 1.649 1.00 0.48 C ATOM 1567 O GLU A 220 14.981 3.782 2.344 1.00 0.55 O ATOM 1568 CB GLU A 220 12.264 2.992 1.080 1.00 0.50 C ATOM 1569 CG GLU A 220 12.749 1.704 1.639 1.00 1.11 C ATOM 1570 CD GLU A 220 12.100 1.340 2.965 1.00 2.32 C ATOM 1571 OE1 GLU A 220 11.102 1.983 3.342 1.00 2.80 O ATOM 1572 OE2 GLU A 220 12.602 0.416 3.640 1.00 3.07 O ATOM 0 H GLU A 220 11.630 5.271 0.436 1.00 0.35 H new ATOM 0 HA GLU A 220 12.476 4.055 2.899 1.00 0.39 H new ATOM 0 HB2 GLU A 220 11.175 2.975 1.051 1.00 0.50 H new ATOM 0 HB3 GLU A 220 12.609 3.081 0.050 1.00 0.50 H new ATOM 0 HG2 GLU A 220 12.558 0.909 0.919 1.00 1.11 H new ATOM 0 HG3 GLU A 220 13.829 1.759 1.774 1.00 1.11 H new ATOM 1579 N SER A 221 14.582 5.208 0.705 1.00 0.52 N ATOM 1580 CA SER A 221 15.994 5.465 0.576 1.00 0.63 C ATOM 1581 C SER A 221 16.479 6.171 1.827 1.00 0.68 C ATOM 1582 O SER A 221 17.667 6.255 2.114 1.00 0.81 O ATOM 1583 CB SER A 221 16.339 6.304 -0.623 1.00 0.70 C ATOM 1584 OG SER A 221 15.688 7.561 -0.582 1.00 0.86 O ATOM 0 H SER A 221 13.975 5.696 0.047 1.00 0.52 H new ATOM 0 HA SER A 221 16.485 4.501 0.442 1.00 0.63 H new ATOM 0 HB2 SER A 221 17.418 6.453 -0.666 1.00 0.70 H new ATOM 0 HB3 SER A 221 16.054 5.775 -1.533 1.00 0.70 H new ATOM 0 HG SER A 221 14.718 7.426 -0.545 1.00 0.86 H new ATOM 1590 N GLN A 222 15.502 6.700 2.532 1.00 0.62 N ATOM 1591 CA GLN A 222 15.691 7.358 3.793 1.00 0.66 C ATOM 1592 C GLN A 222 15.625 6.336 4.917 1.00 0.60 C ATOM 1593 O GLN A 222 16.582 6.144 5.668 1.00 0.63 O ATOM 1594 CB GLN A 222 14.569 8.368 3.959 1.00 0.71 C ATOM 1595 CG GLN A 222 14.412 9.295 2.768 1.00 0.88 C ATOM 1596 CD GLN A 222 13.310 10.315 2.971 1.00 0.95 C ATOM 1597 OE1 GLN A 222 13.037 10.739 4.094 1.00 1.36 O ATOM 1598 NE2 GLN A 222 12.662 10.707 1.889 1.00 1.60 N ATOM 0 H GLN A 222 14.528 6.680 2.229 1.00 0.62 H new ATOM 0 HA GLN A 222 16.662 7.853 3.825 1.00 0.66 H new ATOM 0 HB2 GLN A 222 13.632 7.836 4.122 1.00 0.71 H new ATOM 0 HB3 GLN A 222 14.756 8.964 4.852 1.00 0.71 H new ATOM 0 HG2 GLN A 222 15.354 9.813 2.588 1.00 0.88 H new ATOM 0 HG3 GLN A 222 14.197 8.705 1.877 1.00 0.88 H new ATOM 0 HE21 GLN A 222 12.919 10.331 0.976 1.00 1.60 H new ATOM 0 HE22 GLN A 222 11.904 11.385 1.966 1.00 1.60 H new ATOM 1607 N ALA A 223 14.483 5.662 5.004 1.00 0.56 N ATOM 1608 CA ALA A 223 14.235 4.715 6.075 1.00 0.54 C ATOM 1609 C ALA A 223 15.028 3.439 5.903 1.00 0.53 C ATOM 1610 O ALA A 223 15.562 2.916 6.876 1.00 0.60 O ATOM 1611 CB ALA A 223 12.765 4.377 6.177 1.00 0.59 C ATOM 0 H ALA A 223 13.714 5.758 4.341 1.00 0.56 H new ATOM 0 HA ALA A 223 14.560 5.201 6.995 1.00 0.54 H new ATOM 0 HB1 ALA A 223 12.611 3.665 6.988 1.00 0.59 H new ATOM 0 HB2 ALA A 223 12.196 5.285 6.377 1.00 0.59 H new ATOM 0 HB3 ALA A 223 12.427 3.937 5.239 1.00 0.59 H new ATOM 1617 N ALA A 224 15.120 2.923 4.684 1.00 0.54 N ATOM 1618 CA ALA A 224 15.829 1.678 4.491 1.00 0.64 C ATOM 1619 C ALA A 224 17.315 1.930 4.522 1.00 0.74 C ATOM 1620 O ALA A 224 18.117 1.011 4.575 1.00 0.89 O ATOM 1621 CB ALA A 224 15.464 0.978 3.215 1.00 0.77 C ATOM 0 H ALA A 224 14.723 3.337 3.840 1.00 0.54 H new ATOM 0 HA ALA A 224 15.533 1.019 5.308 1.00 0.64 H new ATOM 0 HB1 ALA A 224 16.032 0.051 3.133 1.00 0.77 H new ATOM 0 HB2 ALA A 224 14.398 0.751 3.217 1.00 0.77 H new ATOM 0 HB3 ALA A 224 15.697 1.622 2.367 1.00 0.77 H new ATOM 1627 N TYR A 225 17.680 3.194 4.452 1.00 0.72 N ATOM 1628 CA TYR A 225 19.052 3.581 4.656 1.00 0.85 C ATOM 1629 C TYR A 225 19.379 3.429 6.119 1.00 0.89 C ATOM 1630 O TYR A 225 20.398 2.857 6.515 1.00 1.06 O ATOM 1631 CB TYR A 225 19.274 5.021 4.220 1.00 0.85 C ATOM 1632 CG TYR A 225 20.623 5.567 4.611 1.00 0.97 C ATOM 1633 CD1 TYR A 225 21.776 5.121 3.982 1.00 1.21 C ATOM 1634 CD2 TYR A 225 20.740 6.529 5.605 1.00 0.95 C ATOM 1635 CE1 TYR A 225 23.015 5.619 4.332 1.00 1.36 C ATOM 1636 CE2 TYR A 225 21.975 7.038 5.959 1.00 1.11 C ATOM 1637 CZ TYR A 225 23.109 6.579 5.318 1.00 1.29 C ATOM 1638 OH TYR A 225 24.343 7.080 5.666 1.00 1.47 O ATOM 0 H TYR A 225 17.043 3.966 4.255 1.00 0.72 H new ATOM 0 HA TYR A 225 19.703 2.944 4.057 1.00 0.85 H new ATOM 0 HB2 TYR A 225 19.165 5.085 3.137 1.00 0.85 H new ATOM 0 HB3 TYR A 225 18.497 5.648 4.656 1.00 0.85 H new ATOM 0 HD1 TYR A 225 21.703 4.373 3.207 1.00 1.21 H new ATOM 0 HD2 TYR A 225 19.853 6.885 6.109 1.00 0.95 H new ATOM 0 HE1 TYR A 225 23.905 5.259 3.837 1.00 1.36 H new ATOM 0 HE2 TYR A 225 22.053 7.789 6.731 1.00 1.11 H new ATOM 0 HH TYR A 225 24.237 7.748 6.375 1.00 1.47 H new ATOM 1648 N GLN A 226 18.475 3.962 6.896 1.00 0.77 N ATOM 1649 CA GLN A 226 18.511 3.884 8.329 1.00 0.84 C ATOM 1650 C GLN A 226 18.451 2.425 8.812 1.00 0.88 C ATOM 1651 O GLN A 226 19.336 1.960 9.534 1.00 0.96 O ATOM 1652 CB GLN A 226 17.335 4.692 8.851 1.00 0.81 C ATOM 1653 CG GLN A 226 16.616 4.034 9.985 1.00 1.19 C ATOM 1654 CD GLN A 226 17.385 4.064 11.299 1.00 1.90 C ATOM 1655 OE1 GLN A 226 17.276 3.149 12.115 1.00 2.75 O ATOM 1656 NE2 GLN A 226 18.149 5.121 11.517 1.00 2.24 N ATOM 0 H GLN A 226 17.671 4.477 6.538 1.00 0.77 H new ATOM 0 HA GLN A 226 19.448 4.289 8.710 1.00 0.84 H new ATOM 0 HB2 GLN A 226 17.691 5.670 9.176 1.00 0.81 H new ATOM 0 HB3 GLN A 226 16.632 4.864 8.036 1.00 0.81 H new ATOM 0 HG2 GLN A 226 15.653 4.525 10.127 1.00 1.19 H new ATOM 0 HG3 GLN A 226 16.409 2.997 9.719 1.00 1.19 H new ATOM 0 HE21 GLN A 226 18.212 5.858 10.815 1.00 2.24 H new ATOM 0 HE22 GLN A 226 18.675 5.199 12.387 1.00 2.24 H new ATOM 1665 N ARG A 227 17.408 1.708 8.399 1.00 0.86 N ATOM 1666 CA ARG A 227 17.160 0.359 8.892 1.00 0.95 C ATOM 1667 C ARG A 227 18.047 -0.646 8.170 1.00 1.02 C ATOM 1668 O ARG A 227 18.546 -1.590 8.779 1.00 1.10 O ATOM 1669 CB ARG A 227 15.687 -0.023 8.701 1.00 0.98 C ATOM 1670 CG ARG A 227 15.287 -0.184 7.248 1.00 0.90 C ATOM 1671 CD ARG A 227 13.832 -0.582 7.097 1.00 0.98 C ATOM 1672 NE ARG A 227 13.377 -1.504 8.143 1.00 1.84 N ATOM 1673 CZ ARG A 227 13.697 -2.799 8.210 1.00 2.35 C ATOM 1674 NH1 ARG A 227 14.573 -3.327 7.360 1.00 2.51 N ATOM 1675 NH2 ARG A 227 13.158 -3.560 9.152 1.00 3.26 N ATOM 0 H ARG A 227 16.721 2.041 7.723 1.00 0.86 H new ATOM 0 HA ARG A 227 17.396 0.340 9.956 1.00 0.95 H new ATOM 0 HB2 ARG A 227 15.491 -0.956 9.229 1.00 0.98 H new ATOM 0 HB3 ARG A 227 15.059 0.741 9.160 1.00 0.98 H new ATOM 0 HG2 ARG A 227 15.463 0.752 6.718 1.00 0.90 H new ATOM 0 HG3 ARG A 227 15.919 -0.939 6.780 1.00 0.90 H new ATOM 0 HD2 ARG A 227 13.212 0.314 7.116 1.00 0.98 H new ATOM 0 HD3 ARG A 227 13.688 -1.048 6.122 1.00 0.98 H new ATOM 0 HE ARG A 227 12.772 -1.129 8.873 1.00 1.84 H new ATOM 0 HH11 ARG A 227 15.008 -2.742 6.647 1.00 2.51 H new ATOM 0 HH12 ARG A 227 14.809 -4.317 7.421 1.00 2.51 H new ATOM 0 HH21 ARG A 227 12.502 -3.156 9.821 1.00 3.26 H new ATOM 0 HH22 ARG A 227 13.399 -4.550 9.208 1.00 3.26 H new ATOM 1689 N ALA A 228 18.240 -0.404 6.881 1.00 1.03 N ATOM 1690 CA ALA A 228 18.986 -1.285 6.000 1.00 1.15 C ATOM 1691 C ALA A 228 18.535 -2.739 6.151 1.00 1.22 C ATOM 1692 O ALA A 228 19.374 -3.593 6.511 1.00 1.61 O ATOM 1693 CB ALA A 228 20.479 -1.130 6.248 1.00 1.25 C ATOM 0 H ALA A 228 17.875 0.425 6.412 1.00 1.03 H new ATOM 0 HA ALA A 228 18.781 -0.998 4.969 1.00 1.15 H new ATOM 0 HB1 ALA A 228 21.029 -1.795 5.582 1.00 1.25 H new ATOM 0 HB2 ALA A 228 20.775 -0.099 6.056 1.00 1.25 H new ATOM 0 HB3 ALA A 228 20.704 -1.385 7.283 1.00 1.25 H new TER 1699 ALA A 228