USER MOD reduce.3.24.130724 H: found=0, std=0, add=1489, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1489 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 79 MET CE :methyl 149:sc= -0.264 (180deg=-1.4!) USER MOD Set 1.2: A 186 THR OG1 : rot 39:sc= 0.00365 USER MOD Set 2.1: A 18 GLN : amide:sc= -3.09! C(o=-2.7!,f=-2.4!) USER MOD Set 2.2: A 22 THR OG1 : rot 94:sc= 0.424 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= -0.081 (180deg=-0.244) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= -1.21! K(o=-1.2!,f=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0.37 USER MOD Single : A 16 SER OG : rot 180:sc= -1.28 USER MOD Single : A 20 MET CE :methyl -153:sc= -0.403 (180deg=-2.3!) USER MOD Single : A 21 LYS NZ :NH3+ -153:sc= -0.207 (180deg=-1.18) USER MOD Single : A 28 GLN : amide:sc= -2.69 K(o=-2.7,f=-3.3) USER MOD Single : A 32 GLN : amide:sc= -1.78 K(o=-1.8,f=-3.1) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 13:sc= 0.00142 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot -139:sc= -7.39! USER MOD Single : A 64 LYS NZ :NH3+ -167:sc= -0.0216 (180deg=-0.326) USER MOD Single : A 72 SER OG : rot -13:sc= 0.814 USER MOD Single : A 73 ASN : amide:sc= -2.83! K(o=-2.8!,f=-0.73) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -3.96! C(o=-4!,f=-6.7!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -164:sc=-0.00448 (180deg=-0.801) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -1.42 K(o=-1.4,f=-4.8!) USER MOD Single : A 106 ASN : amide:sc= -0.0429 K(o=-0.043,f=-1.3) USER MOD Single : A 115 TYR OH : rot 180:sc= -0.195 USER MOD Single : A 118 SER OG : rot 61:sc= 0.245 USER MOD Single : A 119 LYS NZ :NH3+ 171:sc= -0.367 (180deg=-0.382) USER MOD Single : A 123 LYS NZ :NH3+ -154:sc= -0.0931 (180deg=-0.579) USER MOD Single : A 126 CYS SG : rot -57:sc= 0.247 USER MOD Single : A 127 THR OG1 : rot 13:sc= 0.355 USER MOD Single : A 128 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.29) USER MOD Single : A 135 THR OG1 : rot 89:sc= 0.711 USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= -0.118 K(o=-0.12,f=-0.79) USER MOD Single : A 155 GLN : amide:sc= -0.613 X(o=-0.61,f=-0.57) USER MOD Single : A 163 SER OG : rot -55:sc= 0.121 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 32:sc= 0.448 USER MOD Single : A 169 THR OG1 : rot 39:sc= 0.753 USER MOD Single : A 171 GLN : amide:sc= -0.409 X(o=-0.41,f=0) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 THR OG1 : rot 180:sc= -0.0485 USER MOD Single : A 182 THR OG1 : rot 94:sc= 1.21 USER MOD Single : A 184 SER OG : rot 160:sc= -0.265 USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 LYS NZ :NH3+ -155:sc= -0.0486 (180deg=-0.447) USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 40.215 -10.499 0.535 1.00 17.15 N ATOM 2 CA MET A 1 40.566 -10.057 1.914 1.00 16.73 C ATOM 3 C MET A 1 39.338 -10.181 2.819 1.00 16.39 C ATOM 4 O MET A 1 39.446 -10.198 4.029 1.00 16.40 O ATOM 5 CB MET A 1 41.030 -8.599 1.880 1.00 16.98 C ATOM 6 CG MET A 1 41.554 -8.197 3.260 1.00 17.51 C ATOM 7 SD MET A 1 42.306 -6.553 3.165 1.00 17.69 S ATOM 8 CE MET A 1 40.810 -5.595 3.514 1.00 17.86 C ATOM 0 H1 MET A 1 41.069 -10.495 -0.059 1.00 17.15 H new ATOM 0 H2 MET A 1 39.821 -11.461 0.569 1.00 17.15 H new ATOM 0 H3 MET A 1 39.510 -9.850 0.131 1.00 17.15 H new ATOM 0 HA MET A 1 41.368 -10.685 2.303 1.00 16.73 H new ATOM 0 HB2 MET A 1 41.812 -8.473 1.131 1.00 16.98 H new ATOM 0 HB3 MET A 1 40.204 -7.950 1.590 1.00 16.98 H new ATOM 0 HG2 MET A 1 40.739 -8.194 3.984 1.00 17.51 H new ATOM 0 HG3 MET A 1 42.287 -8.924 3.608 1.00 17.51 H new ATOM 0 HE1 MET A 1 41.049 -4.531 3.504 1.00 17.86 H new ATOM 0 HE2 MET A 1 40.058 -5.805 2.754 1.00 17.86 H new ATOM 0 HE3 MET A 1 40.422 -5.871 4.494 1.00 17.86 H new ATOM 20 N ASP A 2 38.171 -10.269 2.242 1.00 16.24 N ATOM 21 CA ASP A 2 36.937 -10.393 3.068 1.00 16.07 C ATOM 22 C ASP A 2 35.795 -10.923 2.197 1.00 15.50 C ATOM 23 O ASP A 2 35.908 -11.003 0.990 1.00 15.56 O ATOM 24 CB ASP A 2 36.559 -9.022 3.632 1.00 16.42 C ATOM 25 CG ASP A 2 36.410 -8.020 2.486 1.00 16.67 C ATOM 26 OD1 ASP A 2 35.352 -7.998 1.878 1.00 16.88 O ATOM 27 OD2 ASP A 2 37.356 -7.292 2.235 1.00 16.77 O ATOM 0 H ASP A 2 38.019 -10.260 1.233 1.00 16.24 H new ATOM 0 HA ASP A 2 37.117 -11.084 3.892 1.00 16.07 H new ATOM 0 HB2 ASP A 2 35.626 -9.092 4.191 1.00 16.42 H new ATOM 0 HB3 ASP A 2 37.324 -8.681 4.330 1.00 16.42 H new ATOM 32 N GLY A 3 34.694 -11.279 2.800 1.00 15.11 N ATOM 33 CA GLY A 3 33.543 -11.798 2.007 1.00 14.72 C ATOM 34 C GLY A 3 33.945 -13.097 1.308 1.00 14.60 C ATOM 35 O GLY A 3 33.284 -13.551 0.394 1.00 14.88 O ATOM 0 H GLY A 3 34.541 -11.233 3.807 1.00 15.11 H new ATOM 0 HA2 GLY A 3 32.688 -11.974 2.660 1.00 14.72 H new ATOM 0 HA3 GLY A 3 33.233 -11.057 1.270 1.00 14.72 H new ATOM 39 N SER A 4 35.023 -13.701 1.728 1.00 14.34 N ATOM 40 CA SER A 4 35.464 -14.971 1.085 1.00 14.41 C ATOM 41 C SER A 4 35.525 -14.779 -0.431 1.00 13.79 C ATOM 42 O SER A 4 35.207 -15.671 -1.193 1.00 14.02 O ATOM 43 CB SER A 4 34.469 -16.083 1.419 1.00 14.82 C ATOM 44 OG SER A 4 34.345 -16.195 2.831 1.00 14.88 O ATOM 0 H SER A 4 35.617 -13.370 2.488 1.00 14.34 H new ATOM 0 HA SER A 4 36.452 -15.244 1.457 1.00 14.41 H new ATOM 0 HB2 SER A 4 33.499 -15.864 0.974 1.00 14.82 H new ATOM 0 HB3 SER A 4 34.808 -17.029 0.996 1.00 14.82 H new ATOM 0 HG SER A 4 33.706 -16.906 3.048 1.00 14.88 H new ATOM 50 N GLY A 5 35.931 -13.621 -0.877 1.00 13.15 N ATOM 51 CA GLY A 5 36.011 -13.374 -2.344 1.00 12.67 C ATOM 52 C GLY A 5 34.605 -13.361 -2.936 1.00 12.31 C ATOM 53 O GLY A 5 33.800 -14.230 -2.669 1.00 12.37 O ATOM 0 H GLY A 5 36.210 -12.836 -0.289 1.00 13.15 H new ATOM 0 HA2 GLY A 5 36.507 -12.423 -2.537 1.00 12.67 H new ATOM 0 HA3 GLY A 5 36.611 -14.149 -2.822 1.00 12.67 H new ATOM 57 N GLU A 6 34.300 -12.379 -3.739 1.00 12.14 N ATOM 58 CA GLU A 6 32.942 -12.314 -4.342 1.00 12.01 C ATOM 59 C GLU A 6 32.933 -11.288 -5.480 1.00 11.53 C ATOM 60 O GLU A 6 33.685 -10.333 -5.476 1.00 11.57 O ATOM 61 CB GLU A 6 31.932 -11.907 -3.263 1.00 12.39 C ATOM 62 CG GLU A 6 30.519 -12.292 -3.705 1.00 12.94 C ATOM 63 CD GLU A 6 30.339 -13.807 -3.591 1.00 13.31 C ATOM 64 OE1 GLU A 6 30.348 -14.303 -2.476 1.00 13.55 O ATOM 65 OE2 GLU A 6 30.195 -14.446 -4.621 1.00 13.50 O ATOM 0 H GLU A 6 34.931 -11.622 -4.002 1.00 12.14 H new ATOM 0 HA GLU A 6 32.670 -13.290 -4.743 1.00 12.01 H new ATOM 0 HB2 GLU A 6 32.175 -12.398 -2.321 1.00 12.39 H new ATOM 0 HB3 GLU A 6 31.988 -10.833 -3.086 1.00 12.39 H new ATOM 0 HG2 GLU A 6 29.782 -11.781 -3.086 1.00 12.94 H new ATOM 0 HG3 GLU A 6 30.349 -11.972 -4.733 1.00 12.94 H new ATOM 72 N GLN A 7 32.087 -11.483 -6.453 1.00 11.25 N ATOM 73 CA GLN A 7 32.021 -10.530 -7.596 1.00 10.97 C ATOM 74 C GLN A 7 31.747 -9.102 -7.060 1.00 10.29 C ATOM 75 O GLN A 7 30.700 -8.882 -6.483 1.00 10.41 O ATOM 76 CB GLN A 7 30.875 -10.952 -8.516 1.00 11.52 C ATOM 77 CG GLN A 7 31.199 -12.324 -9.113 1.00 12.08 C ATOM 78 CD GLN A 7 30.136 -12.705 -10.143 1.00 12.56 C ATOM 79 OE1 GLN A 7 30.218 -13.750 -10.758 1.00 12.91 O ATOM 80 NE2 GLN A 7 29.134 -11.899 -10.361 1.00 12.77 N ATOM 0 H GLN A 7 31.435 -12.266 -6.506 1.00 11.25 H new ATOM 0 HA GLN A 7 32.964 -10.536 -8.143 1.00 10.97 H new ATOM 0 HB2 GLN A 7 29.940 -10.995 -7.958 1.00 11.52 H new ATOM 0 HB3 GLN A 7 30.739 -10.218 -9.310 1.00 11.52 H new ATOM 0 HG2 GLN A 7 32.182 -12.303 -9.583 1.00 12.08 H new ATOM 0 HG3 GLN A 7 31.239 -13.074 -8.323 1.00 12.08 H new ATOM 0 HE21 GLN A 7 29.064 -11.022 -9.846 1.00 12.77 H new ATOM 0 HE22 GLN A 7 28.421 -12.146 -11.047 1.00 12.77 H new ATOM 89 N PRO A 8 32.667 -8.162 -7.239 1.00 9.81 N ATOM 90 CA PRO A 8 32.453 -6.788 -6.736 1.00 9.37 C ATOM 91 C PRO A 8 31.211 -6.167 -7.392 1.00 9.09 C ATOM 92 O PRO A 8 30.753 -5.116 -6.990 1.00 9.07 O ATOM 93 CB PRO A 8 33.736 -6.012 -7.116 1.00 9.20 C ATOM 94 CG PRO A 8 34.676 -7.000 -7.865 1.00 9.57 C ATOM 95 CD PRO A 8 33.961 -8.366 -7.932 1.00 9.93 C ATOM 0 HA PRO A 8 32.277 -6.763 -5.661 1.00 9.37 H new ATOM 0 HB2 PRO A 8 33.494 -5.158 -7.749 1.00 9.20 H new ATOM 0 HB3 PRO A 8 34.225 -5.619 -6.224 1.00 9.20 H new ATOM 0 HG2 PRO A 8 34.896 -6.633 -8.868 1.00 9.57 H new ATOM 0 HG3 PRO A 8 35.629 -7.092 -7.343 1.00 9.57 H new ATOM 0 HD2 PRO A 8 33.809 -8.681 -8.964 1.00 9.93 H new ATOM 0 HD3 PRO A 8 34.550 -9.143 -7.445 1.00 9.93 H new ATOM 103 N ARG A 9 30.667 -6.816 -8.390 1.00 9.13 N ATOM 104 CA ARG A 9 29.453 -6.286 -9.089 1.00 9.14 C ATOM 105 C ARG A 9 29.516 -4.755 -9.213 1.00 8.60 C ATOM 106 O ARG A 9 30.569 -4.155 -9.133 1.00 8.68 O ATOM 107 CB ARG A 9 28.180 -6.696 -8.325 1.00 10.09 C ATOM 108 CG ARG A 9 28.185 -6.120 -6.901 1.00 10.67 C ATOM 109 CD ARG A 9 26.819 -6.351 -6.256 1.00 11.51 C ATOM 110 NE ARG A 9 26.520 -7.809 -6.241 1.00 12.05 N ATOM 111 CZ ARG A 9 25.583 -8.275 -5.462 1.00 12.65 C ATOM 112 NH1 ARG A 9 24.913 -7.465 -4.689 1.00 12.79 N ATOM 113 NH2 ARG A 9 25.318 -9.553 -5.455 1.00 13.27 N ATOM 0 H ARG A 9 31.016 -7.702 -8.756 1.00 9.13 H new ATOM 0 HA ARG A 9 29.425 -6.713 -10.091 1.00 9.14 H new ATOM 0 HB2 ARG A 9 27.300 -6.342 -8.861 1.00 10.09 H new ATOM 0 HB3 ARG A 9 28.111 -7.783 -8.282 1.00 10.09 H new ATOM 0 HG2 ARG A 9 28.965 -6.596 -6.307 1.00 10.67 H new ATOM 0 HG3 ARG A 9 28.411 -5.054 -6.929 1.00 10.67 H new ATOM 0 HD2 ARG A 9 26.813 -5.957 -5.240 1.00 11.51 H new ATOM 0 HD3 ARG A 9 26.048 -5.816 -6.810 1.00 11.51 H new ATOM 0 HE ARG A 9 27.048 -8.444 -6.840 1.00 12.05 H new ATOM 0 HH11 ARG A 9 25.122 -6.467 -4.693 1.00 12.79 H new ATOM 0 HH12 ARG A 9 24.181 -7.830 -4.080 1.00 12.79 H new ATOM 0 HH21 ARG A 9 25.843 -10.186 -6.058 1.00 13.27 H new ATOM 0 HH22 ARG A 9 24.586 -9.919 -4.846 1.00 13.27 H new ATOM 127 N GLY A 10 28.390 -4.131 -9.429 1.00 8.29 N ATOM 128 CA GLY A 10 28.371 -2.640 -9.573 1.00 8.00 C ATOM 129 C GLY A 10 27.066 -2.066 -9.019 1.00 7.45 C ATOM 130 O GLY A 10 25.993 -2.336 -9.520 1.00 7.68 O ATOM 0 H GLY A 10 27.481 -4.586 -9.513 1.00 8.29 H new ATOM 0 HA2 GLY A 10 29.220 -2.207 -9.044 1.00 8.00 H new ATOM 0 HA3 GLY A 10 28.478 -2.369 -10.623 1.00 8.00 H new ATOM 134 N GLY A 11 27.156 -1.264 -7.989 1.00 7.01 N ATOM 135 CA GLY A 11 25.928 -0.659 -7.399 1.00 6.74 C ATOM 136 C GLY A 11 26.314 0.236 -6.218 1.00 5.83 C ATOM 137 O GLY A 11 26.734 -0.238 -5.181 1.00 6.06 O ATOM 0 H GLY A 11 28.029 -1.003 -7.532 1.00 7.01 H new ATOM 0 HA2 GLY A 11 25.399 -0.076 -8.153 1.00 6.74 H new ATOM 0 HA3 GLY A 11 25.247 -1.443 -7.067 1.00 6.74 H new ATOM 141 N GLY A 12 26.178 1.527 -6.366 1.00 5.12 N ATOM 142 CA GLY A 12 26.540 2.447 -5.249 1.00 4.52 C ATOM 143 C GLY A 12 25.666 2.134 -4.025 1.00 3.52 C ATOM 144 O GLY A 12 24.792 1.294 -4.100 1.00 3.54 O ATOM 0 H GLY A 12 25.833 1.983 -7.210 1.00 5.12 H new ATOM 0 HA2 GLY A 12 27.594 2.332 -4.996 1.00 4.52 H new ATOM 0 HA3 GLY A 12 26.397 3.483 -5.556 1.00 4.52 H new ATOM 148 N PRO A 13 25.920 2.820 -2.930 1.00 3.15 N ATOM 149 CA PRO A 13 25.147 2.611 -1.691 1.00 2.77 C ATOM 150 C PRO A 13 23.652 2.867 -1.948 1.00 2.05 C ATOM 151 O PRO A 13 23.204 2.955 -3.074 1.00 2.37 O ATOM 152 CB PRO A 13 25.704 3.654 -0.686 1.00 3.47 C ATOM 153 CG PRO A 13 26.875 4.399 -1.394 1.00 3.99 C ATOM 154 CD PRO A 13 26.981 3.846 -2.835 1.00 3.79 C ATOM 0 HA PRO A 13 25.239 1.591 -1.317 1.00 2.77 H new ATOM 0 HB2 PRO A 13 24.925 4.356 -0.390 1.00 3.47 H new ATOM 0 HB3 PRO A 13 26.054 3.164 0.223 1.00 3.47 H new ATOM 0 HG2 PRO A 13 26.691 5.473 -1.409 1.00 3.99 H new ATOM 0 HG3 PRO A 13 27.809 4.243 -0.855 1.00 3.99 H new ATOM 0 HD2 PRO A 13 26.834 4.635 -3.572 1.00 3.79 H new ATOM 0 HD3 PRO A 13 27.965 3.415 -3.021 1.00 3.79 H new ATOM 162 N THR A 14 22.896 3.018 -0.890 1.00 1.59 N ATOM 163 CA THR A 14 21.434 3.305 -1.008 1.00 1.24 C ATOM 164 C THR A 14 21.128 4.529 -0.136 1.00 1.07 C ATOM 165 O THR A 14 21.921 4.890 0.711 1.00 1.20 O ATOM 166 CB THR A 14 20.627 2.085 -0.519 1.00 1.43 C ATOM 167 OG1 THR A 14 19.309 2.158 -1.041 1.00 2.16 O ATOM 168 CG2 THR A 14 20.563 2.064 1.015 1.00 1.78 C ATOM 0 H THR A 14 23.238 2.953 0.069 1.00 1.59 H new ATOM 0 HA THR A 14 21.160 3.504 -2.044 1.00 1.24 H new ATOM 0 HB THR A 14 21.118 1.175 -0.864 1.00 1.43 H new ATOM 0 HG1 THR A 14 18.792 1.384 -0.734 1.00 2.16 H new ATOM 0 HG21 THR A 14 19.990 1.197 1.343 1.00 1.78 H new ATOM 0 HG22 THR A 14 21.573 2.006 1.421 1.00 1.78 H new ATOM 0 HG23 THR A 14 20.080 2.974 1.372 1.00 1.78 H new ATOM 176 N SER A 15 19.994 5.167 -0.321 1.00 1.07 N ATOM 177 CA SER A 15 19.657 6.364 0.523 1.00 0.91 C ATOM 178 C SER A 15 18.224 6.220 1.045 1.00 0.75 C ATOM 179 O SER A 15 17.286 6.079 0.286 1.00 0.78 O ATOM 180 CB SER A 15 19.797 7.643 -0.324 1.00 0.99 C ATOM 181 OG SER A 15 18.559 8.345 -0.351 1.00 1.38 O ATOM 0 H SER A 15 19.291 4.914 -1.015 1.00 1.07 H new ATOM 0 HA SER A 15 20.339 6.430 1.371 1.00 0.91 H new ATOM 0 HB2 SER A 15 20.577 8.281 0.091 1.00 0.99 H new ATOM 0 HB3 SER A 15 20.101 7.386 -1.339 1.00 0.99 H new ATOM 0 HG SER A 15 18.655 9.158 -0.890 1.00 1.38 H new ATOM 187 N SER A 16 18.053 6.254 2.337 1.00 0.72 N ATOM 188 CA SER A 16 16.688 6.117 2.916 1.00 0.82 C ATOM 189 C SER A 16 15.778 7.212 2.356 1.00 0.81 C ATOM 190 O SER A 16 14.583 7.033 2.228 1.00 0.92 O ATOM 191 CB SER A 16 16.768 6.259 4.437 1.00 1.06 C ATOM 192 OG SER A 16 15.453 6.293 4.976 1.00 1.64 O ATOM 0 H SER A 16 18.802 6.371 3.019 1.00 0.72 H new ATOM 0 HA SER A 16 16.282 5.139 2.656 1.00 0.82 H new ATOM 0 HB2 SER A 16 17.326 5.425 4.863 1.00 1.06 H new ATOM 0 HB3 SER A 16 17.305 7.170 4.701 1.00 1.06 H new ATOM 0 HG SER A 16 15.501 6.382 5.951 1.00 1.64 H new ATOM 198 N GLU A 17 16.331 8.343 2.019 1.00 0.80 N ATOM 199 CA GLU A 17 15.493 9.444 1.468 1.00 0.94 C ATOM 200 C GLU A 17 15.015 9.074 0.062 1.00 0.85 C ATOM 201 O GLU A 17 13.945 9.459 -0.365 1.00 0.89 O ATOM 202 CB GLU A 17 16.323 10.729 1.399 1.00 1.13 C ATOM 203 CG GLU A 17 15.399 11.921 1.132 1.00 1.71 C ATOM 204 CD GLU A 17 14.565 12.213 2.381 1.00 2.26 C ATOM 205 OE1 GLU A 17 15.096 12.073 3.470 1.00 2.68 O ATOM 206 OE2 GLU A 17 13.410 12.574 2.226 1.00 2.90 O ATOM 0 H GLU A 17 17.326 8.553 2.101 1.00 0.80 H new ATOM 0 HA GLU A 17 14.630 9.599 2.115 1.00 0.94 H new ATOM 0 HB2 GLU A 17 16.863 10.876 2.334 1.00 1.13 H new ATOM 0 HB3 GLU A 17 17.070 10.650 0.609 1.00 1.13 H new ATOM 0 HG2 GLU A 17 15.988 12.798 0.863 1.00 1.71 H new ATOM 0 HG3 GLU A 17 14.745 11.705 0.288 1.00 1.71 H new ATOM 213 N GLN A 18 15.810 8.332 -0.663 1.00 0.80 N ATOM 214 CA GLN A 18 15.414 7.939 -2.044 1.00 0.83 C ATOM 215 C GLN A 18 14.250 6.947 -1.977 1.00 0.68 C ATOM 216 O GLN A 18 13.399 6.916 -2.844 1.00 0.69 O ATOM 217 CB GLN A 18 16.616 7.289 -2.753 1.00 0.96 C ATOM 218 CG GLN A 18 16.488 7.458 -4.272 1.00 1.53 C ATOM 219 CD GLN A 18 15.203 6.786 -4.760 1.00 2.23 C ATOM 220 OE1 GLN A 18 14.935 5.648 -4.430 1.00 2.69 O ATOM 221 NE2 GLN A 18 14.393 7.447 -5.542 1.00 3.07 N ATOM 0 H GLN A 18 16.717 7.981 -0.356 1.00 0.80 H new ATOM 0 HA GLN A 18 15.101 8.821 -2.602 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.543 7.745 -2.406 1.00 0.96 H new ATOM 0 HB3 GLN A 18 16.668 6.230 -2.500 1.00 0.96 H new ATOM 0 HG2 GLN A 18 16.476 8.517 -4.530 1.00 1.53 H new ATOM 0 HG3 GLN A 18 17.352 7.018 -4.770 1.00 1.53 H new ATOM 0 HE21 GLN A 18 14.618 8.403 -5.819 1.00 3.07 H new ATOM 0 HE22 GLN A 18 13.535 7.008 -5.876 1.00 3.07 H new ATOM 230 N ILE A 19 14.203 6.136 -0.955 1.00 0.59 N ATOM 231 CA ILE A 19 13.089 5.156 -0.849 1.00 0.58 C ATOM 232 C ILE A 19 11.774 5.919 -0.661 1.00 0.52 C ATOM 233 O ILE A 19 10.807 5.667 -1.352 1.00 0.59 O ATOM 234 CB ILE A 19 13.341 4.185 0.318 1.00 0.64 C ATOM 235 CG1 ILE A 19 14.437 3.188 -0.070 1.00 0.74 C ATOM 236 CG2 ILE A 19 12.060 3.419 0.672 1.00 0.73 C ATOM 237 CD1 ILE A 19 14.906 2.433 1.176 1.00 0.81 C ATOM 0 H ILE A 19 14.883 6.111 -0.195 1.00 0.59 H new ATOM 0 HA ILE A 19 13.028 4.563 -1.762 1.00 0.58 H new ATOM 0 HB ILE A 19 13.656 4.763 1.187 1.00 0.64 H new ATOM 0 HG12 ILE A 19 14.058 2.486 -0.812 1.00 0.74 H new ATOM 0 HG13 ILE A 19 15.276 3.713 -0.527 1.00 0.74 H new ATOM 0 HG21 ILE A 19 12.260 2.738 1.499 1.00 0.73 H new ATOM 0 HG22 ILE A 19 11.282 4.125 0.963 1.00 0.73 H new ATOM 0 HG23 ILE A 19 11.726 2.849 -0.195 1.00 0.73 H new ATOM 0 HD11 ILE A 19 15.686 1.724 0.899 1.00 0.81 H new ATOM 0 HD12 ILE A 19 15.302 3.142 1.904 1.00 0.81 H new ATOM 0 HD13 ILE A 19 14.065 1.895 1.614 1.00 0.81 H new ATOM 249 N MET A 20 11.706 6.824 0.277 1.00 0.51 N ATOM 250 CA MET A 20 10.409 7.534 0.469 1.00 0.60 C ATOM 251 C MET A 20 10.044 8.262 -0.832 1.00 0.55 C ATOM 252 O MET A 20 8.882 8.425 -1.151 1.00 0.59 O ATOM 253 CB MET A 20 10.469 8.527 1.634 1.00 0.82 C ATOM 254 CG MET A 20 10.802 7.813 2.948 1.00 1.07 C ATOM 255 SD MET A 20 9.552 6.556 3.327 1.00 1.43 S ATOM 256 CE MET A 20 8.094 7.630 3.316 1.00 0.93 C ATOM 0 H MET A 20 12.465 7.097 0.901 1.00 0.51 H new ATOM 0 HA MET A 20 9.644 6.797 0.715 1.00 0.60 H new ATOM 0 HB2 MET A 20 11.222 9.288 1.429 1.00 0.82 H new ATOM 0 HB3 MET A 20 9.513 9.041 1.728 1.00 0.82 H new ATOM 0 HG2 MET A 20 11.784 7.346 2.875 1.00 1.07 H new ATOM 0 HG3 MET A 20 10.853 8.539 3.760 1.00 1.07 H new ATOM 0 HE1 MET A 20 7.326 7.208 3.964 1.00 0.93 H new ATOM 0 HE2 MET A 20 8.369 8.621 3.678 1.00 0.93 H new ATOM 0 HE3 MET A 20 7.708 7.709 2.300 1.00 0.93 H new ATOM 266 N LYS A 21 11.014 8.661 -1.607 1.00 0.57 N ATOM 267 CA LYS A 21 10.709 9.329 -2.907 1.00 0.61 C ATOM 268 C LYS A 21 10.133 8.302 -3.889 1.00 0.53 C ATOM 269 O LYS A 21 9.136 8.550 -4.541 1.00 0.51 O ATOM 270 CB LYS A 21 11.994 9.924 -3.488 1.00 0.72 C ATOM 271 CG LYS A 21 11.649 10.819 -4.686 1.00 1.09 C ATOM 272 CD LYS A 21 12.936 11.305 -5.378 1.00 1.24 C ATOM 273 CE LYS A 21 13.505 12.523 -4.642 1.00 1.80 C ATOM 274 NZ LYS A 21 12.515 13.636 -4.682 1.00 2.40 N ATOM 0 H LYS A 21 12.006 8.554 -1.397 1.00 0.57 H new ATOM 0 HA LYS A 21 9.981 10.123 -2.744 1.00 0.61 H new ATOM 0 HB2 LYS A 21 12.516 10.503 -2.726 1.00 0.72 H new ATOM 0 HB3 LYS A 21 12.668 9.126 -3.799 1.00 0.72 H new ATOM 0 HG2 LYS A 21 11.033 10.267 -5.396 1.00 1.09 H new ATOM 0 HG3 LYS A 21 11.062 11.675 -4.352 1.00 1.09 H new ATOM 0 HD2 LYS A 21 13.674 10.503 -5.394 1.00 1.24 H new ATOM 0 HD3 LYS A 21 12.724 11.564 -6.415 1.00 1.24 H new ATOM 0 HE2 LYS A 21 13.733 12.263 -3.609 1.00 1.80 H new ATOM 0 HE3 LYS A 21 14.440 12.837 -5.106 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 13.014 14.547 -4.618 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 11.982 13.595 -5.574 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 11.857 13.545 -3.881 1.00 2.40 H new ATOM 288 N THR A 22 10.732 7.146 -3.996 1.00 0.53 N ATOM 289 CA THR A 22 10.203 6.109 -4.928 1.00 0.52 C ATOM 290 C THR A 22 8.799 5.686 -4.496 1.00 0.45 C ATOM 291 O THR A 22 7.902 5.553 -5.304 1.00 0.48 O ATOM 292 CB THR A 22 11.123 4.884 -4.875 1.00 0.55 C ATOM 293 OG1 THR A 22 12.471 5.299 -5.049 1.00 0.64 O ATOM 294 CG2 THR A 22 10.740 3.909 -5.990 1.00 0.62 C ATOM 0 H THR A 22 11.567 6.875 -3.477 1.00 0.53 H new ATOM 0 HA THR A 22 10.164 6.517 -5.938 1.00 0.52 H new ATOM 0 HB THR A 22 11.016 4.389 -3.910 1.00 0.55 H new ATOM 0 HG1 THR A 22 12.885 5.442 -4.172 1.00 0.64 H new ATOM 0 HG21 THR A 22 11.394 3.038 -5.952 1.00 0.62 H new ATOM 0 HG22 THR A 22 9.706 3.592 -5.857 1.00 0.62 H new ATOM 0 HG23 THR A 22 10.847 4.401 -6.957 1.00 0.62 H new ATOM 302 N GLY A 23 8.607 5.472 -3.223 1.00 0.42 N ATOM 303 CA GLY A 23 7.267 5.053 -2.725 1.00 0.43 C ATOM 304 C GLY A 23 6.241 6.146 -3.014 1.00 0.41 C ATOM 305 O GLY A 23 5.102 5.861 -3.328 1.00 0.47 O ATOM 0 H GLY A 23 9.324 5.570 -2.504 1.00 0.42 H new ATOM 0 HA2 GLY A 23 6.965 4.122 -3.206 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.312 4.858 -1.653 1.00 0.43 H new ATOM 309 N ALA A 24 6.622 7.393 -2.942 1.00 0.40 N ATOM 310 CA ALA A 24 5.655 8.481 -3.249 1.00 0.41 C ATOM 311 C ALA A 24 5.243 8.389 -4.722 1.00 0.41 C ATOM 312 O ALA A 24 4.169 8.806 -5.108 1.00 0.41 O ATOM 313 CB ALA A 24 6.341 9.828 -3.015 1.00 0.42 C ATOM 0 H ALA A 24 7.559 7.703 -2.684 1.00 0.40 H new ATOM 0 HA ALA A 24 4.776 8.386 -2.611 1.00 0.41 H new ATOM 0 HB1 ALA A 24 5.643 10.635 -3.237 1.00 0.42 H new ATOM 0 HB2 ALA A 24 6.659 9.899 -1.975 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.211 9.911 -3.667 1.00 0.42 H new ATOM 319 N LEU A 25 6.092 7.818 -5.543 1.00 0.42 N ATOM 320 CA LEU A 25 5.752 7.672 -6.991 1.00 0.44 C ATOM 321 C LEU A 25 4.844 6.450 -7.122 1.00 0.44 C ATOM 322 O LEU A 25 3.732 6.530 -7.606 1.00 0.46 O ATOM 323 CB LEU A 25 7.041 7.489 -7.819 1.00 0.47 C ATOM 324 CG LEU A 25 7.514 8.838 -8.373 1.00 0.77 C ATOM 325 CD1 LEU A 25 7.960 9.745 -7.226 1.00 1.58 C ATOM 326 CD2 LEU A 25 8.684 8.610 -9.330 1.00 1.67 C ATOM 0 H LEU A 25 7.003 7.448 -5.272 1.00 0.42 H new ATOM 0 HA LEU A 25 5.244 8.561 -7.366 1.00 0.44 H new ATOM 0 HB2 LEU A 25 7.821 7.050 -7.197 1.00 0.47 H new ATOM 0 HB3 LEU A 25 6.859 6.795 -8.640 1.00 0.47 H new ATOM 0 HG LEU A 25 6.692 9.316 -8.906 1.00 0.77 H new ATOM 0 HD11 LEU A 25 8.295 10.701 -7.628 1.00 1.58 H new ATOM 0 HD12 LEU A 25 7.124 9.909 -6.546 1.00 1.58 H new ATOM 0 HD13 LEU A 25 8.780 9.272 -6.685 1.00 1.58 H new ATOM 0 HD21 LEU A 25 9.022 9.568 -9.726 1.00 1.67 H new ATOM 0 HD22 LEU A 25 9.503 8.128 -8.795 1.00 1.67 H new ATOM 0 HD23 LEU A 25 8.362 7.971 -10.152 1.00 1.67 H new ATOM 338 N LEU A 26 5.331 5.311 -6.709 1.00 0.45 N ATOM 339 CA LEU A 26 4.537 4.060 -6.807 1.00 0.47 C ATOM 340 C LEU A 26 3.095 4.306 -6.364 1.00 0.49 C ATOM 341 O LEU A 26 2.158 4.040 -7.092 1.00 0.52 O ATOM 342 CB LEU A 26 5.190 2.990 -5.900 1.00 0.51 C ATOM 343 CG LEU A 26 6.359 2.300 -6.642 1.00 0.69 C ATOM 344 CD1 LEU A 26 7.248 1.561 -5.640 1.00 1.17 C ATOM 345 CD2 LEU A 26 5.797 1.286 -7.652 1.00 1.35 C ATOM 0 H LEU A 26 6.259 5.196 -6.302 1.00 0.45 H new ATOM 0 HA LEU A 26 4.522 3.717 -7.842 1.00 0.47 H new ATOM 0 HB2 LEU A 26 5.555 3.454 -4.983 1.00 0.51 H new ATOM 0 HB3 LEU A 26 4.447 2.248 -5.608 1.00 0.51 H new ATOM 0 HG LEU A 26 6.946 3.057 -7.161 1.00 0.69 H new ATOM 0 HD11 LEU A 26 8.069 1.078 -6.169 1.00 1.17 H new ATOM 0 HD12 LEU A 26 7.650 2.271 -4.918 1.00 1.17 H new ATOM 0 HD13 LEU A 26 6.659 0.807 -5.118 1.00 1.17 H new ATOM 0 HD21 LEU A 26 6.620 0.799 -8.175 1.00 1.35 H new ATOM 0 HD22 LEU A 26 5.208 0.536 -7.125 1.00 1.35 H new ATOM 0 HD23 LEU A 26 5.164 1.803 -8.373 1.00 1.35 H new ATOM 357 N LEU A 27 2.906 4.797 -5.173 1.00 0.50 N ATOM 358 CA LEU A 27 1.521 5.041 -4.690 1.00 0.56 C ATOM 359 C LEU A 27 0.859 6.086 -5.594 1.00 0.56 C ATOM 360 O LEU A 27 -0.226 5.880 -6.100 1.00 0.60 O ATOM 361 CB LEU A 27 1.571 5.528 -3.234 1.00 0.64 C ATOM 362 CG LEU A 27 0.159 5.792 -2.688 1.00 0.95 C ATOM 363 CD1 LEU A 27 -0.596 4.469 -2.498 1.00 1.66 C ATOM 364 CD2 LEU A 27 0.278 6.507 -1.338 1.00 1.42 C ATOM 0 H LEU A 27 3.647 5.039 -4.516 1.00 0.50 H new ATOM 0 HA LEU A 27 0.936 4.122 -4.726 1.00 0.56 H new ATOM 0 HB2 LEU A 27 2.070 4.782 -2.615 1.00 0.64 H new ATOM 0 HB3 LEU A 27 2.164 6.441 -3.173 1.00 0.64 H new ATOM 0 HG LEU A 27 -0.392 6.411 -3.397 1.00 0.95 H new ATOM 0 HD11 LEU A 27 -1.594 4.672 -2.111 1.00 1.66 H new ATOM 0 HD12 LEU A 27 -0.676 3.955 -3.456 1.00 1.66 H new ATOM 0 HD13 LEU A 27 -0.054 3.839 -1.792 1.00 1.66 H new ATOM 0 HD21 LEU A 27 -0.718 6.700 -0.940 1.00 1.42 H new ATOM 0 HD22 LEU A 27 0.832 5.878 -0.641 1.00 1.42 H new ATOM 0 HD23 LEU A 27 0.805 7.452 -1.472 1.00 1.42 H new ATOM 376 N GLN A 28 1.494 7.209 -5.795 1.00 0.55 N ATOM 377 CA GLN A 28 0.888 8.261 -6.660 1.00 0.58 C ATOM 378 C GLN A 28 0.611 7.688 -8.054 1.00 0.54 C ATOM 379 O GLN A 28 -0.389 7.994 -8.673 1.00 0.58 O ATOM 380 CB GLN A 28 1.868 9.429 -6.784 1.00 0.60 C ATOM 381 CG GLN A 28 1.214 10.563 -7.575 1.00 1.00 C ATOM 382 CD GLN A 28 2.097 11.810 -7.504 1.00 1.40 C ATOM 383 OE1 GLN A 28 1.933 12.635 -6.627 1.00 2.09 O ATOM 384 NE2 GLN A 28 3.033 11.983 -8.396 1.00 1.91 N ATOM 0 H GLN A 28 2.404 7.443 -5.399 1.00 0.55 H new ATOM 0 HA GLN A 28 -0.048 8.602 -6.217 1.00 0.58 H new ATOM 0 HB2 GLN A 28 2.157 9.782 -5.794 1.00 0.60 H new ATOM 0 HB3 GLN A 28 2.779 9.101 -7.284 1.00 0.60 H new ATOM 0 HG2 GLN A 28 1.074 10.263 -8.613 1.00 1.00 H new ATOM 0 HG3 GLN A 28 0.226 10.781 -7.170 1.00 1.00 H new ATOM 0 HE21 GLN A 28 3.170 11.290 -9.132 1.00 1.91 H new ATOM 0 HE22 GLN A 28 3.627 12.811 -8.357 1.00 1.91 H new ATOM 393 N GLY A 29 1.496 6.869 -8.556 1.00 0.50 N ATOM 394 CA GLY A 29 1.294 6.287 -9.915 1.00 0.48 C ATOM 395 C GLY A 29 0.056 5.389 -9.916 1.00 0.44 C ATOM 396 O GLY A 29 -0.914 5.655 -10.598 1.00 0.50 O ATOM 0 H GLY A 29 2.351 6.577 -8.083 1.00 0.50 H new ATOM 0 HA2 GLY A 29 1.176 7.085 -10.648 1.00 0.48 H new ATOM 0 HA3 GLY A 29 2.172 5.712 -10.208 1.00 0.48 H new ATOM 400 N PHE A 30 0.084 4.324 -9.162 1.00 0.44 N ATOM 401 CA PHE A 30 -1.090 3.407 -9.124 1.00 0.43 C ATOM 402 C PHE A 30 -2.370 4.220 -8.921 1.00 0.40 C ATOM 403 O PHE A 30 -3.450 3.790 -9.277 1.00 0.43 O ATOM 404 CB PHE A 30 -0.931 2.425 -7.955 1.00 0.47 C ATOM 405 CG PHE A 30 -2.217 1.643 -7.768 1.00 0.47 C ATOM 406 CD1 PHE A 30 -2.648 0.759 -8.765 1.00 1.39 C ATOM 407 CD2 PHE A 30 -2.982 1.811 -6.605 1.00 1.20 C ATOM 408 CE1 PHE A 30 -3.840 0.042 -8.599 1.00 1.42 C ATOM 409 CE2 PHE A 30 -4.173 1.094 -6.440 1.00 1.21 C ATOM 410 CZ PHE A 30 -4.602 0.210 -7.437 1.00 0.58 C ATOM 0 H PHE A 30 0.869 4.050 -8.571 1.00 0.44 H new ATOM 0 HA PHE A 30 -1.149 2.858 -10.064 1.00 0.43 H new ATOM 0 HB2 PHE A 30 -0.104 1.743 -8.150 1.00 0.47 H new ATOM 0 HB3 PHE A 30 -0.688 2.968 -7.042 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -2.061 0.630 -9.662 1.00 1.39 H new ATOM 0 HD2 PHE A 30 -2.652 2.494 -5.836 1.00 1.20 H new ATOM 0 HE1 PHE A 30 -4.171 -0.641 -9.368 1.00 1.42 H new ATOM 0 HE2 PHE A 30 -4.761 1.223 -5.543 1.00 1.21 H new ATOM 0 HZ PHE A 30 -5.521 -0.343 -7.310 1.00 0.58 H new ATOM 420 N ILE A 31 -2.265 5.390 -8.342 1.00 0.40 N ATOM 421 CA ILE A 31 -3.482 6.216 -8.108 1.00 0.40 C ATOM 422 C ILE A 31 -3.835 6.988 -9.385 1.00 0.40 C ATOM 423 O ILE A 31 -4.906 6.837 -9.938 1.00 0.43 O ATOM 424 CB ILE A 31 -3.210 7.212 -6.953 1.00 0.41 C ATOM 425 CG1 ILE A 31 -3.316 6.480 -5.613 1.00 0.53 C ATOM 426 CG2 ILE A 31 -4.237 8.354 -7.007 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.758 7.368 -4.499 1.00 0.48 C ATOM 0 H ILE A 31 -1.390 5.806 -8.023 1.00 0.40 H new ATOM 0 HA ILE A 31 -4.317 5.568 -7.840 1.00 0.40 H new ATOM 0 HB ILE A 31 -2.208 7.627 -7.057 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -4.356 6.229 -5.405 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -2.764 5.541 -5.655 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -4.045 9.054 -6.194 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -4.153 8.874 -7.961 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -5.242 7.945 -6.904 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -2.834 6.846 -3.545 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.712 7.597 -4.705 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -3.330 8.295 -4.452 1.00 0.48 H new ATOM 439 N GLN A 32 -2.960 7.846 -9.828 1.00 0.42 N ATOM 440 CA GLN A 32 -3.270 8.659 -11.032 1.00 0.47 C ATOM 441 C GLN A 32 -3.436 7.755 -12.254 1.00 0.50 C ATOM 442 O GLN A 32 -4.131 8.073 -13.198 1.00 0.61 O ATOM 443 CB GLN A 32 -2.128 9.650 -11.272 1.00 0.57 C ATOM 444 CG GLN A 32 -2.397 10.485 -12.543 1.00 1.19 C ATOM 445 CD GLN A 32 -1.779 9.799 -13.766 1.00 1.59 C ATOM 446 OE1 GLN A 32 -2.481 9.387 -14.668 1.00 2.16 O ATOM 447 NE2 GLN A 32 -0.482 9.661 -13.833 1.00 2.21 N ATOM 0 H GLN A 32 -2.046 8.018 -9.409 1.00 0.42 H new ATOM 0 HA GLN A 32 -4.202 9.200 -10.872 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -2.024 10.310 -10.411 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -1.186 9.111 -11.376 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -3.471 10.605 -12.688 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -1.977 11.484 -12.426 1.00 1.19 H new ATOM 0 HE21 GLN A 32 0.107 10.007 -13.076 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -0.059 9.207 -14.643 1.00 2.21 H new ATOM 456 N ASP A 33 -2.766 6.629 -12.237 1.00 0.49 N ATOM 457 CA ASP A 33 -2.819 5.669 -13.375 1.00 0.58 C ATOM 458 C ASP A 33 -4.169 4.958 -13.450 1.00 0.61 C ATOM 459 O ASP A 33 -4.791 4.898 -14.491 1.00 0.70 O ATOM 460 CB ASP A 33 -1.741 4.606 -13.144 1.00 0.61 C ATOM 461 CG ASP A 33 -1.707 3.647 -14.335 1.00 1.10 C ATOM 462 OD1 ASP A 33 -2.506 2.725 -14.353 1.00 1.89 O ATOM 463 OD2 ASP A 33 -0.882 3.851 -15.211 1.00 1.78 O ATOM 0 H ASP A 33 -2.172 6.332 -11.463 1.00 0.49 H new ATOM 0 HA ASP A 33 -2.664 6.221 -14.302 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -0.768 5.081 -13.018 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -1.948 4.056 -12.226 1.00 0.61 H new ATOM 468 N ARG A 34 -4.609 4.380 -12.363 1.00 0.58 N ATOM 469 CA ARG A 34 -5.898 3.630 -12.390 1.00 0.71 C ATOM 470 C ARG A 34 -7.079 4.549 -12.104 1.00 0.65 C ATOM 471 O ARG A 34 -8.148 4.344 -12.645 1.00 0.85 O ATOM 472 CB ARG A 34 -5.873 2.512 -11.346 1.00 0.85 C ATOM 473 CG ARG A 34 -7.068 1.571 -11.574 1.00 1.25 C ATOM 474 CD ARG A 34 -7.170 0.527 -10.438 1.00 1.31 C ATOM 475 NE ARG A 34 -8.408 0.781 -9.647 1.00 1.58 N ATOM 476 CZ ARG A 34 -8.863 -0.136 -8.836 1.00 2.09 C ATOM 477 NH1 ARG A 34 -8.234 -1.274 -8.720 1.00 2.58 N ATOM 478 NH2 ARG A 34 -9.946 0.084 -8.143 1.00 2.75 N ATOM 0 H ARG A 34 -4.133 4.395 -11.461 1.00 0.58 H new ATOM 0 HA ARG A 34 -6.016 3.208 -13.388 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -4.939 1.955 -11.417 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -5.916 2.936 -10.343 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -7.989 2.151 -11.624 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -6.959 1.063 -12.532 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -7.191 -0.480 -10.854 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -6.293 0.587 -9.793 1.00 1.31 H new ATOM 0 HE ARG A 34 -8.899 1.670 -9.739 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -7.388 -1.447 -9.263 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -8.589 -1.991 -8.087 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -10.438 0.973 -8.234 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -10.301 -0.633 -7.510 1.00 2.75 H new ATOM 492 N ALA A 35 -6.932 5.556 -11.269 1.00 0.59 N ATOM 493 CA ALA A 35 -8.107 6.444 -10.991 1.00 0.66 C ATOM 494 C ALA A 35 -8.065 7.616 -11.970 1.00 0.80 C ATOM 495 O ALA A 35 -9.049 7.950 -12.601 1.00 0.88 O ATOM 496 CB ALA A 35 -8.038 6.949 -9.549 1.00 0.94 C ATOM 0 H ALA A 35 -6.070 5.796 -10.779 1.00 0.59 H new ATOM 0 HA ALA A 35 -9.040 5.894 -11.118 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -8.893 7.595 -9.348 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -8.056 6.100 -8.865 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -7.116 7.512 -9.405 1.00 0.94 H new ATOM 502 N GLY A 36 -6.930 8.249 -12.096 1.00 1.15 N ATOM 503 CA GLY A 36 -6.806 9.403 -13.028 1.00 1.62 C ATOM 504 C GLY A 36 -7.052 8.962 -14.471 1.00 1.54 C ATOM 505 O GLY A 36 -8.168 8.673 -14.852 1.00 2.10 O ATOM 0 H GLY A 36 -6.077 8.013 -11.588 1.00 1.15 H new ATOM 0 HA2 GLY A 36 -7.522 10.178 -12.752 1.00 1.62 H new ATOM 0 HA3 GLY A 36 -5.812 9.842 -12.941 1.00 1.62 H new ATOM 509 N ARG A 37 -6.013 8.880 -15.265 1.00 2.07 N ATOM 510 CA ARG A 37 -6.174 8.440 -16.683 1.00 2.87 C ATOM 511 C ARG A 37 -4.790 8.353 -17.342 1.00 3.46 C ATOM 512 O ARG A 37 -3.951 7.567 -16.947 1.00 4.10 O ATOM 513 CB ARG A 37 -7.038 9.457 -17.449 1.00 3.63 C ATOM 514 CG ARG A 37 -7.403 8.905 -18.849 1.00 4.34 C ATOM 515 CD ARG A 37 -8.801 8.273 -18.822 1.00 5.18 C ATOM 516 NE ARG A 37 -9.123 7.728 -20.172 1.00 5.74 N ATOM 517 CZ ARG A 37 -10.140 6.924 -20.327 1.00 6.53 C ATOM 518 NH1 ARG A 37 -10.886 6.609 -19.304 1.00 6.88 N ATOM 519 NH2 ARG A 37 -10.413 6.440 -21.508 1.00 7.21 N ATOM 0 H ARG A 37 -5.056 9.100 -14.989 1.00 2.07 H new ATOM 0 HA ARG A 37 -6.660 7.465 -16.707 1.00 2.87 H new ATOM 0 HB2 ARG A 37 -7.947 9.669 -16.886 1.00 3.63 H new ATOM 0 HB3 ARG A 37 -6.499 10.399 -17.551 1.00 3.63 H new ATOM 0 HG2 ARG A 37 -7.374 9.709 -19.584 1.00 4.34 H new ATOM 0 HG3 ARG A 37 -6.667 8.163 -19.159 1.00 4.34 H new ATOM 0 HD2 ARG A 37 -8.838 7.477 -18.078 1.00 5.18 H new ATOM 0 HD3 ARG A 37 -9.543 9.017 -18.531 1.00 5.18 H new ATOM 0 HE ARG A 37 -8.548 7.983 -20.975 1.00 5.74 H new ATOM 0 HH11 ARG A 37 -10.675 6.991 -18.382 1.00 6.88 H new ATOM 0 HH12 ARG A 37 -11.680 5.981 -19.426 1.00 6.88 H new ATOM 0 HH21 ARG A 37 -9.832 6.690 -22.308 1.00 7.21 H new ATOM 0 HH22 ARG A 37 -11.207 5.812 -21.631 1.00 7.21 H new ATOM 533 N MET A 38 -4.544 9.160 -18.342 1.00 3.74 N ATOM 534 CA MET A 38 -3.220 9.138 -19.027 1.00 4.68 C ATOM 535 C MET A 38 -3.005 10.481 -19.730 1.00 4.70 C ATOM 536 O MET A 38 -2.018 10.690 -20.408 1.00 5.17 O ATOM 537 CB MET A 38 -3.195 8.004 -20.059 1.00 5.62 C ATOM 538 CG MET A 38 -4.204 8.287 -21.182 1.00 5.93 C ATOM 539 SD MET A 38 -3.433 9.341 -22.435 1.00 6.79 S ATOM 540 CE MET A 38 -4.958 9.879 -23.247 1.00 7.04 C ATOM 0 H MET A 38 -5.209 9.837 -18.715 1.00 3.74 H new ATOM 0 HA MET A 38 -2.427 8.973 -18.298 1.00 4.68 H new ATOM 0 HB2 MET A 38 -2.193 7.905 -20.477 1.00 5.62 H new ATOM 0 HB3 MET A 38 -3.434 7.057 -19.575 1.00 5.62 H new ATOM 0 HG2 MET A 38 -4.535 7.351 -21.632 1.00 5.93 H new ATOM 0 HG3 MET A 38 -5.089 8.776 -20.775 1.00 5.93 H new ATOM 0 HE1 MET A 38 -4.715 10.552 -24.069 1.00 7.04 H new ATOM 0 HE2 MET A 38 -5.490 9.010 -23.634 1.00 7.04 H new ATOM 0 HE3 MET A 38 -5.589 10.400 -22.527 1.00 7.04 H new ATOM 550 N GLY A 39 -3.924 11.395 -19.563 1.00 4.57 N ATOM 551 CA GLY A 39 -3.783 12.732 -20.209 1.00 4.85 C ATOM 552 C GLY A 39 -4.634 13.755 -19.451 1.00 4.67 C ATOM 553 O GLY A 39 -4.151 14.459 -18.586 1.00 4.95 O ATOM 0 H GLY A 39 -4.769 11.272 -19.005 1.00 4.57 H new ATOM 0 HA2 GLY A 39 -2.737 13.040 -20.208 1.00 4.85 H new ATOM 0 HA3 GLY A 39 -4.099 12.680 -21.251 1.00 4.85 H new ATOM 557 N GLY A 40 -5.898 13.845 -19.768 1.00 4.58 N ATOM 558 CA GLY A 40 -6.776 14.825 -19.063 1.00 4.69 C ATOM 559 C GLY A 40 -6.144 16.214 -19.140 1.00 4.20 C ATOM 560 O GLY A 40 -5.395 16.507 -20.052 1.00 4.34 O ATOM 0 H GLY A 40 -6.360 13.284 -20.483 1.00 4.58 H new ATOM 0 HA2 GLY A 40 -7.766 14.837 -19.519 1.00 4.69 H new ATOM 0 HA3 GLY A 40 -6.908 14.530 -18.022 1.00 4.69 H new ATOM 564 N GLU A 41 -6.437 17.084 -18.205 1.00 4.01 N ATOM 565 CA GLU A 41 -5.847 18.450 -18.253 1.00 3.88 C ATOM 566 C GLU A 41 -5.828 19.060 -16.844 1.00 3.63 C ATOM 567 O GLU A 41 -6.855 19.261 -16.230 1.00 4.16 O ATOM 568 CB GLU A 41 -6.693 19.332 -19.172 1.00 4.26 C ATOM 569 CG GLU A 41 -6.048 20.714 -19.290 1.00 4.51 C ATOM 570 CD GLU A 41 -6.837 21.562 -20.290 1.00 4.90 C ATOM 571 OE1 GLU A 41 -6.681 21.338 -21.479 1.00 5.19 O ATOM 572 OE2 GLU A 41 -7.585 22.419 -19.849 1.00 5.28 O ATOM 0 H GLU A 41 -7.057 16.905 -17.415 1.00 4.01 H new ATOM 0 HA GLU A 41 -4.827 18.388 -18.633 1.00 3.88 H new ATOM 0 HB2 GLU A 41 -6.777 18.873 -20.157 1.00 4.26 H new ATOM 0 HB3 GLU A 41 -7.704 19.424 -18.776 1.00 4.26 H new ATOM 0 HG2 GLU A 41 -6.031 21.203 -18.316 1.00 4.51 H new ATOM 0 HG3 GLU A 41 -5.013 20.617 -19.616 1.00 4.51 H new ATOM 579 N ALA A 42 -4.654 19.338 -16.341 1.00 3.19 N ATOM 580 CA ALA A 42 -4.539 19.935 -14.971 1.00 3.24 C ATOM 581 C ALA A 42 -5.203 18.999 -13.944 1.00 2.77 C ATOM 582 O ALA A 42 -6.061 19.425 -13.196 1.00 3.06 O ATOM 583 CB ALA A 42 -5.286 21.269 -15.018 1.00 4.08 C ATOM 0 H ALA A 42 -3.767 19.178 -16.818 1.00 3.19 H new ATOM 0 HA ALA A 42 -3.498 20.075 -14.681 1.00 3.24 H new ATOM 0 HB1 ALA A 42 -5.234 21.750 -14.041 1.00 4.08 H new ATOM 0 HB2 ALA A 42 -4.828 21.916 -15.766 1.00 4.08 H new ATOM 0 HB3 ALA A 42 -6.329 21.093 -15.281 1.00 4.08 H new ATOM 589 N PRO A 43 -4.804 17.744 -13.942 1.00 2.70 N ATOM 590 CA PRO A 43 -5.378 16.747 -13.014 1.00 3.03 C ATOM 591 C PRO A 43 -5.079 17.092 -11.544 1.00 2.67 C ATOM 592 O PRO A 43 -4.654 18.184 -11.221 1.00 2.87 O ATOM 593 CB PRO A 43 -4.683 15.415 -13.393 1.00 3.84 C ATOM 594 CG PRO A 43 -3.565 15.745 -14.420 1.00 3.86 C ATOM 595 CD PRO A 43 -3.763 17.209 -14.855 1.00 3.12 C ATOM 0 HA PRO A 43 -6.464 16.706 -13.101 1.00 3.03 H new ATOM 0 HB2 PRO A 43 -4.262 14.938 -12.508 1.00 3.84 H new ATOM 0 HB3 PRO A 43 -5.402 14.716 -13.821 1.00 3.84 H new ATOM 0 HG2 PRO A 43 -2.580 15.606 -13.974 1.00 3.86 H new ATOM 0 HG3 PRO A 43 -3.623 15.077 -15.280 1.00 3.86 H new ATOM 0 HD2 PRO A 43 -2.835 17.775 -14.770 1.00 3.12 H new ATOM 0 HD3 PRO A 43 -4.081 17.272 -15.896 1.00 3.12 H new ATOM 603 N GLU A 44 -5.329 16.167 -10.659 1.00 2.45 N ATOM 604 CA GLU A 44 -5.097 16.411 -9.206 1.00 2.23 C ATOM 605 C GLU A 44 -3.737 17.059 -8.961 1.00 1.75 C ATOM 606 O GLU A 44 -3.639 18.269 -8.954 1.00 2.00 O ATOM 607 CB GLU A 44 -5.173 15.082 -8.448 1.00 2.55 C ATOM 608 CG GLU A 44 -4.969 15.318 -6.943 1.00 2.70 C ATOM 609 CD GLU A 44 -6.084 16.216 -6.400 1.00 3.17 C ATOM 610 OE1 GLU A 44 -7.148 16.235 -6.998 1.00 3.42 O ATOM 611 OE2 GLU A 44 -5.854 16.874 -5.398 1.00 3.77 O ATOM 0 H GLU A 44 -5.689 15.239 -10.883 1.00 2.45 H new ATOM 0 HA GLU A 44 -5.868 17.093 -8.848 1.00 2.23 H new ATOM 0 HB2 GLU A 44 -6.140 14.610 -8.622 1.00 2.55 H new ATOM 0 HB3 GLU A 44 -4.412 14.397 -8.823 1.00 2.55 H new ATOM 0 HG2 GLU A 44 -4.967 14.365 -6.414 1.00 2.70 H new ATOM 0 HG3 GLU A 44 -3.998 15.782 -6.767 1.00 2.70 H new ATOM 618 N LEU A 45 -2.709 16.266 -8.702 1.00 1.80 N ATOM 619 CA LEU A 45 -1.340 16.824 -8.390 1.00 1.80 C ATOM 620 C LEU A 45 -1.203 18.239 -8.959 1.00 2.29 C ATOM 621 O LEU A 45 -1.181 19.206 -8.225 1.00 3.01 O ATOM 622 CB LEU A 45 -0.242 15.924 -8.974 1.00 2.23 C ATOM 623 CG LEU A 45 -0.601 14.447 -8.782 1.00 2.52 C ATOM 624 CD1 LEU A 45 0.468 13.577 -9.445 1.00 3.22 C ATOM 625 CD2 LEU A 45 -0.663 14.125 -7.287 1.00 3.00 C ATOM 0 H LEU A 45 -2.762 15.247 -8.694 1.00 1.80 H new ATOM 0 HA LEU A 45 -1.225 16.860 -7.307 1.00 1.80 H new ATOM 0 HB2 LEU A 45 -0.114 16.138 -10.035 1.00 2.23 H new ATOM 0 HB3 LEU A 45 0.710 16.139 -8.488 1.00 2.23 H new ATOM 0 HG LEU A 45 -1.571 14.246 -9.236 1.00 2.52 H new ATOM 0 HD11 LEU A 45 0.216 12.525 -9.310 1.00 3.22 H new ATOM 0 HD12 LEU A 45 0.514 13.806 -10.510 1.00 3.22 H new ATOM 0 HD13 LEU A 45 1.437 13.779 -8.988 1.00 3.22 H new ATOM 0 HD21 LEU A 45 -0.918 13.074 -7.151 1.00 3.00 H new ATOM 0 HD22 LEU A 45 0.307 14.324 -6.831 1.00 3.00 H new ATOM 0 HD23 LEU A 45 -1.422 14.747 -6.812 1.00 3.00 H new ATOM 637 N ALA A 46 -1.186 18.369 -10.251 1.00 2.46 N ATOM 638 CA ALA A 46 -1.130 19.727 -10.859 1.00 3.15 C ATOM 639 C ALA A 46 -1.204 19.633 -12.380 1.00 2.91 C ATOM 640 O ALA A 46 -2.140 19.090 -12.931 1.00 3.07 O ATOM 641 CB ALA A 46 0.129 20.498 -10.436 1.00 4.05 C ATOM 0 H ALA A 46 -1.208 17.595 -10.915 1.00 2.46 H new ATOM 0 HA ALA A 46 -1.993 20.282 -10.491 1.00 3.15 H new ATOM 0 HB1 ALA A 46 0.127 21.483 -10.904 1.00 4.05 H new ATOM 0 HB2 ALA A 46 0.139 20.611 -9.352 1.00 4.05 H new ATOM 0 HB3 ALA A 46 1.016 19.948 -10.752 1.00 4.05 H new ATOM 647 N LEU A 47 -0.224 20.168 -13.066 1.00 3.18 N ATOM 648 CA LEU A 47 -0.225 20.124 -14.561 1.00 3.43 C ATOM 649 C LEU A 47 1.174 19.744 -15.057 1.00 3.14 C ATOM 650 O LEU A 47 1.606 20.151 -16.117 1.00 3.51 O ATOM 651 CB LEU A 47 -0.630 21.501 -15.114 1.00 4.05 C ATOM 652 CG LEU A 47 -0.119 22.617 -14.195 1.00 4.77 C ATOM 653 CD1 LEU A 47 1.407 22.540 -14.081 1.00 5.26 C ATOM 654 CD2 LEU A 47 -0.519 23.973 -14.784 1.00 5.35 C ATOM 0 H LEU A 47 0.582 20.636 -12.651 1.00 3.18 H new ATOM 0 HA LEU A 47 -0.941 19.379 -14.909 1.00 3.43 H new ATOM 0 HB2 LEU A 47 -0.223 21.632 -16.117 1.00 4.05 H new ATOM 0 HB3 LEU A 47 -1.715 21.561 -15.201 1.00 4.05 H new ATOM 0 HG LEU A 47 -0.557 22.500 -13.204 1.00 4.77 H new ATOM 0 HD11 LEU A 47 1.764 23.336 -13.427 1.00 5.26 H new ATOM 0 HD12 LEU A 47 1.693 21.573 -13.666 1.00 5.26 H new ATOM 0 HD13 LEU A 47 1.852 22.656 -15.069 1.00 5.26 H new ATOM 0 HD21 LEU A 47 -0.159 24.772 -14.136 1.00 5.35 H new ATOM 0 HD22 LEU A 47 -0.078 24.084 -15.775 1.00 5.35 H new ATOM 0 HD23 LEU A 47 -1.605 24.030 -14.861 1.00 5.35 H new ATOM 666 N ASP A 48 1.882 18.961 -14.285 1.00 3.02 N ATOM 667 CA ASP A 48 3.261 18.531 -14.678 1.00 3.07 C ATOM 668 C ASP A 48 3.227 17.048 -15.121 1.00 2.77 C ATOM 669 O ASP A 48 3.094 16.184 -14.277 1.00 2.85 O ATOM 670 CB ASP A 48 4.180 18.657 -13.462 1.00 3.61 C ATOM 671 CG ASP A 48 4.275 20.127 -13.050 1.00 4.22 C ATOM 672 OD1 ASP A 48 4.714 20.923 -13.864 1.00 4.69 O ATOM 673 OD2 ASP A 48 3.907 20.431 -11.927 1.00 4.68 O ATOM 0 H ASP A 48 1.561 18.596 -13.388 1.00 3.02 H new ATOM 0 HA ASP A 48 3.624 19.154 -15.495 1.00 3.07 H new ATOM 0 HB2 ASP A 48 3.793 18.060 -12.636 1.00 3.61 H new ATOM 0 HB3 ASP A 48 5.171 18.269 -13.699 1.00 3.61 H new ATOM 678 N PRO A 49 3.337 16.767 -16.412 1.00 3.11 N ATOM 679 CA PRO A 49 3.301 15.368 -16.886 1.00 3.40 C ATOM 680 C PRO A 49 4.464 14.574 -16.272 1.00 3.08 C ATOM 681 O PRO A 49 5.619 14.852 -16.525 1.00 3.32 O ATOM 682 CB PRO A 49 3.428 15.461 -18.427 1.00 4.36 C ATOM 683 CG PRO A 49 3.516 16.969 -18.799 1.00 4.66 C ATOM 684 CD PRO A 49 3.500 17.777 -17.483 1.00 3.86 C ATOM 0 HA PRO A 49 2.387 14.849 -16.596 1.00 3.40 H new ATOM 0 HB2 PRO A 49 4.315 14.929 -18.771 1.00 4.36 H new ATOM 0 HB3 PRO A 49 2.569 14.996 -18.911 1.00 4.36 H new ATOM 0 HG2 PRO A 49 4.427 17.172 -19.362 1.00 4.66 H new ATOM 0 HG3 PRO A 49 2.678 17.256 -19.435 1.00 4.66 H new ATOM 0 HD2 PRO A 49 4.424 18.341 -17.356 1.00 3.86 H new ATOM 0 HD3 PRO A 49 2.682 18.498 -17.473 1.00 3.86 H new ATOM 692 N VAL A 50 4.163 13.589 -15.468 1.00 3.08 N ATOM 693 CA VAL A 50 5.247 12.780 -14.840 1.00 3.10 C ATOM 694 C VAL A 50 5.738 11.716 -15.854 1.00 2.75 C ATOM 695 O VAL A 50 4.928 10.955 -16.346 1.00 2.91 O ATOM 696 CB VAL A 50 4.688 12.074 -13.601 1.00 3.88 C ATOM 697 CG1 VAL A 50 5.776 11.200 -12.969 1.00 4.44 C ATOM 698 CG2 VAL A 50 4.233 13.125 -12.587 1.00 4.50 C ATOM 0 H VAL A 50 3.214 13.310 -15.219 1.00 3.08 H new ATOM 0 HA VAL A 50 6.076 13.427 -14.555 1.00 3.10 H new ATOM 0 HB VAL A 50 3.844 11.447 -13.890 1.00 3.88 H new ATOM 0 HG11 VAL A 50 5.374 10.699 -12.088 1.00 4.44 H new ATOM 0 HG12 VAL A 50 6.108 10.454 -13.691 1.00 4.44 H new ATOM 0 HG13 VAL A 50 6.621 11.824 -12.678 1.00 4.44 H new ATOM 0 HG21 VAL A 50 3.834 12.628 -11.703 1.00 4.50 H new ATOM 0 HG22 VAL A 50 5.082 13.747 -12.302 1.00 4.50 H new ATOM 0 HG23 VAL A 50 3.459 13.749 -13.033 1.00 4.50 H new ATOM 708 N PRO A 51 7.031 11.666 -16.155 1.00 2.91 N ATOM 709 CA PRO A 51 7.546 10.665 -17.115 1.00 3.22 C ATOM 710 C PRO A 51 7.267 9.245 -16.596 1.00 2.93 C ATOM 711 O PRO A 51 7.248 9.001 -15.406 1.00 3.37 O ATOM 712 CB PRO A 51 9.067 10.939 -17.208 1.00 4.09 C ATOM 713 CG PRO A 51 9.392 12.109 -16.236 1.00 4.27 C ATOM 714 CD PRO A 51 8.065 12.566 -15.594 1.00 3.50 C ATOM 0 HA PRO A 51 7.068 10.739 -18.092 1.00 3.22 H new ATOM 0 HB2 PRO A 51 9.634 10.048 -16.939 1.00 4.09 H new ATOM 0 HB3 PRO A 51 9.348 11.199 -18.229 1.00 4.09 H new ATOM 0 HG2 PRO A 51 10.096 11.785 -15.470 1.00 4.27 H new ATOM 0 HG3 PRO A 51 9.861 12.933 -16.773 1.00 4.27 H new ATOM 0 HD2 PRO A 51 8.106 12.489 -14.508 1.00 3.50 H new ATOM 0 HD3 PRO A 51 7.851 13.608 -15.832 1.00 3.50 H new ATOM 722 N GLN A 52 7.052 8.310 -17.487 1.00 2.70 N ATOM 723 CA GLN A 52 6.776 6.903 -17.060 1.00 2.85 C ATOM 724 C GLN A 52 8.059 6.070 -17.148 1.00 2.14 C ATOM 725 O GLN A 52 8.361 5.482 -18.168 1.00 2.38 O ATOM 726 CB GLN A 52 5.716 6.294 -17.982 1.00 3.67 C ATOM 727 CG GLN A 52 4.414 7.088 -17.861 1.00 4.37 C ATOM 728 CD GLN A 52 3.355 6.477 -18.781 1.00 5.22 C ATOM 729 OE1 GLN A 52 2.325 6.024 -18.324 1.00 5.74 O ATOM 730 NE2 GLN A 52 3.568 6.444 -20.069 1.00 5.74 N ATOM 0 H GLN A 52 7.056 8.461 -18.496 1.00 2.70 H new ATOM 0 HA GLN A 52 6.417 6.904 -16.031 1.00 2.85 H new ATOM 0 HB2 GLN A 52 6.067 6.306 -19.014 1.00 3.67 H new ATOM 0 HB3 GLN A 52 5.544 5.251 -17.716 1.00 3.67 H new ATOM 0 HG2 GLN A 52 4.064 7.077 -16.829 1.00 4.37 H new ATOM 0 HG3 GLN A 52 4.585 8.131 -18.129 1.00 4.37 H new ATOM 0 HE21 GLN A 52 4.433 6.824 -20.453 1.00 5.74 H new ATOM 0 HE22 GLN A 52 2.869 6.038 -20.691 1.00 5.74 H new ATOM 739 N ASP A 53 8.809 6.004 -16.081 1.00 1.78 N ATOM 740 CA ASP A 53 10.065 5.195 -16.091 1.00 1.30 C ATOM 741 C ASP A 53 9.724 3.724 -16.339 1.00 1.07 C ATOM 742 O ASP A 53 8.621 3.276 -16.098 1.00 1.19 O ATOM 743 CB ASP A 53 10.784 5.338 -14.748 1.00 1.65 C ATOM 744 CG ASP A 53 11.026 6.819 -14.451 1.00 2.27 C ATOM 745 OD1 ASP A 53 11.141 7.581 -15.396 1.00 2.80 O ATOM 746 OD2 ASP A 53 11.091 7.165 -13.283 1.00 2.91 O ATOM 0 H ASP A 53 8.607 6.476 -15.200 1.00 1.78 H new ATOM 0 HA ASP A 53 10.718 5.554 -16.886 1.00 1.30 H new ATOM 0 HB2 ASP A 53 10.186 4.891 -13.954 1.00 1.65 H new ATOM 0 HB3 ASP A 53 11.733 4.802 -14.773 1.00 1.65 H new ATOM 751 N ALA A 54 10.672 2.980 -16.848 1.00 0.91 N ATOM 752 CA ALA A 54 10.429 1.541 -17.152 1.00 0.84 C ATOM 753 C ALA A 54 10.350 0.722 -15.862 1.00 0.76 C ATOM 754 O ALA A 54 9.576 -0.208 -15.753 1.00 0.75 O ATOM 755 CB ALA A 54 11.572 1.009 -18.018 1.00 0.95 C ATOM 0 H ALA A 54 11.611 3.312 -17.067 1.00 0.91 H new ATOM 0 HA ALA A 54 9.481 1.450 -17.683 1.00 0.84 H new ATOM 0 HB1 ALA A 54 11.399 -0.043 -18.243 1.00 0.95 H new ATOM 0 HB2 ALA A 54 11.618 1.576 -18.948 1.00 0.95 H new ATOM 0 HB3 ALA A 54 12.515 1.115 -17.481 1.00 0.95 H new ATOM 761 N SER A 55 11.128 1.058 -14.874 1.00 0.75 N ATOM 762 CA SER A 55 11.069 0.291 -13.601 1.00 0.71 C ATOM 763 C SER A 55 9.680 0.452 -12.988 1.00 0.66 C ATOM 764 O SER A 55 9.090 -0.488 -12.492 1.00 0.66 O ATOM 765 CB SER A 55 12.119 0.838 -12.633 1.00 0.76 C ATOM 766 OG SER A 55 13.413 0.647 -13.189 1.00 1.37 O ATOM 0 H SER A 55 11.799 1.826 -14.892 1.00 0.75 H new ATOM 0 HA SER A 55 11.267 -0.764 -13.793 1.00 0.71 H new ATOM 0 HB2 SER A 55 11.943 1.898 -12.448 1.00 0.76 H new ATOM 0 HB3 SER A 55 12.045 0.329 -11.672 1.00 0.76 H new ATOM 0 HG SER A 55 14.089 0.998 -12.572 1.00 1.37 H new ATOM 772 N THR A 56 9.164 1.649 -12.999 1.00 0.65 N ATOM 773 CA THR A 56 7.826 1.894 -12.398 1.00 0.62 C ATOM 774 C THR A 56 6.711 1.424 -13.335 1.00 0.59 C ATOM 775 O THR A 56 5.587 1.236 -12.915 1.00 0.57 O ATOM 776 CB THR A 56 7.651 3.395 -12.156 1.00 0.67 C ATOM 777 OG1 THR A 56 7.978 4.103 -13.344 1.00 1.09 O ATOM 778 CG2 THR A 56 8.563 3.858 -11.023 1.00 1.06 C ATOM 0 H THR A 56 9.615 2.471 -13.401 1.00 0.65 H new ATOM 0 HA THR A 56 7.764 1.339 -11.462 1.00 0.62 H new ATOM 0 HB THR A 56 6.615 3.592 -11.879 1.00 0.67 H new ATOM 0 HG1 THR A 56 8.036 3.475 -14.094 1.00 1.09 H new ATOM 0 HG21 THR A 56 8.428 4.928 -10.862 1.00 1.06 H new ATOM 0 HG22 THR A 56 8.311 3.319 -10.110 1.00 1.06 H new ATOM 0 HG23 THR A 56 9.602 3.659 -11.287 1.00 1.06 H new ATOM 786 N LYS A 57 6.987 1.247 -14.603 1.00 0.61 N ATOM 787 CA LYS A 57 5.894 0.812 -15.519 1.00 0.59 C ATOM 788 C LYS A 57 5.519 -0.642 -15.213 1.00 0.54 C ATOM 789 O LYS A 57 4.371 -1.029 -15.324 1.00 0.52 O ATOM 790 CB LYS A 57 6.319 0.997 -16.999 1.00 0.65 C ATOM 791 CG LYS A 57 7.050 -0.251 -17.557 1.00 1.20 C ATOM 792 CD LYS A 57 6.045 -1.235 -18.203 1.00 1.33 C ATOM 793 CE LYS A 57 5.917 -0.940 -19.703 1.00 1.94 C ATOM 794 NZ LYS A 57 4.853 -1.799 -20.294 1.00 2.73 N ATOM 0 H LYS A 57 7.901 1.382 -15.034 1.00 0.61 H new ATOM 0 HA LYS A 57 5.013 1.433 -15.357 1.00 0.59 H new ATOM 0 HB2 LYS A 57 5.437 1.201 -17.606 1.00 0.65 H new ATOM 0 HB3 LYS A 57 6.972 1.866 -17.082 1.00 0.65 H new ATOM 0 HG2 LYS A 57 7.791 0.056 -18.295 1.00 1.20 H new ATOM 0 HG3 LYS A 57 7.590 -0.751 -16.753 1.00 1.20 H new ATOM 0 HD2 LYS A 57 6.380 -2.261 -18.053 1.00 1.33 H new ATOM 0 HD3 LYS A 57 5.072 -1.143 -17.721 1.00 1.33 H new ATOM 0 HE2 LYS A 57 5.676 0.112 -19.857 1.00 1.94 H new ATOM 0 HE3 LYS A 57 6.868 -1.126 -20.203 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 4.768 -1.597 -21.311 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 5.100 -2.800 -20.159 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 3.946 -1.600 -19.825 1.00 2.73 H new ATOM 808 N LYS A 58 6.469 -1.461 -14.828 1.00 0.55 N ATOM 809 CA LYS A 58 6.130 -2.882 -14.528 1.00 0.53 C ATOM 810 C LYS A 58 5.538 -2.956 -13.115 1.00 0.48 C ATOM 811 O LYS A 58 4.549 -3.626 -12.894 1.00 0.46 O ATOM 812 CB LYS A 58 7.400 -3.746 -14.649 1.00 0.56 C ATOM 813 CG LYS A 58 7.050 -5.162 -15.119 1.00 0.78 C ATOM 814 CD LYS A 58 6.169 -5.855 -14.075 1.00 0.96 C ATOM 815 CE LYS A 58 6.192 -7.369 -14.303 1.00 0.85 C ATOM 816 NZ LYS A 58 5.379 -8.041 -13.252 1.00 1.75 N ATOM 0 H LYS A 58 7.450 -1.209 -14.711 1.00 0.55 H new ATOM 0 HA LYS A 58 5.394 -3.262 -15.237 1.00 0.53 H new ATOM 0 HB2 LYS A 58 8.094 -3.285 -15.352 1.00 0.56 H new ATOM 0 HB3 LYS A 58 7.907 -3.792 -13.685 1.00 0.56 H new ATOM 0 HG2 LYS A 58 6.530 -5.119 -16.076 1.00 0.78 H new ATOM 0 HG3 LYS A 58 7.962 -5.738 -15.278 1.00 0.78 H new ATOM 0 HD2 LYS A 58 6.527 -5.623 -13.072 1.00 0.96 H new ATOM 0 HD3 LYS A 58 5.147 -5.483 -14.143 1.00 0.96 H new ATOM 0 HE2 LYS A 58 5.796 -7.605 -15.291 1.00 0.85 H new ATOM 0 HE3 LYS A 58 7.218 -7.736 -14.275 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 5.394 -9.069 -13.406 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 5.776 -7.825 -12.315 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 4.398 -7.698 -13.300 1.00 1.75 H new ATOM 830 N LEU A 59 6.117 -2.293 -12.149 1.00 0.50 N ATOM 831 CA LEU A 59 5.532 -2.382 -10.781 1.00 0.47 C ATOM 832 C LEU A 59 4.113 -1.803 -10.823 1.00 0.43 C ATOM 833 O LEU A 59 3.279 -2.106 -9.994 1.00 0.42 O ATOM 834 CB LEU A 59 6.389 -1.603 -9.766 1.00 0.53 C ATOM 835 CG LEU A 59 7.417 -2.522 -9.106 1.00 0.71 C ATOM 836 CD1 LEU A 59 8.387 -3.052 -10.159 1.00 1.07 C ATOM 837 CD2 LEU A 59 8.192 -1.731 -8.049 1.00 1.34 C ATOM 0 H LEU A 59 6.948 -1.709 -12.243 1.00 0.50 H new ATOM 0 HA LEU A 59 5.506 -3.425 -10.465 1.00 0.47 H new ATOM 0 HB2 LEU A 59 6.899 -0.781 -10.269 1.00 0.53 H new ATOM 0 HB3 LEU A 59 5.747 -1.161 -9.004 1.00 0.53 H new ATOM 0 HG LEU A 59 6.906 -3.362 -8.636 1.00 0.71 H new ATOM 0 HD11 LEU A 59 9.118 -3.706 -9.684 1.00 1.07 H new ATOM 0 HD12 LEU A 59 7.835 -3.612 -10.913 1.00 1.07 H new ATOM 0 HD13 LEU A 59 8.902 -2.216 -10.633 1.00 1.07 H new ATOM 0 HD21 LEU A 59 8.927 -2.381 -7.574 1.00 1.34 H new ATOM 0 HD22 LEU A 59 8.702 -0.892 -8.523 1.00 1.34 H new ATOM 0 HD23 LEU A 59 7.500 -1.355 -7.296 1.00 1.34 H new ATOM 849 N SER A 60 3.833 -1.000 -11.812 1.00 0.43 N ATOM 850 CA SER A 60 2.467 -0.427 -11.946 1.00 0.42 C ATOM 851 C SER A 60 1.537 -1.522 -12.473 1.00 0.39 C ATOM 852 O SER A 60 0.379 -1.594 -12.112 1.00 0.41 O ATOM 853 CB SER A 60 2.499 0.730 -12.945 1.00 0.47 C ATOM 854 OG SER A 60 1.171 1.178 -13.185 1.00 1.36 O ATOM 0 H SER A 60 4.494 -0.716 -12.535 1.00 0.43 H new ATOM 0 HA SER A 60 2.115 -0.061 -10.981 1.00 0.42 H new ATOM 0 HB2 SER A 60 3.106 1.547 -12.554 1.00 0.47 H new ATOM 0 HB3 SER A 60 2.961 0.408 -13.878 1.00 0.47 H new ATOM 0 HG SER A 60 1.187 1.921 -13.824 1.00 1.36 H new ATOM 860 N GLU A 61 2.039 -2.381 -13.322 1.00 0.38 N ATOM 861 CA GLU A 61 1.184 -3.476 -13.869 1.00 0.38 C ATOM 862 C GLU A 61 0.851 -4.467 -12.749 1.00 0.38 C ATOM 863 O GLU A 61 -0.224 -5.032 -12.716 1.00 0.41 O ATOM 864 CB GLU A 61 1.923 -4.184 -15.008 1.00 0.39 C ATOM 865 CG GLU A 61 1.095 -5.365 -15.514 1.00 1.06 C ATOM 866 CD GLU A 61 1.735 -5.922 -16.787 1.00 1.67 C ATOM 867 OE1 GLU A 61 2.928 -5.732 -16.959 1.00 2.40 O ATOM 868 OE2 GLU A 61 1.022 -6.529 -17.569 1.00 2.25 O ATOM 0 H GLU A 61 3.002 -2.372 -13.659 1.00 0.38 H new ATOM 0 HA GLU A 61 0.256 -3.060 -14.261 1.00 0.38 H new ATOM 0 HB2 GLU A 61 2.109 -3.484 -15.823 1.00 0.39 H new ATOM 0 HB3 GLU A 61 2.895 -4.533 -14.660 1.00 0.39 H new ATOM 0 HG2 GLU A 61 1.042 -6.141 -14.750 1.00 1.06 H new ATOM 0 HG3 GLU A 61 0.072 -5.047 -15.716 1.00 1.06 H new ATOM 875 N CYS A 62 1.737 -4.659 -11.813 1.00 0.37 N ATOM 876 CA CYS A 62 1.430 -5.584 -10.684 1.00 0.39 C ATOM 877 C CYS A 62 0.279 -4.972 -9.872 1.00 0.38 C ATOM 878 O CYS A 62 -0.725 -5.607 -9.620 1.00 0.44 O ATOM 879 CB CYS A 62 2.688 -5.753 -9.807 1.00 0.41 C ATOM 880 SG CYS A 62 2.823 -7.472 -9.250 1.00 1.62 S ATOM 0 H CYS A 62 2.656 -4.219 -11.779 1.00 0.37 H new ATOM 0 HA CYS A 62 1.136 -6.567 -11.052 1.00 0.39 H new ATOM 0 HB2 CYS A 62 3.577 -5.474 -10.373 1.00 0.41 H new ATOM 0 HB3 CYS A 62 2.635 -5.086 -8.947 1.00 0.41 H new ATOM 0 HG CYS A 62 3.192 -7.497 -8.004 1.00 1.62 H new ATOM 886 N LEU A 63 0.403 -3.728 -9.507 1.00 0.35 N ATOM 887 CA LEU A 63 -0.687 -3.033 -8.762 1.00 0.36 C ATOM 888 C LEU A 63 -1.936 -2.958 -9.646 1.00 0.36 C ATOM 889 O LEU A 63 -3.045 -3.117 -9.176 1.00 0.41 O ATOM 890 CB LEU A 63 -0.212 -1.619 -8.417 1.00 0.38 C ATOM 891 CG LEU A 63 1.052 -1.699 -7.544 1.00 0.69 C ATOM 892 CD1 LEU A 63 1.567 -0.283 -7.267 1.00 1.39 C ATOM 893 CD2 LEU A 63 0.724 -2.381 -6.202 1.00 1.11 C ATOM 0 H LEU A 63 1.224 -3.153 -9.695 1.00 0.35 H new ATOM 0 HA LEU A 63 -0.929 -3.577 -7.849 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -0.001 -1.062 -9.330 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -0.998 -1.079 -7.889 1.00 0.38 H new ATOM 0 HG LEU A 63 1.811 -2.279 -8.070 1.00 0.69 H new ATOM 0 HD11 LEU A 63 2.463 -0.336 -6.648 1.00 1.39 H new ATOM 0 HD12 LEU A 63 1.806 0.208 -8.210 1.00 1.39 H new ATOM 0 HD13 LEU A 63 0.799 0.288 -6.745 1.00 1.39 H new ATOM 0 HD21 LEU A 63 1.625 -2.433 -5.591 1.00 1.11 H new ATOM 0 HD22 LEU A 63 -0.038 -1.804 -5.677 1.00 1.11 H new ATOM 0 HD23 LEU A 63 0.352 -3.389 -6.387 1.00 1.11 H new ATOM 905 N LYS A 64 -1.773 -2.719 -10.916 1.00 0.35 N ATOM 906 CA LYS A 64 -2.958 -2.638 -11.818 1.00 0.37 C ATOM 907 C LYS A 64 -3.578 -4.031 -11.992 1.00 0.39 C ATOM 908 O LYS A 64 -4.784 -4.182 -12.003 1.00 0.43 O ATOM 909 CB LYS A 64 -2.519 -2.094 -13.184 1.00 0.38 C ATOM 910 CG LYS A 64 -3.737 -1.546 -13.935 1.00 0.82 C ATOM 911 CD LYS A 64 -3.302 -1.002 -15.296 1.00 1.35 C ATOM 912 CE LYS A 64 -4.455 -0.214 -15.917 1.00 1.38 C ATOM 913 NZ LYS A 64 -5.640 -1.105 -16.072 1.00 2.09 N ATOM 0 H LYS A 64 -0.871 -2.576 -11.370 1.00 0.35 H new ATOM 0 HA LYS A 64 -3.701 -1.971 -11.380 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -1.776 -1.307 -13.052 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -2.045 -2.884 -13.766 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -4.479 -2.333 -14.068 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -4.211 -0.757 -13.352 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -2.428 -0.361 -15.182 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -3.012 -1.822 -15.953 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -4.708 0.639 -15.287 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -4.157 0.184 -16.887 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -6.342 -0.645 -16.686 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -5.344 -2.006 -16.499 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -6.062 -1.287 -15.139 1.00 2.09 H new ATOM 927 N ARG A 65 -2.772 -5.046 -12.140 1.00 0.43 N ATOM 928 CA ARG A 65 -3.332 -6.418 -12.325 1.00 0.47 C ATOM 929 C ARG A 65 -4.116 -6.831 -11.072 1.00 0.50 C ATOM 930 O ARG A 65 -5.165 -7.439 -11.158 1.00 0.54 O ATOM 931 CB ARG A 65 -2.185 -7.410 -12.574 1.00 0.45 C ATOM 932 CG ARG A 65 -2.736 -8.810 -12.909 1.00 0.94 C ATOM 933 CD ARG A 65 -3.113 -8.897 -14.393 1.00 1.55 C ATOM 934 NE ARG A 65 -3.556 -10.285 -14.706 1.00 1.86 N ATOM 935 CZ ARG A 65 -4.202 -10.531 -15.813 1.00 2.39 C ATOM 936 NH1 ARG A 65 -4.453 -9.564 -16.653 1.00 2.94 N ATOM 937 NH2 ARG A 65 -4.597 -11.746 -16.081 1.00 2.92 N ATOM 0 H ARG A 65 -1.754 -4.987 -12.141 1.00 0.43 H new ATOM 0 HA ARG A 65 -4.005 -6.423 -13.183 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -1.562 -7.054 -13.394 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -1.549 -7.466 -11.691 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -1.989 -9.568 -12.672 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -3.610 -9.021 -12.293 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -3.909 -8.188 -14.620 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -2.259 -8.626 -15.014 1.00 1.55 H new ATOM 0 HE ARG A 65 -3.354 -11.043 -14.054 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -4.144 -8.614 -16.445 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -4.958 -9.758 -17.518 1.00 2.94 H new ATOM 0 HH21 ARG A 65 -4.401 -12.502 -15.425 1.00 2.92 H new ATOM 0 HH22 ARG A 65 -5.102 -11.939 -16.946 1.00 2.92 H new ATOM 951 N ILE A 66 -3.623 -6.499 -9.911 1.00 0.49 N ATOM 952 CA ILE A 66 -4.345 -6.869 -8.658 1.00 0.53 C ATOM 953 C ILE A 66 -5.467 -5.854 -8.409 1.00 0.54 C ATOM 954 O ILE A 66 -6.512 -6.181 -7.881 1.00 0.60 O ATOM 955 CB ILE A 66 -3.348 -6.857 -7.490 1.00 0.52 C ATOM 956 CG1 ILE A 66 -2.428 -8.075 -7.597 1.00 1.22 C ATOM 957 CG2 ILE A 66 -4.092 -6.892 -6.150 1.00 1.29 C ATOM 958 CD1 ILE A 66 -1.248 -7.911 -6.636 1.00 1.25 C ATOM 0 H ILE A 66 -2.751 -5.987 -9.774 1.00 0.49 H new ATOM 0 HA ILE A 66 -4.780 -7.864 -8.749 1.00 0.53 H new ATOM 0 HB ILE A 66 -2.758 -5.942 -7.538 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -2.981 -8.984 -7.359 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -2.066 -8.181 -8.619 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -3.371 -6.883 -5.333 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -4.741 -6.020 -6.071 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -4.695 -7.798 -6.092 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -0.593 -8.779 -6.713 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -0.690 -7.011 -6.895 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -1.620 -7.826 -5.615 1.00 1.25 H new ATOM 970 N GLY A 67 -5.265 -4.631 -8.814 1.00 0.52 N ATOM 971 CA GLY A 67 -6.319 -3.590 -8.636 1.00 0.55 C ATOM 972 C GLY A 67 -7.606 -4.050 -9.322 1.00 0.53 C ATOM 973 O GLY A 67 -8.658 -4.111 -8.716 1.00 0.63 O ATOM 0 H GLY A 67 -4.410 -4.305 -9.264 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -6.501 -3.418 -7.575 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -5.986 -2.643 -9.060 1.00 0.55 H new ATOM 977 N ASP A 68 -7.532 -4.368 -10.583 1.00 0.54 N ATOM 978 CA ASP A 68 -8.749 -4.820 -11.314 1.00 0.54 C ATOM 979 C ASP A 68 -9.265 -6.131 -10.713 1.00 0.52 C ATOM 980 O ASP A 68 -10.452 -6.388 -10.700 1.00 0.56 O ATOM 981 CB ASP A 68 -8.403 -5.044 -12.787 1.00 0.60 C ATOM 982 CG ASP A 68 -7.271 -6.064 -12.900 1.00 1.43 C ATOM 983 OD1 ASP A 68 -7.471 -7.191 -12.477 1.00 2.20 O ATOM 984 OD2 ASP A 68 -6.224 -5.702 -13.410 1.00 2.12 O ATOM 0 H ASP A 68 -6.679 -4.335 -11.141 1.00 0.54 H new ATOM 0 HA ASP A 68 -9.521 -4.056 -11.227 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -9.281 -5.399 -13.327 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -8.105 -4.102 -13.248 1.00 0.60 H new ATOM 989 N GLU A 69 -8.387 -6.970 -10.227 1.00 0.56 N ATOM 990 CA GLU A 69 -8.844 -8.269 -9.645 1.00 0.56 C ATOM 991 C GLU A 69 -9.349 -8.047 -8.214 1.00 0.55 C ATOM 992 O GLU A 69 -10.472 -8.379 -7.890 1.00 0.73 O ATOM 993 CB GLU A 69 -7.677 -9.265 -9.645 1.00 0.61 C ATOM 994 CG GLU A 69 -8.209 -10.699 -9.563 1.00 0.84 C ATOM 995 CD GLU A 69 -8.924 -10.908 -8.228 1.00 1.65 C ATOM 996 OE1 GLU A 69 -8.240 -11.088 -7.233 1.00 2.48 O ATOM 997 OE2 GLU A 69 -10.144 -10.886 -8.222 1.00 2.23 O ATOM 0 H GLU A 69 -7.379 -6.814 -10.207 1.00 0.56 H new ATOM 0 HA GLU A 69 -9.659 -8.672 -10.246 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -7.083 -9.141 -10.550 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -7.018 -9.065 -8.801 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -8.895 -10.890 -10.388 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -7.387 -11.408 -9.661 1.00 0.84 H new ATOM 1004 N LEU A 70 -8.535 -7.508 -7.349 1.00 0.53 N ATOM 1005 CA LEU A 70 -8.992 -7.299 -5.944 1.00 0.52 C ATOM 1006 C LEU A 70 -10.273 -6.453 -5.951 1.00 0.54 C ATOM 1007 O LEU A 70 -11.211 -6.717 -5.226 1.00 0.60 O ATOM 1008 CB LEU A 70 -7.880 -6.590 -5.143 1.00 0.61 C ATOM 1009 CG LEU A 70 -7.839 -7.099 -3.697 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -6.743 -6.350 -2.934 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -9.181 -6.827 -3.009 1.00 1.61 C ATOM 0 H LEU A 70 -7.582 -7.205 -7.550 1.00 0.53 H new ATOM 0 HA LEU A 70 -9.204 -8.259 -5.473 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -6.916 -6.762 -5.621 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -8.051 -5.514 -5.149 1.00 0.61 H new ATOM 0 HG LEU A 70 -7.639 -8.170 -3.702 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -6.708 -6.707 -1.905 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -5.780 -6.528 -3.413 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -6.960 -5.282 -2.941 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -9.144 -7.191 -1.982 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -9.378 -5.755 -3.007 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -9.977 -7.341 -3.548 1.00 1.61 H new ATOM 1023 N ASP A 71 -10.311 -5.442 -6.775 1.00 0.67 N ATOM 1024 CA ASP A 71 -11.519 -4.574 -6.850 1.00 0.91 C ATOM 1025 C ASP A 71 -12.689 -5.351 -7.455 1.00 1.02 C ATOM 1026 O ASP A 71 -13.821 -4.911 -7.399 1.00 1.29 O ATOM 1027 CB ASP A 71 -11.218 -3.373 -7.748 1.00 1.09 C ATOM 1028 CG ASP A 71 -12.412 -2.416 -7.729 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -12.859 -2.081 -6.644 1.00 2.25 O ATOM 1030 OD2 ASP A 71 -12.860 -2.036 -8.798 1.00 2.36 O ATOM 0 H ASP A 71 -9.552 -5.179 -7.403 1.00 0.67 H new ATOM 0 HA ASP A 71 -11.781 -4.244 -5.845 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -10.321 -2.860 -7.401 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -11.021 -3.706 -8.767 1.00 1.09 H new ATOM 1035 N SER A 72 -12.431 -6.500 -8.040 1.00 0.90 N ATOM 1036 CA SER A 72 -13.540 -7.299 -8.661 1.00 1.20 C ATOM 1037 C SER A 72 -13.853 -8.515 -7.795 1.00 0.98 C ATOM 1038 O SER A 72 -14.710 -9.312 -8.123 1.00 1.02 O ATOM 1039 CB SER A 72 -13.128 -7.758 -10.059 1.00 1.57 C ATOM 1040 OG SER A 72 -12.040 -8.668 -9.953 1.00 2.09 O ATOM 0 H SER A 72 -11.503 -6.918 -8.114 1.00 0.90 H new ATOM 0 HA SER A 72 -14.429 -6.673 -8.735 1.00 1.20 H new ATOM 0 HB2 SER A 72 -13.970 -8.236 -10.560 1.00 1.57 H new ATOM 0 HB3 SER A 72 -12.841 -6.900 -10.666 1.00 1.57 H new ATOM 0 HG SER A 72 -11.669 -8.630 -9.047 1.00 2.09 H new ATOM 1046 N ASN A 73 -13.155 -8.672 -6.696 1.00 0.92 N ATOM 1047 CA ASN A 73 -13.406 -9.842 -5.805 1.00 0.83 C ATOM 1048 C ASN A 73 -14.910 -10.068 -5.666 1.00 0.75 C ATOM 1049 O ASN A 73 -15.406 -11.088 -6.084 1.00 1.07 O ATOM 1050 CB ASN A 73 -12.794 -9.586 -4.422 1.00 0.91 C ATOM 1051 CG ASN A 73 -11.284 -9.837 -4.473 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -10.613 -9.776 -3.462 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -10.718 -10.123 -5.614 1.00 1.90 N ATOM 0 H ASN A 73 -12.422 -8.038 -6.379 1.00 0.92 H new ATOM 0 HA ASN A 73 -12.945 -10.728 -6.241 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -12.992 -8.561 -4.110 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -13.257 -10.239 -3.682 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -9.713 -10.295 -5.656 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -11.280 -10.175 -6.463 1.00 1.90 H new ATOM 1060 N MET A 74 -15.623 -9.140 -5.055 1.00 0.71 N ATOM 1061 CA MET A 74 -17.101 -9.250 -4.837 1.00 0.67 C ATOM 1062 C MET A 74 -17.336 -9.661 -3.386 1.00 0.67 C ATOM 1063 O MET A 74 -18.116 -9.059 -2.676 1.00 0.71 O ATOM 1064 CB MET A 74 -17.824 -10.188 -5.823 1.00 0.75 C ATOM 1065 CG MET A 74 -17.473 -9.810 -7.290 1.00 1.20 C ATOM 1066 SD MET A 74 -18.992 -9.529 -8.242 1.00 1.92 S ATOM 1067 CE MET A 74 -19.373 -7.883 -7.593 1.00 1.96 C ATOM 0 H MET A 74 -15.218 -8.279 -4.686 1.00 0.71 H new ATOM 0 HA MET A 74 -17.542 -8.274 -5.038 1.00 0.67 H new ATOM 0 HB2 MET A 74 -17.536 -11.221 -5.629 1.00 0.75 H new ATOM 0 HB3 MET A 74 -18.902 -10.123 -5.672 1.00 0.75 H new ATOM 0 HG2 MET A 74 -16.854 -8.913 -7.304 1.00 1.20 H new ATOM 0 HG3 MET A 74 -16.889 -10.607 -7.749 1.00 1.20 H new ATOM 0 HE1 MET A 74 -20.289 -7.513 -8.054 1.00 1.96 H new ATOM 0 HE2 MET A 74 -19.508 -7.940 -6.513 1.00 1.96 H new ATOM 0 HE3 MET A 74 -18.552 -7.203 -7.821 1.00 1.96 H new ATOM 1077 N GLU A 75 -16.651 -10.676 -2.935 1.00 0.70 N ATOM 1078 CA GLU A 75 -16.816 -11.120 -1.525 1.00 0.75 C ATOM 1079 C GLU A 75 -16.716 -9.894 -0.600 1.00 0.73 C ATOM 1080 O GLU A 75 -17.647 -9.501 0.076 1.00 0.78 O ATOM 1081 CB GLU A 75 -15.675 -12.088 -1.181 1.00 0.87 C ATOM 1082 CG GLU A 75 -16.048 -12.877 0.084 1.00 1.15 C ATOM 1083 CD GLU A 75 -15.003 -13.965 0.339 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -13.876 -13.616 0.648 1.00 2.21 O ATOM 1085 OE2 GLU A 75 -15.349 -15.130 0.223 1.00 2.29 O ATOM 0 H GLU A 75 -15.983 -11.217 -3.484 1.00 0.70 H new ATOM 0 HA GLU A 75 -17.782 -11.608 -1.396 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -15.498 -12.771 -2.012 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -14.749 -11.536 -1.020 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -16.104 -12.205 0.940 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -17.034 -13.326 -0.033 1.00 1.15 H new ATOM 1092 N LEU A 76 -15.549 -9.283 -0.617 1.00 0.74 N ATOM 1093 CA LEU A 76 -15.272 -8.057 0.194 1.00 0.80 C ATOM 1094 C LEU A 76 -16.184 -6.912 -0.249 1.00 0.75 C ATOM 1095 O LEU A 76 -16.627 -6.129 0.567 1.00 0.81 O ATOM 1096 CB LEU A 76 -13.800 -7.622 0.028 1.00 0.92 C ATOM 1097 CG LEU A 76 -12.886 -8.844 -0.075 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -11.428 -8.383 -0.131 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -13.086 -9.743 1.147 1.00 1.51 C ATOM 0 H LEU A 76 -14.757 -9.597 -1.178 1.00 0.74 H new ATOM 0 HA LEU A 76 -15.464 -8.292 1.241 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -13.696 -7.007 -0.866 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -13.499 -7.007 0.876 1.00 0.92 H new ATOM 0 HG LEU A 76 -13.131 -9.403 -0.978 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -10.774 -9.252 -0.204 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -11.282 -7.744 -1.002 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -11.188 -7.824 0.773 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -12.433 -10.612 1.070 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -12.843 -9.186 2.052 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -14.124 -10.072 1.191 1.00 1.51 H new ATOM 1111 N GLN A 77 -16.479 -6.800 -1.518 1.00 0.76 N ATOM 1112 CA GLN A 77 -17.382 -5.695 -1.964 1.00 0.74 C ATOM 1113 C GLN A 77 -18.600 -5.661 -1.036 1.00 0.71 C ATOM 1114 O GLN A 77 -19.196 -4.629 -0.796 1.00 0.72 O ATOM 1115 CB GLN A 77 -17.848 -5.952 -3.400 1.00 0.71 C ATOM 1116 CG GLN A 77 -18.602 -4.727 -3.935 1.00 1.26 C ATOM 1117 CD GLN A 77 -20.015 -4.688 -3.346 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -20.548 -5.705 -2.947 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -20.650 -3.549 -3.277 1.00 2.03 N ATOM 0 H GLN A 77 -16.140 -7.416 -2.257 1.00 0.76 H new ATOM 0 HA GLN A 77 -16.850 -4.745 -1.928 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -16.990 -6.167 -4.036 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -18.495 -6.829 -3.430 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -18.064 -3.815 -3.674 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -18.653 -4.767 -5.023 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -20.204 -2.695 -3.612 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -21.592 -3.513 -2.889 1.00 2.03 H new ATOM 1128 N ARG A 78 -18.956 -6.801 -0.502 1.00 0.72 N ATOM 1129 CA ARG A 78 -20.120 -6.870 0.420 1.00 0.73 C ATOM 1130 C ARG A 78 -19.684 -6.476 1.828 1.00 0.75 C ATOM 1131 O ARG A 78 -20.171 -5.511 2.385 1.00 0.79 O ATOM 1132 CB ARG A 78 -20.663 -8.295 0.447 1.00 0.74 C ATOM 1133 CG ARG A 78 -21.068 -8.711 -0.967 1.00 0.94 C ATOM 1134 CD ARG A 78 -21.930 -9.964 -0.889 1.00 1.23 C ATOM 1135 NE ARG A 78 -22.172 -10.489 -2.264 1.00 1.80 N ATOM 1136 CZ ARG A 78 -22.638 -11.697 -2.432 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -22.917 -12.440 -1.397 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -22.829 -12.161 -3.638 1.00 3.41 N ATOM 0 H ARG A 78 -18.485 -7.690 -0.669 1.00 0.72 H new ATOM 0 HA ARG A 78 -20.894 -6.186 0.072 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -19.907 -8.977 0.836 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -21.521 -8.356 1.116 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -21.618 -7.905 -1.453 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -20.181 -8.901 -1.572 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -21.435 -10.721 -0.281 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -22.879 -9.736 -0.403 1.00 1.23 H new ATOM 0 HE ARG A 78 -21.973 -9.903 -3.075 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -22.771 -12.078 -0.455 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -23.281 -13.384 -1.530 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -22.614 -11.580 -4.448 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -23.193 -13.105 -3.770 1.00 3.41 H new ATOM 1152 N MET A 79 -18.766 -7.203 2.420 1.00 0.75 N ATOM 1153 CA MET A 79 -18.314 -6.843 3.790 1.00 0.77 C ATOM 1154 C MET A 79 -17.863 -5.388 3.793 1.00 0.77 C ATOM 1155 O MET A 79 -18.065 -4.667 4.750 1.00 0.78 O ATOM 1156 CB MET A 79 -17.139 -7.742 4.197 1.00 0.81 C ATOM 1157 CG MET A 79 -17.653 -9.143 4.543 1.00 1.08 C ATOM 1158 SD MET A 79 -16.289 -10.152 5.183 1.00 1.07 S ATOM 1159 CE MET A 79 -15.998 -9.235 6.718 1.00 0.81 C ATOM 0 H MET A 79 -18.317 -8.023 2.013 1.00 0.75 H new ATOM 0 HA MET A 79 -19.133 -6.980 4.497 1.00 0.77 H new ATOM 0 HB2 MET A 79 -16.415 -7.801 3.384 1.00 0.81 H new ATOM 0 HB3 MET A 79 -16.621 -7.313 5.054 1.00 0.81 H new ATOM 0 HG2 MET A 79 -18.448 -9.076 5.285 1.00 1.08 H new ATOM 0 HG3 MET A 79 -18.082 -9.613 3.658 1.00 1.08 H new ATOM 0 HE1 MET A 79 -15.638 -9.918 7.487 1.00 0.81 H new ATOM 0 HE2 MET A 79 -15.252 -8.460 6.543 1.00 0.81 H new ATOM 0 HE3 MET A 79 -16.929 -8.775 7.049 1.00 0.81 H new ATOM 1169 N ILE A 80 -17.260 -4.942 2.725 1.00 0.77 N ATOM 1170 CA ILE A 80 -16.811 -3.530 2.672 1.00 0.80 C ATOM 1171 C ILE A 80 -18.050 -2.635 2.675 1.00 0.80 C ATOM 1172 O ILE A 80 -18.042 -1.538 3.199 1.00 0.83 O ATOM 1173 CB ILE A 80 -15.994 -3.305 1.396 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -14.692 -4.111 1.484 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -15.665 -1.818 1.250 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -14.045 -4.204 0.099 1.00 1.10 C ATOM 0 H ILE A 80 -17.061 -5.495 1.892 1.00 0.77 H new ATOM 0 HA ILE A 80 -16.184 -3.292 3.531 1.00 0.80 H new ATOM 0 HB ILE A 80 -16.571 -3.631 0.531 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -14.006 -3.636 2.185 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -14.897 -5.110 1.867 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -15.084 -1.661 0.341 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -16.590 -1.245 1.192 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -15.086 -1.487 2.112 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -13.121 -4.777 0.167 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -14.729 -4.699 -0.590 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -13.824 -3.202 -0.267 1.00 1.10 H new ATOM 1188 N ALA A 81 -19.126 -3.109 2.095 1.00 0.78 N ATOM 1189 CA ALA A 81 -20.379 -2.303 2.066 1.00 0.80 C ATOM 1190 C ALA A 81 -20.993 -2.286 3.471 1.00 0.81 C ATOM 1191 O ALA A 81 -21.768 -1.413 3.807 1.00 0.85 O ATOM 1192 CB ALA A 81 -21.364 -2.915 1.060 1.00 0.79 C ATOM 0 H ALA A 81 -19.187 -4.020 1.641 1.00 0.78 H new ATOM 0 HA ALA A 81 -20.158 -1.281 1.757 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -22.279 -2.323 1.041 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -20.914 -2.920 0.067 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -21.599 -3.937 1.357 1.00 0.79 H new ATOM 1198 N ALA A 82 -20.636 -3.225 4.301 1.00 0.78 N ATOM 1199 CA ALA A 82 -21.180 -3.242 5.691 1.00 0.80 C ATOM 1200 C ALA A 82 -20.490 -2.142 6.509 1.00 0.79 C ATOM 1201 O ALA A 82 -20.845 -1.879 7.640 1.00 0.83 O ATOM 1202 CB ALA A 82 -20.899 -4.603 6.333 1.00 0.87 C ATOM 0 H ALA A 82 -19.991 -3.983 4.079 1.00 0.78 H new ATOM 0 HA ALA A 82 -22.256 -3.068 5.668 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -21.296 -4.615 7.348 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -21.377 -5.388 5.747 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -19.823 -4.776 6.362 1.00 0.87 H new ATOM 1208 N VAL A 83 -19.508 -1.500 5.938 1.00 0.80 N ATOM 1209 CA VAL A 83 -18.781 -0.411 6.663 1.00 0.85 C ATOM 1210 C VAL A 83 -19.459 0.939 6.405 1.00 0.99 C ATOM 1211 O VAL A 83 -19.071 1.691 5.532 1.00 1.36 O ATOM 1212 CB VAL A 83 -17.324 -0.336 6.183 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -16.499 0.508 7.156 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -16.715 -1.737 6.097 1.00 1.40 C ATOM 0 H VAL A 83 -19.173 -1.683 4.992 1.00 0.80 H new ATOM 0 HA VAL A 83 -18.804 -0.634 7.730 1.00 0.85 H new ATOM 0 HB VAL A 83 -17.312 0.121 5.194 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -15.467 0.557 6.810 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -16.913 1.515 7.206 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -16.528 0.054 8.147 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -15.682 -1.665 5.755 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -16.740 -2.205 7.081 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -17.289 -2.340 5.393 1.00 1.40 H new ATOM 1224 N ASP A 84 -20.456 1.259 7.196 1.00 1.46 N ATOM 1225 CA ASP A 84 -21.164 2.565 7.066 1.00 1.71 C ATOM 1226 C ASP A 84 -20.226 3.698 7.494 1.00 1.39 C ATOM 1227 O ASP A 84 -19.659 4.390 6.672 1.00 1.80 O ATOM 1228 CB ASP A 84 -22.381 2.556 7.994 1.00 2.38 C ATOM 1229 CG ASP A 84 -23.327 1.425 7.588 1.00 2.99 C ATOM 1230 OD1 ASP A 84 -23.486 1.212 6.397 1.00 3.45 O ATOM 1231 OD2 ASP A 84 -23.875 0.790 8.474 1.00 3.57 O ATOM 0 H ASP A 84 -20.812 0.657 7.938 1.00 1.46 H new ATOM 0 HA ASP A 84 -21.474 2.716 6.032 1.00 1.71 H new ATOM 0 HB2 ASP A 84 -22.062 2.423 9.028 1.00 2.38 H new ATOM 0 HB3 ASP A 84 -22.899 3.514 7.941 1.00 2.38 H new ATOM 1236 N THR A 85 -20.044 3.883 8.779 1.00 1.68 N ATOM 1237 CA THR A 85 -19.130 4.961 9.254 1.00 1.97 C ATOM 1238 C THR A 85 -17.701 4.552 8.912 1.00 1.67 C ATOM 1239 O THR A 85 -17.387 3.380 8.853 1.00 2.28 O ATOM 1240 CB THR A 85 -19.279 5.138 10.768 1.00 3.20 C ATOM 1241 OG1 THR A 85 -18.839 3.960 11.428 1.00 3.80 O ATOM 1242 CG2 THR A 85 -20.748 5.399 11.109 1.00 3.87 C ATOM 0 H THR A 85 -20.489 3.335 9.515 1.00 1.68 H new ATOM 0 HA THR A 85 -19.375 5.908 8.772 1.00 1.97 H new ATOM 0 HB THR A 85 -18.675 5.984 11.097 1.00 3.20 H new ATOM 0 HG1 THR A 85 -18.933 4.074 12.397 1.00 3.80 H new ATOM 0 HG21 THR A 85 -20.855 5.525 12.186 1.00 3.87 H new ATOM 0 HG22 THR A 85 -21.084 6.304 10.603 1.00 3.87 H new ATOM 0 HG23 THR A 85 -21.353 4.554 10.781 1.00 3.87 H new ATOM 1250 N ASP A 86 -16.822 5.493 8.705 1.00 1.51 N ATOM 1251 CA ASP A 86 -15.422 5.107 8.388 1.00 1.98 C ATOM 1252 C ASP A 86 -14.490 6.323 8.430 1.00 1.78 C ATOM 1253 O ASP A 86 -13.805 6.594 7.464 1.00 2.48 O ATOM 1254 CB ASP A 86 -15.371 4.493 6.987 1.00 2.56 C ATOM 1255 CG ASP A 86 -13.956 3.985 6.702 1.00 3.06 C ATOM 1256 OD1 ASP A 86 -13.674 2.851 7.052 1.00 3.57 O ATOM 1257 OD2 ASP A 86 -13.179 4.738 6.138 1.00 3.50 O ATOM 0 H ASP A 86 -17.009 6.495 8.741 1.00 1.51 H new ATOM 0 HA ASP A 86 -15.090 4.386 9.135 1.00 1.98 H new ATOM 0 HB2 ASP A 86 -16.085 3.673 6.912 1.00 2.56 H new ATOM 0 HB3 ASP A 86 -15.659 5.235 6.243 1.00 2.56 H new ATOM 1262 N SER A 87 -14.470 7.085 9.511 1.00 1.11 N ATOM 1263 CA SER A 87 -13.587 8.296 9.577 1.00 0.93 C ATOM 1264 C SER A 87 -12.239 8.031 8.863 1.00 0.84 C ATOM 1265 O SER A 87 -11.774 6.915 8.864 1.00 0.97 O ATOM 1266 CB SER A 87 -13.332 8.640 11.053 1.00 0.88 C ATOM 1267 OG SER A 87 -14.338 9.539 11.501 1.00 1.63 O ATOM 0 H SER A 87 -15.029 6.915 10.347 1.00 1.11 H new ATOM 0 HA SER A 87 -14.081 9.128 9.075 1.00 0.93 H new ATOM 0 HB2 SER A 87 -13.342 7.733 11.658 1.00 0.88 H new ATOM 0 HB3 SER A 87 -12.346 9.090 11.169 1.00 0.88 H new ATOM 0 HG SER A 87 -14.182 9.761 12.443 1.00 1.63 H new ATOM 1273 N PRO A 88 -11.653 9.049 8.257 1.00 0.77 N ATOM 1274 CA PRO A 88 -10.370 8.886 7.533 1.00 0.83 C ATOM 1275 C PRO A 88 -9.193 8.542 8.470 1.00 0.73 C ATOM 1276 O PRO A 88 -8.599 7.488 8.361 1.00 0.72 O ATOM 1277 CB PRO A 88 -10.132 10.259 6.858 1.00 1.01 C ATOM 1278 CG PRO A 88 -11.139 11.258 7.486 1.00 1.07 C ATOM 1279 CD PRO A 88 -12.208 10.424 8.215 1.00 0.83 C ATOM 0 HA PRO A 88 -10.424 8.058 6.827 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -9.107 10.594 7.018 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -10.280 10.189 5.780 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -10.634 11.929 8.181 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -11.595 11.881 6.716 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -12.392 10.807 9.219 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -13.160 10.450 7.684 1.00 0.83 H new ATOM 1287 N ARG A 89 -8.809 9.441 9.336 1.00 0.75 N ATOM 1288 CA ARG A 89 -7.621 9.180 10.209 1.00 0.73 C ATOM 1289 C ARG A 89 -7.927 8.201 11.352 1.00 0.67 C ATOM 1290 O ARG A 89 -7.199 7.254 11.574 1.00 0.68 O ATOM 1291 CB ARG A 89 -7.138 10.505 10.797 1.00 0.79 C ATOM 1292 CG ARG A 89 -5.767 10.306 11.462 1.00 1.63 C ATOM 1293 CD ARG A 89 -5.250 11.643 12.054 1.00 1.65 C ATOM 1294 NE ARG A 89 -4.816 11.454 13.480 1.00 2.07 N ATOM 1295 CZ ARG A 89 -5.615 10.943 14.382 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -6.850 10.650 14.081 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -5.181 10.750 15.597 1.00 3.10 N ATOM 0 H ARG A 89 -9.263 10.343 9.479 1.00 0.75 H new ATOM 0 HA ARG A 89 -6.852 8.721 9.588 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -7.067 11.258 10.012 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -7.858 10.874 11.528 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -5.844 9.558 12.251 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -5.054 9.925 10.731 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -4.414 12.012 11.459 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -6.035 12.398 12.003 1.00 1.65 H new ATOM 0 HE ARG A 89 -3.873 11.731 13.753 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -7.199 10.819 13.137 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -7.467 10.252 14.789 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -4.222 10.997 15.841 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -5.801 10.352 16.303 1.00 3.10 H new ATOM 1311 N GLU A 90 -8.980 8.424 12.087 1.00 0.65 N ATOM 1312 CA GLU A 90 -9.304 7.504 13.221 1.00 0.65 C ATOM 1313 C GLU A 90 -9.372 6.060 12.713 1.00 0.64 C ATOM 1314 O GLU A 90 -9.110 5.134 13.456 1.00 0.67 O ATOM 1315 CB GLU A 90 -10.649 7.902 13.835 1.00 0.71 C ATOM 1316 CG GLU A 90 -10.563 9.331 14.376 1.00 1.32 C ATOM 1317 CD GLU A 90 -9.707 9.346 15.643 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -10.260 9.135 16.710 1.00 2.78 O ATOM 1319 OE2 GLU A 90 -8.513 9.569 15.526 1.00 2.46 O ATOM 0 H GLU A 90 -9.630 9.199 11.955 1.00 0.65 H new ATOM 0 HA GLU A 90 -8.525 7.578 13.980 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -11.437 7.833 13.085 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -10.912 7.213 14.638 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -10.130 9.990 13.624 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -11.562 9.709 14.595 1.00 1.32 H new ATOM 1326 N VAL A 91 -9.710 5.843 11.476 1.00 0.64 N ATOM 1327 CA VAL A 91 -9.785 4.437 10.959 1.00 0.67 C ATOM 1328 C VAL A 91 -8.477 4.072 10.261 1.00 0.66 C ATOM 1329 O VAL A 91 -7.976 2.974 10.404 1.00 0.67 O ATOM 1330 CB VAL A 91 -10.943 4.325 9.975 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -11.156 2.866 9.577 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -12.212 4.859 10.636 1.00 0.75 C ATOM 0 H VAL A 91 -9.938 6.569 10.797 1.00 0.64 H new ATOM 0 HA VAL A 91 -9.946 3.751 11.791 1.00 0.67 H new ATOM 0 HB VAL A 91 -10.713 4.906 9.082 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -11.986 2.798 8.874 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -10.251 2.481 9.108 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -11.384 2.276 10.465 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -13.046 4.782 9.938 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -12.431 4.273 11.529 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -12.066 5.903 10.914 1.00 0.75 H new ATOM 1342 N PHE A 92 -7.919 4.970 9.507 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.647 4.651 8.807 1.00 0.65 C ATOM 1344 C PHE A 92 -5.599 4.184 9.820 1.00 0.62 C ATOM 1345 O PHE A 92 -4.779 3.338 9.519 1.00 0.67 O ATOM 1346 CB PHE A 92 -6.134 5.898 8.079 1.00 0.65 C ATOM 1347 CG PHE A 92 -4.763 5.625 7.503 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -4.637 5.024 6.245 1.00 1.31 C ATOM 1349 CD2 PHE A 92 -3.618 5.972 8.230 1.00 1.44 C ATOM 1350 CE1 PHE A 92 -3.367 4.770 5.714 1.00 1.31 C ATOM 1351 CE2 PHE A 92 -2.347 5.718 7.699 1.00 1.47 C ATOM 1352 CZ PHE A 92 -2.222 5.117 6.441 1.00 0.73 C ATOM 0 H PHE A 92 -8.285 5.908 9.344 1.00 0.64 H new ATOM 0 HA PHE A 92 -6.827 3.856 8.084 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -6.825 6.176 7.283 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -6.088 6.740 8.769 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -5.520 4.756 5.684 1.00 1.31 H new ATOM 0 HD2 PHE A 92 -3.715 6.436 9.201 1.00 1.44 H new ATOM 0 HE1 PHE A 92 -3.270 4.306 4.743 1.00 1.31 H new ATOM 0 HE2 PHE A 92 -1.464 5.986 8.260 1.00 1.47 H new ATOM 0 HZ PHE A 92 -1.242 4.921 6.031 1.00 0.73 H new ATOM 1362 N PHE A 93 -5.595 4.734 11.015 1.00 0.58 N ATOM 1363 CA PHE A 93 -4.564 4.318 12.022 1.00 0.57 C ATOM 1364 C PHE A 93 -5.099 3.165 12.879 1.00 0.59 C ATOM 1365 O PHE A 93 -4.363 2.272 13.248 1.00 0.60 O ATOM 1366 CB PHE A 93 -4.204 5.514 12.907 1.00 0.57 C ATOM 1367 CG PHE A 93 -3.121 5.131 13.885 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -1.777 5.224 13.509 1.00 1.47 C ATOM 1369 CD2 PHE A 93 -3.460 4.694 15.172 1.00 1.15 C ATOM 1370 CE1 PHE A 93 -0.771 4.878 14.418 1.00 1.58 C ATOM 1371 CE2 PHE A 93 -2.454 4.347 16.081 1.00 1.07 C ATOM 1372 CZ PHE A 93 -1.108 4.440 15.704 1.00 0.70 C ATOM 0 H PHE A 93 -6.254 5.445 11.333 1.00 0.58 H new ATOM 0 HA PHE A 93 -3.669 3.976 11.502 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -3.868 6.346 12.288 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -5.087 5.855 13.447 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -1.516 5.563 12.517 1.00 1.47 H new ATOM 0 HD2 PHE A 93 -4.498 4.625 15.463 1.00 1.15 H new ATOM 0 HE1 PHE A 93 0.267 4.949 14.127 1.00 1.58 H new ATOM 0 HE2 PHE A 93 -2.715 4.008 17.072 1.00 1.07 H new ATOM 0 HZ PHE A 93 -0.331 4.174 16.405 1.00 0.70 H new ATOM 1382 N ARG A 94 -6.365 3.162 13.200 1.00 0.62 N ATOM 1383 CA ARG A 94 -6.902 2.045 14.030 1.00 0.67 C ATOM 1384 C ARG A 94 -6.901 0.759 13.201 1.00 0.66 C ATOM 1385 O ARG A 94 -6.454 -0.273 13.660 1.00 0.67 O ATOM 1386 CB ARG A 94 -8.328 2.376 14.501 1.00 0.72 C ATOM 1387 CG ARG A 94 -8.773 1.428 15.650 1.00 0.89 C ATOM 1388 CD ARG A 94 -9.641 0.281 15.111 1.00 1.00 C ATOM 1389 NE ARG A 94 -10.167 -0.512 16.257 1.00 1.95 N ATOM 1390 CZ ARG A 94 -11.173 -1.325 16.086 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -11.728 -1.441 14.911 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -11.627 -2.020 17.094 1.00 3.65 N ATOM 0 H ARG A 94 -7.043 3.874 12.928 1.00 0.62 H new ATOM 0 HA ARG A 94 -6.273 1.908 14.909 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -8.371 3.410 14.842 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -9.020 2.288 13.664 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -7.895 1.020 16.151 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -9.332 1.992 16.396 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -10.465 0.679 14.519 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -9.054 -0.357 14.450 1.00 1.00 H new ATOM 0 HE ARG A 94 -9.739 -0.419 17.178 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -11.375 -0.896 14.124 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -12.514 -2.077 14.779 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -11.195 -1.927 18.013 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -12.413 -2.656 16.962 1.00 3.65 H new ATOM 1406 N VAL A 95 -7.382 0.794 11.987 1.00 0.65 N ATOM 1407 CA VAL A 95 -7.381 -0.440 11.154 1.00 0.66 C ATOM 1408 C VAL A 95 -5.941 -0.818 10.796 1.00 0.66 C ATOM 1409 O VAL A 95 -5.567 -1.973 10.831 1.00 0.67 O ATOM 1410 CB VAL A 95 -8.170 -0.163 9.865 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -7.974 -1.309 8.865 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -9.656 -0.050 10.209 1.00 1.08 C ATOM 0 H VAL A 95 -7.774 1.622 11.538 1.00 0.65 H new ATOM 0 HA VAL A 95 -7.840 -1.260 11.706 1.00 0.66 H new ATOM 0 HB VAL A 95 -7.811 0.764 9.418 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -8.539 -1.100 7.956 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -6.916 -1.402 8.621 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -8.328 -2.241 9.306 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -10.226 0.147 9.301 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -9.998 -0.983 10.657 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -9.805 0.767 10.915 1.00 1.08 H new ATOM 1422 N ALA A 96 -5.137 0.143 10.421 1.00 0.65 N ATOM 1423 CA ALA A 96 -3.739 -0.183 10.031 1.00 0.68 C ATOM 1424 C ALA A 96 -3.056 -0.948 11.162 1.00 0.70 C ATOM 1425 O ALA A 96 -2.176 -1.756 10.946 1.00 0.76 O ATOM 1426 CB ALA A 96 -2.975 1.107 9.725 1.00 0.69 C ATOM 0 H ALA A 96 -5.388 1.130 10.369 1.00 0.65 H new ATOM 0 HA ALA A 96 -3.747 -0.807 9.138 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -1.951 0.865 9.440 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -3.465 1.634 8.906 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -2.964 1.742 10.611 1.00 0.69 H new ATOM 1432 N ALA A 97 -3.465 -0.689 12.376 1.00 0.74 N ATOM 1433 CA ALA A 97 -2.859 -1.385 13.544 1.00 0.78 C ATOM 1434 C ALA A 97 -3.491 -2.768 13.695 1.00 0.79 C ATOM 1435 O ALA A 97 -2.882 -3.688 14.204 1.00 0.83 O ATOM 1436 CB ALA A 97 -3.123 -0.569 14.812 1.00 0.77 C ATOM 0 H ALA A 97 -4.199 -0.020 12.608 1.00 0.74 H new ATOM 0 HA ALA A 97 -1.785 -1.488 13.390 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -2.681 -1.076 15.670 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -2.679 0.421 14.707 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -4.198 -0.470 14.964 1.00 0.77 H new ATOM 1442 N ASP A 98 -4.709 -2.923 13.255 1.00 0.78 N ATOM 1443 CA ASP A 98 -5.378 -4.248 13.371 1.00 0.82 C ATOM 1444 C ASP A 98 -4.725 -5.235 12.401 1.00 0.83 C ATOM 1445 O ASP A 98 -4.424 -6.357 12.756 1.00 0.88 O ATOM 1446 CB ASP A 98 -6.866 -4.103 13.039 1.00 0.82 C ATOM 1447 CG ASP A 98 -7.550 -3.254 14.113 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -6.864 -2.466 14.743 1.00 2.13 O ATOM 1449 OD2 ASP A 98 -8.748 -3.406 14.286 1.00 2.19 O ATOM 0 H ASP A 98 -5.269 -2.190 12.821 1.00 0.78 H new ATOM 0 HA ASP A 98 -5.273 -4.621 14.390 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -6.987 -3.637 12.061 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -7.334 -5.086 12.985 1.00 0.82 H new ATOM 1454 N MET A 99 -4.531 -4.841 11.171 1.00 0.81 N ATOM 1455 CA MET A 99 -3.927 -5.776 10.179 1.00 0.85 C ATOM 1456 C MET A 99 -2.609 -6.333 10.737 1.00 0.97 C ATOM 1457 O MET A 99 -2.255 -7.474 10.516 1.00 1.14 O ATOM 1458 CB MET A 99 -3.681 -5.010 8.861 1.00 0.79 C ATOM 1459 CG MET A 99 -3.962 -5.909 7.653 1.00 0.81 C ATOM 1460 SD MET A 99 -3.503 -5.039 6.131 1.00 0.97 S ATOM 1461 CE MET A 99 -4.930 -3.925 6.038 1.00 0.48 C ATOM 0 H MET A 99 -4.764 -3.915 10.811 1.00 0.81 H new ATOM 0 HA MET A 99 -4.600 -6.612 9.987 1.00 0.85 H new ATOM 0 HB2 MET A 99 -4.321 -4.129 8.822 1.00 0.79 H new ATOM 0 HB3 MET A 99 -2.650 -4.657 8.826 1.00 0.79 H new ATOM 0 HG2 MET A 99 -3.397 -6.837 7.738 1.00 0.81 H new ATOM 0 HG3 MET A 99 -5.018 -6.180 7.625 1.00 0.81 H new ATOM 0 HE1 MET A 99 -4.996 -3.501 5.036 1.00 0.48 H new ATOM 0 HE2 MET A 99 -5.841 -4.482 6.256 1.00 0.48 H new ATOM 0 HE3 MET A 99 -4.813 -3.122 6.765 1.00 0.48 H new ATOM 1471 N PHE A 100 -1.896 -5.527 11.472 1.00 0.98 N ATOM 1472 CA PHE A 100 -0.608 -5.973 12.076 1.00 1.14 C ATOM 1473 C PHE A 100 -0.892 -6.886 13.270 1.00 1.28 C ATOM 1474 O PHE A 100 -0.292 -7.931 13.409 1.00 1.67 O ATOM 1475 CB PHE A 100 0.155 -4.731 12.572 1.00 1.19 C ATOM 1476 CG PHE A 100 0.883 -4.082 11.411 1.00 1.15 C ATOM 1477 CD1 PHE A 100 0.154 -3.574 10.329 1.00 1.67 C ATOM 1478 CD2 PHE A 100 2.283 -3.992 11.414 1.00 1.64 C ATOM 1479 CE1 PHE A 100 0.820 -2.976 9.253 1.00 1.79 C ATOM 1480 CE2 PHE A 100 2.948 -3.395 10.337 1.00 1.69 C ATOM 1481 CZ PHE A 100 2.217 -2.887 9.257 1.00 1.38 C ATOM 0 H PHE A 100 -2.154 -4.563 11.683 1.00 0.98 H new ATOM 0 HA PHE A 100 -0.019 -6.514 11.335 1.00 1.14 H new ATOM 0 HB2 PHE A 100 -0.539 -4.021 13.021 1.00 1.19 H new ATOM 0 HB3 PHE A 100 0.867 -5.015 13.347 1.00 1.19 H new ATOM 0 HD1 PHE A 100 -0.924 -3.644 10.325 1.00 1.67 H new ATOM 0 HD2 PHE A 100 2.848 -4.383 12.247 1.00 1.64 H new ATOM 0 HE1 PHE A 100 0.256 -2.583 8.420 1.00 1.79 H new ATOM 0 HE2 PHE A 100 4.026 -3.326 10.339 1.00 1.69 H new ATOM 0 HZ PHE A 100 2.731 -2.426 8.426 1.00 1.38 H new ATOM 1491 N SER A 101 -1.838 -6.516 14.092 1.00 1.34 N ATOM 1492 CA SER A 101 -2.214 -7.358 15.276 1.00 1.52 C ATOM 1493 C SER A 101 -0.990 -7.673 16.167 1.00 1.61 C ATOM 1494 O SER A 101 -1.125 -7.876 17.357 1.00 1.99 O ATOM 1495 CB SER A 101 -2.827 -8.669 14.784 1.00 1.79 C ATOM 1496 OG SER A 101 -3.532 -9.288 15.851 1.00 2.21 O ATOM 0 H SER A 101 -2.376 -5.655 13.995 1.00 1.34 H new ATOM 0 HA SER A 101 -2.932 -6.798 15.875 1.00 1.52 H new ATOM 0 HB2 SER A 101 -3.502 -8.478 13.950 1.00 1.79 H new ATOM 0 HB3 SER A 101 -2.045 -9.333 14.416 1.00 1.79 H new ATOM 0 HG SER A 101 -3.927 -10.128 15.538 1.00 2.21 H new ATOM 1502 N ASP A 102 0.193 -7.739 15.602 1.00 1.99 N ATOM 1503 CA ASP A 102 1.420 -8.066 16.390 1.00 2.34 C ATOM 1504 C ASP A 102 2.469 -6.969 16.198 1.00 2.07 C ATOM 1505 O ASP A 102 3.540 -7.021 16.769 1.00 2.62 O ATOM 1506 CB ASP A 102 1.995 -9.388 15.872 1.00 3.15 C ATOM 1507 CG ASP A 102 2.201 -9.300 14.358 1.00 3.78 C ATOM 1508 OD1 ASP A 102 2.061 -8.213 13.823 1.00 4.10 O ATOM 1509 OD2 ASP A 102 2.496 -10.322 13.760 1.00 4.42 O ATOM 0 H ASP A 102 0.360 -7.577 14.609 1.00 1.99 H new ATOM 0 HA ASP A 102 1.164 -8.144 17.447 1.00 2.34 H new ATOM 0 HB2 ASP A 102 2.943 -9.603 16.366 1.00 3.15 H new ATOM 0 HB3 ASP A 102 1.318 -10.209 16.110 1.00 3.15 H new ATOM 1514 N GLY A 103 2.178 -5.975 15.403 1.00 2.05 N ATOM 1515 CA GLY A 103 3.170 -4.884 15.188 1.00 2.45 C ATOM 1516 C GLY A 103 4.352 -5.417 14.373 1.00 2.44 C ATOM 1517 O GLY A 103 5.279 -4.695 14.064 1.00 3.08 O ATOM 0 H GLY A 103 1.300 -5.872 14.895 1.00 2.05 H new ATOM 0 HA2 GLY A 103 2.701 -4.050 14.665 1.00 2.45 H new ATOM 0 HA3 GLY A 103 3.519 -4.502 16.147 1.00 2.45 H new ATOM 1521 N ASN A 104 4.331 -6.675 14.028 1.00 2.29 N ATOM 1522 CA ASN A 104 5.458 -7.252 13.239 1.00 2.55 C ATOM 1523 C ASN A 104 5.558 -6.545 11.886 1.00 2.17 C ATOM 1524 O ASN A 104 4.921 -5.536 11.655 1.00 2.54 O ATOM 1525 CB ASN A 104 5.214 -8.746 13.020 1.00 3.20 C ATOM 1526 CG ASN A 104 5.308 -9.480 14.359 1.00 3.72 C ATOM 1527 OD1 ASN A 104 5.169 -8.878 15.405 1.00 4.05 O ATOM 1528 ND2 ASN A 104 5.539 -10.764 14.371 1.00 4.31 N ATOM 0 H ASN A 104 3.583 -7.329 14.258 1.00 2.29 H new ATOM 0 HA ASN A 104 6.390 -7.112 13.786 1.00 2.55 H new ATOM 0 HB2 ASN A 104 4.231 -8.903 12.575 1.00 3.20 H new ATOM 0 HB3 ASN A 104 5.948 -9.147 12.321 1.00 3.20 H new ATOM 0 HD21 ASN A 104 5.603 -11.262 15.259 1.00 4.31 H new ATOM 0 HD22 ASN A 104 5.656 -11.269 13.493 1.00 4.31 H new ATOM 1535 N PHE A 105 6.361 -7.070 10.991 1.00 1.90 N ATOM 1536 CA PHE A 105 6.526 -6.442 9.640 1.00 1.74 C ATOM 1537 C PHE A 105 6.276 -7.495 8.555 1.00 1.59 C ATOM 1538 O PHE A 105 6.555 -8.664 8.734 1.00 1.88 O ATOM 1539 CB PHE A 105 7.950 -5.897 9.512 1.00 2.03 C ATOM 1540 CG PHE A 105 8.239 -4.983 10.680 1.00 1.75 C ATOM 1541 CD1 PHE A 105 8.723 -5.514 11.882 1.00 2.28 C ATOM 1542 CD2 PHE A 105 8.019 -3.605 10.564 1.00 2.14 C ATOM 1543 CE1 PHE A 105 8.987 -4.669 12.966 1.00 2.84 C ATOM 1544 CE2 PHE A 105 8.282 -2.759 11.648 1.00 2.60 C ATOM 1545 CZ PHE A 105 8.766 -3.291 12.850 1.00 2.84 C ATOM 0 H PHE A 105 6.914 -7.914 11.140 1.00 1.90 H new ATOM 0 HA PHE A 105 5.812 -5.627 9.521 1.00 1.74 H new ATOM 0 HB2 PHE A 105 8.666 -6.718 9.492 1.00 2.03 H new ATOM 0 HB3 PHE A 105 8.061 -5.354 8.574 1.00 2.03 H new ATOM 0 HD1 PHE A 105 8.893 -6.577 11.973 1.00 2.28 H new ATOM 0 HD2 PHE A 105 7.646 -3.194 9.637 1.00 2.14 H new ATOM 0 HE1 PHE A 105 9.361 -5.080 13.892 1.00 2.84 H new ATOM 0 HE2 PHE A 105 8.112 -1.696 11.557 1.00 2.60 H new ATOM 0 HZ PHE A 105 8.969 -2.639 13.687 1.00 2.84 H new ATOM 1555 N ASN A 106 5.741 -7.087 7.435 1.00 1.85 N ATOM 1556 CA ASN A 106 5.450 -8.047 6.330 1.00 1.93 C ATOM 1557 C ASN A 106 5.484 -7.283 4.998 1.00 1.72 C ATOM 1558 O ASN A 106 5.040 -6.156 4.900 1.00 2.31 O ATOM 1559 CB ASN A 106 4.050 -8.669 6.553 1.00 2.62 C ATOM 1560 CG ASN A 106 4.183 -10.099 7.095 1.00 3.11 C ATOM 1561 OD1 ASN A 106 3.688 -11.035 6.499 1.00 3.46 O ATOM 1562 ND2 ASN A 106 4.838 -10.306 8.204 1.00 3.79 N ATOM 0 H ASN A 106 5.490 -6.118 7.237 1.00 1.85 H new ATOM 0 HA ASN A 106 6.192 -8.845 6.311 1.00 1.93 H new ATOM 0 HB2 ASN A 106 3.481 -8.059 7.254 1.00 2.62 H new ATOM 0 HB3 ASN A 106 3.495 -8.678 5.615 1.00 2.62 H new ATOM 0 HD21 ASN A 106 4.934 -11.253 8.570 1.00 3.79 H new ATOM 0 HD22 ASN A 106 5.254 -9.521 8.705 1.00 3.79 H new ATOM 1569 N TRP A 107 6.027 -7.895 3.980 1.00 1.54 N ATOM 1570 CA TRP A 107 6.120 -7.220 2.653 1.00 1.68 C ATOM 1571 C TRP A 107 4.779 -7.295 1.917 1.00 1.47 C ATOM 1572 O TRP A 107 4.365 -6.364 1.255 1.00 1.49 O ATOM 1573 CB TRP A 107 7.202 -7.907 1.813 1.00 2.30 C ATOM 1574 CG TRP A 107 8.358 -8.262 2.689 1.00 2.32 C ATOM 1575 CD1 TRP A 107 8.772 -9.521 2.957 1.00 2.69 C ATOM 1576 CD2 TRP A 107 9.253 -7.372 3.416 1.00 2.77 C ATOM 1577 NE1 TRP A 107 9.865 -9.461 3.803 1.00 3.12 N ATOM 1578 CE2 TRP A 107 10.200 -8.158 4.114 1.00 3.35 C ATOM 1579 CE3 TRP A 107 9.335 -5.974 3.535 1.00 3.24 C ATOM 1580 CZ2 TRP A 107 11.192 -7.577 4.903 1.00 4.31 C ATOM 1581 CZ3 TRP A 107 10.332 -5.385 4.328 1.00 4.29 C ATOM 1582 CH2 TRP A 107 11.259 -6.185 5.011 1.00 4.80 C ATOM 0 H TRP A 107 6.412 -8.839 4.011 1.00 1.54 H new ATOM 0 HA TRP A 107 6.376 -6.172 2.807 1.00 1.68 H new ATOM 0 HB2 TRP A 107 6.799 -8.804 1.343 1.00 2.30 H new ATOM 0 HB3 TRP A 107 7.529 -7.246 1.010 1.00 2.30 H new ATOM 0 HD1 TRP A 107 8.323 -10.425 2.573 1.00 2.69 H new ATOM 0 HE1 TRP A 107 10.363 -10.279 4.154 1.00 3.12 H new ATOM 0 HE3 TRP A 107 8.626 -5.349 3.013 1.00 3.24 H new ATOM 0 HZ2 TRP A 107 11.903 -8.198 5.427 1.00 4.31 H new ATOM 0 HZ3 TRP A 107 10.385 -4.310 4.413 1.00 4.29 H new ATOM 0 HH2 TRP A 107 12.024 -5.726 5.620 1.00 4.80 H new ATOM 1593 N GLY A 108 4.113 -8.412 2.010 1.00 1.41 N ATOM 1594 CA GLY A 108 2.814 -8.573 1.298 1.00 1.47 C ATOM 1595 C GLY A 108 1.675 -7.941 2.100 1.00 1.05 C ATOM 1596 O GLY A 108 0.692 -7.477 1.541 1.00 1.02 O ATOM 0 H GLY A 108 4.413 -9.223 2.550 1.00 1.41 H new ATOM 0 HA2 GLY A 108 2.873 -8.109 0.314 1.00 1.47 H new ATOM 0 HA3 GLY A 108 2.610 -9.632 1.139 1.00 1.47 H new ATOM 1600 N ARG A 109 1.763 -7.938 3.403 1.00 0.86 N ATOM 1601 CA ARG A 109 0.638 -7.362 4.183 1.00 0.87 C ATOM 1602 C ARG A 109 0.489 -5.900 3.781 1.00 0.70 C ATOM 1603 O ARG A 109 -0.588 -5.335 3.786 1.00 0.81 O ATOM 1604 CB ARG A 109 0.942 -7.484 5.679 1.00 1.08 C ATOM 1605 CG ARG A 109 -0.236 -6.957 6.500 1.00 1.48 C ATOM 1606 CD ARG A 109 0.011 -7.252 7.982 1.00 1.96 C ATOM 1607 NE ARG A 109 0.073 -8.727 8.191 1.00 2.74 N ATOM 1608 CZ ARG A 109 0.572 -9.212 9.296 1.00 3.19 C ATOM 1609 NH1 ARG A 109 1.026 -8.407 10.217 1.00 3.19 N ATOM 1610 NH2 ARG A 109 0.619 -10.503 9.477 1.00 4.08 N ATOM 0 H ARG A 109 2.546 -8.300 3.947 1.00 0.86 H new ATOM 0 HA ARG A 109 -0.291 -7.895 3.980 1.00 0.87 H new ATOM 0 HB2 ARG A 109 1.136 -8.526 5.935 1.00 1.08 H new ATOM 0 HB3 ARG A 109 1.844 -6.923 5.922 1.00 1.08 H new ATOM 0 HG2 ARG A 109 -0.352 -5.884 6.345 1.00 1.48 H new ATOM 0 HG3 ARG A 109 -1.163 -7.428 6.173 1.00 1.48 H new ATOM 0 HD2 ARG A 109 0.943 -6.788 8.306 1.00 1.96 H new ATOM 0 HD3 ARG A 109 -0.786 -6.821 8.587 1.00 1.96 H new ATOM 0 HE ARG A 109 -0.275 -9.358 7.469 1.00 2.74 H new ATOM 0 HH11 ARG A 109 0.991 -7.398 10.074 1.00 3.19 H new ATOM 0 HH12 ARG A 109 1.416 -8.787 11.080 1.00 3.19 H new ATOM 0 HH21 ARG A 109 0.266 -11.132 8.756 1.00 4.08 H new ATOM 0 HH22 ARG A 109 1.009 -10.883 10.340 1.00 4.08 H new ATOM 1624 N VAL A 110 1.594 -5.289 3.435 1.00 0.60 N ATOM 1625 CA VAL A 110 1.579 -3.862 3.026 1.00 0.68 C ATOM 1626 C VAL A 110 0.763 -3.714 1.746 1.00 0.56 C ATOM 1627 O VAL A 110 0.084 -2.726 1.553 1.00 0.60 O ATOM 1628 CB VAL A 110 3.016 -3.384 2.782 1.00 0.88 C ATOM 1629 CG1 VAL A 110 3.004 -1.969 2.197 1.00 1.27 C ATOM 1630 CG2 VAL A 110 3.780 -3.376 4.108 1.00 1.73 C ATOM 0 H VAL A 110 2.514 -5.728 3.420 1.00 0.60 H new ATOM 0 HA VAL A 110 1.129 -3.259 3.815 1.00 0.68 H new ATOM 0 HB VAL A 110 3.503 -4.059 2.079 1.00 0.88 H new ATOM 0 HG11 VAL A 110 4.028 -1.637 2.027 1.00 1.27 H new ATOM 0 HG12 VAL A 110 2.461 -1.971 1.252 1.00 1.27 H new ATOM 0 HG13 VAL A 110 2.514 -1.291 2.896 1.00 1.27 H new ATOM 0 HG21 VAL A 110 4.802 -3.037 3.937 1.00 1.73 H new ATOM 0 HG22 VAL A 110 3.286 -2.702 4.808 1.00 1.73 H new ATOM 0 HG23 VAL A 110 3.797 -4.383 4.524 1.00 1.73 H new ATOM 1640 N VAL A 111 0.809 -4.677 0.858 1.00 0.51 N ATOM 1641 CA VAL A 111 0.014 -4.536 -0.389 1.00 0.50 C ATOM 1642 C VAL A 111 -1.442 -4.307 0.013 1.00 0.46 C ATOM 1643 O VAL A 111 -2.121 -3.449 -0.513 1.00 0.47 O ATOM 1644 CB VAL A 111 0.150 -5.805 -1.236 1.00 0.58 C ATOM 1645 CG1 VAL A 111 -0.639 -5.648 -2.536 1.00 1.41 C ATOM 1646 CG2 VAL A 111 1.627 -6.041 -1.562 1.00 1.36 C ATOM 0 H VAL A 111 1.352 -5.536 0.944 1.00 0.51 H new ATOM 0 HA VAL A 111 0.371 -3.697 -0.985 1.00 0.50 H new ATOM 0 HB VAL A 111 -0.244 -6.655 -0.678 1.00 0.58 H new ATOM 0 HG11 VAL A 111 -0.539 -6.554 -3.134 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -1.691 -5.480 -2.305 1.00 1.41 H new ATOM 0 HG13 VAL A 111 -0.251 -4.798 -3.097 1.00 1.41 H new ATOM 0 HG21 VAL A 111 1.727 -6.944 -2.165 1.00 1.36 H new ATOM 0 HG22 VAL A 111 2.018 -5.189 -2.118 1.00 1.36 H new ATOM 0 HG23 VAL A 111 2.190 -6.159 -0.636 1.00 1.36 H new ATOM 1656 N ALA A 112 -1.914 -5.057 0.974 1.00 0.45 N ATOM 1657 CA ALA A 112 -3.317 -4.863 1.448 1.00 0.47 C ATOM 1658 C ALA A 112 -3.462 -3.430 1.984 1.00 0.46 C ATOM 1659 O ALA A 112 -4.401 -2.734 1.651 1.00 0.54 O ATOM 1660 CB ALA A 112 -3.651 -5.877 2.544 1.00 0.53 C ATOM 0 H ALA A 112 -1.392 -5.793 1.450 1.00 0.45 H new ATOM 0 HA ALA A 112 -4.010 -5.018 0.621 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -4.676 -5.724 2.881 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -3.545 -6.887 2.149 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -2.970 -5.742 3.384 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.532 -2.963 2.766 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.614 -1.556 3.263 1.00 0.43 C ATOM 1668 C LEU A 113 -2.812 -0.609 2.075 1.00 0.42 C ATOM 1669 O LEU A 113 -3.724 0.192 2.042 1.00 0.45 O ATOM 1670 CB LEU A 113 -1.290 -1.194 3.954 1.00 0.44 C ATOM 1671 CG LEU A 113 -1.392 0.201 4.605 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -2.503 0.231 5.679 1.00 1.45 C ATOM 1673 CD2 LEU A 113 -0.047 0.546 5.254 1.00 1.27 C ATOM 0 H LEU A 113 -1.719 -3.490 3.084 1.00 0.43 H new ATOM 0 HA LEU A 113 -3.447 -1.463 3.960 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -1.051 -1.940 4.712 1.00 0.44 H new ATOM 0 HB3 LEU A 113 -0.477 -1.206 3.228 1.00 0.44 H new ATOM 0 HG LEU A 113 -1.641 0.931 3.835 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -2.554 1.226 6.122 1.00 1.45 H new ATOM 0 HD12 LEU A 113 -3.461 -0.010 5.218 1.00 1.45 H new ATOM 0 HD13 LEU A 113 -2.279 -0.501 6.455 1.00 1.45 H new ATOM 0 HD21 LEU A 113 -0.108 1.531 5.717 1.00 1.27 H new ATOM 0 HD22 LEU A 113 0.192 -0.198 6.014 1.00 1.27 H new ATOM 0 HD23 LEU A 113 0.733 0.551 4.493 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.957 -0.712 1.098 1.00 0.40 N ATOM 1686 CA PHE A 114 -2.051 0.152 -0.116 1.00 0.40 C ATOM 1687 C PHE A 114 -3.470 0.123 -0.690 1.00 0.39 C ATOM 1688 O PHE A 114 -3.998 1.128 -1.123 1.00 0.41 O ATOM 1689 CB PHE A 114 -1.070 -0.382 -1.168 1.00 0.41 C ATOM 1690 CG PHE A 114 0.381 -0.077 -0.791 1.00 0.44 C ATOM 1691 CD1 PHE A 114 0.757 0.320 0.516 1.00 1.27 C ATOM 1692 CD2 PHE A 114 1.371 -0.206 -1.776 1.00 1.29 C ATOM 1693 CE1 PHE A 114 2.099 0.578 0.811 1.00 1.27 C ATOM 1694 CE2 PHE A 114 2.712 0.055 -1.471 1.00 1.38 C ATOM 1695 CZ PHE A 114 3.075 0.446 -0.179 1.00 0.68 C ATOM 0 H PHE A 114 -1.180 -1.372 1.087 1.00 0.40 H new ATOM 0 HA PHE A 114 -1.807 1.180 0.153 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -1.200 -1.459 -1.274 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -1.296 0.064 -2.137 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.006 0.423 1.285 1.00 1.27 H new ATOM 0 HD2 PHE A 114 1.097 -0.509 -2.776 1.00 1.29 H new ATOM 0 HE1 PHE A 114 2.382 0.881 1.808 1.00 1.27 H new ATOM 0 HE2 PHE A 114 3.468 -0.046 -2.236 1.00 1.38 H new ATOM 0 HZ PHE A 114 4.111 0.646 0.054 1.00 0.68 H new ATOM 1705 N TYR A 115 -4.086 -1.027 -0.706 1.00 0.40 N ATOM 1706 CA TYR A 115 -5.464 -1.130 -1.264 1.00 0.41 C ATOM 1707 C TYR A 115 -6.473 -0.475 -0.319 1.00 0.41 C ATOM 1708 O TYR A 115 -7.381 0.207 -0.749 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.835 -2.603 -1.459 1.00 0.44 C ATOM 1710 CG TYR A 115 -7.189 -2.699 -2.124 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -7.286 -2.664 -3.520 1.00 1.28 C ATOM 1712 CD2 TYR A 115 -8.346 -2.822 -1.345 1.00 1.24 C ATOM 1713 CE1 TYR A 115 -8.539 -2.752 -4.138 1.00 1.32 C ATOM 1714 CE2 TYR A 115 -9.600 -2.910 -1.963 1.00 1.26 C ATOM 1715 CZ TYR A 115 -9.696 -2.875 -3.359 1.00 0.61 C ATOM 1716 OH TYR A 115 -10.931 -2.961 -3.969 1.00 0.70 O ATOM 0 H TYR A 115 -3.694 -1.901 -0.356 1.00 0.40 H new ATOM 0 HA TYR A 115 -5.489 -0.614 -2.224 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -5.082 -3.101 -2.070 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.854 -3.115 -0.497 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -6.394 -2.569 -4.121 1.00 1.28 H new ATOM 0 HD2 TYR A 115 -8.272 -2.849 -0.268 1.00 1.24 H new ATOM 0 HE1 TYR A 115 -8.613 -2.725 -5.215 1.00 1.32 H new ATOM 0 HE2 TYR A 115 -10.493 -3.005 -1.362 1.00 1.26 H new ATOM 0 HH TYR A 115 -11.628 -3.043 -3.285 1.00 0.70 H new ATOM 1726 N PHE A 116 -6.327 -0.669 0.961 1.00 0.38 N ATOM 1727 CA PHE A 116 -7.294 -0.040 1.902 1.00 0.38 C ATOM 1728 C PHE A 116 -7.281 1.475 1.679 1.00 0.36 C ATOM 1729 O PHE A 116 -8.307 2.125 1.650 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.891 -0.347 3.349 1.00 0.40 C ATOM 1731 CG PHE A 116 -7.925 0.225 4.300 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -9.176 -0.397 4.444 1.00 1.17 C ATOM 1733 CD2 PHE A 116 -7.633 1.379 5.041 1.00 1.35 C ATOM 1734 CE1 PHE A 116 -10.126 0.135 5.324 1.00 1.18 C ATOM 1735 CE2 PHE A 116 -8.586 1.909 5.921 1.00 1.37 C ATOM 1736 CZ PHE A 116 -9.831 1.287 6.062 1.00 0.45 C ATOM 0 H PHE A 116 -5.591 -1.228 1.392 1.00 0.38 H new ATOM 0 HA PHE A 116 -8.293 -0.438 1.722 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.807 -1.424 3.493 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.911 0.080 3.562 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -9.405 -1.286 3.876 1.00 1.17 H new ATOM 0 HD2 PHE A 116 -6.672 1.860 4.933 1.00 1.35 H new ATOM 0 HE1 PHE A 116 -11.088 -0.344 5.434 1.00 1.18 H new ATOM 0 HE2 PHE A 116 -8.359 2.798 6.491 1.00 1.37 H new ATOM 0 HZ PHE A 116 -10.565 1.696 6.741 1.00 0.45 H new ATOM 1746 N ALA A 117 -6.120 2.051 1.521 1.00 0.35 N ATOM 1747 CA ALA A 117 -6.053 3.514 1.301 1.00 0.34 C ATOM 1748 C ALA A 117 -6.590 3.851 -0.095 1.00 0.34 C ATOM 1749 O ALA A 117 -7.150 4.904 -0.313 1.00 0.34 O ATOM 1750 CB ALA A 117 -4.606 3.994 1.424 1.00 0.37 C ATOM 0 H ALA A 117 -5.221 1.569 1.535 1.00 0.35 H new ATOM 0 HA ALA A 117 -6.661 4.016 2.054 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -4.565 5.071 1.261 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -4.230 3.763 2.421 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.991 3.490 0.678 1.00 0.37 H new ATOM 1756 N SER A 118 -6.422 2.968 -1.048 1.00 0.35 N ATOM 1757 CA SER A 118 -6.913 3.245 -2.430 1.00 0.37 C ATOM 1758 C SER A 118 -8.406 3.591 -2.432 1.00 0.36 C ATOM 1759 O SER A 118 -8.827 4.554 -3.039 1.00 0.36 O ATOM 1760 CB SER A 118 -6.690 2.006 -3.299 1.00 0.42 C ATOM 1761 OG SER A 118 -5.334 1.595 -3.197 1.00 1.25 O ATOM 0 H SER A 118 -5.964 2.065 -0.926 1.00 0.35 H new ATOM 0 HA SER A 118 -6.360 4.097 -2.825 1.00 0.37 H new ATOM 0 HB2 SER A 118 -7.351 1.200 -2.979 1.00 0.42 H new ATOM 0 HB3 SER A 118 -6.937 2.227 -4.337 1.00 0.42 H new ATOM 0 HG SER A 118 -5.129 1.371 -2.265 1.00 1.25 H new ATOM 1767 N LYS A 119 -9.206 2.841 -1.723 1.00 0.37 N ATOM 1768 CA LYS A 119 -10.660 3.166 -1.668 1.00 0.39 C ATOM 1769 C LYS A 119 -10.823 4.521 -0.975 1.00 0.36 C ATOM 1770 O LYS A 119 -11.622 5.331 -1.388 1.00 0.38 O ATOM 1771 CB LYS A 119 -11.428 2.074 -0.909 1.00 0.46 C ATOM 1772 CG LYS A 119 -10.674 1.706 0.367 1.00 1.29 C ATOM 1773 CD LYS A 119 -11.552 0.820 1.257 1.00 1.84 C ATOM 1774 CE LYS A 119 -11.807 -0.527 0.575 1.00 2.48 C ATOM 1775 NZ LYS A 119 -12.257 -1.518 1.594 1.00 3.36 N ATOM 0 H LYS A 119 -8.919 2.024 -1.184 1.00 0.37 H new ATOM 0 HA LYS A 119 -11.069 3.215 -2.677 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -12.430 2.425 -0.662 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -11.546 1.193 -1.540 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -9.751 1.183 0.116 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -10.391 2.610 0.906 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -11.065 0.662 2.219 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -12.500 1.319 1.458 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -12.564 -0.417 -0.201 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -10.898 -0.878 0.086 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -12.576 -2.386 1.117 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -11.467 -1.744 2.231 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -13.042 -1.117 2.145 1.00 3.36 H new ATOM 1789 N LEU A 120 -10.048 4.802 0.037 1.00 0.36 N ATOM 1790 CA LEU A 120 -10.150 6.142 0.699 1.00 0.35 C ATOM 1791 C LEU A 120 -9.851 7.230 -0.347 1.00 0.33 C ATOM 1792 O LEU A 120 -10.554 8.214 -0.460 1.00 0.39 O ATOM 1793 CB LEU A 120 -9.113 6.208 1.845 1.00 0.36 C ATOM 1794 CG LEU A 120 -9.810 6.154 3.216 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -10.459 4.781 3.424 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -8.772 6.384 4.315 1.00 1.28 C ATOM 0 H LEU A 120 -9.353 4.170 0.434 1.00 0.36 H new ATOM 0 HA LEU A 120 -11.149 6.297 1.107 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -8.412 5.378 1.755 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -8.532 7.127 1.763 1.00 0.36 H new ATOM 0 HG LEU A 120 -10.579 6.925 3.256 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -10.949 4.754 4.397 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -11.197 4.605 2.641 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -9.693 4.006 3.382 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -9.259 6.347 5.289 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -8.008 5.609 4.262 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -8.308 7.361 4.178 1.00 1.28 H new ATOM 1808 N VAL A 121 -8.828 7.026 -1.131 1.00 0.33 N ATOM 1809 CA VAL A 121 -8.472 7.996 -2.207 1.00 0.39 C ATOM 1810 C VAL A 121 -9.550 7.973 -3.292 1.00 0.36 C ATOM 1811 O VAL A 121 -10.242 8.947 -3.511 1.00 0.39 O ATOM 1812 CB VAL A 121 -7.122 7.608 -2.817 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -6.742 8.629 -3.892 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -6.049 7.610 -1.722 1.00 1.18 C ATOM 0 H VAL A 121 -8.213 6.214 -1.071 1.00 0.33 H new ATOM 0 HA VAL A 121 -8.405 8.999 -1.785 1.00 0.39 H new ATOM 0 HB VAL A 121 -7.194 6.614 -3.259 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -5.781 8.357 -4.329 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -7.505 8.639 -4.670 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -6.669 9.620 -3.443 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -5.087 7.334 -2.154 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -5.978 8.606 -1.284 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -6.318 6.892 -0.948 1.00 1.18 H new ATOM 1824 N LEU A 122 -9.699 6.872 -3.975 1.00 0.37 N ATOM 1825 CA LEU A 122 -10.736 6.794 -5.045 1.00 0.39 C ATOM 1826 C LEU A 122 -12.076 7.320 -4.512 1.00 0.40 C ATOM 1827 O LEU A 122 -12.813 7.970 -5.227 1.00 0.40 O ATOM 1828 CB LEU A 122 -10.894 5.336 -5.519 1.00 0.42 C ATOM 1829 CG LEU A 122 -9.906 5.028 -6.649 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -8.473 5.092 -6.120 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -10.184 3.622 -7.187 1.00 1.24 C ATOM 0 H LEU A 122 -9.149 6.024 -3.840 1.00 0.37 H new ATOM 0 HA LEU A 122 -10.423 7.409 -5.889 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -10.724 4.656 -4.684 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -11.914 5.168 -5.864 1.00 0.42 H new ATOM 0 HG LEU A 122 -10.027 5.763 -7.445 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -7.776 4.872 -6.929 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -8.273 6.090 -5.731 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -8.346 4.359 -5.323 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -9.485 3.396 -7.992 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -10.062 2.895 -6.385 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -11.204 3.573 -7.568 1.00 1.24 H new ATOM 1843 N LYS A 123 -12.401 7.068 -3.275 1.00 0.51 N ATOM 1844 CA LYS A 123 -13.696 7.590 -2.753 1.00 0.55 C ATOM 1845 C LYS A 123 -13.617 9.115 -2.670 1.00 0.54 C ATOM 1846 O LYS A 123 -14.601 9.804 -2.833 1.00 0.55 O ATOM 1847 CB LYS A 123 -13.986 7.018 -1.357 1.00 0.59 C ATOM 1848 CG LYS A 123 -14.536 5.595 -1.489 1.00 0.97 C ATOM 1849 CD LYS A 123 -14.687 4.972 -0.100 1.00 1.37 C ATOM 1850 CE LYS A 123 -15.548 3.712 -0.197 1.00 1.74 C ATOM 1851 NZ LYS A 123 -16.955 4.093 -0.507 1.00 2.32 N ATOM 0 H LYS A 123 -11.839 6.534 -2.613 1.00 0.51 H new ATOM 0 HA LYS A 123 -14.499 7.289 -3.426 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -13.075 7.012 -0.759 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -14.705 7.650 -0.836 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -15.500 5.613 -1.997 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -13.865 4.990 -2.099 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -13.707 4.725 0.308 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -15.146 5.687 0.583 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -15.159 3.052 -0.973 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -15.508 3.159 0.741 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -17.600 3.358 -0.153 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -17.178 4.999 -0.048 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -17.070 4.188 -1.536 1.00 2.32 H new ATOM 1865 N ALA A 124 -12.454 9.651 -2.396 1.00 0.52 N ATOM 1866 CA ALA A 124 -12.335 11.132 -2.281 1.00 0.52 C ATOM 1867 C ALA A 124 -12.322 11.771 -3.670 1.00 0.51 C ATOM 1868 O ALA A 124 -12.754 12.890 -3.860 1.00 0.54 O ATOM 1869 CB ALA A 124 -11.059 11.499 -1.533 1.00 0.51 C ATOM 0 H ALA A 124 -11.590 9.130 -2.248 1.00 0.52 H new ATOM 0 HA ALA A 124 -13.194 11.508 -1.726 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -10.982 12.583 -1.455 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -11.085 11.064 -0.534 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -10.196 11.112 -2.075 1.00 0.51 H new ATOM 1875 N LEU A 125 -11.843 11.049 -4.646 1.00 0.47 N ATOM 1876 CA LEU A 125 -11.812 11.574 -6.030 1.00 0.47 C ATOM 1877 C LEU A 125 -13.248 11.672 -6.540 1.00 0.48 C ATOM 1878 O LEU A 125 -13.648 12.664 -7.114 1.00 0.48 O ATOM 1879 CB LEU A 125 -11.012 10.594 -6.902 1.00 0.51 C ATOM 1880 CG LEU A 125 -11.118 10.978 -8.383 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -10.635 12.419 -8.596 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -10.254 10.022 -9.212 1.00 1.21 C ATOM 0 H LEU A 125 -11.468 10.107 -4.536 1.00 0.47 H new ATOM 0 HA LEU A 125 -11.345 12.558 -6.065 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -9.966 10.596 -6.594 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -11.386 9.581 -6.756 1.00 0.51 H new ATOM 0 HG LEU A 125 -12.159 10.907 -8.697 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -10.716 12.678 -9.652 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -11.250 13.100 -8.007 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -9.595 12.505 -8.280 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -10.325 10.289 -10.266 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -9.216 10.096 -8.888 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -10.606 9.000 -9.072 1.00 1.21 H new ATOM 1894 N CYS A 126 -14.017 10.633 -6.367 1.00 0.52 N ATOM 1895 CA CYS A 126 -15.418 10.648 -6.874 1.00 0.57 C ATOM 1896 C CYS A 126 -16.274 11.648 -6.088 1.00 0.57 C ATOM 1897 O CYS A 126 -17.403 11.915 -6.453 1.00 0.68 O ATOM 1898 CB CYS A 126 -16.022 9.234 -6.759 1.00 0.66 C ATOM 1899 SG CYS A 126 -16.748 8.987 -5.112 1.00 1.67 S ATOM 0 H CYS A 126 -13.736 9.773 -5.896 1.00 0.52 H new ATOM 0 HA CYS A 126 -15.407 10.958 -7.919 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -16.785 9.094 -7.524 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -15.250 8.486 -6.939 1.00 0.66 H new ATOM 0 HG CYS A 126 -15.842 9.193 -4.203 1.00 1.67 H new ATOM 1905 N THR A 127 -15.754 12.208 -5.019 1.00 0.57 N ATOM 1906 CA THR A 127 -16.558 13.193 -4.223 1.00 0.60 C ATOM 1907 C THR A 127 -16.123 14.600 -4.614 1.00 0.62 C ATOM 1908 O THR A 127 -16.687 15.591 -4.197 1.00 0.70 O ATOM 1909 CB THR A 127 -16.318 12.924 -2.721 1.00 0.60 C ATOM 1910 OG1 THR A 127 -14.924 12.878 -2.462 1.00 1.14 O ATOM 1911 CG2 THR A 127 -16.965 11.567 -2.419 1.00 1.19 C ATOM 0 H THR A 127 -14.814 12.027 -4.665 1.00 0.57 H new ATOM 0 HA THR A 127 -17.624 13.092 -4.425 1.00 0.60 H new ATOM 0 HB THR A 127 -16.745 13.708 -2.096 1.00 0.60 H new ATOM 0 HG1 THR A 127 -14.436 13.232 -3.234 1.00 1.14 H new ATOM 0 HG21 THR A 127 -16.826 11.324 -1.366 1.00 1.19 H new ATOM 0 HG22 THR A 127 -18.031 11.614 -2.643 1.00 1.19 H new ATOM 0 HG23 THR A 127 -16.499 10.797 -3.034 1.00 1.19 H new ATOM 1919 N LYS A 128 -15.103 14.666 -5.438 1.00 0.60 N ATOM 1920 CA LYS A 128 -14.574 15.974 -5.915 1.00 0.70 C ATOM 1921 C LYS A 128 -14.075 16.796 -4.730 1.00 0.61 C ATOM 1922 O LYS A 128 -14.590 17.864 -4.465 1.00 0.60 O ATOM 1923 CB LYS A 128 -15.665 16.748 -6.665 1.00 0.87 C ATOM 1924 CG LYS A 128 -16.344 15.839 -7.701 1.00 1.12 C ATOM 1925 CD LYS A 128 -15.370 15.520 -8.840 1.00 1.43 C ATOM 1926 CE LYS A 128 -16.138 14.900 -10.010 1.00 1.83 C ATOM 1927 NZ LYS A 128 -16.838 13.668 -9.548 1.00 2.47 N ATOM 0 H LYS A 128 -14.610 13.851 -5.803 1.00 0.60 H new ATOM 0 HA LYS A 128 -13.744 15.789 -6.597 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -16.406 17.123 -5.959 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -15.230 17.615 -7.161 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -16.674 14.916 -7.225 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -17.233 16.328 -8.099 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -14.863 16.429 -9.165 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -14.599 14.832 -8.492 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -16.860 15.615 -10.405 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -15.452 14.659 -10.822 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -17.114 13.096 -10.372 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -16.202 13.115 -8.940 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -17.688 13.933 -9.010 1.00 2.47 H new ATOM 1941 N VAL A 129 -13.073 16.331 -4.014 1.00 0.60 N ATOM 1942 CA VAL A 129 -12.547 17.120 -2.854 1.00 0.53 C ATOM 1943 C VAL A 129 -11.010 17.005 -2.846 1.00 0.53 C ATOM 1944 O VAL A 129 -10.467 16.242 -2.072 1.00 0.56 O ATOM 1945 CB VAL A 129 -13.106 16.531 -1.557 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -12.672 17.388 -0.368 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -14.634 16.489 -1.631 1.00 1.22 C ATOM 0 H VAL A 129 -12.600 15.443 -4.184 1.00 0.60 H new ATOM 0 HA VAL A 129 -12.845 18.165 -2.937 1.00 0.53 H new ATOM 0 HB VAL A 129 -12.721 15.519 -1.427 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -13.073 16.963 0.552 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -11.584 17.410 -0.313 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -13.049 18.403 -0.494 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -15.032 16.069 -0.707 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -15.020 17.500 -1.766 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -14.941 15.868 -2.473 1.00 1.22 H new ATOM 1957 N PRO A 130 -10.342 17.736 -3.722 1.00 0.62 N ATOM 1958 CA PRO A 130 -8.869 17.672 -3.817 1.00 0.73 C ATOM 1959 C PRO A 130 -8.217 18.039 -2.475 1.00 0.65 C ATOM 1960 O PRO A 130 -7.063 17.738 -2.232 1.00 0.64 O ATOM 1961 CB PRO A 130 -8.487 18.644 -4.953 1.00 1.00 C ATOM 1962 CG PRO A 130 -9.812 19.246 -5.511 1.00 1.00 C ATOM 1963 CD PRO A 130 -10.980 18.675 -4.672 1.00 0.75 C ATOM 0 HA PRO A 130 -8.511 16.667 -4.039 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -7.833 19.433 -4.581 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -7.941 18.122 -5.739 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -9.793 20.334 -5.449 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -9.936 18.989 -6.563 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -11.513 19.467 -4.147 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -11.708 18.165 -5.303 1.00 0.75 H new ATOM 1971 N GLU A 131 -8.954 18.639 -1.591 1.00 0.73 N ATOM 1972 CA GLU A 131 -8.399 18.975 -0.251 1.00 0.82 C ATOM 1973 C GLU A 131 -8.138 17.687 0.534 1.00 0.72 C ATOM 1974 O GLU A 131 -7.196 17.568 1.296 1.00 0.73 O ATOM 1975 CB GLU A 131 -9.450 19.771 0.534 1.00 1.09 C ATOM 1976 CG GLU A 131 -8.806 20.298 1.833 1.00 1.55 C ATOM 1977 CD GLU A 131 -9.717 21.341 2.480 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -10.612 20.946 3.208 1.00 2.52 O ATOM 1979 OE2 GLU A 131 -9.497 22.518 2.244 1.00 2.86 O ATOM 0 H GLU A 131 -9.925 18.915 -1.737 1.00 0.73 H new ATOM 0 HA GLU A 131 -7.478 19.544 -0.380 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -9.821 20.601 -0.067 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -10.306 19.138 0.767 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -8.635 19.473 2.525 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -7.833 20.738 1.614 1.00 1.55 H new ATOM 1986 N LEU A 132 -9.003 16.721 0.342 1.00 0.71 N ATOM 1987 CA LEU A 132 -8.903 15.415 1.048 1.00 0.69 C ATOM 1988 C LEU A 132 -7.916 14.481 0.336 1.00 0.58 C ATOM 1989 O LEU A 132 -7.215 13.727 0.980 1.00 0.59 O ATOM 1990 CB LEU A 132 -10.305 14.788 1.086 1.00 0.80 C ATOM 1991 CG LEU A 132 -10.322 13.533 1.968 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -10.049 13.899 3.441 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -11.700 12.866 1.849 1.00 0.77 C ATOM 0 H LEU A 132 -9.796 16.791 -0.295 1.00 0.71 H new ATOM 0 HA LEU A 132 -8.530 15.569 2.061 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -11.022 15.515 1.468 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -10.620 14.530 0.075 1.00 0.80 H new ATOM 0 HG LEU A 132 -9.541 12.849 1.635 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -10.065 12.995 4.050 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -9.071 14.374 3.523 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -10.817 14.587 3.793 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -11.726 11.972 2.471 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -12.471 13.562 2.181 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -11.882 12.591 0.810 1.00 0.77 H new ATOM 2005 N ILE A 133 -7.833 14.501 -0.966 1.00 0.52 N ATOM 2006 CA ILE A 133 -6.861 13.586 -1.635 1.00 0.46 C ATOM 2007 C ILE A 133 -5.460 13.851 -1.082 1.00 0.43 C ATOM 2008 O ILE A 133 -4.735 12.941 -0.732 1.00 0.46 O ATOM 2009 CB ILE A 133 -6.864 13.825 -3.149 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -8.223 13.392 -3.716 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -5.737 13.007 -3.800 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -8.317 13.755 -5.200 1.00 1.19 C ATOM 0 H ILE A 133 -8.382 15.097 -1.586 1.00 0.52 H new ATOM 0 HA ILE A 133 -7.150 12.553 -1.440 1.00 0.46 H new ATOM 0 HB ILE A 133 -6.700 14.882 -3.361 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -8.353 12.317 -3.588 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -9.027 13.878 -3.164 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -5.739 13.177 -4.877 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -4.777 13.316 -3.386 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -5.894 11.947 -3.600 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -9.286 13.443 -5.590 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -8.209 14.833 -5.318 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -7.524 13.248 -5.750 1.00 1.19 H new ATOM 2024 N ARG A 134 -5.076 15.096 -0.999 1.00 0.42 N ATOM 2025 CA ARG A 134 -3.724 15.431 -0.467 1.00 0.43 C ATOM 2026 C ARG A 134 -3.637 15.039 1.010 1.00 0.40 C ATOM 2027 O ARG A 134 -2.613 14.585 1.481 1.00 0.39 O ATOM 2028 CB ARG A 134 -3.490 16.938 -0.607 1.00 0.51 C ATOM 2029 CG ARG A 134 -2.052 17.274 -0.210 1.00 1.26 C ATOM 2030 CD ARG A 134 -1.806 18.770 -0.414 1.00 1.57 C ATOM 2031 NE ARG A 134 -1.878 19.088 -1.869 1.00 2.30 N ATOM 2032 CZ ARG A 134 -1.980 20.329 -2.262 1.00 2.86 C ATOM 2033 NH1 ARG A 134 -2.000 21.293 -1.383 1.00 2.98 N ATOM 2034 NH2 ARG A 134 -2.057 20.605 -3.535 1.00 3.71 N ATOM 0 H ARG A 134 -5.642 15.898 -1.277 1.00 0.42 H new ATOM 0 HA ARG A 134 -2.967 14.884 -1.029 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -3.677 17.251 -1.634 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -4.190 17.485 0.025 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -1.878 17.004 0.832 1.00 1.26 H new ATOM 0 HG3 ARG A 134 -1.352 16.694 -0.811 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -2.549 19.350 0.134 1.00 1.57 H new ATOM 0 HD3 ARG A 134 -0.829 19.047 -0.018 1.00 1.57 H new ATOM 0 HE ARG A 134 -1.848 18.336 -2.557 1.00 2.30 H new ATOM 0 HH11 ARG A 134 -1.936 21.077 -0.388 1.00 2.98 H new ATOM 0 HH12 ARG A 134 -2.080 22.262 -1.691 1.00 2.98 H new ATOM 0 HH21 ARG A 134 -2.038 19.852 -4.222 1.00 3.71 H new ATOM 0 HH22 ARG A 134 -2.137 21.574 -3.843 1.00 3.71 H new ATOM 2048 N THR A 135 -4.693 15.231 1.749 1.00 0.41 N ATOM 2049 CA THR A 135 -4.651 14.888 3.199 1.00 0.41 C ATOM 2050 C THR A 135 -4.564 13.370 3.406 1.00 0.39 C ATOM 2051 O THR A 135 -4.031 12.896 4.392 1.00 0.52 O ATOM 2052 CB THR A 135 -5.894 15.439 3.900 1.00 0.42 C ATOM 2053 OG1 THR A 135 -5.892 16.855 3.801 1.00 0.89 O ATOM 2054 CG2 THR A 135 -5.879 15.036 5.375 1.00 0.88 C ATOM 0 H THR A 135 -5.580 15.609 1.415 1.00 0.41 H new ATOM 0 HA THR A 135 -3.759 15.342 3.631 1.00 0.41 H new ATOM 0 HB THR A 135 -6.788 15.033 3.426 1.00 0.42 H new ATOM 0 HG1 THR A 135 -6.353 17.126 2.980 1.00 0.89 H new ATOM 0 HG21 THR A 135 -6.767 15.431 5.869 1.00 0.88 H new ATOM 0 HG22 THR A 135 -5.873 13.949 5.455 1.00 0.88 H new ATOM 0 HG23 THR A 135 -4.987 15.440 5.854 1.00 0.88 H new ATOM 2062 N ILE A 136 -5.062 12.602 2.468 1.00 0.35 N ATOM 2063 CA ILE A 136 -4.988 11.118 2.597 1.00 0.36 C ATOM 2064 C ILE A 136 -3.568 10.669 2.243 1.00 0.35 C ATOM 2065 O ILE A 136 -2.792 10.327 3.113 1.00 0.51 O ATOM 2066 CB ILE A 136 -6.010 10.473 1.644 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -7.427 10.716 2.186 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -5.757 8.964 1.545 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -8.459 10.491 1.077 1.00 0.64 C ATOM 0 H ILE A 136 -5.516 12.941 1.620 1.00 0.35 H new ATOM 0 HA ILE A 136 -5.221 10.810 3.616 1.00 0.36 H new ATOM 0 HB ILE A 136 -5.908 10.917 0.654 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -7.626 10.044 3.021 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -7.509 11.733 2.569 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -6.485 8.517 0.868 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -4.751 8.788 1.164 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -5.855 8.513 2.533 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -9.460 10.666 1.471 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -8.267 11.181 0.256 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -8.386 9.466 0.714 1.00 0.64 H new ATOM 2081 N MET A 137 -3.232 10.644 0.975 1.00 0.35 N ATOM 2082 CA MET A 137 -1.866 10.205 0.547 1.00 0.33 C ATOM 2083 C MET A 137 -0.798 10.696 1.545 1.00 0.31 C ATOM 2084 O MET A 137 0.262 10.126 1.702 1.00 0.34 O ATOM 2085 CB MET A 137 -1.609 10.745 -0.882 1.00 0.36 C ATOM 2086 CG MET A 137 -1.091 12.206 -0.900 1.00 0.67 C ATOM 2087 SD MET A 137 0.671 12.214 -1.334 1.00 1.13 S ATOM 2088 CE MET A 137 0.444 12.347 -3.127 1.00 0.67 C ATOM 0 H MET A 137 -3.853 10.912 0.211 1.00 0.35 H new ATOM 0 HA MET A 137 -1.805 9.117 0.535 1.00 0.33 H new ATOM 0 HB2 MET A 137 -0.883 10.103 -1.381 1.00 0.36 H new ATOM 0 HB3 MET A 137 -2.533 10.687 -1.457 1.00 0.36 H new ATOM 0 HG2 MET A 137 -1.657 12.796 -1.621 1.00 0.67 H new ATOM 0 HG3 MET A 137 -1.239 12.668 0.076 1.00 0.67 H new ATOM 0 HE1 MET A 137 1.418 12.370 -3.616 1.00 0.67 H new ATOM 0 HE2 MET A 137 -0.123 11.488 -3.487 1.00 0.67 H new ATOM 0 HE3 MET A 137 -0.099 13.263 -3.358 1.00 0.67 H new ATOM 2098 N GLY A 138 -1.107 11.788 2.193 1.00 0.31 N ATOM 2099 CA GLY A 138 -0.188 12.422 3.186 1.00 0.33 C ATOM 2100 C GLY A 138 -0.029 11.525 4.415 1.00 0.33 C ATOM 2101 O GLY A 138 1.070 11.198 4.814 1.00 0.34 O ATOM 0 H GLY A 138 -1.990 12.284 2.070 1.00 0.31 H new ATOM 0 HA2 GLY A 138 0.786 12.599 2.729 1.00 0.33 H new ATOM 0 HA3 GLY A 138 -0.581 13.394 3.486 1.00 0.33 H new ATOM 2105 N TRP A 139 -1.111 11.119 5.014 1.00 0.34 N ATOM 2106 CA TRP A 139 -0.986 10.237 6.210 1.00 0.37 C ATOM 2107 C TRP A 139 -0.379 8.891 5.791 1.00 0.35 C ATOM 2108 O TRP A 139 0.045 8.107 6.615 1.00 0.39 O ATOM 2109 CB TRP A 139 -2.348 10.010 6.885 1.00 0.43 C ATOM 2110 CG TRP A 139 -2.741 11.195 7.724 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -1.933 11.878 8.582 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -4.050 11.828 7.817 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -2.664 12.894 9.169 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -3.972 12.904 8.733 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -5.286 11.578 7.194 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -5.079 13.701 9.021 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -6.403 12.378 7.483 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -6.299 13.438 8.395 1.00 0.78 C ATOM 0 H TRP A 139 -2.064 11.354 4.735 1.00 0.34 H new ATOM 0 HA TRP A 139 -0.334 10.729 6.932 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -3.108 9.830 6.125 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -2.304 9.117 7.509 1.00 0.43 H new ATOM 0 HD1 TRP A 139 -0.892 11.661 8.772 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -2.282 13.557 9.844 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -5.376 10.765 6.489 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -4.993 14.517 9.724 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -7.348 12.176 7.000 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -7.162 14.050 8.613 1.00 0.78 H new ATOM 2129 N THR A 140 -0.326 8.623 4.511 1.00 0.34 N ATOM 2130 CA THR A 140 0.265 7.335 4.043 1.00 0.36 C ATOM 2131 C THR A 140 1.789 7.415 4.173 1.00 0.34 C ATOM 2132 O THR A 140 2.408 6.610 4.840 1.00 0.39 O ATOM 2133 CB THR A 140 -0.123 7.093 2.580 1.00 0.38 C ATOM 2134 OG1 THR A 140 -1.530 7.235 2.437 1.00 1.20 O ATOM 2135 CG2 THR A 140 0.293 5.683 2.152 1.00 1.17 C ATOM 0 H THR A 140 -0.666 9.239 3.772 1.00 0.34 H new ATOM 0 HA THR A 140 -0.112 6.510 4.648 1.00 0.36 H new ATOM 0 HB THR A 140 0.388 7.821 1.950 1.00 0.38 H new ATOM 0 HG1 THR A 140 -1.781 7.082 1.502 1.00 1.20 H new ATOM 0 HG21 THR A 140 0.013 5.521 1.111 1.00 1.17 H new ATOM 0 HG22 THR A 140 1.372 5.574 2.258 1.00 1.17 H new ATOM 0 HG23 THR A 140 -0.210 4.949 2.781 1.00 1.17 H new ATOM 2143 N LEU A 141 2.396 8.394 3.556 1.00 0.33 N ATOM 2144 CA LEU A 141 3.877 8.544 3.663 1.00 0.34 C ATOM 2145 C LEU A 141 4.255 8.770 5.131 1.00 0.33 C ATOM 2146 O LEU A 141 5.361 8.483 5.544 1.00 0.33 O ATOM 2147 CB LEU A 141 4.348 9.724 2.802 1.00 0.35 C ATOM 2148 CG LEU A 141 4.175 9.392 1.302 1.00 0.41 C ATOM 2149 CD1 LEU A 141 3.977 10.684 0.503 1.00 0.99 C ATOM 2150 CD2 LEU A 141 5.421 8.668 0.778 1.00 0.80 C ATOM 0 H LEU A 141 1.930 9.097 2.982 1.00 0.33 H new ATOM 0 HA LEU A 141 4.364 7.638 3.302 1.00 0.34 H new ATOM 0 HB2 LEU A 141 3.776 10.618 3.053 1.00 0.35 H new ATOM 0 HB3 LEU A 141 5.394 9.945 3.015 1.00 0.35 H new ATOM 0 HG LEU A 141 3.303 8.749 1.185 1.00 0.41 H new ATOM 0 HD11 LEU A 141 3.856 10.444 -0.553 1.00 0.99 H new ATOM 0 HD12 LEU A 141 3.087 11.201 0.862 1.00 0.99 H new ATOM 0 HD13 LEU A 141 4.847 11.328 0.631 1.00 0.99 H new ATOM 0 HD21 LEU A 141 5.290 8.438 -0.279 1.00 0.80 H new ATOM 0 HD22 LEU A 141 6.294 9.308 0.905 1.00 0.80 H new ATOM 0 HD23 LEU A 141 5.565 7.743 1.335 1.00 0.80 H new ATOM 2162 N ASP A 142 3.347 9.265 5.927 1.00 0.36 N ATOM 2163 CA ASP A 142 3.666 9.480 7.369 1.00 0.37 C ATOM 2164 C ASP A 142 3.833 8.113 8.037 1.00 0.37 C ATOM 2165 O ASP A 142 4.676 7.917 8.890 1.00 0.42 O ATOM 2166 CB ASP A 142 2.518 10.237 8.040 1.00 0.37 C ATOM 2167 CG ASP A 142 2.906 10.580 9.479 1.00 0.78 C ATOM 2168 OD1 ASP A 142 3.951 11.182 9.662 1.00 1.59 O ATOM 2169 OD2 ASP A 142 2.153 10.234 10.374 1.00 1.32 O ATOM 0 H ASP A 142 2.403 9.529 5.645 1.00 0.36 H new ATOM 0 HA ASP A 142 4.583 10.062 7.467 1.00 0.37 H new ATOM 0 HB2 ASP A 142 2.296 11.148 7.485 1.00 0.37 H new ATOM 0 HB3 ASP A 142 1.613 9.629 8.031 1.00 0.37 H new ATOM 2174 N PHE A 143 3.032 7.166 7.635 1.00 0.41 N ATOM 2175 CA PHE A 143 3.114 5.791 8.207 1.00 0.43 C ATOM 2176 C PHE A 143 4.331 5.061 7.637 1.00 0.43 C ATOM 2177 O PHE A 143 4.936 4.254 8.315 1.00 0.45 O ATOM 2178 CB PHE A 143 1.842 5.022 7.834 1.00 0.44 C ATOM 2179 CG PHE A 143 1.779 3.724 8.605 1.00 0.47 C ATOM 2180 CD1 PHE A 143 2.416 2.581 8.107 1.00 1.29 C ATOM 2181 CD2 PHE A 143 1.076 3.661 9.815 1.00 1.16 C ATOM 2182 CE1 PHE A 143 2.352 1.376 8.819 1.00 1.35 C ATOM 2183 CE2 PHE A 143 1.010 2.456 10.526 1.00 1.22 C ATOM 2184 CZ PHE A 143 1.649 1.314 10.028 1.00 0.72 C ATOM 0 H PHE A 143 2.312 7.288 6.923 1.00 0.41 H new ATOM 0 HA PHE A 143 3.211 5.853 9.291 1.00 0.43 H new ATOM 0 HB2 PHE A 143 0.963 5.628 8.053 1.00 0.44 H new ATOM 0 HB3 PHE A 143 1.830 4.820 6.763 1.00 0.44 H new ATOM 0 HD1 PHE A 143 2.957 2.628 7.173 1.00 1.29 H new ATOM 0 HD2 PHE A 143 0.584 4.542 10.200 1.00 1.16 H new ATOM 0 HE1 PHE A 143 2.845 0.495 8.435 1.00 1.35 H new ATOM 0 HE2 PHE A 143 0.466 2.408 11.458 1.00 1.22 H new ATOM 0 HZ PHE A 143 1.600 0.385 10.577 1.00 0.72 H new ATOM 2194 N LEU A 144 4.711 5.312 6.413 1.00 0.45 N ATOM 2195 CA LEU A 144 5.901 4.590 5.869 1.00 0.47 C ATOM 2196 C LEU A 144 7.178 5.176 6.498 1.00 0.47 C ATOM 2197 O LEU A 144 8.068 4.449 6.892 1.00 0.49 O ATOM 2198 CB LEU A 144 5.957 4.719 4.330 1.00 0.49 C ATOM 2199 CG LEU A 144 5.387 3.476 3.650 1.00 0.64 C ATOM 2200 CD1 LEU A 144 3.891 3.369 3.946 1.00 1.31 C ATOM 2201 CD2 LEU A 144 5.603 3.595 2.136 1.00 1.01 C ATOM 0 H LEU A 144 4.262 5.971 5.777 1.00 0.45 H new ATOM 0 HA LEU A 144 5.823 3.532 6.118 1.00 0.47 H new ATOM 0 HB2 LEU A 144 5.395 5.599 4.016 1.00 0.49 H new ATOM 0 HB3 LEU A 144 6.989 4.870 4.012 1.00 0.49 H new ATOM 0 HG LEU A 144 5.890 2.586 4.027 1.00 0.64 H new ATOM 0 HD11 LEU A 144 3.486 2.481 3.460 1.00 1.31 H new ATOM 0 HD12 LEU A 144 3.738 3.295 5.023 1.00 1.31 H new ATOM 0 HD13 LEU A 144 3.381 4.255 3.567 1.00 1.31 H new ATOM 0 HD21 LEU A 144 5.199 2.712 1.640 1.00 1.01 H new ATOM 0 HD22 LEU A 144 5.094 4.484 1.765 1.00 1.01 H new ATOM 0 HD23 LEU A 144 6.670 3.673 1.926 1.00 1.01 H new ATOM 2213 N ARG A 145 7.290 6.465 6.574 1.00 0.47 N ATOM 2214 CA ARG A 145 8.527 7.065 7.155 1.00 0.48 C ATOM 2215 C ARG A 145 8.706 6.641 8.624 1.00 0.49 C ATOM 2216 O ARG A 145 9.815 6.477 9.093 1.00 0.50 O ATOM 2217 CB ARG A 145 8.432 8.590 7.069 1.00 0.49 C ATOM 2218 CG ARG A 145 9.817 9.205 7.287 1.00 0.69 C ATOM 2219 CD ARG A 145 9.708 10.730 7.248 1.00 0.68 C ATOM 2220 NE ARG A 145 8.910 11.200 8.415 1.00 1.56 N ATOM 2221 CZ ARG A 145 8.932 12.459 8.757 1.00 2.10 C ATOM 2222 NH1 ARG A 145 9.657 13.307 8.080 1.00 2.12 N ATOM 2223 NH2 ARG A 145 8.230 12.870 9.777 1.00 3.16 N ATOM 0 H ARG A 145 6.585 7.133 6.262 1.00 0.47 H new ATOM 0 HA ARG A 145 9.388 6.710 6.589 1.00 0.48 H new ATOM 0 HB2 ARG A 145 8.041 8.886 6.095 1.00 0.49 H new ATOM 0 HB3 ARG A 145 7.735 8.964 7.819 1.00 0.49 H new ATOM 0 HG2 ARG A 145 10.223 8.883 8.246 1.00 0.69 H new ATOM 0 HG3 ARG A 145 10.506 8.859 6.517 1.00 0.69 H new ATOM 0 HD2 ARG A 145 10.702 11.177 7.269 1.00 0.68 H new ATOM 0 HD3 ARG A 145 9.235 11.048 6.319 1.00 0.68 H new ATOM 0 HE ARG A 145 8.346 10.537 8.947 1.00 1.56 H new ATOM 0 HH11 ARG A 145 10.207 12.986 7.283 1.00 2.12 H new ATOM 0 HH12 ARG A 145 9.674 14.291 8.348 1.00 2.12 H new ATOM 0 HH21 ARG A 145 7.664 12.207 10.307 1.00 3.16 H new ATOM 0 HH22 ARG A 145 8.247 13.854 10.045 1.00 3.16 H new ATOM 2237 N GLU A 146 7.639 6.515 9.370 1.00 0.49 N ATOM 2238 CA GLU A 146 7.778 6.160 10.824 1.00 0.51 C ATOM 2239 C GLU A 146 7.821 4.638 11.062 1.00 0.53 C ATOM 2240 O GLU A 146 8.770 4.132 11.626 1.00 0.55 O ATOM 2241 CB GLU A 146 6.604 6.753 11.606 1.00 0.52 C ATOM 2242 CG GLU A 146 6.579 8.273 11.430 1.00 0.96 C ATOM 2243 CD GLU A 146 5.335 8.844 12.115 1.00 1.48 C ATOM 2244 OE1 GLU A 146 5.011 8.378 13.195 1.00 2.03 O ATOM 2245 OE2 GLU A 146 4.728 9.737 11.548 1.00 2.22 O ATOM 0 H GLU A 146 6.681 6.641 9.043 1.00 0.49 H new ATOM 0 HA GLU A 146 8.726 6.575 11.168 1.00 0.51 H new ATOM 0 HB2 GLU A 146 5.666 6.322 11.255 1.00 0.52 H new ATOM 0 HB3 GLU A 146 6.695 6.501 12.663 1.00 0.52 H new ATOM 0 HG2 GLU A 146 7.479 8.715 11.859 1.00 0.96 H new ATOM 0 HG3 GLU A 146 6.573 8.527 10.370 1.00 0.96 H new ATOM 2252 N ARG A 147 6.801 3.908 10.699 1.00 0.59 N ATOM 2253 CA ARG A 147 6.810 2.435 10.986 1.00 0.62 C ATOM 2254 C ARG A 147 7.696 1.669 9.992 1.00 0.58 C ATOM 2255 O ARG A 147 8.486 0.827 10.369 1.00 0.62 O ATOM 2256 CB ARG A 147 5.379 1.901 10.900 1.00 0.63 C ATOM 2257 CG ARG A 147 4.417 2.861 11.615 1.00 0.73 C ATOM 2258 CD ARG A 147 4.851 3.075 13.072 1.00 1.11 C ATOM 2259 NE ARG A 147 5.219 1.764 13.707 1.00 1.75 N ATOM 2260 CZ ARG A 147 4.380 0.762 13.753 1.00 2.40 C ATOM 2261 NH1 ARG A 147 3.139 0.919 13.383 1.00 2.71 N ATOM 2262 NH2 ARG A 147 4.774 -0.391 14.220 1.00 3.30 N ATOM 0 H ARG A 147 5.970 4.257 10.222 1.00 0.59 H new ATOM 0 HA ARG A 147 7.218 2.285 11.986 1.00 0.62 H new ATOM 0 HB2 ARG A 147 5.086 1.790 9.856 1.00 0.63 H new ATOM 0 HB3 ARG A 147 5.323 0.912 11.354 1.00 0.63 H new ATOM 0 HG2 ARG A 147 4.394 3.817 11.093 1.00 0.73 H new ATOM 0 HG3 ARG A 147 3.405 2.458 11.587 1.00 0.73 H new ATOM 0 HD2 ARG A 147 5.702 3.755 13.108 1.00 1.11 H new ATOM 0 HD3 ARG A 147 4.043 3.544 13.634 1.00 1.11 H new ATOM 0 HE ARG A 147 6.148 1.653 14.113 1.00 1.75 H new ATOM 0 HH11 ARG A 147 2.816 1.829 13.054 1.00 2.71 H new ATOM 0 HH12 ARG A 147 2.492 0.132 13.422 1.00 2.71 H new ATOM 0 HH21 ARG A 147 5.733 -0.508 14.547 1.00 3.30 H new ATOM 0 HH22 ARG A 147 4.123 -1.175 14.258 1.00 3.30 H new ATOM 2276 N LEU A 148 7.560 1.952 8.731 1.00 0.53 N ATOM 2277 CA LEU A 148 8.376 1.244 7.698 1.00 0.57 C ATOM 2278 C LEU A 148 9.644 2.039 7.408 1.00 0.67 C ATOM 2279 O LEU A 148 10.236 2.608 8.300 1.00 1.61 O ATOM 2280 CB LEU A 148 7.554 1.114 6.414 1.00 0.59 C ATOM 2281 CG LEU A 148 6.146 0.591 6.762 1.00 0.70 C ATOM 2282 CD1 LEU A 148 5.311 0.379 5.477 1.00 1.29 C ATOM 2283 CD2 LEU A 148 6.271 -0.737 7.534 1.00 1.34 C ATOM 0 H LEU A 148 6.913 2.650 8.363 1.00 0.53 H new ATOM 0 HA LEU A 148 8.649 0.255 8.066 1.00 0.57 H new ATOM 0 HB2 LEU A 148 7.483 2.080 5.915 1.00 0.59 H new ATOM 0 HB3 LEU A 148 8.047 0.433 5.720 1.00 0.59 H new ATOM 0 HG LEU A 148 5.638 1.329 7.383 1.00 0.70 H new ATOM 0 HD11 LEU A 148 4.321 0.010 5.743 1.00 1.29 H new ATOM 0 HD12 LEU A 148 5.214 1.326 4.946 1.00 1.29 H new ATOM 0 HD13 LEU A 148 5.809 -0.348 4.835 1.00 1.29 H new ATOM 0 HD21 LEU A 148 5.277 -1.109 7.781 1.00 1.34 H new ATOM 0 HD22 LEU A 148 6.789 -1.470 6.916 1.00 1.34 H new ATOM 0 HD23 LEU A 148 6.836 -0.573 8.452 1.00 1.34 H new ATOM 2295 N LEU A 149 10.076 2.040 6.171 1.00 0.67 N ATOM 2296 CA LEU A 149 11.325 2.762 5.774 1.00 0.57 C ATOM 2297 C LEU A 149 12.535 2.037 6.367 1.00 0.56 C ATOM 2298 O LEU A 149 13.290 1.404 5.657 1.00 0.58 O ATOM 2299 CB LEU A 149 11.289 4.233 6.230 1.00 0.54 C ATOM 2300 CG LEU A 149 12.568 4.962 5.789 1.00 0.59 C ATOM 2301 CD1 LEU A 149 12.735 4.896 4.261 1.00 0.83 C ATOM 2302 CD2 LEU A 149 12.477 6.425 6.237 1.00 1.21 C ATOM 0 H LEU A 149 9.605 1.560 5.404 1.00 0.67 H new ATOM 0 HA LEU A 149 11.402 2.764 4.687 1.00 0.57 H new ATOM 0 HB2 LEU A 149 10.416 4.730 5.808 1.00 0.54 H new ATOM 0 HB3 LEU A 149 11.190 4.282 7.314 1.00 0.54 H new ATOM 0 HG LEU A 149 13.432 4.480 6.246 1.00 0.59 H new ATOM 0 HD11 LEU A 149 13.647 5.419 3.972 1.00 0.83 H new ATOM 0 HD12 LEU A 149 12.798 3.854 3.947 1.00 0.83 H new ATOM 0 HD13 LEU A 149 11.878 5.368 3.781 1.00 0.83 H new ATOM 0 HD21 LEU A 149 13.378 6.956 5.931 1.00 1.21 H new ATOM 0 HD22 LEU A 149 11.606 6.893 5.777 1.00 1.21 H new ATOM 0 HD23 LEU A 149 12.381 6.468 7.322 1.00 1.21 H new ATOM 2314 N GLY A 150 12.734 2.112 7.658 1.00 0.56 N ATOM 2315 CA GLY A 150 13.904 1.409 8.260 1.00 0.58 C ATOM 2316 C GLY A 150 13.935 -0.044 7.777 1.00 0.62 C ATOM 2317 O GLY A 150 14.914 -0.508 7.227 1.00 0.70 O ATOM 0 H GLY A 150 12.144 2.624 8.314 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.828 1.915 7.981 1.00 0.58 H new ATOM 0 HA3 GLY A 150 13.839 1.440 9.348 1.00 0.58 H new ATOM 2321 N TRP A 151 12.877 -0.773 8.015 1.00 0.63 N ATOM 2322 CA TRP A 151 12.842 -2.208 7.610 1.00 0.69 C ATOM 2323 C TRP A 151 12.971 -2.337 6.089 1.00 0.70 C ATOM 2324 O TRP A 151 13.518 -3.301 5.591 1.00 0.72 O ATOM 2325 CB TRP A 151 11.513 -2.836 8.073 1.00 0.73 C ATOM 2326 CG TRP A 151 11.614 -3.255 9.510 1.00 1.25 C ATOM 2327 CD1 TRP A 151 11.766 -4.531 9.934 1.00 2.17 C ATOM 2328 CD2 TRP A 151 11.574 -2.427 10.710 1.00 1.86 C ATOM 2329 NE1 TRP A 151 11.822 -4.539 11.316 1.00 2.65 N ATOM 2330 CE2 TRP A 151 11.709 -3.268 11.840 1.00 2.43 C ATOM 2331 CE3 TRP A 151 11.435 -1.044 10.926 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 11.706 -2.755 13.138 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 11.433 -0.524 12.231 1.00 3.62 C ATOM 2334 CH2 TRP A 151 11.568 -1.378 13.334 1.00 3.67 C ATOM 0 H TRP A 151 12.032 -0.434 8.475 1.00 0.63 H new ATOM 0 HA TRP A 151 13.678 -2.729 8.076 1.00 0.69 H new ATOM 0 HB2 TRP A 151 10.701 -2.119 7.951 1.00 0.73 H new ATOM 0 HB3 TRP A 151 11.273 -3.698 7.451 1.00 0.73 H new ATOM 0 HD1 TRP A 151 11.833 -5.401 9.297 1.00 2.17 H new ATOM 0 HE1 TRP A 151 11.933 -5.382 11.879 1.00 2.65 H new ATOM 0 HE3 TRP A 151 11.329 -0.377 10.083 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 11.810 -3.417 13.985 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 11.327 0.540 12.385 1.00 3.62 H new ATOM 0 HH2 TRP A 151 11.565 -0.972 14.335 1.00 3.67 H new ATOM 2345 N ILE A 152 12.470 -1.393 5.341 1.00 0.73 N ATOM 2346 CA ILE A 152 12.577 -1.514 3.860 1.00 0.76 C ATOM 2347 C ILE A 152 14.041 -1.330 3.452 1.00 0.79 C ATOM 2348 O ILE A 152 14.491 -1.846 2.448 1.00 0.89 O ATOM 2349 CB ILE A 152 11.704 -0.454 3.187 1.00 0.78 C ATOM 2350 CG1 ILE A 152 10.245 -0.666 3.601 1.00 0.83 C ATOM 2351 CG2 ILE A 152 11.826 -0.579 1.666 1.00 0.92 C ATOM 2352 CD1 ILE A 152 9.395 0.509 3.115 1.00 0.94 C ATOM 0 H ILE A 152 11.998 -0.556 5.684 1.00 0.73 H new ATOM 0 HA ILE A 152 12.232 -2.498 3.544 1.00 0.76 H new ATOM 0 HB ILE A 152 12.033 0.539 3.495 1.00 0.78 H new ATOM 0 HG12 ILE A 152 9.869 -1.598 3.179 1.00 0.83 H new ATOM 0 HG13 ILE A 152 10.174 -0.755 4.685 1.00 0.83 H new ATOM 0 HG21 ILE A 152 11.203 0.177 1.188 1.00 0.92 H new ATOM 0 HG22 ILE A 152 12.865 -0.433 1.371 1.00 0.92 H new ATOM 0 HG23 ILE A 152 11.497 -1.570 1.355 1.00 0.92 H new ATOM 0 HD11 ILE A 152 8.357 0.355 3.411 1.00 0.94 H new ATOM 0 HD12 ILE A 152 9.765 1.434 3.558 1.00 0.94 H new ATOM 0 HD13 ILE A 152 9.456 0.577 2.029 1.00 0.94 H new ATOM 2364 N GLN A 153 14.786 -0.602 4.240 1.00 0.77 N ATOM 2365 CA GLN A 153 16.227 -0.378 3.929 1.00 0.80 C ATOM 2366 C GLN A 153 17.008 -1.660 4.241 1.00 0.81 C ATOM 2367 O GLN A 153 17.829 -2.098 3.460 1.00 0.82 O ATOM 2368 CB GLN A 153 16.750 0.791 4.769 1.00 0.82 C ATOM 2369 CG GLN A 153 18.052 1.332 4.177 1.00 1.09 C ATOM 2370 CD GLN A 153 18.534 2.508 5.028 1.00 1.98 C ATOM 2371 OE1 GLN A 153 18.414 2.487 6.237 1.00 2.66 O ATOM 2372 NE2 GLN A 153 19.080 3.541 4.446 1.00 2.77 N ATOM 0 H GLN A 153 14.455 -0.150 5.092 1.00 0.77 H new ATOM 0 HA GLN A 153 16.354 -0.133 2.874 1.00 0.80 H new ATOM 0 HB2 GLN A 153 16.003 1.584 4.806 1.00 0.82 H new ATOM 0 HB3 GLN A 153 16.918 0.463 5.795 1.00 0.82 H new ATOM 0 HG2 GLN A 153 18.809 0.548 4.154 1.00 1.09 H new ATOM 0 HG3 GLN A 153 17.893 1.652 3.147 1.00 1.09 H new ATOM 0 HE21 GLN A 153 19.181 3.560 3.431 1.00 2.77 H new ATOM 0 HE22 GLN A 153 19.405 4.329 5.006 1.00 2.77 H new ATOM 2381 N ASP A 154 16.752 -2.273 5.364 1.00 0.83 N ATOM 2382 CA ASP A 154 17.474 -3.535 5.703 1.00 0.86 C ATOM 2383 C ASP A 154 17.308 -4.531 4.549 1.00 0.85 C ATOM 2384 O ASP A 154 18.193 -5.308 4.250 1.00 0.94 O ATOM 2385 CB ASP A 154 16.879 -4.128 6.982 1.00 0.90 C ATOM 2386 CG ASP A 154 16.992 -3.108 8.117 1.00 1.28 C ATOM 2387 OD1 ASP A 154 17.976 -2.387 8.143 1.00 1.84 O ATOM 2388 OD2 ASP A 154 16.092 -3.063 8.939 1.00 1.99 O ATOM 0 H ASP A 154 16.077 -1.957 6.060 1.00 0.83 H new ATOM 0 HA ASP A 154 18.533 -3.328 5.858 1.00 0.86 H new ATOM 0 HB2 ASP A 154 15.834 -4.394 6.821 1.00 0.90 H new ATOM 0 HB3 ASP A 154 17.404 -5.045 7.249 1.00 0.90 H new ATOM 2393 N GLN A 155 16.182 -4.495 3.893 1.00 0.79 N ATOM 2394 CA GLN A 155 15.939 -5.414 2.748 1.00 0.79 C ATOM 2395 C GLN A 155 16.886 -5.064 1.602 1.00 0.72 C ATOM 2396 O GLN A 155 17.487 -5.926 0.993 1.00 1.03 O ATOM 2397 CB GLN A 155 14.493 -5.253 2.270 1.00 0.90 C ATOM 2398 CG GLN A 155 14.141 -6.389 1.302 1.00 1.37 C ATOM 2399 CD GLN A 155 12.646 -6.346 0.983 1.00 2.01 C ATOM 2400 OE1 GLN A 155 11.965 -7.349 1.071 1.00 2.72 O ATOM 2401 NE2 GLN A 155 12.102 -5.220 0.613 1.00 2.54 N ATOM 0 H GLN A 155 15.412 -3.861 4.104 1.00 0.79 H new ATOM 0 HA GLN A 155 16.113 -6.442 3.065 1.00 0.79 H new ATOM 0 HB2 GLN A 155 13.814 -5.265 3.123 1.00 0.90 H new ATOM 0 HB3 GLN A 155 14.368 -4.289 1.776 1.00 0.90 H new ATOM 0 HG2 GLN A 155 14.722 -6.292 0.385 1.00 1.37 H new ATOM 0 HG3 GLN A 155 14.401 -7.351 1.744 1.00 1.37 H new ATOM 0 HE21 GLN A 155 12.673 -4.378 0.539 1.00 2.54 H new ATOM 0 HE22 GLN A 155 11.106 -5.181 0.398 1.00 2.54 H new ATOM 2410 N GLY A 156 17.016 -3.799 1.303 1.00 0.63 N ATOM 2411 CA GLY A 156 17.916 -3.368 0.191 1.00 0.72 C ATOM 2412 C GLY A 156 17.227 -2.251 -0.589 1.00 0.87 C ATOM 2413 O GLY A 156 17.777 -1.188 -0.799 1.00 1.38 O ATOM 0 H GLY A 156 16.534 -3.040 1.784 1.00 0.63 H new ATOM 0 HA2 GLY A 156 18.869 -3.019 0.589 1.00 0.72 H new ATOM 0 HA3 GLY A 156 18.134 -4.209 -0.467 1.00 0.72 H new ATOM 2417 N GLY A 157 16.025 -2.500 -1.034 1.00 0.81 N ATOM 2418 CA GLY A 157 15.282 -1.472 -1.819 1.00 1.10 C ATOM 2419 C GLY A 157 13.945 -2.062 -2.282 1.00 0.84 C ATOM 2420 O GLY A 157 13.626 -3.201 -2.007 1.00 0.88 O ATOM 0 H GLY A 157 15.523 -3.376 -0.887 1.00 0.81 H new ATOM 0 HA2 GLY A 157 15.110 -0.585 -1.209 1.00 1.10 H new ATOM 0 HA3 GLY A 157 15.872 -1.157 -2.680 1.00 1.10 H new ATOM 2424 N TRP A 158 13.156 -1.281 -2.971 1.00 0.67 N ATOM 2425 CA TRP A 158 11.827 -1.773 -3.443 1.00 0.50 C ATOM 2426 C TRP A 158 12.000 -3.023 -4.310 1.00 0.51 C ATOM 2427 O TRP A 158 11.033 -3.663 -4.686 1.00 0.53 O ATOM 2428 CB TRP A 158 11.130 -0.678 -4.252 1.00 0.51 C ATOM 2429 CG TRP A 158 10.756 0.454 -3.350 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.328 1.680 -3.364 1.00 0.59 C ATOM 2431 CD2 TRP A 158 9.738 0.488 -2.308 1.00 0.46 C ATOM 2432 NE1 TRP A 158 10.725 2.465 -2.398 1.00 0.55 N ATOM 2433 CE2 TRP A 158 9.739 1.775 -1.720 1.00 0.47 C ATOM 2434 CE3 TRP A 158 8.824 -0.463 -1.822 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 8.863 2.107 -0.686 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 7.941 -0.133 -0.781 1.00 0.84 C ATOM 2437 CH2 TRP A 158 7.960 1.150 -0.215 1.00 0.78 C ATOM 0 H TRP A 158 13.375 -0.319 -3.229 1.00 0.67 H new ATOM 0 HA TRP A 158 11.218 -2.028 -2.576 1.00 0.50 H new ATOM 0 HB2 TRP A 158 11.789 -0.322 -5.044 1.00 0.51 H new ATOM 0 HB3 TRP A 158 10.240 -1.080 -4.735 1.00 0.51 H new ATOM 0 HD1 TRP A 158 12.125 1.994 -4.022 1.00 0.59 H new ATOM 0 HE1 TRP A 158 10.978 3.435 -2.209 1.00 0.55 H new ATOM 0 HE3 TRP A 158 8.801 -1.454 -2.252 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 8.883 3.096 -0.253 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 7.243 -0.871 -0.414 1.00 0.84 H new ATOM 0 HH2 TRP A 158 7.277 1.398 0.584 1.00 0.78 H new ATOM 2448 N ASP A 159 13.205 -3.392 -4.637 1.00 0.50 N ATOM 2449 CA ASP A 159 13.382 -4.607 -5.476 1.00 0.51 C ATOM 2450 C ASP A 159 12.752 -5.794 -4.746 1.00 0.51 C ATOM 2451 O ASP A 159 12.238 -6.711 -5.355 1.00 0.51 O ATOM 2452 CB ASP A 159 14.873 -4.861 -5.705 1.00 0.54 C ATOM 2453 CG ASP A 159 15.492 -3.665 -6.432 1.00 1.66 C ATOM 2454 OD1 ASP A 159 15.775 -2.678 -5.773 1.00 2.46 O ATOM 2455 OD2 ASP A 159 15.672 -3.756 -7.635 1.00 2.37 O ATOM 0 H ASP A 159 14.063 -2.913 -4.365 1.00 0.50 H new ATOM 0 HA ASP A 159 12.900 -4.471 -6.444 1.00 0.51 H new ATOM 0 HB2 ASP A 159 15.376 -5.020 -4.751 1.00 0.54 H new ATOM 0 HB3 ASP A 159 15.012 -5.768 -6.293 1.00 0.54 H new ATOM 2460 N GLY A 160 12.776 -5.775 -3.439 1.00 0.52 N ATOM 2461 CA GLY A 160 12.162 -6.892 -2.665 1.00 0.54 C ATOM 2462 C GLY A 160 10.680 -6.981 -3.028 1.00 0.53 C ATOM 2463 O GLY A 160 10.095 -8.045 -3.040 1.00 0.54 O ATOM 0 H GLY A 160 13.194 -5.035 -2.875 1.00 0.52 H new ATOM 0 HA2 GLY A 160 12.665 -7.832 -2.894 1.00 0.54 H new ATOM 0 HA3 GLY A 160 12.280 -6.720 -1.595 1.00 0.54 H new ATOM 2467 N LEU A 161 10.076 -5.870 -3.354 1.00 0.54 N ATOM 2468 CA LEU A 161 8.642 -5.890 -3.749 1.00 0.56 C ATOM 2469 C LEU A 161 8.515 -6.713 -5.031 1.00 0.56 C ATOM 2470 O LEU A 161 7.613 -7.509 -5.203 1.00 0.62 O ATOM 2471 CB LEU A 161 8.170 -4.441 -4.016 1.00 0.58 C ATOM 2472 CG LEU A 161 6.693 -4.289 -3.603 1.00 0.74 C ATOM 2473 CD1 LEU A 161 6.228 -2.857 -3.856 1.00 1.63 C ATOM 2474 CD2 LEU A 161 5.826 -5.258 -4.415 1.00 1.56 C ATOM 0 H LEU A 161 10.516 -4.950 -3.363 1.00 0.54 H new ATOM 0 HA LEU A 161 8.031 -6.326 -2.958 1.00 0.56 H new ATOM 0 HB2 LEU A 161 8.788 -3.739 -3.457 1.00 0.58 H new ATOM 0 HB3 LEU A 161 8.289 -4.199 -5.072 1.00 0.58 H new ATOM 0 HG LEU A 161 6.596 -4.517 -2.542 1.00 0.74 H new ATOM 0 HD11 LEU A 161 5.183 -2.756 -3.562 1.00 1.63 H new ATOM 0 HD12 LEU A 161 6.837 -2.168 -3.271 1.00 1.63 H new ATOM 0 HD13 LEU A 161 6.331 -2.623 -4.916 1.00 1.63 H new ATOM 0 HD21 LEU A 161 4.783 -5.147 -4.120 1.00 1.56 H new ATOM 0 HD22 LEU A 161 5.928 -5.035 -5.477 1.00 1.56 H new ATOM 0 HD23 LEU A 161 6.150 -6.282 -4.226 1.00 1.56 H new ATOM 2486 N LEU A 162 9.446 -6.514 -5.931 1.00 0.53 N ATOM 2487 CA LEU A 162 9.444 -7.255 -7.223 1.00 0.56 C ATOM 2488 C LEU A 162 10.051 -8.645 -6.998 1.00 0.55 C ATOM 2489 O LEU A 162 9.572 -9.625 -7.533 1.00 0.57 O ATOM 2490 CB LEU A 162 10.285 -6.459 -8.256 1.00 0.61 C ATOM 2491 CG LEU A 162 9.610 -6.426 -9.637 1.00 0.80 C ATOM 2492 CD1 LEU A 162 10.566 -5.767 -10.645 1.00 1.56 C ATOM 2493 CD2 LEU A 162 9.272 -7.855 -10.108 1.00 1.33 C ATOM 0 H LEU A 162 10.219 -5.858 -5.820 1.00 0.53 H new ATOM 0 HA LEU A 162 8.428 -7.368 -7.600 1.00 0.56 H new ATOM 0 HB2 LEU A 162 10.431 -5.440 -7.898 1.00 0.61 H new ATOM 0 HB3 LEU A 162 11.273 -6.910 -8.345 1.00 0.61 H new ATOM 0 HG LEU A 162 8.684 -5.855 -9.568 1.00 0.80 H new ATOM 0 HD11 LEU A 162 10.096 -5.739 -11.628 1.00 1.56 H new ATOM 0 HD12 LEU A 162 10.792 -4.751 -10.322 1.00 1.56 H new ATOM 0 HD13 LEU A 162 11.489 -6.343 -10.701 1.00 1.56 H new ATOM 0 HD21 LEU A 162 8.795 -7.812 -11.087 1.00 1.33 H new ATOM 0 HD22 LEU A 162 10.188 -8.442 -10.176 1.00 1.33 H new ATOM 0 HD23 LEU A 162 8.594 -8.323 -9.394 1.00 1.33 H new ATOM 2505 N SER A 163 11.096 -8.749 -6.230 1.00 0.54 N ATOM 2506 CA SER A 163 11.702 -10.090 -6.008 1.00 0.56 C ATOM 2507 C SER A 163 10.628 -11.050 -5.485 1.00 0.53 C ATOM 2508 O SER A 163 10.710 -12.249 -5.661 1.00 0.60 O ATOM 2509 CB SER A 163 12.837 -9.979 -4.987 1.00 0.63 C ATOM 2510 OG SER A 163 12.315 -10.177 -3.679 1.00 1.32 O ATOM 0 H SER A 163 11.554 -7.974 -5.751 1.00 0.54 H new ATOM 0 HA SER A 163 12.103 -10.470 -6.948 1.00 0.56 H new ATOM 0 HB2 SER A 163 13.607 -10.721 -5.200 1.00 0.63 H new ATOM 0 HB3 SER A 163 13.310 -9.000 -5.058 1.00 0.63 H new ATOM 0 HG SER A 163 11.583 -9.545 -3.520 1.00 1.32 H new ATOM 2516 N TYR A 164 9.622 -10.523 -4.838 1.00 0.59 N ATOM 2517 CA TYR A 164 8.537 -11.390 -4.294 1.00 0.64 C ATOM 2518 C TYR A 164 7.543 -11.728 -5.406 1.00 0.63 C ATOM 2519 O TYR A 164 6.959 -12.794 -5.423 1.00 0.68 O ATOM 2520 CB TYR A 164 7.807 -10.643 -3.173 1.00 0.69 C ATOM 2521 CG TYR A 164 6.829 -11.575 -2.492 1.00 0.72 C ATOM 2522 CD1 TYR A 164 7.300 -12.574 -1.632 1.00 1.50 C ATOM 2523 CD2 TYR A 164 5.452 -11.439 -2.717 1.00 1.34 C ATOM 2524 CE1 TYR A 164 6.398 -13.437 -0.998 1.00 1.57 C ATOM 2525 CE2 TYR A 164 4.550 -12.303 -2.082 1.00 1.35 C ATOM 2526 CZ TYR A 164 5.023 -13.301 -1.223 1.00 0.87 C ATOM 2527 OH TYR A 164 4.135 -14.152 -0.597 1.00 0.97 O ATOM 0 H TYR A 164 9.505 -9.525 -4.663 1.00 0.59 H new ATOM 0 HA TYR A 164 8.970 -12.311 -3.903 1.00 0.64 H new ATOM 0 HB2 TYR A 164 8.526 -10.262 -2.448 1.00 0.69 H new ATOM 0 HB3 TYR A 164 7.279 -9.781 -3.581 1.00 0.69 H new ATOM 0 HD1 TYR A 164 8.361 -12.679 -1.457 1.00 1.50 H new ATOM 0 HD2 TYR A 164 5.086 -10.668 -3.380 1.00 1.34 H new ATOM 0 HE1 TYR A 164 6.763 -14.208 -0.335 1.00 1.57 H new ATOM 0 HE2 TYR A 164 3.489 -12.199 -2.256 1.00 1.35 H new ATOM 0 HH TYR A 164 3.220 -13.921 -0.861 1.00 0.97 H new ATOM 2537 N PHE A 165 7.344 -10.836 -6.337 1.00 0.64 N ATOM 2538 CA PHE A 165 6.384 -11.122 -7.440 1.00 0.72 C ATOM 2539 C PHE A 165 7.018 -12.108 -8.432 1.00 0.82 C ATOM 2540 O PHE A 165 7.203 -11.809 -9.596 1.00 1.56 O ATOM 2541 CB PHE A 165 6.008 -9.806 -8.160 1.00 0.74 C ATOM 2542 CG PHE A 165 4.770 -9.197 -7.526 1.00 0.84 C ATOM 2543 CD1 PHE A 165 3.557 -9.898 -7.557 1.00 1.42 C ATOM 2544 CD2 PHE A 165 4.834 -7.936 -6.916 1.00 1.65 C ATOM 2545 CE1 PHE A 165 2.410 -9.342 -6.978 1.00 1.71 C ATOM 2546 CE2 PHE A 165 3.686 -7.381 -6.337 1.00 1.96 C ATOM 2547 CZ PHE A 165 2.475 -8.084 -6.367 1.00 1.66 C ATOM 0 H PHE A 165 7.802 -9.926 -6.382 1.00 0.64 H new ATOM 0 HA PHE A 165 5.479 -11.568 -7.027 1.00 0.72 H new ATOM 0 HB2 PHE A 165 6.838 -9.102 -8.104 1.00 0.74 H new ATOM 0 HB3 PHE A 165 5.826 -10.000 -9.217 1.00 0.74 H new ATOM 0 HD1 PHE A 165 3.507 -10.868 -8.028 1.00 1.42 H new ATOM 0 HD2 PHE A 165 5.768 -7.393 -6.893 1.00 1.65 H new ATOM 0 HE1 PHE A 165 1.476 -9.883 -7.003 1.00 1.71 H new ATOM 0 HE2 PHE A 165 3.735 -6.410 -5.867 1.00 1.96 H new ATOM 0 HZ PHE A 165 1.591 -7.655 -5.919 1.00 1.66 H new ATOM 2557 N GLY A 166 7.372 -13.280 -7.968 1.00 0.94 N ATOM 2558 CA GLY A 166 8.010 -14.294 -8.863 1.00 1.01 C ATOM 2559 C GLY A 166 7.444 -15.679 -8.548 1.00 1.23 C ATOM 2560 O GLY A 166 7.821 -16.665 -9.150 1.00 1.85 O ATOM 0 H GLY A 166 7.246 -13.580 -7.001 1.00 0.94 H new ATOM 0 HA2 GLY A 166 7.824 -14.042 -9.907 1.00 1.01 H new ATOM 0 HA3 GLY A 166 9.091 -14.290 -8.722 1.00 1.01 H new ATOM 2564 N THR A 167 6.540 -15.764 -7.609 1.00 1.51 N ATOM 2565 CA THR A 167 5.956 -17.089 -7.263 1.00 2.01 C ATOM 2566 C THR A 167 4.996 -17.527 -8.395 1.00 1.65 C ATOM 2567 O THR A 167 4.179 -16.732 -8.815 1.00 2.06 O ATOM 2568 CB THR A 167 5.170 -16.969 -5.956 1.00 3.10 C ATOM 2569 OG1 THR A 167 4.117 -16.030 -6.123 1.00 3.65 O ATOM 2570 CG2 THR A 167 6.104 -16.500 -4.841 1.00 3.92 C ATOM 0 H THR A 167 6.183 -14.976 -7.069 1.00 1.51 H new ATOM 0 HA THR A 167 6.752 -17.824 -7.145 1.00 2.01 H new ATOM 0 HB THR A 167 4.751 -17.940 -5.692 1.00 3.10 H new ATOM 0 HG1 THR A 167 3.795 -16.061 -7.048 1.00 3.65 H new ATOM 0 HG21 THR A 167 5.544 -16.414 -3.910 1.00 3.92 H new ATOM 0 HG22 THR A 167 6.911 -17.222 -4.715 1.00 3.92 H new ATOM 0 HG23 THR A 167 6.524 -15.529 -5.103 1.00 3.92 H new ATOM 2578 N PRO A 168 5.094 -18.761 -8.870 1.00 1.84 N ATOM 2579 CA PRO A 168 4.198 -19.230 -9.948 1.00 2.36 C ATOM 2580 C PRO A 168 2.734 -19.172 -9.482 1.00 1.79 C ATOM 2581 O PRO A 168 1.836 -18.913 -10.259 1.00 2.00 O ATOM 2582 CB PRO A 168 4.637 -20.687 -10.231 1.00 3.35 C ATOM 2583 CG PRO A 168 5.763 -21.042 -9.219 1.00 3.48 C ATOM 2584 CD PRO A 168 6.071 -19.771 -8.400 1.00 2.53 C ATOM 0 HA PRO A 168 4.264 -18.612 -10.843 1.00 2.36 H new ATOM 0 HB2 PRO A 168 3.794 -21.369 -10.121 1.00 3.35 H new ATOM 0 HB3 PRO A 168 4.997 -20.787 -11.255 1.00 3.35 H new ATOM 0 HG2 PRO A 168 5.447 -21.853 -8.563 1.00 3.48 H new ATOM 0 HG3 PRO A 168 6.655 -21.385 -9.743 1.00 3.48 H new ATOM 0 HD2 PRO A 168 5.964 -19.955 -7.331 1.00 2.53 H new ATOM 0 HD3 PRO A 168 7.095 -19.435 -8.564 1.00 2.53 H new ATOM 2592 N THR A 169 2.490 -19.424 -8.226 1.00 1.73 N ATOM 2593 CA THR A 169 1.089 -19.397 -7.719 1.00 1.33 C ATOM 2594 C THR A 169 0.604 -17.950 -7.604 1.00 1.05 C ATOM 2595 O THR A 169 0.843 -17.281 -6.618 1.00 1.06 O ATOM 2596 CB THR A 169 1.033 -20.064 -6.343 1.00 1.53 C ATOM 2597 OG1 THR A 169 1.806 -19.309 -5.421 1.00 1.94 O ATOM 2598 CG2 THR A 169 1.592 -21.485 -6.439 1.00 2.40 C ATOM 0 H THR A 169 3.200 -19.647 -7.529 1.00 1.73 H new ATOM 0 HA THR A 169 0.446 -19.936 -8.414 1.00 1.33 H new ATOM 0 HB THR A 169 -0.001 -20.106 -6.001 1.00 1.53 H new ATOM 0 HG1 THR A 169 1.679 -18.353 -5.593 1.00 1.94 H new ATOM 0 HG21 THR A 169 1.552 -21.959 -5.458 1.00 2.40 H new ATOM 0 HG22 THR A 169 0.997 -22.063 -7.146 1.00 2.40 H new ATOM 0 HG23 THR A 169 2.626 -21.447 -6.781 1.00 2.40 H new ATOM 2606 N TRP A 170 -0.085 -17.464 -8.601 1.00 1.04 N ATOM 2607 CA TRP A 170 -0.593 -16.064 -8.547 1.00 1.01 C ATOM 2608 C TRP A 170 -1.866 -16.022 -7.698 1.00 0.92 C ATOM 2609 O TRP A 170 -2.228 -14.998 -7.153 1.00 0.95 O ATOM 2610 CB TRP A 170 -0.910 -15.581 -9.964 1.00 1.32 C ATOM 2611 CG TRP A 170 0.264 -15.835 -10.854 1.00 1.70 C ATOM 2612 CD1 TRP A 170 0.477 -16.975 -11.551 1.00 2.30 C ATOM 2613 CD2 TRP A 170 1.385 -14.955 -11.154 1.00 2.52 C ATOM 2614 NE1 TRP A 170 1.658 -16.850 -12.260 1.00 3.04 N ATOM 2615 CE2 TRP A 170 2.255 -15.623 -12.048 1.00 3.15 C ATOM 2616 CE3 TRP A 170 1.729 -13.655 -10.742 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 3.424 -15.023 -12.517 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 2.905 -13.048 -11.212 1.00 4.37 C ATOM 2619 CH2 TRP A 170 3.751 -13.730 -12.098 1.00 4.64 C ATOM 0 H TRP A 170 -0.318 -17.977 -9.451 1.00 1.04 H new ATOM 0 HA TRP A 170 0.164 -15.417 -8.105 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -1.789 -16.099 -10.348 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -1.147 -14.517 -9.952 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -0.169 -17.840 -11.553 1.00 2.30 H new ATOM 0 HE1 TRP A 170 2.041 -17.576 -12.866 1.00 3.04 H new ATOM 0 HE3 TRP A 170 1.085 -13.120 -10.060 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 4.072 -15.554 -13.199 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 3.159 -12.049 -10.889 1.00 4.37 H new ATOM 0 HH2 TRP A 170 4.654 -13.257 -12.456 1.00 4.64 H new ATOM 2630 N GLN A 171 -2.546 -17.130 -7.583 1.00 0.88 N ATOM 2631 CA GLN A 171 -3.797 -17.161 -6.771 1.00 0.84 C ATOM 2632 C GLN A 171 -3.441 -17.196 -5.281 1.00 0.75 C ATOM 2633 O GLN A 171 -4.253 -16.867 -4.439 1.00 0.75 O ATOM 2634 CB GLN A 171 -4.608 -18.408 -7.137 1.00 0.88 C ATOM 2635 CG GLN A 171 -6.013 -18.307 -6.539 1.00 1.57 C ATOM 2636 CD GLN A 171 -6.775 -19.607 -6.805 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -6.997 -19.972 -7.943 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -7.186 -20.327 -5.797 1.00 2.34 N ATOM 0 H GLN A 171 -2.289 -18.017 -8.017 1.00 0.88 H new ATOM 0 HA GLN A 171 -4.389 -16.269 -6.978 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -4.670 -18.507 -8.221 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -4.107 -19.301 -6.763 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -5.951 -18.122 -5.467 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -6.547 -17.464 -6.977 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -7.000 -20.021 -4.842 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -7.693 -21.196 -5.964 1.00 2.34 H new ATOM 2647 N THR A 172 -2.235 -17.567 -4.941 1.00 0.67 N ATOM 2648 CA THR A 172 -1.850 -17.589 -3.498 1.00 0.60 C ATOM 2649 C THR A 172 -1.521 -16.156 -3.059 1.00 0.59 C ATOM 2650 O THR A 172 -1.565 -15.842 -1.888 1.00 0.74 O ATOM 2651 CB THR A 172 -0.625 -18.499 -3.296 1.00 0.59 C ATOM 2652 OG1 THR A 172 -1.035 -19.857 -3.369 1.00 0.81 O ATOM 2653 CG2 THR A 172 -0.001 -18.224 -1.922 1.00 0.92 C ATOM 0 H THR A 172 -1.505 -17.854 -5.593 1.00 0.67 H new ATOM 0 HA THR A 172 -2.672 -17.980 -2.898 1.00 0.60 H new ATOM 0 HB THR A 172 0.113 -18.297 -4.072 1.00 0.59 H new ATOM 0 HG1 THR A 172 -0.258 -20.441 -3.243 1.00 0.81 H new ATOM 0 HG21 THR A 172 0.866 -18.869 -1.781 1.00 0.92 H new ATOM 0 HG22 THR A 172 0.310 -17.181 -1.866 1.00 0.92 H new ATOM 0 HG23 THR A 172 -0.735 -18.426 -1.142 1.00 0.92 H new ATOM 2661 N VAL A 173 -1.223 -15.280 -3.977 1.00 0.59 N ATOM 2662 CA VAL A 173 -0.926 -13.867 -3.598 1.00 0.58 C ATOM 2663 C VAL A 173 -2.246 -13.102 -3.512 1.00 0.57 C ATOM 2664 O VAL A 173 -2.415 -12.242 -2.670 1.00 0.60 O ATOM 2665 CB VAL A 173 -0.026 -13.238 -4.668 1.00 0.64 C ATOM 2666 CG1 VAL A 173 0.086 -11.727 -4.440 1.00 1.13 C ATOM 2667 CG2 VAL A 173 1.367 -13.866 -4.590 1.00 1.01 C ATOM 0 H VAL A 173 -1.172 -15.480 -4.976 1.00 0.59 H new ATOM 0 HA VAL A 173 -0.415 -13.829 -2.636 1.00 0.58 H new ATOM 0 HB VAL A 173 -0.460 -13.419 -5.651 1.00 0.64 H new ATOM 0 HG11 VAL A 173 0.727 -11.290 -5.205 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -0.905 -11.276 -4.496 1.00 1.13 H new ATOM 0 HG13 VAL A 173 0.515 -11.538 -3.456 1.00 1.13 H new ATOM 0 HG21 VAL A 173 2.010 -13.421 -5.350 1.00 1.01 H new ATOM 0 HG22 VAL A 173 1.793 -13.685 -3.603 1.00 1.01 H new ATOM 0 HG23 VAL A 173 1.292 -14.940 -4.762 1.00 1.01 H new ATOM 2677 N THR A 174 -3.192 -13.417 -4.344 1.00 0.55 N ATOM 2678 CA THR A 174 -4.499 -12.710 -4.265 1.00 0.56 C ATOM 2679 C THR A 174 -5.189 -13.115 -2.958 1.00 0.53 C ATOM 2680 O THR A 174 -5.864 -12.323 -2.331 1.00 0.55 O ATOM 2681 CB THR A 174 -5.370 -13.117 -5.456 1.00 0.59 C ATOM 2682 OG1 THR A 174 -5.446 -14.534 -5.521 1.00 1.37 O ATOM 2683 CG2 THR A 174 -4.752 -12.578 -6.747 1.00 1.27 C ATOM 0 H THR A 174 -3.121 -14.128 -5.072 1.00 0.55 H new ATOM 0 HA THR A 174 -4.348 -11.631 -4.288 1.00 0.56 H new ATOM 0 HB THR A 174 -6.371 -12.704 -5.334 1.00 0.59 H new ATOM 0 HG1 THR A 174 -6.005 -14.797 -6.282 1.00 1.37 H new ATOM 0 HG21 THR A 174 -5.372 -12.868 -7.596 1.00 1.27 H new ATOM 0 HG22 THR A 174 -4.692 -11.491 -6.696 1.00 1.27 H new ATOM 0 HG23 THR A 174 -3.751 -12.991 -6.871 1.00 1.27 H new ATOM 2691 N ILE A 175 -5.032 -14.344 -2.547 1.00 0.51 N ATOM 2692 CA ILE A 175 -5.685 -14.802 -1.285 1.00 0.50 C ATOM 2693 C ILE A 175 -4.855 -14.344 -0.079 1.00 0.49 C ATOM 2694 O ILE A 175 -5.353 -14.231 1.023 1.00 0.49 O ATOM 2695 CB ILE A 175 -5.758 -16.329 -1.297 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -6.633 -16.788 -2.466 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -6.354 -16.839 0.017 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -6.465 -18.295 -2.670 1.00 0.89 C ATOM 0 H ILE A 175 -4.479 -15.052 -3.030 1.00 0.51 H new ATOM 0 HA ILE A 175 -6.687 -14.378 -1.213 1.00 0.50 H new ATOM 0 HB ILE A 175 -4.752 -16.732 -1.410 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -7.678 -16.552 -2.266 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -6.354 -16.254 -3.374 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -6.401 -17.928 -0.003 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -5.728 -16.518 0.849 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -7.359 -16.435 0.142 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -7.088 -18.621 -3.503 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -5.421 -18.518 -2.889 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -6.766 -18.821 -1.764 1.00 0.89 H new ATOM 2710 N PHE A 176 -3.594 -14.067 -0.287 1.00 0.48 N ATOM 2711 CA PHE A 176 -2.727 -13.601 0.837 1.00 0.49 C ATOM 2712 C PHE A 176 -3.144 -12.185 1.238 1.00 0.49 C ATOM 2713 O PHE A 176 -3.346 -11.903 2.400 1.00 0.56 O ATOM 2714 CB PHE A 176 -1.271 -13.570 0.364 1.00 0.51 C ATOM 2715 CG PHE A 176 -0.372 -13.258 1.535 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -0.069 -11.929 1.851 1.00 1.23 C ATOM 2717 CD2 PHE A 176 0.157 -14.300 2.308 1.00 1.41 C ATOM 2718 CE1 PHE A 176 0.763 -11.640 2.939 1.00 1.22 C ATOM 2719 CE2 PHE A 176 0.989 -14.011 3.395 1.00 1.52 C ATOM 2720 CZ PHE A 176 1.292 -12.682 3.711 1.00 0.76 C ATOM 0 H PHE A 176 -3.125 -14.144 -1.190 1.00 0.48 H new ATOM 0 HA PHE A 176 -2.831 -14.275 1.687 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -0.998 -14.531 -0.073 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -1.146 -12.818 -0.415 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -0.477 -11.126 1.255 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -0.077 -15.326 2.065 1.00 1.41 H new ATOM 0 HE1 PHE A 176 0.997 -10.614 3.183 1.00 1.22 H new ATOM 0 HE2 PHE A 176 1.398 -14.814 3.990 1.00 1.52 H new ATOM 0 HZ PHE A 176 1.934 -12.460 4.551 1.00 0.76 H new ATOM 2730 N VAL A 177 -3.246 -11.286 0.298 1.00 0.46 N ATOM 2731 CA VAL A 177 -3.621 -9.884 0.645 1.00 0.48 C ATOM 2732 C VAL A 177 -5.130 -9.783 0.876 1.00 0.44 C ATOM 2733 O VAL A 177 -5.589 -8.967 1.650 1.00 0.57 O ATOM 2734 CB VAL A 177 -3.228 -8.962 -0.511 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -1.726 -9.084 -0.778 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -3.999 -9.367 -1.770 1.00 1.24 C ATOM 0 H VAL A 177 -3.086 -11.460 -0.694 1.00 0.46 H new ATOM 0 HA VAL A 177 -3.101 -9.589 1.556 1.00 0.48 H new ATOM 0 HB VAL A 177 -3.468 -7.932 -0.248 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -1.448 -8.426 -1.602 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -1.173 -8.798 0.117 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -1.485 -10.114 -1.039 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -3.720 -8.711 -2.594 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -3.757 -10.398 -2.029 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -5.070 -9.281 -1.584 1.00 1.24 H new ATOM 2746 N ALA A 178 -5.905 -10.600 0.225 1.00 0.45 N ATOM 2747 CA ALA A 178 -7.380 -10.534 0.426 1.00 0.43 C ATOM 2748 C ALA A 178 -7.747 -11.151 1.779 1.00 0.40 C ATOM 2749 O ALA A 178 -8.448 -10.559 2.575 1.00 0.40 O ATOM 2750 CB ALA A 178 -8.081 -11.307 -0.691 1.00 0.46 C ATOM 0 H ALA A 178 -5.585 -11.309 -0.435 1.00 0.45 H new ATOM 0 HA ALA A 178 -7.699 -9.492 0.407 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -9.160 -11.259 -0.545 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -7.826 -10.866 -1.654 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -7.758 -12.348 -0.671 1.00 0.46 H new ATOM 2756 N GLY A 179 -7.288 -12.345 2.037 1.00 0.41 N ATOM 2757 CA GLY A 179 -7.618 -13.014 3.328 1.00 0.43 C ATOM 2758 C GLY A 179 -7.174 -12.146 4.506 1.00 0.43 C ATOM 2759 O GLY A 179 -7.959 -11.810 5.371 1.00 0.48 O ATOM 0 H GLY A 179 -6.697 -12.888 1.408 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -8.691 -13.197 3.387 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -7.126 -13.985 3.378 1.00 0.43 H new ATOM 2763 N VAL A 180 -5.920 -11.798 4.562 1.00 0.42 N ATOM 2764 CA VAL A 180 -5.428 -10.975 5.700 1.00 0.45 C ATOM 2765 C VAL A 180 -6.163 -9.636 5.772 1.00 0.45 C ATOM 2766 O VAL A 180 -6.444 -9.121 6.838 1.00 0.43 O ATOM 2767 CB VAL A 180 -3.925 -10.713 5.547 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -3.677 -9.797 4.341 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -3.397 -10.033 6.816 1.00 1.41 C ATOM 0 H VAL A 180 -5.214 -12.048 3.869 1.00 0.42 H new ATOM 0 HA VAL A 180 -5.618 -11.530 6.619 1.00 0.45 H new ATOM 0 HB VAL A 180 -3.408 -11.660 5.393 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -2.608 -9.614 4.237 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -4.053 -10.276 3.437 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -4.194 -8.849 4.491 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -2.328 -9.845 6.711 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -3.918 -9.088 6.966 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -3.568 -10.682 7.675 1.00 1.41 H new ATOM 2779 N LEU A 181 -6.460 -9.056 4.636 1.00 0.49 N ATOM 2780 CA LEU A 181 -7.151 -7.740 4.636 1.00 0.50 C ATOM 2781 C LEU A 181 -8.539 -7.903 5.261 1.00 0.49 C ATOM 2782 O LEU A 181 -9.026 -7.056 5.984 1.00 0.51 O ATOM 2783 CB LEU A 181 -7.275 -7.256 3.186 1.00 0.56 C ATOM 2784 CG LEU A 181 -8.159 -6.008 3.096 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -7.652 -4.924 4.049 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -8.123 -5.489 1.656 1.00 1.20 C ATOM 0 H LEU A 181 -6.253 -9.439 3.714 1.00 0.49 H new ATOM 0 HA LEU A 181 -6.587 -7.010 5.216 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -6.285 -7.034 2.787 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -7.697 -8.050 2.569 1.00 0.56 H new ATOM 0 HG LEU A 181 -9.180 -6.263 3.380 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -8.291 -4.044 3.973 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -7.673 -5.300 5.072 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -6.630 -4.654 3.783 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -8.748 -4.600 1.574 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -7.097 -5.238 1.385 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -8.498 -6.259 0.982 1.00 1.20 H new ATOM 2798 N THR A 182 -9.177 -9.007 4.960 1.00 0.49 N ATOM 2799 CA THR A 182 -10.541 -9.276 5.495 1.00 0.51 C ATOM 2800 C THR A 182 -10.472 -9.494 7.007 1.00 0.48 C ATOM 2801 O THR A 182 -11.340 -9.072 7.746 1.00 0.51 O ATOM 2802 CB THR A 182 -11.110 -10.529 4.819 1.00 0.54 C ATOM 2803 OG1 THR A 182 -10.952 -10.417 3.411 1.00 1.16 O ATOM 2804 CG2 THR A 182 -12.595 -10.670 5.156 1.00 1.07 C ATOM 0 H THR A 182 -8.803 -9.741 4.358 1.00 0.49 H new ATOM 0 HA THR A 182 -11.187 -8.423 5.288 1.00 0.51 H new ATOM 0 HB THR A 182 -10.576 -11.408 5.179 1.00 0.54 H new ATOM 0 HG1 THR A 182 -10.119 -10.857 3.139 1.00 1.16 H new ATOM 0 HG21 THR A 182 -12.995 -11.562 4.673 1.00 1.07 H new ATOM 0 HG22 THR A 182 -12.716 -10.757 6.236 1.00 1.07 H new ATOM 0 HG23 THR A 182 -13.134 -9.792 4.800 1.00 1.07 H new ATOM 2812 N ALA A 183 -9.452 -10.163 7.473 1.00 0.45 N ATOM 2813 CA ALA A 183 -9.335 -10.420 8.936 1.00 0.44 C ATOM 2814 C ALA A 183 -9.491 -9.099 9.695 1.00 0.44 C ATOM 2815 O ALA A 183 -10.318 -8.964 10.575 1.00 0.50 O ATOM 2816 CB ALA A 183 -7.962 -11.025 9.238 1.00 0.46 C ATOM 0 H ALA A 183 -8.695 -10.542 6.904 1.00 0.45 H new ATOM 0 HA ALA A 183 -10.114 -11.115 9.250 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -7.875 -11.214 10.308 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -7.850 -11.963 8.694 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -7.182 -10.330 8.927 1.00 0.46 H new ATOM 2822 N SER A 184 -8.708 -8.122 9.333 1.00 0.47 N ATOM 2823 CA SER A 184 -8.803 -6.788 9.999 1.00 0.51 C ATOM 2824 C SER A 184 -10.247 -6.288 9.920 1.00 0.54 C ATOM 2825 O SER A 184 -10.786 -5.743 10.866 1.00 0.56 O ATOM 2826 CB SER A 184 -7.886 -5.795 9.288 1.00 0.62 C ATOM 2827 OG SER A 184 -7.938 -4.545 9.964 1.00 1.55 O ATOM 0 H SER A 184 -8.001 -8.188 8.600 1.00 0.47 H new ATOM 0 HA SER A 184 -8.500 -6.879 11.042 1.00 0.51 H new ATOM 0 HB2 SER A 184 -6.863 -6.172 9.273 1.00 0.62 H new ATOM 0 HB3 SER A 184 -8.196 -5.674 8.250 1.00 0.62 H new ATOM 0 HG SER A 184 -7.146 -4.015 9.734 1.00 1.55 H new ATOM 2833 N LEU A 185 -10.884 -6.498 8.804 1.00 0.58 N ATOM 2834 CA LEU A 185 -12.297 -6.069 8.639 1.00 0.69 C ATOM 2835 C LEU A 185 -13.212 -6.999 9.436 1.00 0.69 C ATOM 2836 O LEU A 185 -14.227 -6.605 9.976 1.00 0.79 O ATOM 2837 CB LEU A 185 -12.652 -6.187 7.146 1.00 0.71 C ATOM 2838 CG LEU A 185 -13.965 -5.439 6.836 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -13.837 -3.936 7.167 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -14.284 -5.616 5.346 1.00 1.18 C ATOM 0 H LEU A 185 -10.478 -6.956 7.988 1.00 0.58 H new ATOM 0 HA LEU A 185 -12.425 -5.046 8.994 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -11.843 -5.777 6.541 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -12.753 -7.237 6.873 1.00 0.71 H new ATOM 0 HG LEU A 185 -14.766 -5.851 7.450 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -14.776 -3.432 6.939 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -13.608 -3.815 8.226 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -13.037 -3.499 6.570 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -15.210 -5.093 5.108 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -13.471 -5.204 4.748 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -14.398 -6.677 5.122 1.00 1.18 H new ATOM 2852 N THR A 186 -12.830 -8.247 9.496 1.00 0.62 N ATOM 2853 CA THR A 186 -13.614 -9.276 10.232 1.00 0.68 C ATOM 2854 C THR A 186 -13.596 -9.018 11.734 1.00 0.62 C ATOM 2855 O THR A 186 -14.628 -8.991 12.375 1.00 0.64 O ATOM 2856 CB THR A 186 -12.974 -10.644 9.991 1.00 0.73 C ATOM 2857 OG1 THR A 186 -12.806 -10.845 8.595 1.00 0.89 O ATOM 2858 CG2 THR A 186 -13.885 -11.737 10.559 1.00 1.00 C ATOM 0 H THR A 186 -11.983 -8.603 9.052 1.00 0.62 H new ATOM 0 HA THR A 186 -14.643 -9.240 9.874 1.00 0.68 H new ATOM 0 HB THR A 186 -12.003 -10.687 10.484 1.00 0.73 H new ATOM 0 HG1 THR A 186 -12.524 -10.005 8.175 1.00 0.89 H new ATOM 0 HG21 THR A 186 -13.432 -12.713 10.389 1.00 1.00 H new ATOM 0 HG22 THR A 186 -14.018 -11.580 11.629 1.00 1.00 H new ATOM 0 HG23 THR A 186 -14.855 -11.696 10.063 1.00 1.00 H new ATOM 2866 N ILE A 187 -12.437 -8.861 12.320 1.00 0.64 N ATOM 2867 CA ILE A 187 -12.396 -8.653 13.789 1.00 0.66 C ATOM 2868 C ILE A 187 -13.053 -7.323 14.134 1.00 0.66 C ATOM 2869 O ILE A 187 -13.432 -7.102 15.268 1.00 0.75 O ATOM 2870 CB ILE A 187 -10.943 -8.673 14.283 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -10.148 -7.535 13.611 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -10.301 -10.014 13.921 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -8.704 -7.485 14.143 1.00 0.87 C ATOM 0 H ILE A 187 -11.532 -8.868 11.849 1.00 0.64 H new ATOM 0 HA ILE A 187 -12.941 -9.458 14.282 1.00 0.66 H new ATOM 0 HB ILE A 187 -10.930 -8.537 15.364 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -10.137 -7.682 12.531 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -10.642 -6.581 13.798 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -9.269 -10.030 14.271 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -10.857 -10.823 14.394 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -10.319 -10.146 12.839 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -8.164 -6.674 13.654 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -8.719 -7.314 15.219 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -8.206 -8.431 13.933 1.00 0.87 H new ATOM 2885 N TRP A 188 -13.141 -6.401 13.210 1.00 0.64 N ATOM 2886 CA TRP A 188 -13.724 -5.074 13.555 1.00 0.70 C ATOM 2887 C TRP A 188 -15.067 -5.258 14.285 1.00 0.81 C ATOM 2888 O TRP A 188 -15.646 -4.306 14.768 1.00 1.06 O ATOM 2889 CB TRP A 188 -13.918 -4.278 12.251 1.00 0.85 C ATOM 2890 CG TRP A 188 -13.748 -2.813 12.492 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -12.575 -2.146 12.408 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -14.760 -1.826 12.838 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -12.801 -0.811 12.686 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -14.133 -0.563 12.958 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -16.146 -1.902 13.060 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -14.856 0.583 13.285 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -16.877 -0.750 13.391 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -16.233 0.490 13.503 1.00 1.71 C ATOM 0 H TRP A 188 -12.837 -6.509 12.242 1.00 0.64 H new ATOM 0 HA TRP A 188 -13.055 -4.530 14.221 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -13.198 -4.614 11.504 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -14.911 -4.471 11.846 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -11.619 -2.584 12.164 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -12.073 -0.096 12.690 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -16.652 -2.853 12.975 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -14.355 1.536 13.369 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -17.941 -0.820 13.560 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -16.801 1.373 13.758 1.00 1.71 H new ATOM 2909 N LYS A 189 -15.553 -6.471 14.376 1.00 0.95 N ATOM 2910 CA LYS A 189 -16.838 -6.734 15.082 1.00 1.23 C ATOM 2911 C LYS A 189 -18.019 -6.301 14.210 1.00 1.53 C ATOM 2912 O LYS A 189 -18.436 -5.160 14.241 1.00 2.02 O ATOM 2913 CB LYS A 189 -16.857 -5.967 16.418 1.00 1.90 C ATOM 2914 CG LYS A 189 -17.720 -6.717 17.445 1.00 2.68 C ATOM 2915 CD LYS A 189 -17.647 -6.009 18.805 1.00 3.60 C ATOM 2916 CE LYS A 189 -18.617 -4.822 18.838 1.00 4.51 C ATOM 2917 NZ LYS A 189 -18.634 -4.234 20.207 1.00 5.09 N ATOM 0 H LYS A 189 -15.105 -7.299 13.984 1.00 0.95 H new ATOM 0 HA LYS A 189 -16.926 -7.802 15.279 1.00 1.23 H new ATOM 0 HB2 LYS A 189 -15.841 -5.856 16.797 1.00 1.90 H new ATOM 0 HB3 LYS A 189 -17.251 -4.963 16.264 1.00 1.90 H new ATOM 0 HG2 LYS A 189 -18.754 -6.760 17.102 1.00 2.68 H new ATOM 0 HG3 LYS A 189 -17.374 -7.746 17.542 1.00 2.68 H new ATOM 0 HD2 LYS A 189 -17.893 -6.711 19.602 1.00 3.60 H new ATOM 0 HD3 LYS A 189 -16.630 -5.662 18.988 1.00 3.60 H new ATOM 0 HE2 LYS A 189 -18.313 -4.069 18.111 1.00 4.51 H new ATOM 0 HE3 LYS A 189 -19.619 -5.149 18.558 1.00 4.51 H new ATOM 0 HZ1 LYS A 189 -19.292 -3.429 20.231 1.00 5.09 H new ATOM 0 HZ2 LYS A 189 -18.944 -4.954 20.890 1.00 5.09 H new ATOM 0 HZ3 LYS A 189 -17.678 -3.908 20.457 1.00 5.09 H new ATOM 2931 N LYS A 190 -18.566 -7.209 13.438 1.00 2.36 N ATOM 2932 CA LYS A 190 -19.732 -6.866 12.564 1.00 3.37 C ATOM 2933 C LYS A 190 -20.989 -7.540 13.116 1.00 3.71 C ATOM 2934 O LYS A 190 -21.764 -6.936 13.831 1.00 4.35 O ATOM 2935 CB LYS A 190 -19.465 -7.358 11.137 1.00 4.30 C ATOM 2936 CG LYS A 190 -20.635 -6.962 10.228 1.00 5.08 C ATOM 2937 CD LYS A 190 -20.361 -7.445 8.797 1.00 5.78 C ATOM 2938 CE LYS A 190 -21.673 -7.503 8.010 1.00 6.76 C ATOM 2939 NZ LYS A 190 -22.495 -8.645 8.503 1.00 7.40 N ATOM 0 H LYS A 190 -18.253 -8.178 13.376 1.00 2.36 H new ATOM 0 HA LYS A 190 -19.875 -5.786 12.549 1.00 3.37 H new ATOM 0 HB2 LYS A 190 -18.537 -6.927 10.761 1.00 4.30 H new ATOM 0 HB3 LYS A 190 -19.338 -8.441 11.133 1.00 4.30 H new ATOM 0 HG2 LYS A 190 -21.562 -7.400 10.599 1.00 5.08 H new ATOM 0 HG3 LYS A 190 -20.767 -5.880 10.239 1.00 5.08 H new ATOM 0 HD2 LYS A 190 -19.660 -6.772 8.304 1.00 5.78 H new ATOM 0 HD3 LYS A 190 -19.895 -8.430 8.819 1.00 5.78 H new ATOM 0 HE2 LYS A 190 -22.222 -6.568 8.127 1.00 6.76 H new ATOM 0 HE3 LYS A 190 -21.467 -7.621 6.946 1.00 6.76 H new ATOM 0 HZ1 LYS A 190 -23.143 -8.956 7.751 1.00 7.40 H new ATOM 0 HZ2 LYS A 190 -21.870 -9.433 8.770 1.00 7.40 H new ATOM 0 HZ3 LYS A 190 -23.046 -8.344 9.332 1.00 7.40 H new ATOM 2953 N MET A 191 -21.201 -8.786 12.788 1.00 3.81 N ATOM 2954 CA MET A 191 -22.412 -9.499 13.290 1.00 4.63 C ATOM 2955 C MET A 191 -22.106 -10.128 14.653 1.00 4.97 C ATOM 2956 O MET A 191 -22.822 -9.928 15.614 1.00 5.27 O ATOM 2957 CB MET A 191 -22.802 -10.594 12.286 1.00 5.48 C ATOM 2958 CG MET A 191 -24.254 -11.026 12.509 1.00 5.71 C ATOM 2959 SD MET A 191 -24.381 -11.953 14.059 1.00 7.00 S ATOM 2960 CE MET A 191 -25.772 -13.005 13.578 1.00 7.52 C ATOM 0 H MET A 191 -20.587 -9.342 12.193 1.00 3.81 H new ATOM 0 HA MET A 191 -23.237 -8.795 13.399 1.00 4.63 H new ATOM 0 HB2 MET A 191 -22.677 -10.225 11.268 1.00 5.48 H new ATOM 0 HB3 MET A 191 -22.139 -11.452 12.397 1.00 5.48 H new ATOM 0 HG2 MET A 191 -24.903 -10.151 12.543 1.00 5.71 H new ATOM 0 HG3 MET A 191 -24.593 -11.642 11.676 1.00 5.71 H new ATOM 0 HE1 MET A 191 -26.026 -13.672 14.402 1.00 7.52 H new ATOM 0 HE2 MET A 191 -26.633 -12.382 13.337 1.00 7.52 H new ATOM 0 HE3 MET A 191 -25.496 -13.596 12.705 1.00 7.52 H new ATOM 2970 N GLY A 192 -21.045 -10.883 14.745 1.00 5.37 N ATOM 2971 CA GLY A 192 -20.694 -11.521 16.045 1.00 6.15 C ATOM 2972 C GLY A 192 -21.715 -12.612 16.372 1.00 6.68 C ATOM 2973 O GLY A 192 -21.700 -13.630 15.699 1.00 7.01 O ATOM 2974 OXT GLY A 192 -22.493 -12.412 17.290 1.00 7.06 O ATOM 0 H GLY A 192 -20.406 -11.085 13.976 1.00 5.37 H new ATOM 0 HA2 GLY A 192 -19.693 -11.949 15.993 1.00 6.15 H new ATOM 0 HA3 GLY A 192 -20.680 -10.772 16.837 1.00 6.15 H new TER 2978 GLY A 192