USER MOD reduce.3.24.130724 H: found=0, std=0, add=1489, rem=0, adj=37 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 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 186 THR OG1 : rot 59:sc= 0.391 USER MOD Set 2.1: A 28 GLN : amide:sc= -1.92! C(o=-2!,f=-8.2!) USER MOD Set 2.2: A 137 MET CE :methyl 138:sc= -0.106 (180deg=-0.581) USER MOD Set 3.1: A 126 CYS SG : rot -56:sc= 0.983 USER MOD Set 3.2: A 127 THR OG1 : rot -47:sc= -1.72! USER MOD Set 4.1: A 16 SER OG : rot 180:sc= -2.02 USER MOD Set 4.2: A 153 GLN : amide:sc= -1.96 X(o=-4,f=-3.7!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.28 (180deg=-1.06) USER MOD Single : A 4 SER OG : rot -12:sc= 0.835 USER MOD Single : A 7 GLN : amide:sc= -0.0206 K(o=-0.021,f=-2!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.854 USER MOD Single : A 18 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.3) USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 80:sc= 0.244 USER MOD Single : A 32 GLN : amide:sc= -0.046 X(o=-0.046,f=-0.046) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc=-0.00533 K(o=-0.0053,f=-0.88) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.265) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot -69:sc= 0.579 USER MOD Single : A 62 CYS SG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 143:sc= -0.186 (180deg=-0.601) USER MOD Single : A 72 SER OG : rot 98:sc= 0.925 USER MOD Single : A 73 ASN : amide:sc= -7.52! C(o=-7.5!,f=-8.6!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.105 K(o=-0.1,f=-2.2!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot -17:sc= 0.636 USER MOD Single : A 99 MET CE :methyl -162:sc= 0 (180deg=-0.675) USER MOD Single : A 101 SER OG : rot -55:sc= 0.954 USER MOD Single : A 104 ASN : amide:sc= -0.0895 X(o=-0.09,f=0) USER MOD Single : A 106 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot -80:sc= 0.619 USER MOD Single : A 119 LYS NZ :NH3+ -105:sc= -1.78 (180deg=-5.68!) USER MOD Single : A 123 LYS NZ :NH3+ -130:sc= -2.67! (180deg=-5.02!) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 81:sc= 0.0803 USER MOD Single : A 140 THR OG1 : rot -21:sc= -0.868 USER MOD Single : A 155 GLN : amide:sc= 0.162 X(o=0.16,f=-0.26) USER MOD Single : A 163 SER OG : rot 91:sc= 1.23 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 180:sc=-0.00268 USER MOD Single : A 169 THR OG1 : rot 16:sc=-0.000629 USER MOD Single : A 171 GLN : amide:sc= -4.41! C(o=-4.4!,f=-6!) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 THR OG1 : rot 76:sc= 0.979 USER MOD Single : A 182 THR OG1 : rot 88:sc= 1.05 USER MOD Single : A 184 SER OG : rot 160:sc= -0.543 USER MOD Single : A 189 LYS NZ :NH3+ -152:sc= -0.0698 (180deg=-0.516) USER MOD Single : A 190 LYS NZ :NH3+ 158:sc= -0.0896 (180deg=-0.656) USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 38.275 8.494 -21.518 1.00 17.15 N ATOM 2 CA MET A 1 38.922 7.998 -20.270 1.00 16.73 C ATOM 3 C MET A 1 38.832 9.075 -19.186 1.00 16.39 C ATOM 4 O MET A 1 39.031 8.811 -18.017 1.00 16.40 O ATOM 5 CB MET A 1 40.392 7.680 -20.550 1.00 16.98 C ATOM 6 CG MET A 1 40.484 6.617 -21.646 1.00 17.51 C ATOM 7 SD MET A 1 42.225 6.283 -22.021 1.00 17.69 S ATOM 8 CE MET A 1 41.972 4.919 -23.189 1.00 17.86 C ATOM 0 H1 MET A 1 38.060 7.689 -22.141 1.00 17.15 H new ATOM 0 H2 MET A 1 37.393 8.991 -21.278 1.00 17.15 H new ATOM 0 H3 MET A 1 38.919 9.148 -22.007 1.00 17.15 H new ATOM 0 HA MET A 1 38.413 7.096 -19.930 1.00 16.73 H new ATOM 0 HB2 MET A 1 40.918 8.583 -20.859 1.00 16.98 H new ATOM 0 HB3 MET A 1 40.878 7.324 -19.641 1.00 16.98 H new ATOM 0 HG2 MET A 1 39.989 5.702 -21.322 1.00 17.51 H new ATOM 0 HG3 MET A 1 39.967 6.959 -22.543 1.00 17.51 H new ATOM 0 HE1 MET A 1 42.938 4.562 -23.546 1.00 17.86 H new ATOM 0 HE2 MET A 1 41.446 4.105 -22.690 1.00 17.86 H new ATOM 0 HE3 MET A 1 41.380 5.269 -24.034 1.00 17.86 H new ATOM 20 N ASP A 2 38.534 10.287 -19.566 1.00 16.24 N ATOM 21 CA ASP A 2 38.433 11.380 -18.558 1.00 16.07 C ATOM 22 C ASP A 2 37.209 11.148 -17.667 1.00 15.50 C ATOM 23 O ASP A 2 36.224 10.574 -18.087 1.00 15.56 O ATOM 24 CB ASP A 2 38.293 12.724 -19.276 1.00 16.42 C ATOM 25 CG ASP A 2 39.466 12.913 -20.239 1.00 16.67 C ATOM 26 OD1 ASP A 2 40.588 12.989 -19.767 1.00 16.77 O ATOM 27 OD2 ASP A 2 39.223 12.977 -21.433 1.00 16.88 O ATOM 0 H ASP A 2 38.356 10.568 -20.530 1.00 16.24 H new ATOM 0 HA ASP A 2 39.332 11.387 -17.942 1.00 16.07 H new ATOM 0 HB2 ASP A 2 37.351 12.760 -19.823 1.00 16.42 H new ATOM 0 HB3 ASP A 2 38.271 13.536 -18.549 1.00 16.42 H new ATOM 32 N GLY A 3 37.265 11.590 -16.440 1.00 15.11 N ATOM 33 CA GLY A 3 36.107 11.394 -15.522 1.00 14.72 C ATOM 34 C GLY A 3 35.904 9.899 -15.269 1.00 14.60 C ATOM 35 O GLY A 3 35.516 9.153 -16.146 1.00 14.88 O ATOM 0 H GLY A 3 38.063 12.078 -16.034 1.00 15.11 H new ATOM 0 HA2 GLY A 3 36.284 11.912 -14.580 1.00 14.72 H new ATOM 0 HA3 GLY A 3 35.206 11.825 -15.958 1.00 14.72 H new ATOM 39 N SER A 4 36.166 9.461 -14.066 1.00 14.34 N ATOM 40 CA SER A 4 35.995 8.019 -13.734 1.00 14.41 C ATOM 41 C SER A 4 35.877 7.861 -12.215 1.00 13.79 C ATOM 42 O SER A 4 34.872 8.205 -11.624 1.00 14.02 O ATOM 43 CB SER A 4 37.207 7.234 -14.237 1.00 14.82 C ATOM 44 OG SER A 4 37.251 7.298 -15.657 1.00 14.88 O ATOM 0 H SER A 4 36.493 10.045 -13.296 1.00 14.34 H new ATOM 0 HA SER A 4 35.093 7.637 -14.212 1.00 14.41 H new ATOM 0 HB2 SER A 4 38.123 7.646 -13.814 1.00 14.82 H new ATOM 0 HB3 SER A 4 37.144 6.196 -13.910 1.00 14.82 H new ATOM 0 HG SER A 4 36.406 7.662 -15.994 1.00 14.88 H new ATOM 50 N GLY A 5 36.896 7.347 -11.576 1.00 13.15 N ATOM 51 CA GLY A 5 36.842 7.173 -10.092 1.00 12.67 C ATOM 52 C GLY A 5 37.709 5.980 -9.681 1.00 12.31 C ATOM 53 O GLY A 5 37.692 4.941 -10.310 1.00 12.37 O ATOM 0 H GLY A 5 37.763 7.040 -12.017 1.00 13.15 H new ATOM 0 HA2 GLY A 5 37.194 8.078 -9.597 1.00 12.67 H new ATOM 0 HA3 GLY A 5 35.812 7.014 -9.772 1.00 12.67 H new ATOM 57 N GLU A 6 38.467 6.122 -8.626 1.00 12.14 N ATOM 58 CA GLU A 6 39.332 4.996 -8.172 1.00 12.01 C ATOM 59 C GLU A 6 38.474 3.971 -7.421 1.00 11.53 C ATOM 60 O GLU A 6 38.704 2.780 -7.495 1.00 11.57 O ATOM 61 CB GLU A 6 40.430 5.540 -7.245 1.00 12.39 C ATOM 62 CG GLU A 6 39.866 6.690 -6.403 1.00 12.94 C ATOM 63 CD GLU A 6 40.783 6.949 -5.205 1.00 13.31 C ATOM 64 OE1 GLU A 6 40.914 6.059 -4.380 1.00 13.50 O ATOM 65 OE2 GLU A 6 41.340 8.032 -5.132 1.00 13.55 O ATOM 0 H GLU A 6 38.524 6.969 -8.060 1.00 12.14 H new ATOM 0 HA GLU A 6 39.796 4.515 -9.033 1.00 12.01 H new ATOM 0 HB2 GLU A 6 40.798 4.746 -6.595 1.00 12.39 H new ATOM 0 HB3 GLU A 6 41.278 5.889 -7.834 1.00 12.39 H new ATOM 0 HG2 GLU A 6 39.782 7.591 -7.010 1.00 12.94 H new ATOM 0 HG3 GLU A 6 38.862 6.443 -6.058 1.00 12.94 H new ATOM 72 N GLN A 7 37.483 4.426 -6.703 1.00 11.25 N ATOM 73 CA GLN A 7 36.606 3.482 -5.952 1.00 10.97 C ATOM 74 C GLN A 7 35.257 4.163 -5.664 1.00 10.29 C ATOM 75 O GLN A 7 34.953 4.452 -4.523 1.00 10.41 O ATOM 76 CB GLN A 7 37.279 3.095 -4.630 1.00 11.52 C ATOM 77 CG GLN A 7 37.895 4.333 -3.979 1.00 12.08 C ATOM 78 CD GLN A 7 38.346 3.991 -2.558 1.00 12.56 C ATOM 79 OE1 GLN A 7 37.936 2.991 -2.002 1.00 12.91 O ATOM 80 NE2 GLN A 7 39.180 4.783 -1.943 1.00 12.77 N ATOM 0 H GLN A 7 37.242 5.412 -6.604 1.00 11.25 H new ATOM 0 HA GLN A 7 36.442 2.584 -6.548 1.00 10.97 H new ATOM 0 HB2 GLN A 7 36.548 2.645 -3.958 1.00 11.52 H new ATOM 0 HB3 GLN A 7 38.050 2.346 -4.810 1.00 11.52 H new ATOM 0 HG2 GLN A 7 38.744 4.682 -4.567 1.00 12.08 H new ATOM 0 HG3 GLN A 7 37.168 5.145 -3.956 1.00 12.08 H new ATOM 0 HE21 GLN A 7 39.524 5.622 -2.409 1.00 12.77 H new ATOM 0 HE22 GLN A 7 39.488 4.563 -0.996 1.00 12.77 H new ATOM 89 N PRO A 8 34.484 4.410 -6.704 1.00 9.81 N ATOM 90 CA PRO A 8 33.171 5.069 -6.553 1.00 9.37 C ATOM 91 C PRO A 8 32.252 4.222 -5.661 1.00 9.09 C ATOM 92 O PRO A 8 31.930 3.094 -5.978 1.00 9.07 O ATOM 93 CB PRO A 8 32.612 5.184 -7.994 1.00 9.20 C ATOM 94 CG PRO A 8 33.665 4.560 -8.957 1.00 9.57 C ATOM 95 CD PRO A 8 34.848 4.060 -8.097 1.00 9.93 C ATOM 0 HA PRO A 8 33.245 6.046 -6.076 1.00 9.37 H new ATOM 0 HB2 PRO A 8 31.659 4.662 -8.078 1.00 9.20 H new ATOM 0 HB3 PRO A 8 32.428 6.227 -8.251 1.00 9.20 H new ATOM 0 HG2 PRO A 8 33.227 3.737 -9.521 1.00 9.57 H new ATOM 0 HG3 PRO A 8 34.005 5.299 -9.683 1.00 9.57 H new ATOM 0 HD2 PRO A 8 34.991 2.985 -8.209 1.00 9.93 H new ATOM 0 HD3 PRO A 8 35.781 4.539 -8.393 1.00 9.93 H new ATOM 103 N ARG A 9 31.823 4.763 -4.553 1.00 9.13 N ATOM 104 CA ARG A 9 30.920 3.995 -3.650 1.00 9.14 C ATOM 105 C ARG A 9 29.488 4.077 -4.181 1.00 8.60 C ATOM 106 O ARG A 9 28.533 3.946 -3.441 1.00 8.68 O ATOM 107 CB ARG A 9 30.976 4.591 -2.241 1.00 10.09 C ATOM 108 CG ARG A 9 32.433 4.698 -1.787 1.00 10.67 C ATOM 109 CD ARG A 9 32.484 5.221 -0.350 1.00 11.51 C ATOM 110 NE ARG A 9 33.889 5.574 -0.001 1.00 12.05 N ATOM 111 CZ ARG A 9 34.139 6.299 1.056 1.00 12.65 C ATOM 112 NH1 ARG A 9 33.159 6.708 1.814 1.00 12.79 N ATOM 113 NH2 ARG A 9 35.370 6.611 1.355 1.00 13.27 N ATOM 0 H ARG A 9 32.059 5.703 -4.235 1.00 9.13 H new ATOM 0 HA ARG A 9 31.239 2.953 -3.614 1.00 9.14 H new ATOM 0 HB2 ARG A 9 30.509 5.576 -2.233 1.00 10.09 H new ATOM 0 HB3 ARG A 9 30.413 3.965 -1.548 1.00 10.09 H new ATOM 0 HG2 ARG A 9 32.916 3.723 -1.847 1.00 10.67 H new ATOM 0 HG3 ARG A 9 32.983 5.368 -2.448 1.00 10.67 H new ATOM 0 HD2 ARG A 9 31.841 6.095 -0.247 1.00 11.51 H new ATOM 0 HD3 ARG A 9 32.106 4.464 0.338 1.00 11.51 H new ATOM 0 HE ARG A 9 34.657 5.249 -0.589 1.00 12.05 H new ATOM 0 HH11 ARG A 9 32.197 6.461 1.581 1.00 12.79 H new ATOM 0 HH12 ARG A 9 33.355 7.274 2.639 1.00 12.79 H new ATOM 0 HH21 ARG A 9 36.136 6.289 0.763 1.00 13.27 H new ATOM 0 HH22 ARG A 9 35.567 7.177 2.180 1.00 13.27 H new ATOM 127 N GLY A 10 29.330 4.289 -5.460 1.00 8.29 N ATOM 128 CA GLY A 10 27.960 4.375 -6.038 1.00 8.00 C ATOM 129 C GLY A 10 27.285 3.007 -5.945 1.00 7.45 C ATOM 130 O GLY A 10 27.231 2.267 -6.908 1.00 7.68 O ATOM 0 H GLY A 10 30.091 4.406 -6.129 1.00 8.29 H new ATOM 0 HA2 GLY A 10 27.373 5.120 -5.501 1.00 8.00 H new ATOM 0 HA3 GLY A 10 28.011 4.698 -7.078 1.00 8.00 H new ATOM 134 N GLY A 11 26.772 2.659 -4.799 1.00 7.01 N ATOM 135 CA GLY A 11 26.107 1.335 -4.659 1.00 6.74 C ATOM 136 C GLY A 11 25.496 1.208 -3.263 1.00 5.83 C ATOM 137 O GLY A 11 26.193 1.075 -2.278 1.00 6.06 O ATOM 0 H GLY A 11 26.784 3.232 -3.955 1.00 7.01 H new ATOM 0 HA2 GLY A 11 25.331 1.225 -5.417 1.00 6.74 H new ATOM 0 HA3 GLY A 11 26.829 0.536 -4.824 1.00 6.74 H new ATOM 141 N GLY A 12 24.195 1.229 -3.176 1.00 5.12 N ATOM 142 CA GLY A 12 23.530 1.086 -1.853 1.00 4.52 C ATOM 143 C GLY A 12 22.035 0.790 -2.054 1.00 3.52 C ATOM 144 O GLY A 12 21.200 1.548 -1.603 1.00 3.54 O ATOM 0 H GLY A 12 23.562 1.340 -3.968 1.00 5.12 H new ATOM 0 HA2 GLY A 12 23.997 0.281 -1.286 1.00 4.52 H new ATOM 0 HA3 GLY A 12 23.655 2.000 -1.272 1.00 4.52 H new ATOM 148 N PRO A 13 21.731 -0.305 -2.726 1.00 3.15 N ATOM 149 CA PRO A 13 20.330 -0.691 -2.980 1.00 2.77 C ATOM 150 C PRO A 13 19.592 -0.915 -1.652 1.00 2.05 C ATOM 151 O PRO A 13 18.383 -0.811 -1.584 1.00 2.37 O ATOM 152 CB PRO A 13 20.417 -2.006 -3.796 1.00 3.47 C ATOM 153 CG PRO A 13 21.926 -2.344 -3.984 1.00 3.99 C ATOM 154 CD PRO A 13 22.741 -1.236 -3.279 1.00 3.79 C ATOM 0 HA PRO A 13 19.777 0.080 -3.517 1.00 2.77 H new ATOM 0 HB2 PRO A 13 19.905 -2.815 -3.274 1.00 3.47 H new ATOM 0 HB3 PRO A 13 19.927 -1.890 -4.763 1.00 3.47 H new ATOM 0 HG2 PRO A 13 22.156 -3.320 -3.557 1.00 3.99 H new ATOM 0 HG3 PRO A 13 22.179 -2.391 -5.043 1.00 3.99 H new ATOM 0 HD2 PRO A 13 23.369 -1.650 -2.490 1.00 3.79 H new ATOM 0 HD3 PRO A 13 23.403 -0.728 -3.980 1.00 3.79 H new ATOM 162 N THR A 14 20.304 -1.222 -0.598 1.00 1.59 N ATOM 163 CA THR A 14 19.632 -1.451 0.720 1.00 1.24 C ATOM 164 C THR A 14 19.595 -0.143 1.515 1.00 1.07 C ATOM 165 O THR A 14 19.813 -0.123 2.710 1.00 1.20 O ATOM 166 CB THR A 14 20.388 -2.517 1.517 1.00 1.43 C ATOM 167 OG1 THR A 14 21.726 -2.081 1.718 1.00 2.16 O ATOM 168 CG2 THR A 14 20.396 -3.840 0.751 1.00 1.78 C ATOM 0 H THR A 14 21.319 -1.324 -0.591 1.00 1.59 H new ATOM 0 HA THR A 14 18.613 -1.796 0.543 1.00 1.24 H new ATOM 0 HB THR A 14 19.894 -2.667 2.477 1.00 1.43 H new ATOM 0 HG1 THR A 14 22.217 -2.757 2.229 1.00 2.16 H new ATOM 0 HG21 THR A 14 20.936 -4.591 1.327 1.00 1.78 H new ATOM 0 HG22 THR A 14 19.371 -4.174 0.591 1.00 1.78 H new ATOM 0 HG23 THR A 14 20.886 -3.700 -0.212 1.00 1.78 H new ATOM 176 N SER A 15 19.283 0.944 0.861 1.00 1.07 N ATOM 177 CA SER A 15 19.188 2.258 1.569 1.00 0.91 C ATOM 178 C SER A 15 17.716 2.545 1.889 1.00 0.75 C ATOM 179 O SER A 15 16.856 2.460 1.034 1.00 0.78 O ATOM 180 CB SER A 15 19.743 3.367 0.677 1.00 0.99 C ATOM 181 OG SER A 15 18.904 3.521 -0.454 1.00 1.38 O ATOM 0 H SER A 15 19.088 0.980 -0.140 1.00 1.07 H new ATOM 0 HA SER A 15 19.767 2.220 2.491 1.00 0.91 H new ATOM 0 HB2 SER A 15 19.799 4.303 1.233 1.00 0.99 H new ATOM 0 HB3 SER A 15 20.757 3.122 0.361 1.00 0.99 H new ATOM 0 HG SER A 15 19.256 4.233 -1.028 1.00 1.38 H new ATOM 187 N SER A 16 17.421 2.868 3.119 1.00 0.72 N ATOM 188 CA SER A 16 16.006 3.145 3.508 1.00 0.82 C ATOM 189 C SER A 16 15.409 4.222 2.597 1.00 0.81 C ATOM 190 O SER A 16 14.270 4.132 2.184 1.00 0.92 O ATOM 191 CB SER A 16 15.965 3.626 4.959 1.00 1.06 C ATOM 192 OG SER A 16 16.420 2.582 5.810 1.00 1.64 O ATOM 0 H SER A 16 18.101 2.953 3.875 1.00 0.72 H new ATOM 0 HA SER A 16 15.422 2.230 3.405 1.00 0.82 H new ATOM 0 HB2 SER A 16 16.592 4.509 5.080 1.00 1.06 H new ATOM 0 HB3 SER A 16 14.950 3.916 5.230 1.00 1.06 H new ATOM 0 HG SER A 16 16.397 2.886 6.741 1.00 1.64 H new ATOM 198 N GLU A 17 16.159 5.239 2.277 1.00 0.80 N ATOM 199 CA GLU A 17 15.621 6.310 1.390 1.00 0.94 C ATOM 200 C GLU A 17 15.148 5.718 0.058 1.00 0.85 C ATOM 201 O GLU A 17 14.220 6.221 -0.544 1.00 0.89 O ATOM 202 CB GLU A 17 16.688 7.379 1.135 1.00 1.13 C ATOM 203 CG GLU A 17 16.903 8.219 2.395 1.00 1.71 C ATOM 204 CD GLU A 17 17.393 7.322 3.533 1.00 2.26 C ATOM 205 OE1 GLU A 17 18.509 6.836 3.439 1.00 2.68 O ATOM 206 OE2 GLU A 17 16.646 7.136 4.478 1.00 2.90 O ATOM 0 H GLU A 17 17.120 5.376 2.590 1.00 0.80 H new ATOM 0 HA GLU A 17 14.770 6.772 1.891 1.00 0.94 H new ATOM 0 HB2 GLU A 17 17.625 6.906 0.840 1.00 1.13 H new ATOM 0 HB3 GLU A 17 16.381 8.021 0.309 1.00 1.13 H new ATOM 0 HG2 GLU A 17 17.631 9.006 2.200 1.00 1.71 H new ATOM 0 HG3 GLU A 17 15.972 8.710 2.680 1.00 1.71 H new ATOM 213 N GLN A 18 15.752 4.664 -0.417 1.00 0.80 N ATOM 214 CA GLN A 18 15.279 4.088 -1.709 1.00 0.83 C ATOM 215 C GLN A 18 13.840 3.576 -1.533 1.00 0.68 C ATOM 216 O GLN A 18 13.040 3.601 -2.447 1.00 0.69 O ATOM 217 CB GLN A 18 16.187 2.927 -2.129 1.00 0.96 C ATOM 218 CG GLN A 18 15.993 2.641 -3.620 1.00 1.53 C ATOM 219 CD GLN A 18 16.678 3.734 -4.445 1.00 2.23 C ATOM 220 OE1 GLN A 18 17.855 3.986 -4.282 1.00 2.69 O ATOM 221 NE2 GLN A 18 15.985 4.397 -5.330 1.00 3.07 N ATOM 0 H GLN A 18 16.537 4.184 0.022 1.00 0.80 H new ATOM 0 HA GLN A 18 15.308 4.857 -2.481 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.229 3.175 -1.928 1.00 0.96 H new ATOM 0 HB3 GLN A 18 15.953 2.038 -1.544 1.00 0.96 H new ATOM 0 HG2 GLN A 18 16.411 1.666 -3.871 1.00 1.53 H new ATOM 0 HG3 GLN A 18 14.930 2.603 -3.858 1.00 1.53 H new ATOM 0 HE21 GLN A 18 14.997 4.185 -5.467 1.00 3.07 H new ATOM 0 HE22 GLN A 18 16.432 5.127 -5.885 1.00 3.07 H new ATOM 230 N ILE A 19 13.515 3.115 -0.349 1.00 0.59 N ATOM 231 CA ILE A 19 12.137 2.599 -0.074 1.00 0.58 C ATOM 232 C ILE A 19 11.133 3.753 -0.117 1.00 0.52 C ATOM 233 O ILE A 19 10.047 3.625 -0.645 1.00 0.59 O ATOM 234 CB ILE A 19 12.102 1.929 1.301 1.00 0.64 C ATOM 235 CG1 ILE A 19 13.266 0.940 1.418 1.00 0.74 C ATOM 236 CG2 ILE A 19 10.780 1.181 1.471 1.00 0.73 C ATOM 237 CD1 ILE A 19 13.284 0.336 2.823 1.00 0.81 C ATOM 0 H ILE A 19 14.152 3.074 0.446 1.00 0.59 H new ATOM 0 HA ILE A 19 11.869 1.866 -0.835 1.00 0.58 H new ATOM 0 HB ILE A 19 12.192 2.689 2.077 1.00 0.64 H new ATOM 0 HG12 ILE A 19 13.163 0.151 0.673 1.00 0.74 H new ATOM 0 HG13 ILE A 19 14.210 1.447 1.217 1.00 0.74 H new ATOM 0 HG21 ILE A 19 10.755 0.704 2.451 1.00 0.73 H new ATOM 0 HG22 ILE A 19 9.951 1.884 1.389 1.00 0.73 H new ATOM 0 HG23 ILE A 19 10.690 0.421 0.695 1.00 0.73 H new ATOM 0 HD11 ILE A 19 14.112 -0.368 2.906 1.00 0.81 H new ATOM 0 HD12 ILE A 19 13.408 1.130 3.559 1.00 0.81 H new ATOM 0 HD13 ILE A 19 12.345 -0.186 3.007 1.00 0.81 H new ATOM 249 N MET A 20 11.499 4.879 0.415 1.00 0.51 N ATOM 250 CA MET A 20 10.604 6.065 0.400 1.00 0.60 C ATOM 251 C MET A 20 10.293 6.501 -1.033 1.00 0.55 C ATOM 252 O MET A 20 9.193 6.905 -1.355 1.00 0.59 O ATOM 253 CB MET A 20 11.353 7.215 1.109 1.00 0.82 C ATOM 254 CG MET A 20 11.080 7.132 2.627 1.00 1.07 C ATOM 255 SD MET A 20 9.382 7.695 2.967 1.00 1.43 S ATOM 256 CE MET A 20 8.752 6.204 3.794 1.00 0.93 C ATOM 0 H MET A 20 12.399 5.032 0.869 1.00 0.51 H new ATOM 0 HA MET A 20 9.665 5.819 0.897 1.00 0.60 H new ATOM 0 HB2 MET A 20 12.423 7.144 0.914 1.00 0.82 H new ATOM 0 HB3 MET A 20 11.021 8.177 0.719 1.00 0.82 H new ATOM 0 HG2 MET A 20 11.212 6.108 2.976 1.00 1.07 H new ATOM 0 HG3 MET A 20 11.795 7.749 3.171 1.00 1.07 H new ATOM 0 HE1 MET A 20 7.712 6.359 4.081 1.00 0.93 H new ATOM 0 HE2 MET A 20 8.818 5.355 3.114 1.00 0.93 H new ATOM 0 HE3 MET A 20 9.348 6.003 4.684 1.00 0.93 H new ATOM 266 N LYS A 21 11.278 6.422 -1.898 1.00 0.57 N ATOM 267 CA LYS A 21 11.076 6.832 -3.313 1.00 0.61 C ATOM 268 C LYS A 21 10.274 5.763 -4.054 1.00 0.53 C ATOM 269 O LYS A 21 9.343 6.069 -4.772 1.00 0.51 O ATOM 270 CB LYS A 21 12.447 7.003 -3.996 1.00 0.72 C ATOM 271 CG LYS A 21 13.001 8.409 -3.730 1.00 1.09 C ATOM 272 CD LYS A 21 14.491 8.483 -4.144 1.00 1.24 C ATOM 273 CE LYS A 21 15.393 8.220 -2.932 1.00 1.80 C ATOM 274 NZ LYS A 21 16.814 8.165 -3.377 1.00 2.40 N ATOM 0 H LYS A 21 12.216 6.088 -1.677 1.00 0.57 H new ATOM 0 HA LYS A 21 10.530 7.775 -3.339 1.00 0.61 H new ATOM 0 HB2 LYS A 21 13.144 6.253 -3.622 1.00 0.72 H new ATOM 0 HB3 LYS A 21 12.349 6.840 -5.069 1.00 0.72 H new ATOM 0 HG2 LYS A 21 12.424 9.147 -4.287 1.00 1.09 H new ATOM 0 HG3 LYS A 21 12.897 8.655 -2.673 1.00 1.09 H new ATOM 0 HD2 LYS A 21 14.696 7.750 -4.924 1.00 1.24 H new ATOM 0 HD3 LYS A 21 14.711 9.465 -4.563 1.00 1.24 H new ATOM 0 HE2 LYS A 21 15.263 9.008 -2.190 1.00 1.80 H new ATOM 0 HE3 LYS A 21 15.113 7.282 -2.453 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 17.428 7.987 -2.557 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 16.931 7.399 -4.070 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 17.076 9.071 -3.815 1.00 2.40 H new ATOM 288 N THR A 22 10.624 4.511 -3.902 1.00 0.53 N ATOM 289 CA THR A 22 9.880 3.447 -4.620 1.00 0.52 C ATOM 290 C THR A 22 8.483 3.299 -4.035 1.00 0.45 C ATOM 291 O THR A 22 7.519 3.268 -4.758 1.00 0.48 O ATOM 292 CB THR A 22 10.628 2.114 -4.474 1.00 0.55 C ATOM 293 OG1 THR A 22 11.951 2.255 -4.973 1.00 0.64 O ATOM 294 CG2 THR A 22 9.898 1.017 -5.258 1.00 0.62 C ATOM 0 H THR A 22 11.391 4.186 -3.313 1.00 0.53 H new ATOM 0 HA THR A 22 9.803 3.718 -5.673 1.00 0.52 H new ATOM 0 HB THR A 22 10.663 1.837 -3.420 1.00 0.55 H new ATOM 0 HG1 THR A 22 12.511 2.689 -4.296 1.00 0.64 H new ATOM 0 HG21 THR A 22 10.434 0.074 -5.150 1.00 0.62 H new ATOM 0 HG22 THR A 22 8.886 0.905 -4.870 1.00 0.62 H new ATOM 0 HG23 THR A 22 9.854 1.291 -6.312 1.00 0.62 H new ATOM 302 N GLY A 23 8.366 3.237 -2.734 1.00 0.42 N ATOM 303 CA GLY A 23 7.018 3.094 -2.102 1.00 0.43 C ATOM 304 C GLY A 23 6.081 4.202 -2.590 1.00 0.41 C ATOM 305 O GLY A 23 5.091 3.946 -3.251 1.00 0.47 O ATOM 0 H GLY A 23 9.147 3.279 -2.079 1.00 0.42 H new ATOM 0 HA2 GLY A 23 6.596 2.119 -2.346 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.111 3.139 -1.017 1.00 0.43 H new ATOM 309 N ALA A 24 6.385 5.426 -2.270 1.00 0.40 N ATOM 310 CA ALA A 24 5.519 6.556 -2.712 1.00 0.41 C ATOM 311 C ALA A 24 5.269 6.469 -4.217 1.00 0.41 C ATOM 312 O ALA A 24 4.297 6.987 -4.729 1.00 0.41 O ATOM 313 CB ALA A 24 6.230 7.874 -2.414 1.00 0.42 C ATOM 0 H ALA A 24 7.200 5.696 -1.719 1.00 0.40 H new ATOM 0 HA ALA A 24 4.568 6.504 -2.181 1.00 0.41 H new ATOM 0 HB1 ALA A 24 5.603 8.706 -2.734 1.00 0.42 H new ATOM 0 HB2 ALA A 24 6.417 7.952 -1.343 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.178 7.906 -2.952 1.00 0.42 H new ATOM 319 N LEU A 25 6.139 5.800 -4.930 1.00 0.42 N ATOM 320 CA LEU A 25 5.944 5.675 -6.402 1.00 0.44 C ATOM 321 C LEU A 25 4.911 4.577 -6.670 1.00 0.44 C ATOM 322 O LEU A 25 4.055 4.732 -7.518 1.00 0.46 O ATOM 323 CB LEU A 25 7.292 5.355 -7.088 1.00 0.47 C ATOM 324 CG LEU A 25 7.895 6.605 -7.766 1.00 0.77 C ATOM 325 CD1 LEU A 25 7.165 6.890 -9.091 1.00 1.58 C ATOM 326 CD2 LEU A 25 7.814 7.838 -6.836 1.00 1.67 C ATOM 0 H LEU A 25 6.969 5.339 -4.558 1.00 0.42 H new ATOM 0 HA LEU A 25 5.577 6.615 -6.815 1.00 0.44 H new ATOM 0 HB2 LEU A 25 7.994 4.967 -6.350 1.00 0.47 H new ATOM 0 HB3 LEU A 25 7.146 4.572 -7.832 1.00 0.47 H new ATOM 0 HG LEU A 25 8.947 6.406 -7.972 1.00 0.77 H new ATOM 0 HD11 LEU A 25 7.597 7.773 -9.562 1.00 1.58 H new ATOM 0 HD12 LEU A 25 7.273 6.034 -9.757 1.00 1.58 H new ATOM 0 HD13 LEU A 25 6.107 7.065 -8.893 1.00 1.58 H new ATOM 0 HD21 LEU A 25 8.246 8.703 -7.340 1.00 1.67 H new ATOM 0 HD22 LEU A 25 6.771 8.043 -6.593 1.00 1.67 H new ATOM 0 HD23 LEU A 25 8.368 7.639 -5.919 1.00 1.67 H new ATOM 338 N LEU A 26 4.996 3.449 -6.003 1.00 0.45 N ATOM 339 CA LEU A 26 4.015 2.364 -6.300 1.00 0.47 C ATOM 340 C LEU A 26 2.607 2.956 -6.288 1.00 0.49 C ATOM 341 O LEU A 26 1.846 2.771 -7.217 1.00 0.52 O ATOM 342 CB LEU A 26 4.120 1.219 -5.274 1.00 0.51 C ATOM 343 CG LEU A 26 5.587 0.855 -5.042 1.00 0.69 C ATOM 344 CD1 LEU A 26 5.701 -0.331 -4.082 1.00 1.17 C ATOM 345 CD2 LEU A 26 6.260 0.523 -6.381 1.00 1.35 C ATOM 0 H LEU A 26 5.687 3.238 -5.283 1.00 0.45 H new ATOM 0 HA LEU A 26 4.236 1.946 -7.282 1.00 0.47 H new ATOM 0 HB2 LEU A 26 3.659 1.520 -4.333 1.00 0.51 H new ATOM 0 HB3 LEU A 26 3.573 0.347 -5.633 1.00 0.51 H new ATOM 0 HG LEU A 26 6.093 1.709 -4.592 1.00 0.69 H new ATOM 0 HD11 LEU A 26 6.752 -0.576 -3.929 1.00 1.17 H new ATOM 0 HD12 LEU A 26 5.246 -0.071 -3.126 1.00 1.17 H new ATOM 0 HD13 LEU A 26 5.186 -1.193 -4.506 1.00 1.17 H new ATOM 0 HD21 LEU A 26 7.305 0.265 -6.209 1.00 1.35 H new ATOM 0 HD22 LEU A 26 5.749 -0.320 -6.846 1.00 1.35 H new ATOM 0 HD23 LEU A 26 6.204 1.389 -7.041 1.00 1.35 H new ATOM 357 N LEU A 27 2.238 3.644 -5.246 1.00 0.50 N ATOM 358 CA LEU A 27 0.855 4.202 -5.229 1.00 0.56 C ATOM 359 C LEU A 27 0.699 5.199 -6.380 1.00 0.56 C ATOM 360 O LEU A 27 -0.246 5.132 -7.141 1.00 0.60 O ATOM 361 CB LEU A 27 0.541 4.897 -3.902 1.00 0.64 C ATOM 362 CG LEU A 27 1.089 4.079 -2.742 1.00 0.95 C ATOM 363 CD1 LEU A 27 0.733 4.776 -1.428 1.00 1.66 C ATOM 364 CD2 LEU A 27 0.468 2.681 -2.771 1.00 1.42 C ATOM 0 H LEU A 27 2.813 3.842 -4.427 1.00 0.50 H new ATOM 0 HA LEU A 27 0.154 3.376 -5.346 1.00 0.56 H new ATOM 0 HB2 LEU A 27 0.979 5.895 -3.893 1.00 0.64 H new ATOM 0 HB3 LEU A 27 -0.536 5.021 -3.793 1.00 0.64 H new ATOM 0 HG LEU A 27 2.172 3.993 -2.826 1.00 0.95 H new ATOM 0 HD11 LEU A 27 1.122 4.196 -0.591 1.00 1.66 H new ATOM 0 HD12 LEU A 27 1.173 5.773 -1.414 1.00 1.66 H new ATOM 0 HD13 LEU A 27 -0.351 4.856 -1.341 1.00 1.66 H new ATOM 0 HD21 LEU A 27 0.859 2.092 -1.941 1.00 1.42 H new ATOM 0 HD22 LEU A 27 -0.615 2.762 -2.680 1.00 1.42 H new ATOM 0 HD23 LEU A 27 0.718 2.191 -3.712 1.00 1.42 H new ATOM 376 N GLN A 28 1.597 6.134 -6.505 1.00 0.55 N ATOM 377 CA GLN A 28 1.470 7.136 -7.596 1.00 0.58 C ATOM 378 C GLN A 28 1.241 6.427 -8.938 1.00 0.54 C ATOM 379 O GLN A 28 0.422 6.832 -9.739 1.00 0.58 O ATOM 380 CB GLN A 28 2.761 7.963 -7.670 1.00 0.60 C ATOM 381 CG GLN A 28 2.474 9.303 -8.354 1.00 1.00 C ATOM 382 CD GLN A 28 1.726 10.221 -7.385 1.00 1.40 C ATOM 383 OE1 GLN A 28 2.220 10.529 -6.318 1.00 2.09 O ATOM 384 NE2 GLN A 28 0.545 10.674 -7.711 1.00 1.91 N ATOM 0 H GLN A 28 2.411 6.247 -5.901 1.00 0.55 H new ATOM 0 HA GLN A 28 0.621 7.788 -7.390 1.00 0.58 H new ATOM 0 HB2 GLN A 28 3.155 8.132 -6.668 1.00 0.60 H new ATOM 0 HB3 GLN A 28 3.524 7.416 -8.224 1.00 0.60 H new ATOM 0 HG2 GLN A 28 3.407 9.771 -8.667 1.00 1.00 H new ATOM 0 HG3 GLN A 28 1.879 9.144 -9.254 1.00 1.00 H new ATOM 0 HE21 GLN A 28 0.129 10.416 -8.606 1.00 1.91 H new ATOM 0 HE22 GLN A 28 0.039 11.285 -7.071 1.00 1.91 H new ATOM 393 N GLY A 29 1.980 5.376 -9.190 1.00 0.50 N ATOM 394 CA GLY A 29 1.835 4.640 -10.479 1.00 0.48 C ATOM 395 C GLY A 29 0.554 3.809 -10.469 1.00 0.44 C ATOM 396 O GLY A 29 -0.215 3.831 -11.410 1.00 0.50 O ATOM 0 H GLY A 29 2.681 4.996 -8.554 1.00 0.50 H new ATOM 0 HA2 GLY A 29 1.813 5.346 -11.309 1.00 0.48 H new ATOM 0 HA3 GLY A 29 2.697 3.991 -10.635 1.00 0.48 H new ATOM 400 N PHE A 30 0.315 3.070 -9.420 1.00 0.44 N ATOM 401 CA PHE A 30 -0.920 2.241 -9.374 1.00 0.43 C ATOM 402 C PHE A 30 -2.135 3.161 -9.301 1.00 0.40 C ATOM 403 O PHE A 30 -3.184 2.853 -9.833 1.00 0.43 O ATOM 404 CB PHE A 30 -0.894 1.320 -8.146 1.00 0.47 C ATOM 405 CG PHE A 30 -2.248 0.654 -7.971 1.00 0.47 C ATOM 406 CD1 PHE A 30 -2.779 -0.139 -8.999 1.00 1.20 C ATOM 407 CD2 PHE A 30 -2.973 0.834 -6.784 1.00 1.39 C ATOM 408 CE1 PHE A 30 -4.029 -0.749 -8.839 1.00 1.21 C ATOM 409 CE2 PHE A 30 -4.223 0.222 -6.626 1.00 1.42 C ATOM 410 CZ PHE A 30 -4.750 -0.569 -7.653 1.00 0.58 C ATOM 0 H PHE A 30 0.917 3.005 -8.599 1.00 0.44 H new ATOM 0 HA PHE A 30 -0.976 1.625 -10.272 1.00 0.43 H new ATOM 0 HB2 PHE A 30 -0.119 0.563 -8.265 1.00 0.47 H new ATOM 0 HB3 PHE A 30 -0.644 1.895 -7.254 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -2.223 -0.279 -9.914 1.00 1.20 H new ATOM 0 HD2 PHE A 30 -2.567 1.445 -5.991 1.00 1.39 H new ATOM 0 HE1 PHE A 30 -4.437 -1.359 -9.631 1.00 1.21 H new ATOM 0 HE2 PHE A 30 -4.780 0.361 -5.711 1.00 1.42 H new ATOM 0 HZ PHE A 30 -5.714 -1.041 -7.530 1.00 0.58 H new ATOM 420 N ILE A 31 -2.015 4.295 -8.661 1.00 0.40 N ATOM 421 CA ILE A 31 -3.178 5.211 -8.589 1.00 0.40 C ATOM 422 C ILE A 31 -3.354 5.861 -9.969 1.00 0.40 C ATOM 423 O ILE A 31 -4.422 5.823 -10.547 1.00 0.43 O ATOM 424 CB ILE A 31 -2.939 6.273 -7.499 1.00 0.41 C ATOM 425 CG1 ILE A 31 -2.985 5.609 -6.119 1.00 0.53 C ATOM 426 CG2 ILE A 31 -4.021 7.342 -7.602 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.418 6.565 -5.063 1.00 0.48 C ATOM 0 H ILE A 31 -1.169 4.619 -8.192 1.00 0.40 H new ATOM 0 HA ILE A 31 -4.085 4.667 -8.325 1.00 0.40 H new ATOM 0 HB ILE A 31 -1.961 6.734 -7.636 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -4.012 5.343 -5.868 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -2.409 4.683 -6.131 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -3.860 8.098 -6.834 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -3.978 7.809 -8.586 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -5.000 6.884 -7.460 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -2.453 6.088 -4.084 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.385 6.809 -5.311 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -3.012 7.479 -5.043 1.00 0.48 H new ATOM 439 N GLN A 32 -2.321 6.458 -10.500 1.00 0.42 N ATOM 440 CA GLN A 32 -2.429 7.103 -11.844 1.00 0.47 C ATOM 441 C GLN A 32 -2.924 6.096 -12.892 1.00 0.50 C ATOM 442 O GLN A 32 -3.771 6.408 -13.706 1.00 0.61 O ATOM 443 CB GLN A 32 -1.053 7.632 -12.259 1.00 0.57 C ATOM 444 CG GLN A 32 -0.697 8.864 -11.417 1.00 1.19 C ATOM 445 CD GLN A 32 -1.425 10.095 -11.963 1.00 1.59 C ATOM 446 OE1 GLN A 32 -1.038 10.644 -12.976 1.00 2.16 O ATOM 447 NE2 GLN A 32 -2.470 10.556 -11.331 1.00 2.21 N ATOM 0 H GLN A 32 -1.403 6.528 -10.061 1.00 0.42 H new ATOM 0 HA GLN A 32 -3.145 7.923 -11.784 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -0.299 6.857 -12.124 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -1.057 7.892 -13.318 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -0.976 8.697 -10.377 1.00 1.19 H new ATOM 0 HG3 GLN A 32 0.380 9.029 -11.436 1.00 1.19 H new ATOM 0 HE21 GLN A 32 -2.796 10.096 -10.481 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -2.961 11.376 -11.687 1.00 2.21 H new ATOM 456 N ASP A 33 -2.403 4.897 -12.895 1.00 0.49 N ATOM 457 CA ASP A 33 -2.853 3.897 -13.910 1.00 0.58 C ATOM 458 C ASP A 33 -4.364 3.681 -13.777 1.00 0.61 C ATOM 459 O ASP A 33 -5.078 3.585 -14.754 1.00 0.70 O ATOM 460 CB ASP A 33 -2.117 2.572 -13.687 1.00 0.61 C ATOM 461 CG ASP A 33 -2.522 1.569 -14.768 1.00 1.10 C ATOM 462 OD1 ASP A 33 -3.114 1.991 -15.748 1.00 1.78 O ATOM 463 OD2 ASP A 33 -2.233 0.396 -14.598 1.00 1.89 O ATOM 0 H ASP A 33 -1.690 4.568 -12.244 1.00 0.49 H new ATOM 0 HA ASP A 33 -2.628 4.266 -14.911 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -1.040 2.735 -13.713 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -2.355 2.174 -12.701 1.00 0.61 H new ATOM 468 N ARG A 34 -4.850 3.609 -12.571 1.00 0.58 N ATOM 469 CA ARG A 34 -6.312 3.407 -12.347 1.00 0.71 C ATOM 470 C ARG A 34 -7.054 4.743 -12.490 1.00 0.65 C ATOM 471 O ARG A 34 -8.267 4.769 -12.552 1.00 0.85 O ATOM 472 CB ARG A 34 -6.532 2.833 -10.927 1.00 0.85 C ATOM 473 CG ARG A 34 -6.730 1.309 -10.988 1.00 1.25 C ATOM 474 CD ARG A 34 -8.062 0.962 -11.697 1.00 1.31 C ATOM 475 NE ARG A 34 -8.781 -0.110 -10.935 1.00 1.58 N ATOM 476 CZ ARG A 34 -8.157 -1.181 -10.517 1.00 2.09 C ATOM 477 NH1 ARG A 34 -6.912 -1.389 -10.844 1.00 2.58 N ATOM 478 NH2 ARG A 34 -8.793 -2.062 -9.795 1.00 2.75 N ATOM 0 H ARG A 34 -4.293 3.682 -11.720 1.00 0.58 H new ATOM 0 HA ARG A 34 -6.701 2.709 -13.089 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -5.675 3.070 -10.296 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -7.404 3.301 -10.470 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -5.897 0.849 -11.521 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -6.730 0.896 -9.979 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -8.688 1.851 -11.769 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -7.866 0.627 -12.715 1.00 1.31 H new ATOM 0 HE ARG A 34 -9.776 -0.002 -10.739 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -6.419 -0.715 -11.429 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -6.431 -2.226 -10.515 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -9.774 -1.915 -9.558 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -8.309 -2.898 -9.468 1.00 2.75 H new ATOM 492 N ALA A 35 -6.366 5.852 -12.551 1.00 0.59 N ATOM 493 CA ALA A 35 -7.099 7.151 -12.693 1.00 0.66 C ATOM 494 C ALA A 35 -7.473 7.360 -14.165 1.00 0.80 C ATOM 495 O ALA A 35 -8.564 7.788 -14.486 1.00 0.88 O ATOM 496 CB ALA A 35 -6.222 8.304 -12.202 1.00 0.94 C ATOM 0 H ALA A 35 -5.349 5.919 -12.510 1.00 0.59 H new ATOM 0 HA ALA A 35 -8.006 7.125 -12.090 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -6.763 9.244 -12.309 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -5.970 8.148 -11.153 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -5.307 8.343 -12.793 1.00 0.94 H new ATOM 502 N GLY A 36 -6.593 7.016 -15.056 1.00 1.15 N ATOM 503 CA GLY A 36 -6.917 7.154 -16.505 1.00 1.62 C ATOM 504 C GLY A 36 -5.684 6.886 -17.360 1.00 1.54 C ATOM 505 O GLY A 36 -4.859 6.052 -17.049 1.00 2.10 O ATOM 0 H GLY A 36 -5.665 6.646 -14.849 1.00 1.15 H new ATOM 0 HA2 GLY A 36 -7.711 6.457 -16.773 1.00 1.62 H new ATOM 0 HA3 GLY A 36 -7.293 8.157 -16.705 1.00 1.62 H new ATOM 509 N ARG A 37 -5.570 7.592 -18.449 1.00 2.07 N ATOM 510 CA ARG A 37 -4.409 7.399 -19.360 1.00 2.87 C ATOM 511 C ARG A 37 -3.211 8.201 -18.842 1.00 3.46 C ATOM 512 O ARG A 37 -2.502 7.772 -17.953 1.00 4.10 O ATOM 513 CB ARG A 37 -4.788 7.886 -20.763 1.00 3.63 C ATOM 514 CG ARG A 37 -6.022 7.123 -21.259 1.00 4.34 C ATOM 515 CD ARG A 37 -6.315 7.478 -22.735 1.00 5.18 C ATOM 516 NE ARG A 37 -7.790 7.640 -22.940 1.00 5.74 N ATOM 517 CZ ARG A 37 -8.644 6.769 -22.466 1.00 6.53 C ATOM 518 NH1 ARG A 37 -8.227 5.676 -21.892 1.00 6.88 N ATOM 519 NH2 ARG A 37 -9.925 6.978 -22.605 1.00 7.21 N ATOM 0 H ARG A 37 -6.238 8.301 -18.750 1.00 2.07 H new ATOM 0 HA ARG A 37 -4.142 6.343 -19.398 1.00 2.87 H new ATOM 0 HB2 ARG A 37 -4.994 8.956 -20.744 1.00 3.63 H new ATOM 0 HB3 ARG A 37 -3.955 7.734 -21.449 1.00 3.63 H new ATOM 0 HG2 ARG A 37 -5.858 6.050 -21.162 1.00 4.34 H new ATOM 0 HG3 ARG A 37 -6.884 7.371 -20.640 1.00 4.34 H new ATOM 0 HD2 ARG A 37 -5.799 8.399 -23.005 1.00 5.18 H new ATOM 0 HD3 ARG A 37 -5.933 6.694 -23.389 1.00 5.18 H new ATOM 0 HE ARG A 37 -8.136 8.446 -23.460 1.00 5.74 H new ATOM 0 HH11 ARG A 37 -7.227 5.493 -21.809 1.00 6.88 H new ATOM 0 HH12 ARG A 37 -8.901 5.003 -21.526 1.00 6.88 H new ATOM 0 HH21 ARG A 37 -10.256 7.817 -23.081 1.00 7.21 H new ATOM 0 HH22 ARG A 37 -10.595 6.302 -22.237 1.00 7.21 H new ATOM 533 N MET A 38 -2.981 9.362 -19.393 1.00 3.74 N ATOM 534 CA MET A 38 -1.833 10.197 -18.942 1.00 4.68 C ATOM 535 C MET A 38 -2.080 11.647 -19.361 1.00 4.70 C ATOM 536 O MET A 38 -1.170 12.451 -19.406 1.00 5.17 O ATOM 537 CB MET A 38 -0.549 9.693 -19.607 1.00 5.62 C ATOM 538 CG MET A 38 -0.764 9.585 -21.120 1.00 5.93 C ATOM 539 SD MET A 38 0.820 9.259 -21.933 1.00 6.79 S ATOM 540 CE MET A 38 0.728 7.453 -21.898 1.00 7.04 C ATOM 0 H MET A 38 -3.543 9.769 -20.140 1.00 3.74 H new ATOM 0 HA MET A 38 -1.733 10.134 -17.858 1.00 4.68 H new ATOM 0 HB2 MET A 38 0.275 10.374 -19.394 1.00 5.62 H new ATOM 0 HB3 MET A 38 -0.273 8.721 -19.198 1.00 5.62 H new ATOM 0 HG2 MET A 38 -1.470 8.785 -21.342 1.00 5.93 H new ATOM 0 HG3 MET A 38 -1.198 10.508 -21.503 1.00 5.93 H new ATOM 0 HE1 MET A 38 1.623 7.034 -22.359 1.00 7.04 H new ATOM 0 HE2 MET A 38 0.658 7.112 -20.865 1.00 7.04 H new ATOM 0 HE3 MET A 38 -0.152 7.123 -22.449 1.00 7.04 H new ATOM 550 N GLY A 39 -3.308 12.000 -19.634 1.00 4.57 N ATOM 551 CA GLY A 39 -3.615 13.411 -20.018 1.00 4.85 C ATOM 552 C GLY A 39 -3.940 14.196 -18.747 1.00 4.67 C ATOM 553 O GLY A 39 -4.417 15.312 -18.790 1.00 4.95 O ATOM 0 H GLY A 39 -4.112 11.373 -19.608 1.00 4.57 H new ATOM 0 HA2 GLY A 39 -2.764 13.858 -20.533 1.00 4.85 H new ATOM 0 HA3 GLY A 39 -4.458 13.442 -20.709 1.00 4.85 H new ATOM 557 N GLY A 40 -3.688 13.601 -17.615 1.00 4.58 N ATOM 558 CA GLY A 40 -3.979 14.280 -16.322 1.00 4.69 C ATOM 559 C GLY A 40 -3.132 15.546 -16.202 1.00 4.20 C ATOM 560 O GLY A 40 -2.160 15.724 -16.910 1.00 4.34 O ATOM 0 H GLY A 40 -3.290 12.666 -17.530 1.00 4.58 H new ATOM 0 HA2 GLY A 40 -5.038 14.532 -16.263 1.00 4.69 H new ATOM 0 HA3 GLY A 40 -3.765 13.608 -15.491 1.00 4.69 H new ATOM 564 N GLU A 41 -3.493 16.428 -15.311 1.00 4.01 N ATOM 565 CA GLU A 41 -2.728 17.690 -15.121 1.00 3.88 C ATOM 566 C GLU A 41 -1.790 17.544 -13.919 1.00 3.63 C ATOM 567 O GLU A 41 -1.404 18.515 -13.301 1.00 4.16 O ATOM 568 CB GLU A 41 -3.738 18.818 -14.832 1.00 4.26 C ATOM 569 CG GLU A 41 -3.113 20.173 -15.192 1.00 4.51 C ATOM 570 CD GLU A 41 -4.002 21.310 -14.687 1.00 4.90 C ATOM 571 OE1 GLU A 41 -5.210 21.184 -14.795 1.00 5.28 O ATOM 572 OE2 GLU A 41 -3.458 22.290 -14.205 1.00 5.19 O ATOM 0 H GLU A 41 -4.300 16.324 -14.696 1.00 4.01 H new ATOM 0 HA GLU A 41 -2.141 17.913 -16.012 1.00 3.88 H new ATOM 0 HB2 GLU A 41 -4.649 18.661 -15.410 1.00 4.26 H new ATOM 0 HB3 GLU A 41 -4.022 18.805 -13.780 1.00 4.26 H new ATOM 0 HG2 GLU A 41 -2.120 20.253 -14.750 1.00 4.51 H new ATOM 0 HG3 GLU A 41 -2.989 20.250 -16.272 1.00 4.51 H new ATOM 579 N ALA A 42 -1.445 16.337 -13.567 1.00 3.19 N ATOM 580 CA ALA A 42 -0.558 16.128 -12.389 1.00 3.24 C ATOM 581 C ALA A 42 -1.141 16.866 -11.175 1.00 2.77 C ATOM 582 O ALA A 42 -0.552 17.818 -10.701 1.00 3.06 O ATOM 583 CB ALA A 42 0.834 16.677 -12.685 1.00 4.08 C ATOM 0 H ALA A 42 -1.739 15.485 -14.045 1.00 3.19 H new ATOM 0 HA ALA A 42 -0.490 15.061 -12.177 1.00 3.24 H new ATOM 0 HB1 ALA A 42 1.478 16.521 -11.820 1.00 4.08 H new ATOM 0 HB2 ALA A 42 1.254 16.159 -13.548 1.00 4.08 H new ATOM 0 HB3 ALA A 42 0.766 17.744 -12.900 1.00 4.08 H new ATOM 589 N PRO A 43 -2.288 16.421 -10.707 1.00 2.70 N ATOM 590 CA PRO A 43 -2.951 17.058 -9.553 1.00 3.03 C ATOM 591 C PRO A 43 -2.068 16.966 -8.299 1.00 2.67 C ATOM 592 O PRO A 43 -1.755 17.961 -7.676 1.00 2.87 O ATOM 593 CB PRO A 43 -4.268 16.267 -9.365 1.00 3.84 C ATOM 594 CG PRO A 43 -4.301 15.142 -10.439 1.00 3.86 C ATOM 595 CD PRO A 43 -3.012 15.262 -11.280 1.00 3.12 C ATOM 0 HA PRO A 43 -3.134 18.120 -9.718 1.00 3.03 H new ATOM 0 HB2 PRO A 43 -4.319 15.841 -8.363 1.00 3.84 H new ATOM 0 HB3 PRO A 43 -5.129 16.926 -9.475 1.00 3.84 H new ATOM 0 HG2 PRO A 43 -4.359 14.162 -9.965 1.00 3.86 H new ATOM 0 HG3 PRO A 43 -5.182 15.243 -11.072 1.00 3.86 H new ATOM 0 HD2 PRO A 43 -2.414 14.353 -11.218 1.00 3.12 H new ATOM 0 HD3 PRO A 43 -3.241 15.421 -12.334 1.00 3.12 H new ATOM 603 N GLU A 44 -1.688 15.775 -7.913 1.00 2.45 N ATOM 604 CA GLU A 44 -0.851 15.610 -6.685 1.00 2.23 C ATOM 605 C GLU A 44 0.188 14.514 -6.899 1.00 1.75 C ATOM 606 O GLU A 44 -0.136 13.346 -6.976 1.00 2.00 O ATOM 607 CB GLU A 44 -1.767 15.235 -5.505 1.00 2.55 C ATOM 608 CG GLU A 44 -0.945 14.709 -4.316 1.00 2.70 C ATOM 609 CD GLU A 44 0.173 15.699 -3.982 1.00 3.17 C ATOM 610 OE1 GLU A 44 -0.108 16.886 -3.936 1.00 3.77 O ATOM 611 OE2 GLU A 44 1.290 15.254 -3.775 1.00 3.42 O ATOM 0 H GLU A 44 -1.921 14.907 -8.396 1.00 2.45 H new ATOM 0 HA GLU A 44 -0.332 16.544 -6.471 1.00 2.23 H new ATOM 0 HB2 GLU A 44 -2.344 16.107 -5.196 1.00 2.55 H new ATOM 0 HB3 GLU A 44 -2.482 14.476 -5.822 1.00 2.55 H new ATOM 0 HG2 GLU A 44 -1.591 14.569 -3.449 1.00 2.70 H new ATOM 0 HG3 GLU A 44 -0.521 13.735 -4.558 1.00 2.70 H new ATOM 618 N LEU A 45 1.437 14.885 -6.988 1.00 1.80 N ATOM 619 CA LEU A 45 2.519 13.880 -7.186 1.00 1.80 C ATOM 620 C LEU A 45 3.318 13.771 -5.892 1.00 2.29 C ATOM 621 O LEU A 45 4.266 14.502 -5.697 1.00 3.01 O ATOM 622 CB LEU A 45 3.444 14.353 -8.321 1.00 2.23 C ATOM 623 CG LEU A 45 2.931 13.844 -9.676 1.00 2.52 C ATOM 624 CD1 LEU A 45 3.096 12.311 -9.784 1.00 3.22 C ATOM 625 CD2 LEU A 45 1.454 14.221 -9.842 1.00 3.00 C ATOM 0 H LEU A 45 1.756 15.852 -6.931 1.00 1.80 H new ATOM 0 HA LEU A 45 2.094 12.910 -7.446 1.00 1.80 H new ATOM 0 HB2 LEU A 45 3.493 15.442 -8.329 1.00 2.23 H new ATOM 0 HB3 LEU A 45 4.457 13.990 -8.149 1.00 2.23 H new ATOM 0 HG LEU A 45 3.518 14.310 -10.467 1.00 2.52 H new ATOM 0 HD11 LEU A 45 2.726 11.973 -10.752 1.00 3.22 H new ATOM 0 HD12 LEU A 45 4.150 12.051 -9.687 1.00 3.22 H new ATOM 0 HD13 LEU A 45 2.528 11.827 -8.989 1.00 3.22 H new ATOM 0 HD21 LEU A 45 1.092 13.859 -10.804 1.00 3.00 H new ATOM 0 HD22 LEU A 45 0.870 13.768 -9.041 1.00 3.00 H new ATOM 0 HD23 LEU A 45 1.348 15.305 -9.799 1.00 3.00 H new ATOM 637 N ALA A 46 2.940 12.840 -5.037 1.00 2.46 N ATOM 638 CA ALA A 46 3.651 12.595 -3.725 1.00 3.15 C ATOM 639 C ALA A 46 4.862 13.521 -3.559 1.00 2.91 C ATOM 640 O ALA A 46 4.765 14.581 -2.972 1.00 3.07 O ATOM 641 CB ALA A 46 4.125 11.142 -3.713 1.00 4.05 C ATOM 0 H ALA A 46 2.145 12.221 -5.197 1.00 2.46 H new ATOM 0 HA ALA A 46 2.963 12.797 -2.904 1.00 3.15 H new ATOM 0 HB1 ALA A 46 4.643 10.936 -2.776 1.00 4.05 H new ATOM 0 HB2 ALA A 46 3.266 10.478 -3.806 1.00 4.05 H new ATOM 0 HB3 ALA A 46 4.805 10.974 -4.548 1.00 4.05 H new ATOM 647 N LEU A 47 5.992 13.135 -4.102 1.00 3.18 N ATOM 648 CA LEU A 47 7.218 13.990 -4.013 1.00 3.43 C ATOM 649 C LEU A 47 7.744 14.270 -5.421 1.00 3.14 C ATOM 650 O LEU A 47 7.339 15.224 -6.056 1.00 3.51 O ATOM 651 CB LEU A 47 8.298 13.263 -3.204 1.00 4.05 C ATOM 652 CG LEU A 47 7.850 13.109 -1.740 1.00 4.77 C ATOM 653 CD1 LEU A 47 8.649 11.984 -1.078 1.00 5.26 C ATOM 654 CD2 LEU A 47 8.101 14.412 -0.967 1.00 5.35 C ATOM 0 H LEU A 47 6.118 12.258 -4.607 1.00 3.18 H new ATOM 0 HA LEU A 47 6.968 14.929 -3.520 1.00 3.43 H new ATOM 0 HB2 LEU A 47 8.490 12.282 -3.639 1.00 4.05 H new ATOM 0 HB3 LEU A 47 9.234 13.820 -3.249 1.00 4.05 H new ATOM 0 HG LEU A 47 6.785 12.876 -1.723 1.00 4.77 H new ATOM 0 HD11 LEU A 47 8.332 11.874 -0.041 1.00 5.26 H new ATOM 0 HD12 LEU A 47 8.473 11.050 -1.612 1.00 5.26 H new ATOM 0 HD13 LEU A 47 9.712 12.225 -1.109 1.00 5.26 H new ATOM 0 HD21 LEU A 47 7.780 14.289 0.067 1.00 5.35 H new ATOM 0 HD22 LEU A 47 9.164 14.650 -0.991 1.00 5.35 H new ATOM 0 HD23 LEU A 47 7.537 15.223 -1.428 1.00 5.35 H new ATOM 666 N ASP A 48 8.651 13.462 -5.913 1.00 3.02 N ATOM 667 CA ASP A 48 9.212 13.703 -7.282 1.00 3.07 C ATOM 668 C ASP A 48 9.373 12.353 -8.013 1.00 2.77 C ATOM 669 O ASP A 48 9.502 11.331 -7.367 1.00 2.85 O ATOM 670 CB ASP A 48 10.583 14.388 -7.128 1.00 3.61 C ATOM 671 CG ASP A 48 10.394 15.905 -7.018 1.00 4.22 C ATOM 672 OD1 ASP A 48 9.870 16.486 -7.954 1.00 4.68 O ATOM 673 OD2 ASP A 48 10.772 16.457 -5.998 1.00 4.69 O ATOM 0 H ASP A 48 9.027 12.647 -5.428 1.00 3.02 H new ATOM 0 HA ASP A 48 8.544 14.339 -7.863 1.00 3.07 H new ATOM 0 HB2 ASP A 48 11.091 14.010 -6.241 1.00 3.61 H new ATOM 0 HB3 ASP A 48 11.216 14.152 -7.983 1.00 3.61 H new ATOM 678 N PRO A 49 9.366 12.372 -9.338 1.00 3.11 N ATOM 679 CA PRO A 49 9.518 11.130 -10.120 1.00 3.40 C ATOM 680 C PRO A 49 10.813 10.412 -9.725 1.00 3.08 C ATOM 681 O PRO A 49 11.366 10.632 -8.665 1.00 3.32 O ATOM 682 CB PRO A 49 9.562 11.588 -11.601 1.00 4.36 C ATOM 683 CG PRO A 49 9.393 13.135 -11.617 1.00 4.66 C ATOM 684 CD PRO A 49 9.211 13.600 -10.156 1.00 3.86 C ATOM 0 HA PRO A 49 8.706 10.425 -9.944 1.00 3.40 H new ATOM 0 HB2 PRO A 49 10.506 11.301 -12.063 1.00 4.36 H new ATOM 0 HB3 PRO A 49 8.768 11.110 -12.174 1.00 4.36 H new ATOM 0 HG2 PRO A 49 10.266 13.611 -12.064 1.00 4.66 H new ATOM 0 HG3 PRO A 49 8.531 13.420 -12.220 1.00 4.66 H new ATOM 0 HD2 PRO A 49 9.954 14.350 -9.886 1.00 3.86 H new ATOM 0 HD3 PRO A 49 8.231 14.053 -10.006 1.00 3.86 H new ATOM 692 N VAL A 50 11.310 9.572 -10.589 1.00 3.08 N ATOM 693 CA VAL A 50 12.576 8.857 -10.283 1.00 3.10 C ATOM 694 C VAL A 50 13.221 8.353 -11.620 1.00 2.75 C ATOM 695 O VAL A 50 12.528 7.750 -12.416 1.00 2.91 O ATOM 696 CB VAL A 50 12.292 7.658 -9.335 1.00 3.88 C ATOM 697 CG1 VAL A 50 11.686 6.498 -10.134 1.00 4.44 C ATOM 698 CG2 VAL A 50 13.655 7.210 -8.798 1.00 4.50 C ATOM 0 H VAL A 50 10.893 9.351 -11.493 1.00 3.08 H new ATOM 0 HA VAL A 50 13.268 9.536 -9.785 1.00 3.10 H new ATOM 0 HB VAL A 50 11.602 7.941 -8.540 1.00 3.88 H new ATOM 0 HG11 VAL A 50 11.489 5.660 -9.466 1.00 4.44 H new ATOM 0 HG12 VAL A 50 10.753 6.822 -10.595 1.00 4.44 H new ATOM 0 HG13 VAL A 50 12.385 6.186 -10.910 1.00 4.44 H new ATOM 0 HG21 VAL A 50 13.520 6.366 -8.122 1.00 4.50 H new ATOM 0 HG22 VAL A 50 14.293 6.911 -9.629 1.00 4.50 H new ATOM 0 HG23 VAL A 50 14.123 8.034 -8.260 1.00 4.50 H new ATOM 708 N PRO A 51 14.516 8.593 -11.850 1.00 2.91 N ATOM 709 CA PRO A 51 15.179 8.121 -13.102 1.00 3.22 C ATOM 710 C PRO A 51 15.143 6.574 -13.213 1.00 2.93 C ATOM 711 O PRO A 51 16.164 5.923 -13.223 1.00 3.37 O ATOM 712 CB PRO A 51 16.640 8.644 -12.998 1.00 4.09 C ATOM 713 CG PRO A 51 16.793 9.352 -11.622 1.00 4.27 C ATOM 714 CD PRO A 51 15.410 9.350 -10.935 1.00 3.50 C ATOM 0 HA PRO A 51 14.674 8.490 -13.994 1.00 3.22 H new ATOM 0 HB2 PRO A 51 17.348 7.820 -13.085 1.00 4.09 H new ATOM 0 HB3 PRO A 51 16.857 9.337 -13.811 1.00 4.09 H new ATOM 0 HG2 PRO A 51 17.527 8.834 -11.005 1.00 4.27 H new ATOM 0 HG3 PRO A 51 17.152 10.372 -11.755 1.00 4.27 H new ATOM 0 HD2 PRO A 51 15.459 8.877 -9.954 1.00 3.50 H new ATOM 0 HD3 PRO A 51 15.046 10.366 -10.782 1.00 3.50 H new ATOM 722 N GLN A 52 13.974 6.003 -13.374 1.00 2.70 N ATOM 723 CA GLN A 52 13.842 4.517 -13.563 1.00 2.85 C ATOM 724 C GLN A 52 12.364 4.153 -13.448 1.00 2.14 C ATOM 725 O GLN A 52 11.617 4.781 -12.724 1.00 2.38 O ATOM 726 CB GLN A 52 14.631 3.713 -12.514 1.00 3.67 C ATOM 727 CG GLN A 52 14.274 4.208 -11.124 1.00 4.37 C ATOM 728 CD GLN A 52 15.134 3.513 -10.073 1.00 5.22 C ATOM 729 OE1 GLN A 52 16.289 3.226 -10.309 1.00 5.74 O ATOM 730 NE2 GLN A 52 14.613 3.236 -8.909 1.00 5.74 N ATOM 0 H GLN A 52 13.089 6.510 -13.383 1.00 2.70 H new ATOM 0 HA GLN A 52 14.250 4.265 -14.542 1.00 2.85 H new ATOM 0 HB2 GLN A 52 14.400 2.652 -12.604 1.00 3.67 H new ATOM 0 HB3 GLN A 52 15.702 3.822 -12.687 1.00 3.67 H new ATOM 0 HG2 GLN A 52 14.420 5.287 -11.067 1.00 4.37 H new ATOM 0 HG3 GLN A 52 13.220 4.018 -10.923 1.00 4.37 H new ATOM 0 HE21 GLN A 52 13.642 3.479 -8.714 1.00 5.74 H new ATOM 0 HE22 GLN A 52 15.177 2.777 -8.194 1.00 5.74 H new ATOM 739 N ASP A 53 11.927 3.152 -14.159 1.00 1.78 N ATOM 740 CA ASP A 53 10.490 2.766 -14.083 1.00 1.30 C ATOM 741 C ASP A 53 10.306 1.304 -14.496 1.00 1.07 C ATOM 742 O ASP A 53 9.286 0.707 -14.217 1.00 1.19 O ATOM 743 CB ASP A 53 9.676 3.660 -15.023 1.00 1.65 C ATOM 744 CG ASP A 53 8.183 3.486 -14.735 1.00 2.27 C ATOM 745 OD1 ASP A 53 7.843 2.570 -14.004 1.00 2.80 O ATOM 746 OD2 ASP A 53 7.405 4.272 -15.250 1.00 2.91 O ATOM 0 H ASP A 53 12.499 2.587 -14.787 1.00 1.78 H new ATOM 0 HA ASP A 53 10.146 2.890 -13.056 1.00 1.30 H new ATOM 0 HB2 ASP A 53 9.963 4.703 -14.888 1.00 1.65 H new ATOM 0 HB3 ASP A 53 9.889 3.402 -16.061 1.00 1.65 H new ATOM 751 N ALA A 54 11.255 0.717 -15.177 1.00 0.91 N ATOM 752 CA ALA A 54 11.057 -0.697 -15.601 1.00 0.84 C ATOM 753 C ALA A 54 10.737 -1.548 -14.367 1.00 0.76 C ATOM 754 O ALA A 54 9.938 -2.462 -14.415 1.00 0.75 O ATOM 755 CB ALA A 54 12.310 -1.224 -16.308 1.00 0.95 C ATOM 0 H ALA A 54 12.139 1.145 -15.452 1.00 0.91 H new ATOM 0 HA ALA A 54 10.226 -0.753 -16.304 1.00 0.84 H new ATOM 0 HB1 ALA A 54 12.149 -2.258 -16.611 1.00 0.95 H new ATOM 0 HB2 ALA A 54 12.514 -0.615 -17.189 1.00 0.95 H new ATOM 0 HB3 ALA A 54 13.160 -1.174 -15.627 1.00 0.95 H new ATOM 761 N SER A 55 11.349 -1.233 -13.258 1.00 0.75 N ATOM 762 CA SER A 55 11.088 -1.988 -11.995 1.00 0.71 C ATOM 763 C SER A 55 9.703 -1.623 -11.457 1.00 0.66 C ATOM 764 O SER A 55 8.860 -2.470 -11.246 1.00 0.66 O ATOM 765 CB SER A 55 12.135 -1.595 -10.955 1.00 0.76 C ATOM 766 OG SER A 55 13.410 -2.062 -11.373 1.00 1.37 O ATOM 0 H SER A 55 12.027 -0.476 -13.171 1.00 0.75 H new ATOM 0 HA SER A 55 11.136 -3.058 -12.195 1.00 0.71 H new ATOM 0 HB2 SER A 55 12.154 -0.512 -10.832 1.00 0.76 H new ATOM 0 HB3 SER A 55 11.879 -2.021 -9.985 1.00 0.76 H new ATOM 0 HG SER A 55 14.085 -1.810 -10.708 1.00 1.37 H new ATOM 772 N THR A 56 9.466 -0.359 -11.254 1.00 0.65 N ATOM 773 CA THR A 56 8.141 0.089 -10.738 1.00 0.62 C ATOM 774 C THR A 56 7.065 -0.204 -11.776 1.00 0.59 C ATOM 775 O THR A 56 5.901 -0.344 -11.458 1.00 0.57 O ATOM 776 CB THR A 56 8.187 1.594 -10.475 1.00 0.67 C ATOM 777 OG1 THR A 56 9.171 1.863 -9.486 1.00 1.09 O ATOM 778 CG2 THR A 56 6.826 2.078 -9.971 1.00 1.06 C ATOM 0 H THR A 56 10.137 0.390 -11.424 1.00 0.65 H new ATOM 0 HA THR A 56 7.911 -0.442 -9.814 1.00 0.62 H new ATOM 0 HB THR A 56 8.433 2.114 -11.401 1.00 0.67 H new ATOM 0 HG1 THR A 56 9.207 2.827 -9.314 1.00 1.09 H new ATOM 0 HG21 THR A 56 6.867 3.151 -9.786 1.00 1.06 H new ATOM 0 HG22 THR A 56 6.064 1.868 -10.722 1.00 1.06 H new ATOM 0 HG23 THR A 56 6.575 1.560 -9.045 1.00 1.06 H new ATOM 786 N LYS A 57 7.444 -0.291 -13.018 1.00 0.61 N ATOM 787 CA LYS A 57 6.441 -0.564 -14.077 1.00 0.59 C ATOM 788 C LYS A 57 5.893 -1.981 -13.896 1.00 0.54 C ATOM 789 O LYS A 57 4.710 -2.223 -14.049 1.00 0.52 O ATOM 790 CB LYS A 57 7.106 -0.420 -15.450 1.00 0.65 C ATOM 791 CG LYS A 57 6.145 -0.864 -16.556 1.00 1.20 C ATOM 792 CD LYS A 57 6.759 -0.536 -17.921 1.00 1.33 C ATOM 793 CE LYS A 57 6.022 -1.308 -19.016 1.00 1.94 C ATOM 794 NZ LYS A 57 4.563 -1.021 -18.931 1.00 2.73 N ATOM 0 H LYS A 57 8.405 -0.185 -13.344 1.00 0.61 H new ATOM 0 HA LYS A 57 5.617 0.146 -14.007 1.00 0.59 H new ATOM 0 HB2 LYS A 57 7.402 0.617 -15.611 1.00 0.65 H new ATOM 0 HB3 LYS A 57 8.015 -1.021 -15.486 1.00 0.65 H new ATOM 0 HG2 LYS A 57 5.952 -1.934 -16.479 1.00 1.20 H new ATOM 0 HG3 LYS A 57 5.186 -0.359 -16.445 1.00 1.20 H new ATOM 0 HD2 LYS A 57 6.695 0.535 -18.112 1.00 1.33 H new ATOM 0 HD3 LYS A 57 7.817 -0.798 -17.927 1.00 1.33 H new ATOM 0 HE2 LYS A 57 6.403 -1.022 -19.996 1.00 1.94 H new ATOM 0 HE3 LYS A 57 6.200 -2.378 -18.904 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 4.105 -1.283 -19.827 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 4.145 -1.573 -18.155 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 4.419 -0.007 -18.752 1.00 2.73 H new ATOM 808 N LYS A 58 6.736 -2.925 -13.566 1.00 0.55 N ATOM 809 CA LYS A 58 6.240 -4.316 -13.378 1.00 0.53 C ATOM 810 C LYS A 58 5.478 -4.394 -12.050 1.00 0.48 C ATOM 811 O LYS A 58 4.460 -5.055 -11.956 1.00 0.46 O ATOM 812 CB LYS A 58 7.425 -5.288 -13.377 1.00 0.56 C ATOM 813 CG LYS A 58 6.918 -6.727 -13.468 1.00 0.78 C ATOM 814 CD LYS A 58 8.110 -7.687 -13.508 1.00 0.96 C ATOM 815 CE LYS A 58 7.603 -9.125 -13.641 1.00 0.85 C ATOM 816 NZ LYS A 58 8.762 -10.063 -13.649 1.00 1.75 N ATOM 0 H LYS A 58 7.737 -2.793 -13.420 1.00 0.55 H new ATOM 0 HA LYS A 58 5.570 -4.590 -14.193 1.00 0.53 H new ATOM 0 HB2 LYS A 58 8.084 -5.072 -14.217 1.00 0.56 H new ATOM 0 HB3 LYS A 58 8.013 -5.157 -12.469 1.00 0.56 H new ATOM 0 HG2 LYS A 58 6.283 -6.955 -12.612 1.00 0.78 H new ATOM 0 HG3 LYS A 58 6.306 -6.852 -14.361 1.00 0.78 H new ATOM 0 HD2 LYS A 58 8.761 -7.441 -14.347 1.00 0.96 H new ATOM 0 HD3 LYS A 58 8.705 -7.582 -12.601 1.00 0.96 H new ATOM 0 HE2 LYS A 58 6.934 -9.364 -12.814 1.00 0.85 H new ATOM 0 HE3 LYS A 58 7.026 -9.235 -14.559 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 8.417 -11.040 -13.739 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 9.384 -9.840 -14.452 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 9.294 -9.965 -12.761 1.00 1.75 H new ATOM 830 N LEU A 59 5.959 -3.759 -11.012 1.00 0.50 N ATOM 831 CA LEU A 59 5.229 -3.860 -9.713 1.00 0.47 C ATOM 832 C LEU A 59 3.819 -3.274 -9.898 1.00 0.43 C ATOM 833 O LEU A 59 2.911 -3.553 -9.140 1.00 0.42 O ATOM 834 CB LEU A 59 5.973 -3.093 -8.596 1.00 0.53 C ATOM 835 CG LEU A 59 6.978 -3.984 -7.844 1.00 0.71 C ATOM 836 CD1 LEU A 59 6.268 -5.166 -7.158 1.00 1.07 C ATOM 837 CD2 LEU A 59 8.050 -4.495 -8.810 1.00 1.34 C ATOM 0 H LEU A 59 6.804 -3.188 -11.005 1.00 0.50 H new ATOM 0 HA LEU A 59 5.170 -4.907 -9.417 1.00 0.47 H new ATOM 0 HB2 LEU A 59 6.499 -2.243 -9.031 1.00 0.53 H new ATOM 0 HB3 LEU A 59 5.247 -2.691 -7.889 1.00 0.53 H new ATOM 0 HG LEU A 59 7.454 -3.383 -7.069 1.00 0.71 H new ATOM 0 HD11 LEU A 59 7.003 -5.778 -6.635 1.00 1.07 H new ATOM 0 HD12 LEU A 59 5.537 -4.787 -6.444 1.00 1.07 H new ATOM 0 HD13 LEU A 59 5.761 -5.771 -7.909 1.00 1.07 H new ATOM 0 HD21 LEU A 59 8.757 -5.124 -8.269 1.00 1.34 H new ATOM 0 HD22 LEU A 59 7.578 -5.077 -9.602 1.00 1.34 H new ATOM 0 HD23 LEU A 59 8.579 -3.648 -9.247 1.00 1.34 H new ATOM 849 N SER A 60 3.630 -2.497 -10.932 1.00 0.43 N ATOM 850 CA SER A 60 2.282 -1.918 -11.208 1.00 0.42 C ATOM 851 C SER A 60 1.413 -3.018 -11.823 1.00 0.39 C ATOM 852 O SER A 60 0.255 -3.180 -11.496 1.00 0.41 O ATOM 853 CB SER A 60 2.426 -0.771 -12.207 1.00 0.47 C ATOM 854 OG SER A 60 2.568 -1.301 -13.517 1.00 1.36 O ATOM 0 H SER A 60 4.355 -2.237 -11.601 1.00 0.43 H new ATOM 0 HA SER A 60 1.829 -1.543 -10.290 1.00 0.42 H new ATOM 0 HB2 SER A 60 1.553 -0.120 -12.159 1.00 0.47 H new ATOM 0 HB3 SER A 60 3.293 -0.160 -11.954 1.00 0.47 H new ATOM 0 HG SER A 60 3.436 -1.749 -13.596 1.00 1.36 H new ATOM 860 N GLU A 61 2.002 -3.801 -12.686 1.00 0.38 N ATOM 861 CA GLU A 61 1.274 -4.942 -13.323 1.00 0.38 C ATOM 862 C GLU A 61 0.621 -5.808 -12.246 1.00 0.38 C ATOM 863 O GLU A 61 -0.489 -6.272 -12.410 1.00 0.41 O ATOM 864 CB GLU A 61 2.277 -5.794 -14.104 1.00 0.39 C ATOM 865 CG GLU A 61 1.523 -6.791 -14.988 1.00 1.06 C ATOM 866 CD GLU A 61 0.877 -6.051 -16.162 1.00 1.67 C ATOM 867 OE1 GLU A 61 1.113 -4.860 -16.289 1.00 2.40 O ATOM 868 OE2 GLU A 61 0.158 -6.687 -16.915 1.00 2.25 O ATOM 0 H GLU A 61 2.972 -3.698 -12.983 1.00 0.38 H new ATOM 0 HA GLU A 61 0.505 -4.554 -13.990 1.00 0.38 H new ATOM 0 HB2 GLU A 61 2.912 -5.155 -14.718 1.00 0.39 H new ATOM 0 HB3 GLU A 61 2.932 -6.326 -13.415 1.00 0.39 H new ATOM 0 HG2 GLU A 61 2.208 -7.554 -15.359 1.00 1.06 H new ATOM 0 HG3 GLU A 61 0.759 -7.305 -14.404 1.00 1.06 H new ATOM 875 N CYS A 62 1.281 -6.025 -11.144 1.00 0.37 N ATOM 876 CA CYS A 62 0.666 -6.863 -10.074 1.00 0.39 C ATOM 877 C CYS A 62 -0.489 -6.090 -9.429 1.00 0.38 C ATOM 878 O CYS A 62 -1.604 -6.568 -9.359 1.00 0.44 O ATOM 879 CB CYS A 62 1.717 -7.194 -9.016 1.00 0.41 C ATOM 880 SG CYS A 62 3.131 -8.003 -9.805 1.00 1.62 S ATOM 0 H CYS A 62 2.212 -5.663 -10.937 1.00 0.37 H new ATOM 0 HA CYS A 62 0.288 -7.790 -10.506 1.00 0.39 H new ATOM 0 HB2 CYS A 62 2.040 -6.284 -8.511 1.00 0.41 H new ATOM 0 HB3 CYS A 62 1.289 -7.846 -8.254 1.00 0.41 H new ATOM 0 HG CYS A 62 4.028 -8.283 -8.906 1.00 1.62 H new ATOM 886 N LEU A 63 -0.242 -4.886 -8.991 1.00 0.35 N ATOM 887 CA LEU A 63 -1.328 -4.060 -8.388 1.00 0.36 C ATOM 888 C LEU A 63 -2.457 -3.888 -9.407 1.00 0.36 C ATOM 889 O LEU A 63 -3.595 -3.651 -9.055 1.00 0.41 O ATOM 890 CB LEU A 63 -0.743 -2.693 -8.009 1.00 0.38 C ATOM 891 CG LEU A 63 0.408 -2.880 -7.002 1.00 0.69 C ATOM 892 CD1 LEU A 63 1.133 -1.545 -6.805 1.00 1.39 C ATOM 893 CD2 LEU A 63 -0.149 -3.322 -5.639 1.00 1.11 C ATOM 0 H LEU A 63 0.672 -4.435 -9.025 1.00 0.35 H new ATOM 0 HA LEU A 63 -1.730 -4.546 -7.499 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -0.379 -2.183 -8.901 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -1.519 -2.062 -7.575 1.00 0.38 H new ATOM 0 HG LEU A 63 1.090 -3.636 -7.390 1.00 0.69 H new ATOM 0 HD11 LEU A 63 1.948 -1.675 -6.093 1.00 1.39 H new ATOM 0 HD12 LEU A 63 1.536 -1.205 -7.759 1.00 1.39 H new ATOM 0 HD13 LEU A 63 0.432 -0.803 -6.423 1.00 1.39 H new ATOM 0 HD21 LEU A 63 0.673 -3.451 -4.935 1.00 1.11 H new ATOM 0 HD22 LEU A 63 -0.834 -2.562 -5.262 1.00 1.11 H new ATOM 0 HD23 LEU A 63 -0.682 -4.266 -5.752 1.00 1.11 H new ATOM 905 N LYS A 64 -2.146 -4.000 -10.665 1.00 0.35 N ATOM 906 CA LYS A 64 -3.201 -3.841 -11.712 1.00 0.37 C ATOM 907 C LYS A 64 -3.909 -5.182 -11.943 1.00 0.39 C ATOM 908 O LYS A 64 -5.112 -5.237 -12.107 1.00 0.43 O ATOM 909 CB LYS A 64 -2.563 -3.361 -13.022 1.00 0.38 C ATOM 910 CG LYS A 64 -3.649 -3.086 -14.079 1.00 0.82 C ATOM 911 CD LYS A 64 -4.507 -1.878 -13.667 1.00 1.35 C ATOM 912 CE LYS A 64 -5.249 -1.331 -14.886 1.00 1.38 C ATOM 913 NZ LYS A 64 -6.165 -0.237 -14.456 1.00 2.09 N ATOM 0 H LYS A 64 -1.209 -4.195 -11.018 1.00 0.35 H new ATOM 0 HA LYS A 64 -3.930 -3.104 -11.376 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -1.984 -2.455 -12.842 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -1.868 -4.114 -13.393 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -3.184 -2.896 -15.046 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -4.282 -3.966 -14.197 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -5.220 -2.173 -12.897 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -3.875 -1.102 -13.236 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -4.537 -0.957 -15.621 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -5.816 -2.127 -15.368 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -6.182 0.507 -15.182 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -7.124 -0.618 -14.328 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -5.829 0.164 -13.557 1.00 2.09 H new ATOM 927 N ARG A 65 -3.174 -6.258 -11.970 1.00 0.43 N ATOM 928 CA ARG A 65 -3.804 -7.592 -12.205 1.00 0.47 C ATOM 929 C ARG A 65 -4.682 -7.990 -11.012 1.00 0.50 C ATOM 930 O ARG A 65 -5.784 -8.478 -11.177 1.00 0.54 O ATOM 931 CB ARG A 65 -2.706 -8.641 -12.394 1.00 0.45 C ATOM 932 CG ARG A 65 -3.300 -9.893 -13.044 1.00 0.94 C ATOM 933 CD ARG A 65 -2.262 -11.016 -13.034 1.00 1.55 C ATOM 934 NE ARG A 65 -2.751 -12.147 -13.871 1.00 1.86 N ATOM 935 CZ ARG A 65 -1.928 -13.090 -14.240 1.00 2.39 C ATOM 936 NH1 ARG A 65 -0.678 -13.048 -13.869 1.00 2.94 N ATOM 937 NH2 ARG A 65 -2.357 -14.076 -14.980 1.00 2.92 N ATOM 0 H ARG A 65 -2.162 -6.274 -11.840 1.00 0.43 H new ATOM 0 HA ARG A 65 -4.427 -7.535 -13.097 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -1.908 -8.239 -13.018 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -2.261 -8.894 -11.432 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -4.194 -10.206 -12.505 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -3.605 -9.674 -14.067 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -1.310 -10.650 -13.418 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -2.085 -11.354 -12.013 1.00 1.55 H new ATOM 0 HE ARG A 65 -3.730 -12.184 -14.156 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -0.343 -12.278 -13.290 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -0.035 -13.785 -14.158 1.00 2.94 H new ATOM 0 HH21 ARG A 65 -3.335 -14.109 -15.269 1.00 2.92 H new ATOM 0 HH22 ARG A 65 -1.715 -14.814 -15.269 1.00 2.92 H new ATOM 951 N ILE A 66 -4.214 -7.772 -9.814 1.00 0.49 N ATOM 952 CA ILE A 66 -5.029 -8.130 -8.618 1.00 0.53 C ATOM 953 C ILE A 66 -6.112 -7.063 -8.434 1.00 0.54 C ATOM 954 O ILE A 66 -7.236 -7.348 -8.072 1.00 0.60 O ATOM 955 CB ILE A 66 -4.109 -8.168 -7.388 1.00 0.52 C ATOM 956 CG1 ILE A 66 -3.231 -9.420 -7.439 1.00 1.22 C ATOM 957 CG2 ILE A 66 -4.932 -8.160 -6.093 1.00 1.29 C ATOM 958 CD1 ILE A 66 -2.115 -9.298 -6.399 1.00 1.25 C ATOM 0 H ILE A 66 -3.303 -7.361 -9.611 1.00 0.49 H new ATOM 0 HA ILE A 66 -5.498 -9.106 -8.745 1.00 0.53 H new ATOM 0 HB ILE A 66 -3.477 -7.280 -7.399 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -3.832 -10.308 -7.242 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -2.804 -9.539 -8.435 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -4.260 -8.187 -5.235 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -5.537 -7.254 -6.052 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -5.584 -9.033 -6.071 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -1.487 -10.189 -6.433 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -1.509 -8.419 -6.617 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -2.553 -9.200 -5.406 1.00 1.25 H new ATOM 970 N GLY A 67 -5.773 -5.837 -8.714 1.00 0.52 N ATOM 971 CA GLY A 67 -6.757 -4.723 -8.596 1.00 0.55 C ATOM 972 C GLY A 67 -7.963 -5.001 -9.491 1.00 0.53 C ATOM 973 O GLY A 67 -9.039 -4.486 -9.264 1.00 0.63 O ATOM 0 H GLY A 67 -4.843 -5.554 -9.024 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -7.078 -4.618 -7.560 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -6.290 -3.781 -8.882 1.00 0.55 H new ATOM 977 N ASP A 68 -7.804 -5.799 -10.514 1.00 0.54 N ATOM 978 CA ASP A 68 -8.957 -6.088 -11.417 1.00 0.54 C ATOM 979 C ASP A 68 -9.737 -7.296 -10.892 1.00 0.52 C ATOM 980 O ASP A 68 -10.941 -7.376 -11.033 1.00 0.56 O ATOM 981 CB ASP A 68 -8.429 -6.395 -12.820 1.00 0.60 C ATOM 982 CG ASP A 68 -9.603 -6.535 -13.790 1.00 1.43 C ATOM 983 OD1 ASP A 68 -10.440 -7.392 -13.558 1.00 2.20 O ATOM 984 OD2 ASP A 68 -9.646 -5.782 -14.750 1.00 2.12 O ATOM 0 H ASP A 68 -6.930 -6.261 -10.763 1.00 0.54 H new ATOM 0 HA ASP A 68 -9.618 -5.222 -11.451 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -7.763 -5.598 -13.151 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -7.844 -7.314 -12.806 1.00 0.60 H new ATOM 989 N GLU A 69 -9.063 -8.241 -10.291 1.00 0.56 N ATOM 990 CA GLU A 69 -9.775 -9.443 -9.766 1.00 0.56 C ATOM 991 C GLU A 69 -10.450 -9.092 -8.436 1.00 0.55 C ATOM 992 O GLU A 69 -11.561 -9.505 -8.168 1.00 0.73 O ATOM 993 CB GLU A 69 -8.765 -10.584 -9.562 1.00 0.61 C ATOM 994 CG GLU A 69 -9.480 -11.938 -9.616 1.00 0.84 C ATOM 995 CD GLU A 69 -10.506 -12.024 -8.484 1.00 1.65 C ATOM 996 OE1 GLU A 69 -10.133 -11.769 -7.351 1.00 2.48 O ATOM 997 OE2 GLU A 69 -11.647 -12.347 -8.771 1.00 2.23 O ATOM 0 H GLU A 69 -8.054 -8.233 -10.141 1.00 0.56 H new ATOM 0 HA GLU A 69 -10.536 -9.764 -10.478 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -7.995 -10.540 -10.332 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -8.263 -10.468 -8.602 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -9.975 -12.060 -10.579 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -8.755 -12.747 -9.525 1.00 0.84 H new ATOM 1004 N LEU A 70 -9.791 -8.342 -7.598 1.00 0.53 N ATOM 1005 CA LEU A 70 -10.406 -7.981 -6.290 1.00 0.52 C ATOM 1006 C LEU A 70 -11.481 -6.916 -6.512 1.00 0.54 C ATOM 1007 O LEU A 70 -12.568 -6.998 -5.991 1.00 0.60 O ATOM 1008 CB LEU A 70 -9.314 -7.431 -5.337 1.00 0.61 C ATOM 1009 CG LEU A 70 -8.945 -8.470 -4.271 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -8.417 -9.753 -4.940 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -7.874 -7.870 -3.351 1.00 1.61 C ATOM 0 H LEU A 70 -8.857 -7.965 -7.761 1.00 0.53 H new ATOM 0 HA LEU A 70 -10.859 -8.866 -5.843 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -8.427 -7.162 -5.911 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -9.671 -6.521 -4.855 1.00 0.61 H new ATOM 0 HG LEU A 70 -9.828 -8.730 -3.687 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -8.158 -10.483 -4.173 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -9.187 -10.167 -5.591 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -7.531 -9.518 -5.530 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -7.601 -8.598 -2.587 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -6.993 -7.613 -3.938 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -8.266 -6.972 -2.873 1.00 1.61 H new ATOM 1023 N ASP A 71 -11.182 -5.909 -7.272 1.00 0.67 N ATOM 1024 CA ASP A 71 -12.193 -4.850 -7.501 1.00 0.91 C ATOM 1025 C ASP A 71 -13.391 -5.420 -8.262 1.00 1.02 C ATOM 1026 O ASP A 71 -14.389 -4.741 -8.404 1.00 1.29 O ATOM 1027 CB ASP A 71 -11.575 -3.711 -8.313 1.00 1.09 C ATOM 1028 CG ASP A 71 -12.551 -2.534 -8.362 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -13.550 -2.589 -7.663 1.00 2.25 O ATOM 1030 OD2 ASP A 71 -12.284 -1.598 -9.097 1.00 2.36 O ATOM 0 H ASP A 71 -10.287 -5.773 -7.742 1.00 0.67 H new ATOM 0 HA ASP A 71 -12.528 -4.472 -6.535 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -10.633 -3.398 -7.863 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -11.348 -4.052 -9.323 1.00 1.09 H new ATOM 1035 N SER A 72 -13.322 -6.646 -8.769 1.00 0.90 N ATOM 1036 CA SER A 72 -14.502 -7.198 -9.534 1.00 1.20 C ATOM 1037 C SER A 72 -15.324 -8.142 -8.645 1.00 0.98 C ATOM 1038 O SER A 72 -16.270 -8.759 -9.094 1.00 1.02 O ATOM 1039 CB SER A 72 -14.035 -7.912 -10.801 1.00 1.57 C ATOM 1040 OG SER A 72 -13.588 -6.951 -11.748 1.00 2.09 O ATOM 0 H SER A 72 -12.520 -7.271 -8.688 1.00 0.90 H new ATOM 0 HA SER A 72 -15.141 -6.367 -9.831 1.00 1.20 H new ATOM 0 HB2 SER A 72 -13.229 -8.607 -10.564 1.00 1.57 H new ATOM 0 HB3 SER A 72 -14.850 -8.501 -11.221 1.00 1.57 H new ATOM 0 HG SER A 72 -12.612 -6.874 -11.700 1.00 2.09 H new ATOM 1046 N ASN A 73 -15.021 -8.206 -7.378 1.00 0.92 N ATOM 1047 CA ASN A 73 -15.842 -9.045 -6.455 1.00 0.83 C ATOM 1048 C ASN A 73 -16.967 -8.148 -5.932 1.00 0.75 C ATOM 1049 O ASN A 73 -16.740 -7.152 -5.279 1.00 1.07 O ATOM 1050 CB ASN A 73 -14.985 -9.584 -5.294 1.00 0.91 C ATOM 1051 CG ASN A 73 -14.171 -8.454 -4.653 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -14.548 -7.303 -4.704 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -13.047 -8.733 -4.053 1.00 1.90 N ATOM 0 H ASN A 73 -14.241 -7.715 -6.940 1.00 0.92 H new ATOM 0 HA ASN A 73 -16.246 -9.914 -6.975 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -15.628 -10.046 -4.545 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -14.313 -10.360 -5.661 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -12.494 -7.986 -3.632 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -12.721 -9.698 -4.004 1.00 1.90 H new ATOM 1060 N MET A 74 -18.194 -8.491 -6.229 1.00 0.71 N ATOM 1061 CA MET A 74 -19.333 -7.652 -5.774 1.00 0.67 C ATOM 1062 C MET A 74 -19.518 -7.777 -4.264 1.00 0.67 C ATOM 1063 O MET A 74 -20.250 -7.028 -3.657 1.00 0.71 O ATOM 1064 CB MET A 74 -20.612 -8.098 -6.485 1.00 0.75 C ATOM 1065 CG MET A 74 -20.522 -7.752 -7.973 1.00 1.20 C ATOM 1066 SD MET A 74 -20.702 -5.964 -8.191 1.00 1.92 S ATOM 1067 CE MET A 74 -20.027 -5.870 -9.868 1.00 1.96 C ATOM 0 H MET A 74 -18.452 -9.318 -6.768 1.00 0.71 H new ATOM 0 HA MET A 74 -19.121 -6.611 -6.016 1.00 0.67 H new ATOM 0 HB2 MET A 74 -20.754 -9.171 -6.359 1.00 0.75 H new ATOM 0 HB3 MET A 74 -21.477 -7.607 -6.039 1.00 0.75 H new ATOM 0 HG2 MET A 74 -19.565 -8.084 -8.377 1.00 1.20 H new ATOM 0 HG3 MET A 74 -21.301 -8.277 -8.527 1.00 1.20 H new ATOM 0 HE1 MET A 74 -20.043 -4.835 -10.209 1.00 1.96 H new ATOM 0 HE2 MET A 74 -19.000 -6.236 -9.868 1.00 1.96 H new ATOM 0 HE3 MET A 74 -20.631 -6.482 -10.538 1.00 1.96 H new ATOM 1077 N GLU A 75 -18.837 -8.705 -3.651 1.00 0.70 N ATOM 1078 CA GLU A 75 -18.946 -8.872 -2.177 1.00 0.75 C ATOM 1079 C GLU A 75 -18.154 -7.751 -1.495 1.00 0.73 C ATOM 1080 O GLU A 75 -18.722 -6.879 -0.871 1.00 0.78 O ATOM 1081 CB GLU A 75 -18.378 -10.246 -1.780 1.00 0.87 C ATOM 1082 CG GLU A 75 -18.972 -10.684 -0.439 1.00 1.15 C ATOM 1083 CD GLU A 75 -18.355 -12.019 -0.016 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -17.143 -12.076 0.110 1.00 2.29 O ATOM 1085 OE2 GLU A 75 -19.105 -12.962 0.176 1.00 2.21 O ATOM 0 H GLU A 75 -18.205 -9.359 -4.113 1.00 0.70 H new ATOM 0 HA GLU A 75 -19.989 -8.819 -1.864 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -18.611 -10.982 -2.549 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -17.292 -10.194 -1.707 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -18.780 -9.926 0.320 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -20.054 -10.783 -0.524 1.00 1.15 H new ATOM 1092 N LEU A 76 -16.857 -7.755 -1.614 1.00 0.74 N ATOM 1093 CA LEU A 76 -16.050 -6.671 -0.975 1.00 0.80 C ATOM 1094 C LEU A 76 -16.574 -5.300 -1.424 1.00 0.75 C ATOM 1095 O LEU A 76 -16.581 -4.353 -0.665 1.00 0.81 O ATOM 1096 CB LEU A 76 -14.565 -6.822 -1.371 1.00 0.92 C ATOM 1097 CG LEU A 76 -13.764 -7.467 -0.239 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -14.233 -8.907 -0.026 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -12.281 -7.460 -0.611 1.00 1.51 C ATOM 0 H LEU A 76 -16.319 -8.457 -2.123 1.00 0.74 H new ATOM 0 HA LEU A 76 -16.139 -6.749 0.109 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -14.484 -7.430 -2.272 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -14.146 -5.844 -1.608 1.00 0.92 H new ATOM 0 HG LEU A 76 -13.916 -6.905 0.682 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -13.659 -9.361 0.782 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -15.291 -8.910 0.235 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -14.084 -9.478 -0.943 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -11.703 -7.918 0.191 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -12.134 -8.024 -1.532 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -11.947 -6.433 -0.758 1.00 1.51 H new ATOM 1111 N GLN A 77 -17.064 -5.202 -2.622 1.00 0.76 N ATOM 1112 CA GLN A 77 -17.625 -3.898 -3.071 1.00 0.74 C ATOM 1113 C GLN A 77 -18.884 -3.622 -2.255 1.00 0.71 C ATOM 1114 O GLN A 77 -19.236 -2.486 -1.999 1.00 0.72 O ATOM 1115 CB GLN A 77 -17.964 -3.945 -4.561 1.00 0.71 C ATOM 1116 CG GLN A 77 -18.326 -2.541 -5.047 1.00 1.26 C ATOM 1117 CD GLN A 77 -18.707 -2.597 -6.527 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -18.956 -3.659 -7.061 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -18.762 -1.490 -7.216 1.00 2.03 N ATOM 0 H GLN A 77 -17.102 -5.958 -3.306 1.00 0.76 H new ATOM 0 HA GLN A 77 -16.893 -3.105 -2.920 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -17.115 -4.329 -5.126 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -18.796 -4.627 -4.734 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -19.156 -2.144 -4.462 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -17.483 -1.866 -4.903 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -18.553 -0.599 -6.767 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -19.014 -1.516 -8.204 1.00 2.03 H new ATOM 1128 N ARG A 78 -19.557 -4.651 -1.824 1.00 0.72 N ATOM 1129 CA ARG A 78 -20.783 -4.437 -1.014 1.00 0.73 C ATOM 1130 C ARG A 78 -20.389 -4.045 0.412 1.00 0.75 C ATOM 1131 O ARG A 78 -20.945 -3.129 0.984 1.00 0.79 O ATOM 1132 CB ARG A 78 -21.611 -5.723 -0.986 1.00 0.74 C ATOM 1133 CG ARG A 78 -23.065 -5.400 -0.610 1.00 0.94 C ATOM 1134 CD ARG A 78 -23.935 -6.662 -0.729 1.00 1.23 C ATOM 1135 NE ARG A 78 -23.942 -7.381 0.574 1.00 1.80 N ATOM 1136 CZ ARG A 78 -24.822 -8.318 0.794 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -25.688 -8.627 -0.132 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -24.835 -8.947 1.937 1.00 3.41 N ATOM 0 H ARG A 78 -19.311 -5.626 -1.997 1.00 0.72 H new ATOM 0 HA ARG A 78 -21.377 -3.638 -1.458 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -21.578 -6.209 -1.961 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -21.187 -6.423 -0.266 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -23.108 -5.014 0.408 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -23.453 -4.619 -1.264 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -24.952 -6.391 -1.013 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -23.547 -7.312 -1.514 1.00 1.23 H new ATOM 0 HE ARG A 78 -23.260 -7.141 1.294 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -25.676 -8.136 -1.026 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -26.377 -9.360 0.038 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -24.157 -8.706 2.659 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -25.524 -9.680 2.108 1.00 3.41 H new ATOM 1152 N MET A 79 -19.425 -4.721 0.996 1.00 0.75 N ATOM 1153 CA MET A 79 -19.002 -4.369 2.376 1.00 0.77 C ATOM 1154 C MET A 79 -18.475 -2.939 2.377 1.00 0.77 C ATOM 1155 O MET A 79 -18.872 -2.121 3.183 1.00 0.78 O ATOM 1156 CB MET A 79 -17.888 -5.328 2.815 1.00 0.81 C ATOM 1157 CG MET A 79 -18.471 -6.725 3.046 1.00 1.08 C ATOM 1158 SD MET A 79 -17.183 -7.817 3.698 1.00 1.07 S ATOM 1159 CE MET A 79 -17.459 -7.473 5.454 1.00 0.81 C ATOM 0 H MET A 79 -18.919 -5.498 0.571 1.00 0.75 H new ATOM 0 HA MET A 79 -19.844 -4.451 3.063 1.00 0.77 H new ATOM 0 HB2 MET A 79 -17.110 -5.370 2.053 1.00 0.81 H new ATOM 0 HB3 MET A 79 -17.420 -4.963 3.729 1.00 0.81 H new ATOM 0 HG2 MET A 79 -19.305 -6.671 3.745 1.00 1.08 H new ATOM 0 HG3 MET A 79 -18.864 -7.126 2.112 1.00 1.08 H new ATOM 0 HE1 MET A 79 -16.758 -8.054 6.053 1.00 0.81 H new ATOM 0 HE2 MET A 79 -17.307 -6.411 5.645 1.00 0.81 H new ATOM 0 HE3 MET A 79 -18.479 -7.747 5.723 1.00 0.81 H new ATOM 1169 N ILE A 80 -17.585 -2.627 1.474 1.00 0.77 N ATOM 1170 CA ILE A 80 -17.042 -1.245 1.416 1.00 0.80 C ATOM 1171 C ILE A 80 -18.220 -0.266 1.382 1.00 0.80 C ATOM 1172 O ILE A 80 -18.139 0.841 1.878 1.00 0.83 O ATOM 1173 CB ILE A 80 -16.177 -1.095 0.159 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -14.947 -2.005 0.289 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -15.725 0.360 0.016 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -14.290 -2.195 -1.080 1.00 1.10 C ATOM 0 H ILE A 80 -17.212 -3.271 0.776 1.00 0.77 H new ATOM 0 HA ILE A 80 -16.423 -1.035 2.288 1.00 0.80 H new ATOM 0 HB ILE A 80 -16.755 -1.378 -0.721 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -14.233 -1.568 0.987 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -15.241 -2.972 0.698 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -15.110 0.464 -0.878 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -16.599 1.006 -0.067 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -15.143 0.648 0.892 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -13.418 -2.842 -0.979 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -15.003 -2.652 -1.766 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -13.980 -1.227 -1.472 1.00 1.10 H new ATOM 1188 N ALA A 81 -19.319 -0.673 0.800 1.00 0.78 N ATOM 1189 CA ALA A 81 -20.513 0.218 0.733 1.00 0.80 C ATOM 1190 C ALA A 81 -21.281 0.174 2.060 1.00 0.81 C ATOM 1191 O ALA A 81 -22.091 1.034 2.347 1.00 0.85 O ATOM 1192 CB ALA A 81 -21.437 -0.268 -0.383 1.00 0.79 C ATOM 0 H ALA A 81 -19.440 -1.589 0.367 1.00 0.78 H new ATOM 0 HA ALA A 81 -20.184 1.239 0.539 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -22.313 0.379 -0.438 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -20.905 -0.240 -1.334 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -21.753 -1.290 -0.174 1.00 0.79 H new ATOM 1198 N ALA A 82 -21.046 -0.829 2.866 1.00 0.78 N ATOM 1199 CA ALA A 82 -21.776 -0.937 4.166 1.00 0.80 C ATOM 1200 C ALA A 82 -21.070 -0.098 5.233 1.00 0.79 C ATOM 1201 O ALA A 82 -21.638 0.223 6.258 1.00 0.83 O ATOM 1202 CB ALA A 82 -21.802 -2.401 4.611 1.00 0.87 C ATOM 0 H ALA A 82 -20.380 -1.579 2.681 1.00 0.78 H new ATOM 0 HA ALA A 82 -22.794 -0.570 4.037 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -22.334 -2.484 5.559 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -22.310 -3.002 3.856 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -20.781 -2.762 4.735 1.00 0.87 H new ATOM 1208 N VAL A 83 -19.838 0.262 5.001 1.00 0.80 N ATOM 1209 CA VAL A 83 -19.092 1.085 6.004 1.00 0.85 C ATOM 1210 C VAL A 83 -19.309 2.571 5.690 1.00 0.99 C ATOM 1211 O VAL A 83 -18.638 3.168 4.875 1.00 1.36 O ATOM 1212 CB VAL A 83 -17.596 0.720 5.964 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -17.099 0.647 4.517 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -16.780 1.761 6.736 1.00 1.40 C ATOM 0 H VAL A 83 -19.312 0.023 4.160 1.00 0.80 H new ATOM 0 HA VAL A 83 -19.462 0.882 7.009 1.00 0.85 H new ATOM 0 HB VAL A 83 -17.468 -0.257 6.430 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -16.040 0.388 4.509 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -17.663 -0.113 3.977 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -17.240 1.614 4.035 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -15.724 1.494 6.702 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -16.921 2.742 6.283 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -17.114 1.789 7.773 1.00 1.40 H new ATOM 1224 N ASP A 84 -20.245 3.172 6.366 1.00 1.46 N ATOM 1225 CA ASP A 84 -20.520 4.619 6.148 1.00 1.71 C ATOM 1226 C ASP A 84 -19.288 5.433 6.550 1.00 1.39 C ATOM 1227 O ASP A 84 -18.597 5.105 7.495 1.00 1.80 O ATOM 1228 CB ASP A 84 -21.711 5.047 7.010 1.00 2.38 C ATOM 1229 CG ASP A 84 -21.474 4.618 8.459 1.00 2.99 C ATOM 1230 OD1 ASP A 84 -21.814 3.493 8.786 1.00 3.45 O ATOM 1231 OD2 ASP A 84 -20.957 5.422 9.217 1.00 3.57 O ATOM 0 H ASP A 84 -20.836 2.721 7.065 1.00 1.46 H new ATOM 0 HA ASP A 84 -20.749 4.793 5.097 1.00 1.71 H new ATOM 0 HB2 ASP A 84 -21.842 6.128 6.957 1.00 2.38 H new ATOM 0 HB3 ASP A 84 -22.628 4.596 6.631 1.00 2.38 H new ATOM 1236 N THR A 85 -19.001 6.488 5.837 1.00 1.68 N ATOM 1237 CA THR A 85 -17.808 7.316 6.175 1.00 1.97 C ATOM 1238 C THR A 85 -18.155 8.275 7.315 1.00 1.67 C ATOM 1239 O THR A 85 -19.288 8.688 7.469 1.00 2.28 O ATOM 1240 CB THR A 85 -17.384 8.119 4.942 1.00 3.20 C ATOM 1241 OG1 THR A 85 -18.470 8.927 4.510 1.00 3.80 O ATOM 1242 CG2 THR A 85 -16.981 7.161 3.821 1.00 3.87 C ATOM 0 H THR A 85 -19.541 6.813 5.035 1.00 1.68 H new ATOM 0 HA THR A 85 -16.990 6.666 6.487 1.00 1.97 H new ATOM 0 HB THR A 85 -16.535 8.755 5.195 1.00 3.20 H new ATOM 0 HG1 THR A 85 -18.200 9.443 3.722 1.00 3.80 H new ATOM 0 HG21 THR A 85 -16.679 7.734 2.944 1.00 3.87 H new ATOM 0 HG22 THR A 85 -16.148 6.541 4.154 1.00 3.87 H new ATOM 0 HG23 THR A 85 -17.828 6.524 3.565 1.00 3.87 H new ATOM 1250 N ASP A 86 -17.189 8.635 8.117 1.00 1.51 N ATOM 1251 CA ASP A 86 -17.466 9.568 9.244 1.00 1.98 C ATOM 1252 C ASP A 86 -16.147 10.074 9.833 1.00 1.78 C ATOM 1253 O ASP A 86 -16.064 11.164 10.364 1.00 2.48 O ATOM 1254 CB ASP A 86 -18.266 8.842 10.327 1.00 2.56 C ATOM 1255 CG ASP A 86 -18.569 9.809 11.473 1.00 3.06 C ATOM 1256 OD1 ASP A 86 -19.540 10.540 11.364 1.00 3.50 O ATOM 1257 OD2 ASP A 86 -17.824 9.804 12.439 1.00 3.57 O ATOM 0 H ASP A 86 -16.221 8.323 8.039 1.00 1.51 H new ATOM 0 HA ASP A 86 -18.043 10.416 8.874 1.00 1.98 H new ATOM 0 HB2 ASP A 86 -19.195 8.454 9.909 1.00 2.56 H new ATOM 0 HB3 ASP A 86 -17.702 7.986 10.699 1.00 2.56 H new ATOM 1262 N SER A 87 -15.111 9.282 9.736 1.00 1.11 N ATOM 1263 CA SER A 87 -13.787 9.700 10.277 1.00 0.93 C ATOM 1264 C SER A 87 -12.692 8.839 9.612 1.00 0.84 C ATOM 1265 O SER A 87 -12.259 7.861 10.190 1.00 0.97 O ATOM 1266 CB SER A 87 -13.763 9.486 11.790 1.00 0.88 C ATOM 1267 OG SER A 87 -14.800 10.254 12.387 1.00 1.63 O ATOM 0 H SER A 87 -15.127 8.359 9.303 1.00 1.11 H new ATOM 0 HA SER A 87 -13.611 10.755 10.066 1.00 0.93 H new ATOM 0 HB2 SER A 87 -13.897 8.429 12.022 1.00 0.88 H new ATOM 0 HB3 SER A 87 -12.795 9.781 12.196 1.00 0.88 H new ATOM 0 HG SER A 87 -15.104 10.939 11.756 1.00 1.63 H new ATOM 1273 N PRO A 88 -12.289 9.200 8.402 1.00 0.77 N ATOM 1274 CA PRO A 88 -11.271 8.426 7.661 1.00 0.83 C ATOM 1275 C PRO A 88 -9.928 8.432 8.404 1.00 0.73 C ATOM 1276 O PRO A 88 -9.167 7.490 8.323 1.00 0.72 O ATOM 1277 CB PRO A 88 -11.152 9.129 6.286 1.00 1.01 C ATOM 1278 CG PRO A 88 -12.111 10.354 6.302 1.00 1.07 C ATOM 1279 CD PRO A 88 -12.803 10.388 7.681 1.00 0.83 C ATOM 0 HA PRO A 88 -11.552 7.378 7.557 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -10.125 9.448 6.106 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -11.418 8.444 5.481 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -11.557 11.276 6.129 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -12.850 10.272 5.505 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -12.567 11.307 8.218 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -13.887 10.348 7.579 1.00 0.83 H new ATOM 1287 N ARG A 89 -9.633 9.472 9.131 1.00 0.75 N ATOM 1288 CA ARG A 89 -8.344 9.518 9.872 1.00 0.73 C ATOM 1289 C ARG A 89 -8.398 8.506 11.023 1.00 0.67 C ATOM 1290 O ARG A 89 -7.478 7.741 11.231 1.00 0.68 O ATOM 1291 CB ARG A 89 -8.104 10.947 10.410 1.00 0.79 C ATOM 1292 CG ARG A 89 -9.445 11.639 10.696 1.00 1.63 C ATOM 1293 CD ARG A 89 -9.202 13.038 11.257 1.00 1.65 C ATOM 1294 NE ARG A 89 -10.519 13.680 11.535 1.00 2.07 N ATOM 1295 CZ ARG A 89 -10.583 14.768 12.252 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -9.490 15.310 12.712 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -11.740 15.315 12.504 1.00 3.10 N ATOM 0 H ARG A 89 -10.229 10.292 9.244 1.00 0.75 H new ATOM 0 HA ARG A 89 -7.519 9.260 9.208 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -7.507 10.905 11.321 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -7.535 11.526 9.683 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -10.033 11.703 9.781 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -10.024 11.049 11.407 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -8.610 12.981 12.170 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -8.633 13.636 10.545 1.00 1.65 H new ATOM 0 HE ARG A 89 -11.374 13.266 11.163 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -8.586 14.883 12.511 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -9.539 16.161 13.273 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -12.594 14.892 12.141 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -11.791 16.166 13.065 1.00 3.10 H new ATOM 1311 N GLU A 90 -9.474 8.488 11.763 1.00 0.65 N ATOM 1312 CA GLU A 90 -9.592 7.516 12.889 1.00 0.65 C ATOM 1313 C GLU A 90 -9.704 6.100 12.318 1.00 0.64 C ATOM 1314 O GLU A 90 -9.042 5.192 12.780 1.00 0.67 O ATOM 1315 CB GLU A 90 -10.842 7.836 13.710 1.00 0.71 C ATOM 1316 CG GLU A 90 -10.715 9.236 14.313 1.00 1.32 C ATOM 1317 CD GLU A 90 -11.961 9.546 15.145 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -12.023 9.089 16.275 1.00 2.46 O ATOM 1319 OE2 GLU A 90 -12.831 10.234 14.639 1.00 2.78 O ATOM 0 H GLU A 90 -10.277 9.104 11.637 1.00 0.65 H new ATOM 0 HA GLU A 90 -8.713 7.586 13.529 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -11.729 7.780 13.078 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -10.968 7.098 14.502 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -9.823 9.296 14.937 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -10.600 9.976 13.521 1.00 1.32 H new ATOM 1326 N VAL A 91 -10.535 5.886 11.336 1.00 0.64 N ATOM 1327 CA VAL A 91 -10.673 4.512 10.776 1.00 0.67 C ATOM 1328 C VAL A 91 -9.341 4.069 10.165 1.00 0.66 C ATOM 1329 O VAL A 91 -8.891 2.959 10.364 1.00 0.67 O ATOM 1330 CB VAL A 91 -11.760 4.516 9.699 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -11.805 3.152 9.005 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -13.114 4.792 10.356 1.00 0.75 C ATOM 0 H VAL A 91 -11.121 6.598 10.899 1.00 0.64 H new ATOM 0 HA VAL A 91 -10.949 3.818 11.570 1.00 0.67 H new ATOM 0 HB VAL A 91 -11.539 5.289 8.962 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -12.580 3.159 8.239 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -10.840 2.947 8.542 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -12.027 2.377 9.739 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -13.894 4.796 9.594 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -13.328 4.015 11.090 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -13.086 5.762 10.853 1.00 0.75 H new ATOM 1342 N PHE A 92 -8.708 4.938 9.424 1.00 0.64 N ATOM 1343 CA PHE A 92 -7.403 4.587 8.792 1.00 0.65 C ATOM 1344 C PHE A 92 -6.453 4.007 9.838 1.00 0.62 C ATOM 1345 O PHE A 92 -5.780 3.025 9.592 1.00 0.67 O ATOM 1346 CB PHE A 92 -6.776 5.843 8.180 1.00 0.65 C ATOM 1347 CG PHE A 92 -5.432 5.499 7.582 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -5.366 4.843 6.347 1.00 1.44 C ATOM 1349 CD2 PHE A 92 -4.252 5.837 8.258 1.00 1.31 C ATOM 1350 CE1 PHE A 92 -4.122 4.525 5.788 1.00 1.47 C ATOM 1351 CE2 PHE A 92 -3.008 5.519 7.698 1.00 1.31 C ATOM 1352 CZ PHE A 92 -2.944 4.863 6.463 1.00 0.73 C ATOM 0 H PHE A 92 -9.041 5.882 9.228 1.00 0.64 H new ATOM 0 HA PHE A 92 -7.575 3.844 8.013 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -7.433 6.252 7.412 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -6.659 6.612 8.943 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -6.275 4.582 5.825 1.00 1.44 H new ATOM 0 HD2 PHE A 92 -4.302 6.343 9.211 1.00 1.31 H new ATOM 0 HE1 PHE A 92 -4.072 4.019 4.835 1.00 1.47 H new ATOM 0 HE2 PHE A 92 -2.099 5.780 8.219 1.00 1.31 H new ATOM 0 HZ PHE A 92 -1.985 4.618 6.031 1.00 0.73 H new ATOM 1362 N PHE A 93 -6.376 4.595 11.001 1.00 0.58 N ATOM 1363 CA PHE A 93 -5.449 4.050 12.036 1.00 0.57 C ATOM 1364 C PHE A 93 -6.110 2.853 12.721 1.00 0.59 C ATOM 1365 O PHE A 93 -5.445 1.945 13.180 1.00 0.60 O ATOM 1366 CB PHE A 93 -5.134 5.138 13.067 1.00 0.57 C ATOM 1367 CG PHE A 93 -4.028 4.675 13.985 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -2.692 4.831 13.602 1.00 1.15 C ATOM 1369 CD2 PHE A 93 -4.340 4.096 15.222 1.00 1.47 C ATOM 1370 CE1 PHE A 93 -1.666 4.409 14.455 1.00 1.07 C ATOM 1371 CE2 PHE A 93 -3.313 3.674 16.076 1.00 1.58 C ATOM 1372 CZ PHE A 93 -1.976 3.830 15.692 1.00 0.70 C ATOM 0 H PHE A 93 -6.908 5.420 11.278 1.00 0.58 H new ATOM 0 HA PHE A 93 -4.519 3.729 11.567 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -4.837 6.056 12.560 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -6.027 5.370 13.648 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -2.452 5.277 12.648 1.00 1.15 H new ATOM 0 HD2 PHE A 93 -5.372 3.975 15.517 1.00 1.47 H new ATOM 0 HE1 PHE A 93 -0.634 4.530 14.159 1.00 1.07 H new ATOM 0 HE2 PHE A 93 -3.553 3.229 17.030 1.00 1.58 H new ATOM 0 HZ PHE A 93 -1.184 3.504 16.349 1.00 0.70 H new ATOM 1382 N ARG A 94 -7.411 2.848 12.805 1.00 0.62 N ATOM 1383 CA ARG A 94 -8.103 1.712 13.470 1.00 0.67 C ATOM 1384 C ARG A 94 -8.044 0.470 12.577 1.00 0.66 C ATOM 1385 O ARG A 94 -7.552 -0.563 12.988 1.00 0.67 O ATOM 1386 CB ARG A 94 -9.568 2.092 13.751 1.00 0.72 C ATOM 1387 CG ARG A 94 -10.124 1.292 14.947 1.00 0.89 C ATOM 1388 CD ARG A 94 -10.548 -0.126 14.515 1.00 1.00 C ATOM 1389 NE ARG A 94 -11.390 -0.095 13.269 1.00 1.95 N ATOM 1390 CZ ARG A 94 -12.445 0.677 13.158 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -12.911 1.329 14.185 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -13.077 0.741 12.019 1.00 3.65 N ATOM 0 H ARG A 94 -8.023 3.580 12.443 1.00 0.62 H new ATOM 0 HA ARG A 94 -7.605 1.490 14.414 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -9.638 3.160 13.959 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -10.174 1.899 12.866 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -9.367 1.227 15.729 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -10.979 1.817 15.374 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -9.661 -0.735 14.341 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -11.107 -0.601 15.321 1.00 1.00 H new ATOM 0 HE ARG A 94 -11.132 -0.694 12.485 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -12.455 1.244 15.093 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -13.732 1.925 14.081 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -12.750 0.193 11.223 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -13.898 1.339 11.924 1.00 3.65 H new ATOM 1406 N VAL A 95 -8.530 0.540 11.363 1.00 0.65 N ATOM 1407 CA VAL A 95 -8.479 -0.654 10.483 1.00 0.66 C ATOM 1408 C VAL A 95 -7.030 -1.118 10.335 1.00 0.66 C ATOM 1409 O VAL A 95 -6.738 -2.297 10.384 1.00 0.67 O ATOM 1410 CB VAL A 95 -9.055 -0.276 9.106 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -8.093 0.663 8.368 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -9.271 -1.540 8.270 1.00 1.08 C ATOM 0 H VAL A 95 -8.956 1.370 10.950 1.00 0.65 H new ATOM 0 HA VAL A 95 -9.065 -1.465 10.916 1.00 0.66 H new ATOM 0 HB VAL A 95 -10.008 0.232 9.253 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -8.512 0.923 7.396 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -7.948 1.570 8.955 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -7.134 0.165 8.228 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -9.679 -1.267 7.297 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -8.319 -2.053 8.134 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -9.969 -2.201 8.783 1.00 1.08 H new ATOM 1422 N ALA A 96 -6.124 -0.202 10.123 1.00 0.65 N ATOM 1423 CA ALA A 96 -4.706 -0.600 9.937 1.00 0.68 C ATOM 1424 C ALA A 96 -4.218 -1.376 11.162 1.00 0.70 C ATOM 1425 O ALA A 96 -3.453 -2.316 11.066 1.00 0.76 O ATOM 1426 CB ALA A 96 -3.852 0.653 9.738 1.00 0.69 C ATOM 0 H ALA A 96 -6.307 0.800 10.071 1.00 0.65 H new ATOM 0 HA ALA A 96 -4.620 -1.240 9.059 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -2.810 0.365 9.601 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -4.198 1.193 8.857 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -3.939 1.295 10.614 1.00 0.69 H new ATOM 1432 N ALA A 97 -4.662 -0.964 12.324 1.00 0.74 N ATOM 1433 CA ALA A 97 -4.241 -1.641 13.582 1.00 0.78 C ATOM 1434 C ALA A 97 -4.911 -3.009 13.674 1.00 0.79 C ATOM 1435 O ALA A 97 -4.362 -3.946 14.218 1.00 0.83 O ATOM 1436 CB ALA A 97 -4.659 -0.790 14.785 1.00 0.77 C ATOM 0 H ALA A 97 -5.303 -0.181 12.452 1.00 0.74 H new ATOM 0 HA ALA A 97 -3.158 -1.765 13.581 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -4.351 -1.285 15.706 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -4.182 0.188 14.722 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -5.742 -0.666 14.784 1.00 0.77 H new ATOM 1442 N ASP A 98 -6.098 -3.132 13.148 1.00 0.78 N ATOM 1443 CA ASP A 98 -6.799 -4.441 13.208 1.00 0.82 C ATOM 1444 C ASP A 98 -6.080 -5.443 12.307 1.00 0.83 C ATOM 1445 O ASP A 98 -5.883 -6.587 12.668 1.00 0.88 O ATOM 1446 CB ASP A 98 -8.244 -4.270 12.733 1.00 0.82 C ATOM 1447 CG ASP A 98 -9.014 -5.572 12.966 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -8.941 -6.442 12.114 1.00 2.13 O ATOM 1449 OD2 ASP A 98 -9.664 -5.677 13.993 1.00 2.19 O ATOM 0 H ASP A 98 -6.610 -2.384 12.681 1.00 0.78 H new ATOM 0 HA ASP A 98 -6.797 -4.808 14.234 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -8.721 -3.451 13.272 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -8.262 -4.008 11.675 1.00 0.82 H new ATOM 1454 N MET A 99 -5.719 -5.036 11.117 1.00 0.81 N ATOM 1455 CA MET A 99 -5.054 -5.985 10.181 1.00 0.85 C ATOM 1456 C MET A 99 -3.838 -6.604 10.879 1.00 0.97 C ATOM 1457 O MET A 99 -3.478 -7.742 10.649 1.00 1.14 O ATOM 1458 CB MET A 99 -4.614 -5.216 8.910 1.00 0.79 C ATOM 1459 CG MET A 99 -4.879 -6.042 7.638 1.00 0.81 C ATOM 1460 SD MET A 99 -6.534 -5.664 7.007 1.00 0.97 S ATOM 1461 CE MET A 99 -6.072 -4.232 5.998 1.00 0.48 C ATOM 0 H MET A 99 -5.856 -4.092 10.756 1.00 0.81 H new ATOM 0 HA MET A 99 -5.742 -6.780 9.894 1.00 0.85 H new ATOM 0 HB2 MET A 99 -5.151 -4.270 8.850 1.00 0.79 H new ATOM 0 HB3 MET A 99 -3.553 -4.976 8.976 1.00 0.79 H new ATOM 0 HG2 MET A 99 -4.129 -5.814 6.881 1.00 0.81 H new ATOM 0 HG3 MET A 99 -4.797 -7.106 7.859 1.00 0.81 H new ATOM 0 HE1 MET A 99 -6.962 -3.646 5.770 1.00 0.48 H new ATOM 0 HE2 MET A 99 -5.361 -3.614 6.547 1.00 0.48 H new ATOM 0 HE3 MET A 99 -5.614 -4.574 5.070 1.00 0.48 H new ATOM 1471 N PHE A 100 -3.204 -5.843 11.723 1.00 0.98 N ATOM 1472 CA PHE A 100 -2.005 -6.343 12.444 1.00 1.14 C ATOM 1473 C PHE A 100 -2.452 -7.311 13.531 1.00 1.28 C ATOM 1474 O PHE A 100 -1.784 -8.291 13.797 1.00 1.67 O ATOM 1475 CB PHE A 100 -1.267 -5.156 13.086 1.00 1.19 C ATOM 1476 CG PHE A 100 -0.413 -4.455 12.046 1.00 1.15 C ATOM 1477 CD1 PHE A 100 -0.986 -4.012 10.843 1.00 1.67 C ATOM 1478 CD2 PHE A 100 0.953 -4.251 12.282 1.00 1.64 C ATOM 1479 CE1 PHE A 100 -0.198 -3.371 9.885 1.00 1.79 C ATOM 1480 CE2 PHE A 100 1.741 -3.609 11.321 1.00 1.69 C ATOM 1481 CZ PHE A 100 1.166 -3.170 10.122 1.00 1.38 C ATOM 0 H PHE A 100 -3.469 -4.884 11.946 1.00 0.98 H new ATOM 0 HA PHE A 100 -1.337 -6.851 11.749 1.00 1.14 H new ATOM 0 HB2 PHE A 100 -1.987 -4.456 13.510 1.00 1.19 H new ATOM 0 HB3 PHE A 100 -0.641 -5.507 13.907 1.00 1.19 H new ATOM 0 HD1 PHE A 100 -2.039 -4.167 10.658 1.00 1.67 H new ATOM 0 HD2 PHE A 100 1.398 -4.590 13.206 1.00 1.64 H new ATOM 0 HE1 PHE A 100 -0.642 -3.030 8.961 1.00 1.79 H new ATOM 0 HE2 PHE A 100 2.794 -3.452 11.504 1.00 1.69 H new ATOM 0 HZ PHE A 100 1.776 -2.676 9.380 1.00 1.38 H new ATOM 1491 N SER A 101 -3.577 -7.053 14.160 1.00 1.34 N ATOM 1492 CA SER A 101 -4.059 -7.971 15.238 1.00 1.52 C ATOM 1493 C SER A 101 -2.867 -8.374 16.098 1.00 1.61 C ATOM 1494 O SER A 101 -2.653 -9.543 16.341 1.00 1.99 O ATOM 1495 CB SER A 101 -4.637 -9.228 14.592 1.00 1.79 C ATOM 1496 OG SER A 101 -5.045 -10.130 15.613 1.00 2.21 O ATOM 0 H SER A 101 -4.178 -6.250 13.973 1.00 1.34 H new ATOM 0 HA SER A 101 -4.818 -7.476 15.844 1.00 1.52 H new ATOM 0 HB2 SER A 101 -5.485 -8.969 13.958 1.00 1.79 H new ATOM 0 HB3 SER A 101 -3.891 -9.698 13.951 1.00 1.79 H new ATOM 0 HG SER A 101 -4.290 -10.310 16.212 1.00 2.21 H new ATOM 1502 N ASP A 102 -2.110 -7.427 16.584 1.00 1.99 N ATOM 1503 CA ASP A 102 -0.932 -7.734 17.438 1.00 2.34 C ATOM 1504 C ASP A 102 -0.074 -8.907 16.922 1.00 2.07 C ATOM 1505 O ASP A 102 0.899 -9.281 17.546 1.00 2.62 O ATOM 1506 CB ASP A 102 -1.404 -8.006 18.863 1.00 3.15 C ATOM 1507 CG ASP A 102 -2.287 -6.845 19.323 1.00 3.78 C ATOM 1508 OD1 ASP A 102 -3.451 -6.830 18.956 1.00 4.42 O ATOM 1509 OD2 ASP A 102 -1.785 -5.987 20.031 1.00 4.10 O ATOM 0 H ASP A 102 -2.265 -6.432 16.420 1.00 1.99 H new ATOM 0 HA ASP A 102 -0.281 -6.860 17.408 1.00 2.34 H new ATOM 0 HB2 ASP A 102 -1.961 -8.942 18.903 1.00 3.15 H new ATOM 0 HB3 ASP A 102 -0.548 -8.115 19.529 1.00 3.15 H new ATOM 1514 N GLY A 103 -0.434 -9.523 15.815 1.00 2.05 N ATOM 1515 CA GLY A 103 0.365 -10.677 15.317 1.00 2.45 C ATOM 1516 C GLY A 103 1.563 -10.182 14.505 1.00 2.44 C ATOM 1517 O GLY A 103 2.020 -9.068 14.661 1.00 3.08 O ATOM 0 H GLY A 103 -1.242 -9.273 15.244 1.00 2.05 H new ATOM 0 HA2 GLY A 103 0.710 -11.279 16.158 1.00 2.45 H new ATOM 0 HA3 GLY A 103 -0.260 -11.322 14.699 1.00 2.45 H new ATOM 1521 N ASN A 104 2.074 -11.015 13.640 1.00 2.29 N ATOM 1522 CA ASN A 104 3.246 -10.616 12.814 1.00 2.55 C ATOM 1523 C ASN A 104 2.810 -9.625 11.737 1.00 2.17 C ATOM 1524 O ASN A 104 1.641 -9.341 11.570 1.00 2.54 O ATOM 1525 CB ASN A 104 3.836 -11.857 12.137 1.00 3.20 C ATOM 1526 CG ASN A 104 4.296 -12.854 13.200 1.00 3.72 C ATOM 1527 OD1 ASN A 104 3.936 -14.014 13.159 1.00 4.05 O ATOM 1528 ND2 ASN A 104 5.085 -12.450 14.157 1.00 4.31 N ATOM 0 H ASN A 104 1.727 -11.959 13.470 1.00 2.29 H new ATOM 0 HA ASN A 104 3.993 -10.150 13.457 1.00 2.55 H new ATOM 0 HB2 ASN A 104 3.091 -12.319 11.490 1.00 3.20 H new ATOM 0 HB3 ASN A 104 4.676 -11.573 11.503 1.00 3.20 H new ATOM 0 HD21 ASN A 104 5.400 -13.108 14.870 1.00 4.31 H new ATOM 0 HD22 ASN A 104 5.387 -11.476 14.192 1.00 4.31 H new ATOM 1535 N PHE A 105 3.749 -9.113 10.991 1.00 1.90 N ATOM 1536 CA PHE A 105 3.414 -8.156 9.900 1.00 1.74 C ATOM 1537 C PHE A 105 3.286 -8.961 8.605 1.00 1.59 C ATOM 1538 O PHE A 105 2.218 -9.120 8.074 1.00 1.88 O ATOM 1539 CB PHE A 105 4.537 -7.118 9.788 1.00 2.03 C ATOM 1540 CG PHE A 105 4.988 -6.738 11.183 1.00 1.75 C ATOM 1541 CD1 PHE A 105 4.081 -6.144 12.071 1.00 2.14 C ATOM 1542 CD2 PHE A 105 6.305 -6.987 11.595 1.00 2.28 C ATOM 1543 CE1 PHE A 105 4.489 -5.800 13.366 1.00 2.60 C ATOM 1544 CE2 PHE A 105 6.712 -6.641 12.891 1.00 2.84 C ATOM 1545 CZ PHE A 105 5.804 -6.048 13.776 1.00 2.84 C ATOM 0 H PHE A 105 4.743 -9.319 11.092 1.00 1.90 H new ATOM 0 HA PHE A 105 2.480 -7.630 10.100 1.00 1.74 H new ATOM 0 HB2 PHE A 105 5.372 -7.525 9.219 1.00 2.03 H new ATOM 0 HB3 PHE A 105 4.185 -6.237 9.252 1.00 2.03 H new ATOM 0 HD1 PHE A 105 3.066 -5.951 11.756 1.00 2.14 H new ATOM 0 HD2 PHE A 105 7.006 -7.446 10.913 1.00 2.28 H new ATOM 0 HE1 PHE A 105 3.788 -5.343 14.049 1.00 2.60 H new ATOM 0 HE2 PHE A 105 7.727 -6.832 13.207 1.00 2.84 H new ATOM 0 HZ PHE A 105 6.118 -5.782 14.775 1.00 2.84 H new ATOM 1555 N ASN A 106 4.388 -9.427 8.089 1.00 1.85 N ATOM 1556 CA ASN A 106 4.372 -10.211 6.809 1.00 1.93 C ATOM 1557 C ASN A 106 4.256 -9.231 5.645 1.00 1.72 C ATOM 1558 O ASN A 106 3.431 -8.346 5.659 1.00 2.31 O ATOM 1559 CB ASN A 106 3.179 -11.193 6.792 1.00 2.62 C ATOM 1560 CG ASN A 106 3.476 -12.366 5.851 1.00 3.11 C ATOM 1561 OD1 ASN A 106 3.048 -12.370 4.714 1.00 3.46 O ATOM 1562 ND2 ASN A 106 4.191 -13.369 6.281 1.00 3.79 N ATOM 0 H ASN A 106 5.313 -9.300 8.500 1.00 1.85 H new ATOM 0 HA ASN A 106 5.291 -10.791 6.722 1.00 1.93 H new ATOM 0 HB2 ASN A 106 2.989 -11.564 7.799 1.00 2.62 H new ATOM 0 HB3 ASN A 106 2.276 -10.675 6.467 1.00 2.62 H new ATOM 0 HD21 ASN A 106 4.390 -14.155 5.663 1.00 3.79 H new ATOM 0 HD22 ASN A 106 4.551 -13.367 7.235 1.00 3.79 H new ATOM 1569 N TRP A 107 5.088 -9.368 4.655 1.00 1.54 N ATOM 1570 CA TRP A 107 5.046 -8.421 3.501 1.00 1.68 C ATOM 1571 C TRP A 107 3.762 -8.608 2.690 1.00 1.47 C ATOM 1572 O TRP A 107 3.569 -7.992 1.662 1.00 1.49 O ATOM 1573 CB TRP A 107 6.278 -8.645 2.603 1.00 2.30 C ATOM 1574 CG TRP A 107 7.392 -9.193 3.430 1.00 2.32 C ATOM 1575 CD1 TRP A 107 8.040 -10.353 3.185 1.00 2.69 C ATOM 1576 CD2 TRP A 107 7.987 -8.634 4.636 1.00 2.77 C ATOM 1577 NE1 TRP A 107 8.999 -10.543 4.161 1.00 3.12 N ATOM 1578 CE2 TRP A 107 9.007 -9.511 5.078 1.00 3.35 C ATOM 1579 CE3 TRP A 107 7.746 -7.463 5.382 1.00 3.24 C ATOM 1580 CZ2 TRP A 107 9.761 -9.239 6.219 1.00 4.31 C ATOM 1581 CZ3 TRP A 107 8.506 -7.188 6.532 1.00 4.29 C ATOM 1582 CH2 TRP A 107 9.511 -8.074 6.949 1.00 4.80 C ATOM 0 H TRP A 107 5.799 -10.096 4.591 1.00 1.54 H new ATOM 0 HA TRP A 107 5.059 -7.401 3.886 1.00 1.68 H new ATOM 0 HB2 TRP A 107 6.034 -9.336 1.796 1.00 2.30 H new ATOM 0 HB3 TRP A 107 6.581 -7.706 2.139 1.00 2.30 H new ATOM 0 HD1 TRP A 107 7.841 -11.022 2.361 1.00 2.69 H new ATOM 0 HE1 TRP A 107 9.625 -11.348 4.199 1.00 3.12 H new ATOM 0 HE3 TRP A 107 6.975 -6.775 5.069 1.00 3.24 H new ATOM 0 HZ2 TRP A 107 10.533 -9.924 6.536 1.00 4.31 H new ATOM 0 HZ3 TRP A 107 8.315 -6.289 7.099 1.00 4.29 H new ATOM 0 HH2 TRP A 107 10.091 -7.856 7.834 1.00 4.80 H new ATOM 1593 N GLY A 108 2.905 -9.492 3.117 1.00 1.41 N ATOM 1594 CA GLY A 108 1.653 -9.751 2.350 1.00 1.47 C ATOM 1595 C GLY A 108 0.501 -8.896 2.882 1.00 1.05 C ATOM 1596 O GLY A 108 -0.283 -8.335 2.121 1.00 1.02 O ATOM 0 H GLY A 108 3.017 -10.048 3.965 1.00 1.41 H new ATOM 0 HA2 GLY A 108 1.816 -9.532 1.295 1.00 1.47 H new ATOM 0 HA3 GLY A 108 1.390 -10.807 2.420 1.00 1.47 H new ATOM 1600 N ARG A 109 0.342 -8.816 4.179 1.00 0.86 N ATOM 1601 CA ARG A 109 -0.813 -8.041 4.695 1.00 0.87 C ATOM 1602 C ARG A 109 -0.633 -6.579 4.288 1.00 0.70 C ATOM 1603 O ARG A 109 -1.582 -5.846 4.083 1.00 0.81 O ATOM 1604 CB ARG A 109 -0.894 -8.192 6.224 1.00 1.08 C ATOM 1605 CG ARG A 109 -1.513 -9.571 6.589 1.00 1.48 C ATOM 1606 CD ARG A 109 -0.858 -10.160 7.849 1.00 1.96 C ATOM 1607 NE ARG A 109 -1.313 -9.415 9.056 1.00 2.74 N ATOM 1608 CZ ARG A 109 -1.107 -9.917 10.245 1.00 3.19 C ATOM 1609 NH1 ARG A 109 -0.452 -11.039 10.374 1.00 3.19 N ATOM 1610 NH2 ARG A 109 -1.546 -9.293 11.304 1.00 4.08 N ATOM 0 H ARG A 109 0.946 -9.243 4.881 1.00 0.86 H new ATOM 0 HA ARG A 109 -1.747 -8.413 4.275 1.00 0.87 H new ATOM 0 HB2 ARG A 109 0.101 -8.104 6.660 1.00 1.08 H new ATOM 0 HB3 ARG A 109 -1.499 -7.389 6.646 1.00 1.08 H new ATOM 0 HG2 ARG A 109 -2.585 -9.459 6.752 1.00 1.48 H new ATOM 0 HG3 ARG A 109 -1.387 -10.261 5.755 1.00 1.48 H new ATOM 0 HD2 ARG A 109 -1.116 -11.215 7.944 1.00 1.96 H new ATOM 0 HD3 ARG A 109 0.227 -10.104 7.765 1.00 1.96 H new ATOM 0 HE ARG A 109 -1.784 -8.516 8.955 1.00 2.74 H new ATOM 0 HH11 ARG A 109 -0.102 -11.523 9.547 1.00 3.19 H new ATOM 0 HH12 ARG A 109 -0.291 -11.432 11.301 1.00 3.19 H new ATOM 0 HH21 ARG A 109 -2.051 -8.412 11.204 1.00 4.08 H new ATOM 0 HH22 ARG A 109 -1.384 -9.686 12.231 1.00 4.08 H new ATOM 1624 N VAL A 110 0.607 -6.155 4.181 1.00 0.60 N ATOM 1625 CA VAL A 110 0.894 -4.745 3.796 1.00 0.68 C ATOM 1626 C VAL A 110 0.309 -4.488 2.408 1.00 0.56 C ATOM 1627 O VAL A 110 -0.151 -3.402 2.117 1.00 0.60 O ATOM 1628 CB VAL A 110 2.419 -4.490 3.799 1.00 0.88 C ATOM 1629 CG1 VAL A 110 3.052 -5.175 5.008 1.00 1.27 C ATOM 1630 CG2 VAL A 110 3.052 -5.046 2.515 1.00 1.73 C ATOM 0 H VAL A 110 1.432 -6.732 4.346 1.00 0.60 H new ATOM 0 HA VAL A 110 0.438 -4.064 4.515 1.00 0.68 H new ATOM 0 HB VAL A 110 2.595 -3.415 3.850 1.00 0.88 H new ATOM 0 HG11 VAL A 110 4.127 -4.994 5.008 1.00 1.27 H new ATOM 0 HG12 VAL A 110 2.617 -4.773 5.923 1.00 1.27 H new ATOM 0 HG13 VAL A 110 2.865 -6.248 4.958 1.00 1.27 H new ATOM 0 HG21 VAL A 110 4.126 -4.860 2.529 1.00 1.73 H new ATOM 0 HG22 VAL A 110 2.870 -6.119 2.455 1.00 1.73 H new ATOM 0 HG23 VAL A 110 2.610 -4.554 1.649 1.00 1.73 H new ATOM 1640 N VAL A 111 0.317 -5.472 1.544 1.00 0.51 N ATOM 1641 CA VAL A 111 -0.246 -5.258 0.188 1.00 0.50 C ATOM 1642 C VAL A 111 -1.706 -4.841 0.336 1.00 0.46 C ATOM 1643 O VAL A 111 -2.154 -3.877 -0.252 1.00 0.47 O ATOM 1644 CB VAL A 111 -0.161 -6.566 -0.605 1.00 0.58 C ATOM 1645 CG1 VAL A 111 -0.801 -6.385 -1.983 1.00 1.41 C ATOM 1646 CG2 VAL A 111 1.307 -6.963 -0.773 1.00 1.36 C ATOM 0 H VAL A 111 0.687 -6.405 1.722 1.00 0.51 H new ATOM 0 HA VAL A 111 0.312 -4.484 -0.339 1.00 0.50 H new ATOM 0 HB VAL A 111 -0.694 -7.348 -0.064 1.00 0.58 H new ATOM 0 HG11 VAL A 111 -0.736 -7.320 -2.540 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -1.848 -6.105 -1.864 1.00 1.41 H new ATOM 0 HG13 VAL A 111 -0.276 -5.601 -2.528 1.00 1.41 H new ATOM 0 HG21 VAL A 111 1.370 -7.894 -1.337 1.00 1.36 H new ATOM 0 HG22 VAL A 111 1.837 -6.177 -1.310 1.00 1.36 H new ATOM 0 HG23 VAL A 111 1.761 -7.102 0.208 1.00 1.36 H new ATOM 1656 N ALA A 112 -2.447 -5.555 1.141 1.00 0.45 N ATOM 1657 CA ALA A 112 -3.881 -5.187 1.350 1.00 0.47 C ATOM 1658 C ALA A 112 -3.969 -3.753 1.887 1.00 0.46 C ATOM 1659 O ALA A 112 -4.944 -3.064 1.663 1.00 0.54 O ATOM 1660 CB ALA A 112 -4.536 -6.147 2.338 1.00 0.53 C ATOM 0 H ALA A 112 -2.126 -6.372 1.660 1.00 0.45 H new ATOM 0 HA ALA A 112 -4.406 -5.253 0.397 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -5.580 -5.867 2.480 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -4.483 -7.163 1.947 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -4.014 -6.098 3.293 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.960 -3.282 2.551 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.989 -1.876 3.050 1.00 0.43 C ATOM 1668 C LEU A 113 -3.062 -0.922 1.846 1.00 0.42 C ATOM 1669 O LEU A 113 -3.976 -0.132 1.720 1.00 0.45 O ATOM 1670 CB LEU A 113 -1.697 -1.610 3.856 1.00 0.44 C ATOM 1671 CG LEU A 113 -1.992 -0.630 5.004 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -0.731 -0.412 5.836 1.00 1.45 C ATOM 1673 CD2 LEU A 113 -2.465 0.704 4.424 1.00 1.27 C ATOM 0 H LEU A 113 -2.113 -3.805 2.773 1.00 0.43 H new ATOM 0 HA LEU A 113 -3.857 -1.715 3.690 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -1.308 -2.546 4.256 1.00 0.44 H new ATOM 0 HB3 LEU A 113 -0.928 -1.198 3.202 1.00 0.44 H new ATOM 0 HG LEU A 113 -2.772 -1.045 5.643 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -0.946 0.283 6.648 1.00 1.45 H new ATOM 0 HD12 LEU A 113 -0.400 -1.364 6.252 1.00 1.45 H new ATOM 0 HD13 LEU A 113 0.055 0.001 5.204 1.00 1.45 H new ATOM 0 HD21 LEU A 113 -2.675 1.400 5.236 1.00 1.27 H new ATOM 0 HD22 LEU A 113 -1.687 1.118 3.783 1.00 1.27 H new ATOM 0 HD23 LEU A 113 -3.371 0.546 3.839 1.00 1.27 H new ATOM 1685 N PHE A 114 -2.116 -1.016 0.952 1.00 0.40 N ATOM 1686 CA PHE A 114 -2.116 -0.150 -0.266 1.00 0.40 C ATOM 1687 C PHE A 114 -3.472 -0.195 -0.970 1.00 0.39 C ATOM 1688 O PHE A 114 -3.999 0.816 -1.391 1.00 0.41 O ATOM 1689 CB PHE A 114 -1.036 -0.653 -1.230 1.00 0.41 C ATOM 1690 CG PHE A 114 0.257 -0.941 -0.483 1.00 0.44 C ATOM 1691 CD1 PHE A 114 0.662 -0.144 0.605 1.00 1.27 C ATOM 1692 CD2 PHE A 114 1.058 -2.015 -0.889 1.00 1.29 C ATOM 1693 CE1 PHE A 114 1.858 -0.426 1.273 1.00 1.27 C ATOM 1694 CE2 PHE A 114 2.254 -2.294 -0.217 1.00 1.38 C ATOM 1695 CZ PHE A 114 2.653 -1.500 0.864 1.00 0.68 C ATOM 0 H PHE A 114 -1.331 -1.665 1.013 1.00 0.40 H new ATOM 0 HA PHE A 114 -1.916 0.878 0.035 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -1.381 -1.557 -1.732 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -0.856 0.093 -2.004 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.049 0.686 0.924 1.00 1.27 H new ATOM 0 HD2 PHE A 114 0.753 -2.630 -1.723 1.00 1.29 H new ATOM 0 HE1 PHE A 114 2.168 0.187 2.106 1.00 1.27 H new ATOM 0 HE2 PHE A 114 2.870 -3.123 -0.533 1.00 1.38 H new ATOM 0 HZ PHE A 114 3.575 -1.717 1.382 1.00 0.68 H new ATOM 1705 N TYR A 115 -4.038 -1.361 -1.106 1.00 0.40 N ATOM 1706 CA TYR A 115 -5.356 -1.474 -1.793 1.00 0.41 C ATOM 1707 C TYR A 115 -6.432 -0.754 -0.982 1.00 0.41 C ATOM 1708 O TYR A 115 -7.228 -0.009 -1.517 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.738 -2.949 -1.952 1.00 0.44 C ATOM 1710 CG TYR A 115 -7.096 -3.052 -2.606 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -7.213 -2.945 -3.996 1.00 1.24 C ATOM 1712 CD2 TYR A 115 -8.240 -3.254 -1.821 1.00 1.28 C ATOM 1713 CE1 TYR A 115 -8.471 -3.040 -4.604 1.00 1.26 C ATOM 1714 CE2 TYR A 115 -9.498 -3.348 -2.429 1.00 1.32 C ATOM 1715 CZ TYR A 115 -9.613 -3.242 -3.821 1.00 0.61 C ATOM 1716 OH TYR A 115 -10.853 -3.335 -4.420 1.00 0.70 O ATOM 0 H TYR A 115 -3.646 -2.241 -0.771 1.00 0.40 H new ATOM 0 HA TYR A 115 -5.279 -1.013 -2.778 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -4.992 -3.465 -2.556 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.754 -3.438 -0.978 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -6.332 -2.789 -4.601 1.00 1.24 H new ATOM 0 HD2 TYR A 115 -8.151 -3.337 -0.748 1.00 1.28 H new ATOM 0 HE1 TYR A 115 -8.560 -2.957 -5.677 1.00 1.26 H new ATOM 0 HE2 TYR A 115 -10.380 -3.502 -1.825 1.00 1.32 H new ATOM 0 HH TYR A 115 -11.538 -3.476 -3.734 1.00 0.70 H new ATOM 1726 N PHE A 116 -6.464 -0.965 0.302 1.00 0.38 N ATOM 1727 CA PHE A 116 -7.497 -0.283 1.127 1.00 0.38 C ATOM 1728 C PHE A 116 -7.326 1.238 1.000 1.00 0.36 C ATOM 1729 O PHE A 116 -8.277 1.972 0.808 1.00 0.35 O ATOM 1730 CB PHE A 116 -7.332 -0.695 2.598 1.00 0.40 C ATOM 1731 CG PHE A 116 -8.207 0.175 3.477 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -9.590 -0.042 3.527 1.00 1.17 C ATOM 1733 CD2 PHE A 116 -7.634 1.205 4.235 1.00 1.35 C ATOM 1734 CE1 PHE A 116 -10.398 0.770 4.333 1.00 1.18 C ATOM 1735 CE2 PHE A 116 -8.442 2.016 5.042 1.00 1.37 C ATOM 1736 CZ PHE A 116 -9.824 1.798 5.090 1.00 0.45 C ATOM 0 H PHE A 116 -5.826 -1.575 0.813 1.00 0.38 H new ATOM 0 HA PHE A 116 -8.489 -0.570 0.779 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -7.603 -1.743 2.724 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -6.289 -0.597 2.898 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -10.033 -0.836 2.944 1.00 1.17 H new ATOM 0 HD2 PHE A 116 -6.568 1.374 4.197 1.00 1.35 H new ATOM 0 HE1 PHE A 116 -11.464 0.603 4.370 1.00 1.18 H new ATOM 0 HE2 PHE A 116 -7.999 2.809 5.627 1.00 1.37 H new ATOM 0 HZ PHE A 116 -10.448 2.423 5.712 1.00 0.45 H new ATOM 1746 N ALA A 117 -6.111 1.712 1.104 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.861 3.177 0.991 1.00 0.34 C ATOM 1748 C ALA A 117 -6.128 3.640 -0.440 1.00 0.34 C ATOM 1749 O ALA A 117 -6.571 4.747 -0.673 1.00 0.34 O ATOM 1750 CB ALA A 117 -4.403 3.475 1.350 1.00 0.37 C ATOM 0 H ALA A 117 -5.279 1.144 1.263 1.00 0.35 H new ATOM 0 HA ALA A 117 -6.526 3.706 1.674 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -4.220 4.546 1.267 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -4.206 3.151 2.372 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.743 2.940 0.667 1.00 0.37 H new ATOM 1756 N SER A 118 -5.849 2.807 -1.403 1.00 0.35 N ATOM 1757 CA SER A 118 -6.074 3.206 -2.816 1.00 0.37 C ATOM 1758 C SER A 118 -7.509 3.686 -3.009 1.00 0.36 C ATOM 1759 O SER A 118 -7.747 4.694 -3.628 1.00 0.36 O ATOM 1760 CB SER A 118 -5.826 2.011 -3.738 1.00 0.42 C ATOM 1761 OG SER A 118 -6.928 1.117 -3.651 1.00 1.25 O ATOM 0 H SER A 118 -5.475 1.867 -1.271 1.00 0.35 H new ATOM 0 HA SER A 118 -5.385 4.014 -3.060 1.00 0.37 H new ATOM 0 HB2 SER A 118 -5.698 2.350 -4.766 1.00 0.42 H new ATOM 0 HB3 SER A 118 -4.906 1.501 -3.453 1.00 0.42 H new ATOM 0 HG SER A 118 -6.841 0.568 -2.844 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.458 2.992 -2.438 1.00 0.37 N ATOM 1768 CA LYS A 119 -9.886 3.417 -2.561 1.00 0.39 C ATOM 1769 C LYS A 119 -10.090 4.735 -1.811 1.00 0.36 C ATOM 1770 O LYS A 119 -10.783 5.619 -2.273 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.797 2.343 -1.956 1.00 0.46 C ATOM 1772 CG LYS A 119 -10.421 0.972 -2.522 1.00 1.29 C ATOM 1773 CD LYS A 119 -11.463 -0.066 -2.089 1.00 1.84 C ATOM 1774 CE LYS A 119 -11.558 -0.111 -0.556 1.00 2.48 C ATOM 1775 NZ LYS A 119 -12.518 0.928 -0.088 1.00 3.36 N ATOM 0 H LYS A 119 -8.306 2.146 -1.889 1.00 0.37 H new ATOM 0 HA LYS A 119 -10.134 3.552 -3.614 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -10.699 2.339 -0.870 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -11.840 2.567 -2.181 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -10.369 1.018 -3.610 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -9.433 0.680 -2.168 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -12.435 0.184 -2.514 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -11.190 -1.049 -2.473 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -11.886 -1.098 -0.230 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -10.576 0.060 -0.115 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -11.993 1.726 0.324 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -13.085 1.265 -0.892 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -13.148 0.520 0.632 1.00 3.36 H new ATOM 1789 N LEU A 120 -9.488 4.877 -0.665 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.643 6.144 0.106 1.00 0.35 C ATOM 1791 C LEU A 120 -9.288 7.333 -0.794 1.00 0.33 C ATOM 1792 O LEU A 120 -10.039 8.281 -0.917 1.00 0.39 O ATOM 1793 CB LEU A 120 -8.705 6.098 1.330 1.00 0.36 C ATOM 1794 CG LEU A 120 -9.306 6.907 2.499 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -10.354 6.067 3.245 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -8.195 7.288 3.481 1.00 1.28 C ATOM 0 H LEU A 120 -8.895 4.172 -0.227 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.673 6.257 0.445 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -8.548 5.064 1.638 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -7.729 6.503 1.063 1.00 0.36 H new ATOM 0 HG LEU A 120 -9.778 7.803 2.096 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -10.770 6.650 4.067 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -11.153 5.788 2.558 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -9.884 5.166 3.640 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -8.619 7.859 4.307 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -7.726 6.384 3.869 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -7.447 7.893 2.968 1.00 1.28 H new ATOM 1808 N VAL A 121 -8.161 7.271 -1.443 1.00 0.33 N ATOM 1809 CA VAL A 121 -7.757 8.370 -2.361 1.00 0.39 C ATOM 1810 C VAL A 121 -8.597 8.288 -3.647 1.00 0.36 C ATOM 1811 O VAL A 121 -9.120 9.290 -4.093 1.00 0.39 O ATOM 1812 CB VAL A 121 -6.220 8.341 -2.620 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -5.627 7.035 -2.094 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.883 8.475 -4.115 1.00 1.18 C ATOM 0 H VAL A 121 -7.497 6.500 -1.376 1.00 0.33 H new ATOM 0 HA VAL A 121 -7.958 9.338 -1.901 1.00 0.39 H new ATOM 0 HB VAL A 121 -5.789 9.193 -2.095 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -4.553 7.023 -2.279 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -5.812 6.957 -1.023 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -6.093 6.192 -2.605 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.801 8.450 -4.248 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -6.336 7.650 -4.665 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -6.273 9.420 -4.493 1.00 1.18 H new ATOM 1824 N LEU A 122 -8.742 7.140 -4.265 1.00 0.37 N ATOM 1825 CA LEU A 122 -9.567 7.081 -5.509 1.00 0.39 C ATOM 1826 C LEU A 122 -10.961 7.654 -5.227 1.00 0.40 C ATOM 1827 O LEU A 122 -11.517 8.361 -6.043 1.00 0.40 O ATOM 1828 CB LEU A 122 -9.681 5.604 -5.979 1.00 0.42 C ATOM 1829 CG LEU A 122 -9.131 5.421 -7.397 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -7.601 5.480 -7.371 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -9.573 4.054 -7.927 1.00 1.24 C ATOM 0 H LEU A 122 -8.331 6.255 -3.967 1.00 0.37 H new ATOM 0 HA LEU A 122 -9.094 7.671 -6.294 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -9.135 4.959 -5.290 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -10.725 5.291 -5.950 1.00 0.42 H new ATOM 0 HG LEU A 122 -9.510 6.214 -8.041 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -7.215 5.349 -8.382 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -7.281 6.447 -6.982 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -7.217 4.686 -6.730 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -9.187 3.913 -8.937 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -9.186 3.269 -7.277 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -10.662 4.005 -7.945 1.00 1.24 H new ATOM 1843 N LYS A 123 -11.528 7.370 -4.093 1.00 0.51 N ATOM 1844 CA LYS A 123 -12.876 7.924 -3.792 1.00 0.55 C ATOM 1845 C LYS A 123 -12.761 9.441 -3.616 1.00 0.54 C ATOM 1846 O LYS A 123 -13.687 10.177 -3.894 1.00 0.55 O ATOM 1847 CB LYS A 123 -13.429 7.274 -2.521 1.00 0.59 C ATOM 1848 CG LYS A 123 -13.773 5.806 -2.809 1.00 0.97 C ATOM 1849 CD LYS A 123 -13.892 5.031 -1.492 1.00 1.37 C ATOM 1850 CE LYS A 123 -14.923 5.704 -0.581 1.00 1.74 C ATOM 1851 NZ LYS A 123 -14.288 6.856 0.119 1.00 2.32 N ATOM 0 H LYS A 123 -11.122 6.783 -3.365 1.00 0.51 H new ATOM 0 HA LYS A 123 -13.561 7.710 -4.613 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -12.695 7.336 -1.718 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -14.317 7.808 -2.183 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -14.710 5.745 -3.363 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -13.002 5.359 -3.436 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -14.188 4.001 -1.692 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -12.923 4.993 -0.994 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -15.775 6.046 -1.168 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -15.304 4.988 0.147 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -14.483 6.793 1.139 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -13.260 6.835 -0.039 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -14.677 7.746 -0.253 1.00 2.32 H new ATOM 1865 N ALA A 124 -11.634 9.916 -3.159 1.00 0.52 N ATOM 1866 CA ALA A 124 -11.465 11.386 -2.968 1.00 0.52 C ATOM 1867 C ALA A 124 -11.220 12.064 -4.317 1.00 0.51 C ATOM 1868 O ALA A 124 -11.578 13.205 -4.533 1.00 0.54 O ATOM 1869 CB ALA A 124 -10.279 11.646 -2.045 1.00 0.51 C ATOM 0 H ALA A 124 -10.823 9.350 -2.910 1.00 0.52 H new ATOM 0 HA ALA A 124 -12.372 11.795 -2.523 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -10.155 12.720 -1.905 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -10.459 11.173 -1.080 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -9.374 11.231 -2.490 1.00 0.51 H new ATOM 1875 N LEU A 125 -10.623 11.347 -5.232 1.00 0.47 N ATOM 1876 CA LEU A 125 -10.354 11.895 -6.580 1.00 0.47 C ATOM 1877 C LEU A 125 -11.684 12.160 -7.288 1.00 0.48 C ATOM 1878 O LEU A 125 -11.860 13.179 -7.924 1.00 0.48 O ATOM 1879 CB LEU A 125 -9.542 10.853 -7.371 1.00 0.51 C ATOM 1880 CG LEU A 125 -9.350 11.307 -8.825 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -8.574 12.632 -8.880 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -8.572 10.235 -9.594 1.00 1.21 C ATOM 0 H LEU A 125 -10.307 10.387 -5.092 1.00 0.47 H new ATOM 0 HA LEU A 125 -9.795 12.828 -6.510 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -8.571 10.707 -6.899 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -10.055 9.892 -7.349 1.00 0.51 H new ATOM 0 HG LEU A 125 -10.331 11.454 -9.277 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -8.448 12.937 -9.919 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -9.128 13.401 -8.341 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -7.595 12.500 -8.420 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -8.435 10.556 -10.627 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -7.598 10.087 -9.127 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -9.129 9.298 -9.576 1.00 1.21 H new ATOM 1894 N CYS A 126 -12.609 11.240 -7.218 1.00 0.52 N ATOM 1895 CA CYS A 126 -13.908 11.438 -7.924 1.00 0.57 C ATOM 1896 C CYS A 126 -14.726 12.513 -7.222 1.00 0.57 C ATOM 1897 O CYS A 126 -15.704 13.012 -7.742 1.00 0.68 O ATOM 1898 CB CYS A 126 -14.698 10.117 -7.922 1.00 0.66 C ATOM 1899 SG CYS A 126 -15.621 9.937 -6.365 1.00 1.67 S ATOM 0 H CYS A 126 -12.522 10.363 -6.704 1.00 0.52 H new ATOM 0 HA CYS A 126 -13.711 11.750 -8.950 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -15.387 10.096 -8.766 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -14.015 9.277 -8.047 1.00 0.66 H new ATOM 0 HG CYS A 126 -14.799 10.017 -5.361 1.00 1.67 H new ATOM 1905 N THR A 127 -14.318 12.885 -6.046 1.00 0.57 N ATOM 1906 CA THR A 127 -15.069 13.932 -5.311 1.00 0.60 C ATOM 1907 C THR A 127 -14.528 15.299 -5.730 1.00 0.62 C ATOM 1908 O THR A 127 -15.037 16.323 -5.327 1.00 0.70 O ATOM 1909 CB THR A 127 -14.904 13.720 -3.783 1.00 0.60 C ATOM 1910 OG1 THR A 127 -14.399 12.417 -3.543 1.00 1.14 O ATOM 1911 CG2 THR A 127 -16.262 13.866 -3.083 1.00 1.19 C ATOM 0 H THR A 127 -13.501 12.511 -5.564 1.00 0.57 H new ATOM 0 HA THR A 127 -16.131 13.875 -5.548 1.00 0.60 H new ATOM 0 HB THR A 127 -14.213 14.467 -3.392 1.00 0.60 H new ATOM 0 HG1 THR A 127 -14.908 11.767 -4.071 1.00 1.14 H new ATOM 0 HG21 THR A 127 -16.137 13.716 -2.011 1.00 1.19 H new ATOM 0 HG22 THR A 127 -16.660 14.864 -3.265 1.00 1.19 H new ATOM 0 HG23 THR A 127 -16.955 13.122 -3.475 1.00 1.19 H new ATOM 1919 N LYS A 128 -13.476 15.303 -6.531 1.00 0.60 N ATOM 1920 CA LYS A 128 -12.875 16.595 -6.987 1.00 0.70 C ATOM 1921 C LYS A 128 -12.245 17.336 -5.819 1.00 0.61 C ATOM 1922 O LYS A 128 -12.516 18.502 -5.621 1.00 0.60 O ATOM 1923 CB LYS A 128 -13.923 17.501 -7.654 1.00 0.87 C ATOM 1924 CG LYS A 128 -14.643 16.747 -8.771 1.00 1.12 C ATOM 1925 CD LYS A 128 -15.606 17.705 -9.476 1.00 1.43 C ATOM 1926 CE LYS A 128 -16.267 16.996 -10.658 1.00 1.83 C ATOM 1927 NZ LYS A 128 -17.114 17.967 -11.407 1.00 2.47 N ATOM 0 H LYS A 128 -13.014 14.465 -6.884 1.00 0.60 H new ATOM 0 HA LYS A 128 -12.107 16.350 -7.721 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -14.645 17.841 -6.912 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -13.440 18.390 -8.059 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -13.920 16.348 -9.483 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -15.189 15.898 -8.361 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -16.366 18.051 -8.776 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -15.067 18.587 -9.824 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -15.506 16.577 -11.316 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -16.875 16.164 -10.303 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -17.565 17.486 -12.212 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -17.848 18.347 -10.776 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -16.521 18.747 -11.757 1.00 2.47 H new ATOM 1941 N VAL A 129 -11.367 16.703 -5.062 1.00 0.60 N ATOM 1942 CA VAL A 129 -10.684 17.422 -3.945 1.00 0.53 C ATOM 1943 C VAL A 129 -9.204 16.992 -3.953 1.00 0.53 C ATOM 1944 O VAL A 129 -8.811 16.166 -3.152 1.00 0.56 O ATOM 1945 CB VAL A 129 -11.324 17.017 -2.622 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -10.804 17.912 -1.501 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -12.839 17.153 -2.739 1.00 1.22 C ATOM 0 H VAL A 129 -11.100 15.725 -5.175 1.00 0.60 H new ATOM 0 HA VAL A 129 -10.772 18.502 -4.066 1.00 0.53 H new ATOM 0 HB VAL A 129 -11.069 15.983 -2.391 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -11.265 17.618 -0.558 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -9.722 17.808 -1.424 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -11.054 18.950 -1.719 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -13.304 16.865 -1.796 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -13.095 18.187 -2.969 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -13.202 16.504 -3.536 1.00 1.22 H new ATOM 1957 N PRO A 130 -8.424 17.528 -4.878 1.00 0.62 N ATOM 1958 CA PRO A 130 -7.009 17.149 -4.994 1.00 0.73 C ATOM 1959 C PRO A 130 -6.236 17.466 -3.707 1.00 0.65 C ATOM 1960 O PRO A 130 -5.213 16.848 -3.423 1.00 0.64 O ATOM 1961 CB PRO A 130 -6.460 17.930 -6.205 1.00 1.00 C ATOM 1962 CG PRO A 130 -7.625 18.806 -6.747 1.00 1.00 C ATOM 1963 CD PRO A 130 -8.870 18.531 -5.866 1.00 0.75 C ATOM 0 HA PRO A 130 -6.895 16.075 -5.140 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -5.614 18.552 -5.912 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -6.101 17.246 -6.974 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -7.358 19.862 -6.712 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -7.833 18.564 -7.789 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -9.216 19.441 -5.376 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -9.701 18.155 -6.463 1.00 0.75 H new ATOM 1971 N GLU A 131 -6.658 18.436 -2.934 1.00 0.73 N ATOM 1972 CA GLU A 131 -5.848 18.761 -1.726 1.00 0.82 C ATOM 1973 C GLU A 131 -5.907 17.564 -0.766 1.00 0.72 C ATOM 1974 O GLU A 131 -5.052 17.375 0.084 1.00 0.73 O ATOM 1975 CB GLU A 131 -6.397 20.035 -1.079 1.00 1.09 C ATOM 1976 CG GLU A 131 -5.495 20.523 0.047 1.00 1.55 C ATOM 1977 CD GLU A 131 -6.124 21.772 0.672 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -6.089 22.811 0.032 1.00 2.86 O ATOM 1979 OE2 GLU A 131 -6.640 21.667 1.773 1.00 2.52 O ATOM 0 H GLU A 131 -7.497 18.997 -3.080 1.00 0.73 H new ATOM 0 HA GLU A 131 -4.806 18.944 -1.989 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -6.493 20.815 -1.834 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -7.397 19.844 -0.689 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -5.374 19.744 0.799 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -4.501 20.752 -0.337 1.00 1.55 H new ATOM 1986 N LEU A 132 -6.907 16.743 -0.928 1.00 0.71 N ATOM 1987 CA LEU A 132 -7.060 15.534 -0.080 1.00 0.69 C ATOM 1988 C LEU A 132 -6.198 14.390 -0.638 1.00 0.58 C ATOM 1989 O LEU A 132 -5.717 13.563 0.112 1.00 0.59 O ATOM 1990 CB LEU A 132 -8.548 15.137 -0.027 1.00 0.80 C ATOM 1991 CG LEU A 132 -8.888 14.496 1.328 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -9.068 15.580 2.402 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -10.190 13.698 1.205 1.00 0.77 C ATOM 0 H LEU A 132 -7.639 16.864 -1.628 1.00 0.71 H new ATOM 0 HA LEU A 132 -6.720 15.745 0.934 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -9.171 16.017 -0.186 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -8.773 14.438 -0.833 1.00 0.80 H new ATOM 0 HG LEU A 132 -8.070 13.836 1.616 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -9.308 15.111 3.356 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -8.145 16.151 2.501 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -9.879 16.248 2.112 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -10.430 13.244 2.166 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -10.999 14.365 0.906 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -10.068 12.917 0.455 1.00 0.77 H new ATOM 2005 N ILE A 133 -5.966 14.330 -1.913 1.00 0.52 N ATOM 2006 CA ILE A 133 -5.099 13.239 -2.441 1.00 0.46 C ATOM 2007 C ILE A 133 -3.761 13.287 -1.708 1.00 0.43 C ATOM 2008 O ILE A 133 -3.241 12.278 -1.274 1.00 0.46 O ATOM 2009 CB ILE A 133 -4.894 13.439 -3.958 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -6.272 13.516 -4.663 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -4.098 12.267 -4.531 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -7.173 12.377 -4.205 1.00 1.19 C ATOM 0 H ILE A 133 -6.332 14.979 -2.610 1.00 0.52 H new ATOM 0 HA ILE A 133 -5.565 12.267 -2.280 1.00 0.46 H new ATOM 0 HB ILE A 133 -4.345 14.366 -4.125 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -6.746 14.473 -4.443 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -6.137 13.468 -5.744 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -3.956 12.413 -5.602 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -3.126 12.212 -4.040 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -4.643 11.339 -4.360 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -8.136 12.449 -4.711 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -6.705 11.423 -4.448 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -7.324 12.443 -3.128 1.00 1.19 H new ATOM 2024 N ARG A 134 -3.207 14.458 -1.554 1.00 0.42 N ATOM 2025 CA ARG A 134 -1.904 14.576 -0.829 1.00 0.43 C ATOM 2026 C ARG A 134 -2.100 14.237 0.659 1.00 0.40 C ATOM 2027 O ARG A 134 -1.267 13.598 1.270 1.00 0.39 O ATOM 2028 CB ARG A 134 -1.371 16.011 -0.949 1.00 0.51 C ATOM 2029 CG ARG A 134 0.114 16.039 -0.570 1.00 1.26 C ATOM 2030 CD ARG A 134 0.644 17.471 -0.675 1.00 1.57 C ATOM 2031 NE ARG A 134 2.109 17.478 -0.403 1.00 2.30 N ATOM 2032 CZ ARG A 134 2.827 18.523 -0.712 1.00 2.86 C ATOM 2033 NH1 ARG A 134 2.262 19.566 -1.256 1.00 2.98 N ATOM 2034 NH2 ARG A 134 4.111 18.526 -0.475 1.00 3.71 N ATOM 0 H ARG A 134 -3.596 15.337 -1.896 1.00 0.42 H new ATOM 0 HA ARG A 134 -1.191 13.880 -1.272 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -1.504 16.376 -1.968 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -1.936 16.676 -0.296 1.00 0.51 H new ATOM 0 HG2 ARG A 134 0.248 15.665 0.445 1.00 1.26 H new ATOM 0 HG3 ARG A 134 0.680 15.382 -1.230 1.00 1.26 H new ATOM 0 HD2 ARG A 134 0.446 17.872 -1.669 1.00 1.57 H new ATOM 0 HD3 ARG A 134 0.128 18.115 0.037 1.00 1.57 H new ATOM 0 HE ARG A 134 2.551 16.665 0.025 1.00 2.30 H new ATOM 0 HH11 ARG A 134 1.259 19.565 -1.440 1.00 2.98 H new ATOM 0 HH12 ARG A 134 2.824 20.383 -1.497 1.00 2.98 H new ATOM 0 HH21 ARG A 134 4.553 17.712 -0.048 1.00 3.71 H new ATOM 0 HH22 ARG A 134 4.672 19.343 -0.717 1.00 3.71 H new ATOM 2048 N THR A 135 -3.181 14.676 1.252 1.00 0.41 N ATOM 2049 CA THR A 135 -3.396 14.388 2.705 1.00 0.41 C ATOM 2050 C THR A 135 -3.498 12.879 2.958 1.00 0.39 C ATOM 2051 O THR A 135 -3.144 12.394 4.015 1.00 0.52 O ATOM 2052 CB THR A 135 -4.671 15.080 3.203 1.00 0.42 C ATOM 2053 OG1 THR A 135 -4.498 16.488 3.138 1.00 0.89 O ATOM 2054 CG2 THR A 135 -4.965 14.670 4.649 1.00 0.88 C ATOM 0 H THR A 135 -3.918 15.216 0.799 1.00 0.41 H new ATOM 0 HA THR A 135 -2.537 14.776 3.253 1.00 0.41 H new ATOM 0 HB THR A 135 -5.508 14.780 2.572 1.00 0.42 H new ATOM 0 HG1 THR A 135 -4.657 16.795 2.221 1.00 0.89 H new ATOM 0 HG21 THR A 135 -5.872 15.168 4.991 1.00 0.88 H new ATOM 0 HG22 THR A 135 -5.102 13.590 4.700 1.00 0.88 H new ATOM 0 HG23 THR A 135 -4.130 14.960 5.286 1.00 0.88 H new ATOM 2062 N ILE A 136 -3.973 12.130 1.993 1.00 0.35 N ATOM 2063 CA ILE A 136 -4.095 10.655 2.175 1.00 0.36 C ATOM 2064 C ILE A 136 -2.773 9.975 1.811 1.00 0.35 C ATOM 2065 O ILE A 136 -2.341 9.057 2.475 1.00 0.51 O ATOM 2066 CB ILE A 136 -5.207 10.133 1.266 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -6.551 10.696 1.735 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -5.246 8.605 1.318 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -7.604 10.499 0.642 1.00 0.64 C ATOM 0 H ILE A 136 -4.281 12.480 1.086 1.00 0.35 H new ATOM 0 HA ILE A 136 -4.332 10.433 3.215 1.00 0.36 H new ATOM 0 HB ILE A 136 -5.014 10.450 0.241 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -6.866 10.196 2.651 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -6.450 11.756 1.969 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -6.041 8.239 0.668 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -4.289 8.205 0.982 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -5.436 8.280 2.341 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -8.559 10.901 0.980 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -7.291 11.020 -0.263 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -7.713 9.436 0.429 1.00 0.64 H new ATOM 2081 N MET A 137 -2.101 10.444 0.795 1.00 0.35 N ATOM 2082 CA MET A 137 -0.788 9.830 0.436 1.00 0.33 C ATOM 2083 C MET A 137 0.186 10.144 1.575 1.00 0.31 C ATOM 2084 O MET A 137 1.127 9.430 1.854 1.00 0.34 O ATOM 2085 CB MET A 137 -0.293 10.420 -0.892 1.00 0.36 C ATOM 2086 CG MET A 137 -1.310 10.125 -2.024 1.00 0.67 C ATOM 2087 SD MET A 137 -0.723 8.736 -3.033 1.00 1.13 S ATOM 2088 CE MET A 137 0.535 9.638 -3.977 1.00 0.67 C ATOM 0 H MET A 137 -2.399 11.218 0.202 1.00 0.35 H new ATOM 0 HA MET A 137 -0.873 8.751 0.307 1.00 0.33 H new ATOM 0 HB2 MET A 137 -0.154 11.496 -0.790 1.00 0.36 H new ATOM 0 HB3 MET A 137 0.678 9.996 -1.147 1.00 0.36 H new ATOM 0 HG2 MET A 137 -2.285 9.889 -1.597 1.00 0.67 H new ATOM 0 HG3 MET A 137 -1.440 11.009 -2.648 1.00 0.67 H new ATOM 0 HE1 MET A 137 1.434 9.027 -4.061 1.00 0.67 H new ATOM 0 HE2 MET A 137 0.152 9.860 -4.973 1.00 0.67 H new ATOM 0 HE3 MET A 137 0.776 10.569 -3.465 1.00 0.67 H new ATOM 2098 N GLY A 138 -0.081 11.234 2.227 1.00 0.31 N ATOM 2099 CA GLY A 138 0.738 11.702 3.386 1.00 0.33 C ATOM 2100 C GLY A 138 0.553 10.737 4.561 1.00 0.33 C ATOM 2101 O GLY A 138 1.490 10.397 5.256 1.00 0.34 O ATOM 0 H GLY A 138 -0.863 11.848 1.999 1.00 0.31 H new ATOM 0 HA2 GLY A 138 1.790 11.753 3.105 1.00 0.33 H new ATOM 0 HA3 GLY A 138 0.436 12.708 3.676 1.00 0.33 H new ATOM 2105 N TRP A 139 -0.652 10.297 4.784 1.00 0.34 N ATOM 2106 CA TRP A 139 -0.908 9.345 5.909 1.00 0.37 C ATOM 2107 C TRP A 139 -0.370 7.949 5.564 1.00 0.35 C ATOM 2108 O TRP A 139 -0.108 7.147 6.439 1.00 0.39 O ATOM 2109 CB TRP A 139 -2.406 9.255 6.201 1.00 0.43 C ATOM 2110 CG TRP A 139 -2.962 10.602 6.559 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -2.239 11.723 6.816 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -4.360 10.981 6.704 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -3.110 12.756 7.114 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -4.428 12.348 7.057 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -5.567 10.272 6.565 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -5.651 12.989 7.266 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -6.798 10.914 6.772 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -6.839 12.270 7.123 1.00 0.78 C ATOM 0 H TRP A 139 -1.474 10.553 4.238 1.00 0.34 H new ATOM 0 HA TRP A 139 -0.392 9.718 6.794 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -2.928 8.862 5.329 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -2.580 8.556 7.019 1.00 0.43 H new ATOM 0 HD1 TRP A 139 -1.162 11.796 6.792 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -2.814 13.704 7.347 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -5.546 9.226 6.297 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -5.678 14.034 7.537 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -7.718 10.360 6.660 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -7.789 12.758 7.283 1.00 0.78 H new ATOM 2129 N THR A 140 -0.195 7.647 4.305 1.00 0.34 N ATOM 2130 CA THR A 140 0.335 6.300 3.937 1.00 0.36 C ATOM 2131 C THR A 140 1.829 6.241 4.269 1.00 0.34 C ATOM 2132 O THR A 140 2.277 5.389 5.010 1.00 0.39 O ATOM 2133 CB THR A 140 0.128 6.051 2.440 1.00 0.38 C ATOM 2134 OG1 THR A 140 0.658 7.141 1.701 1.00 1.20 O ATOM 2135 CG2 THR A 140 -1.366 5.907 2.146 1.00 1.17 C ATOM 0 H THR A 140 -0.394 8.268 3.521 1.00 0.34 H new ATOM 0 HA THR A 140 -0.196 5.533 4.500 1.00 0.36 H new ATOM 0 HB THR A 140 0.641 5.134 2.150 1.00 0.38 H new ATOM 0 HG1 THR A 140 0.724 7.928 2.281 1.00 1.20 H new ATOM 0 HG21 THR A 140 -1.512 5.730 1.080 1.00 1.17 H new ATOM 0 HG22 THR A 140 -1.769 5.067 2.712 1.00 1.17 H new ATOM 0 HG23 THR A 140 -1.884 6.821 2.436 1.00 1.17 H new ATOM 2143 N LEU A 141 2.602 7.148 3.734 1.00 0.33 N ATOM 2144 CA LEU A 141 4.066 7.156 4.026 1.00 0.34 C ATOM 2145 C LEU A 141 4.295 7.378 5.524 1.00 0.33 C ATOM 2146 O LEU A 141 5.282 6.937 6.079 1.00 0.33 O ATOM 2147 CB LEU A 141 4.758 8.260 3.224 1.00 0.35 C ATOM 2148 CG LEU A 141 4.346 8.167 1.753 1.00 0.41 C ATOM 2149 CD1 LEU A 141 4.984 9.321 0.974 1.00 0.99 C ATOM 2150 CD2 LEU A 141 4.820 6.831 1.169 1.00 0.80 C ATOM 0 H LEU A 141 2.282 7.885 3.106 1.00 0.33 H new ATOM 0 HA LEU A 141 4.489 6.194 3.737 1.00 0.34 H new ATOM 0 HB2 LEU A 141 4.489 9.237 3.626 1.00 0.35 H new ATOM 0 HB3 LEU A 141 5.840 8.165 3.315 1.00 0.35 H new ATOM 0 HG LEU A 141 3.261 8.229 1.675 1.00 0.41 H new ATOM 0 HD11 LEU A 141 4.692 9.257 -0.074 1.00 0.99 H new ATOM 0 HD12 LEU A 141 4.645 10.271 1.388 1.00 0.99 H new ATOM 0 HD13 LEU A 141 6.069 9.257 1.053 1.00 0.99 H new ATOM 0 HD21 LEU A 141 4.526 6.767 0.121 1.00 0.80 H new ATOM 0 HD22 LEU A 141 5.905 6.765 1.246 1.00 0.80 H new ATOM 0 HD23 LEU A 141 4.367 6.010 1.724 1.00 0.80 H new ATOM 2162 N ASP A 142 3.389 8.040 6.188 1.00 0.36 N ATOM 2163 CA ASP A 142 3.560 8.263 7.651 1.00 0.37 C ATOM 2164 C ASP A 142 3.497 6.910 8.363 1.00 0.37 C ATOM 2165 O ASP A 142 4.281 6.613 9.242 1.00 0.42 O ATOM 2166 CB ASP A 142 2.427 9.154 8.162 1.00 0.37 C ATOM 2167 CG ASP A 142 2.639 9.437 9.650 1.00 0.78 C ATOM 2168 OD1 ASP A 142 3.695 9.090 10.154 1.00 1.59 O ATOM 2169 OD2 ASP A 142 1.743 9.995 10.261 1.00 1.32 O ATOM 0 H ASP A 142 2.540 8.435 5.783 1.00 0.36 H new ATOM 0 HA ASP A 142 4.518 8.745 7.846 1.00 0.37 H new ATOM 0 HB2 ASP A 142 2.403 10.089 7.602 1.00 0.37 H new ATOM 0 HB3 ASP A 142 1.466 8.665 8.006 1.00 0.37 H new ATOM 2174 N PHE A 143 2.562 6.089 7.972 1.00 0.41 N ATOM 2175 CA PHE A 143 2.414 4.740 8.588 1.00 0.43 C ATOM 2176 C PHE A 143 3.544 3.830 8.094 1.00 0.43 C ATOM 2177 O PHE A 143 3.967 2.930 8.792 1.00 0.45 O ATOM 2178 CB PHE A 143 1.053 4.160 8.185 1.00 0.44 C ATOM 2179 CG PHE A 143 0.727 2.953 9.034 1.00 0.47 C ATOM 2180 CD1 PHE A 143 1.148 1.681 8.630 1.00 1.29 C ATOM 2181 CD2 PHE A 143 -0.005 3.105 10.219 1.00 1.16 C ATOM 2182 CE1 PHE A 143 0.840 0.561 9.411 1.00 1.35 C ATOM 2183 CE2 PHE A 143 -0.315 1.984 10.999 1.00 1.22 C ATOM 2184 CZ PHE A 143 0.108 0.712 10.595 1.00 0.72 C ATOM 0 H PHE A 143 1.883 6.299 7.240 1.00 0.41 H new ATOM 0 HA PHE A 143 2.469 4.813 9.674 1.00 0.43 H new ATOM 0 HB2 PHE A 143 0.278 4.917 8.303 1.00 0.44 H new ATOM 0 HB3 PHE A 143 1.067 3.880 7.132 1.00 0.44 H new ATOM 0 HD1 PHE A 143 1.711 1.564 7.716 1.00 1.29 H new ATOM 0 HD2 PHE A 143 -0.330 4.087 10.531 1.00 1.16 H new ATOM 0 HE1 PHE A 143 1.167 -0.420 9.100 1.00 1.35 H new ATOM 0 HE2 PHE A 143 -0.880 2.101 11.912 1.00 1.22 H new ATOM 0 HZ PHE A 143 -0.130 -0.153 11.197 1.00 0.72 H new ATOM 2194 N LEU A 144 4.033 4.036 6.900 1.00 0.45 N ATOM 2195 CA LEU A 144 5.134 3.163 6.383 1.00 0.47 C ATOM 2196 C LEU A 144 6.455 3.598 7.049 1.00 0.47 C ATOM 2197 O LEU A 144 7.197 2.780 7.554 1.00 0.49 O ATOM 2198 CB LEU A 144 5.180 3.316 4.849 1.00 0.49 C ATOM 2199 CG LEU A 144 5.928 2.148 4.156 1.00 0.64 C ATOM 2200 CD1 LEU A 144 5.245 1.804 2.828 1.00 1.31 C ATOM 2201 CD2 LEU A 144 7.386 2.544 3.882 1.00 1.01 C ATOM 0 H LEU A 144 3.721 4.767 6.261 1.00 0.45 H new ATOM 0 HA LEU A 144 4.969 2.112 6.620 1.00 0.47 H new ATOM 0 HB2 LEU A 144 4.162 3.371 4.462 1.00 0.49 H new ATOM 0 HB3 LEU A 144 5.669 4.257 4.596 1.00 0.49 H new ATOM 0 HG LEU A 144 5.904 1.280 4.815 1.00 0.64 H new ATOM 0 HD11 LEU A 144 5.777 0.983 2.348 1.00 1.31 H new ATOM 0 HD12 LEU A 144 4.213 1.508 3.016 1.00 1.31 H new ATOM 0 HD13 LEU A 144 5.259 2.677 2.175 1.00 1.31 H new ATOM 0 HD21 LEU A 144 7.902 1.717 3.395 1.00 1.01 H new ATOM 0 HD22 LEU A 144 7.409 3.419 3.232 1.00 1.01 H new ATOM 0 HD23 LEU A 144 7.883 2.778 4.824 1.00 1.01 H new ATOM 2213 N ARG A 145 6.746 4.864 7.067 1.00 0.47 N ATOM 2214 CA ARG A 145 8.006 5.340 7.722 1.00 0.48 C ATOM 2215 C ARG A 145 8.007 4.978 9.221 1.00 0.49 C ATOM 2216 O ARG A 145 9.048 4.737 9.800 1.00 0.50 O ATOM 2217 CB ARG A 145 8.114 6.861 7.560 1.00 0.49 C ATOM 2218 CG ARG A 145 9.344 7.374 8.314 1.00 0.69 C ATOM 2219 CD ARG A 145 9.652 8.812 7.883 1.00 0.68 C ATOM 2220 NE ARG A 145 10.235 8.808 6.510 1.00 1.56 N ATOM 2221 CZ ARG A 145 10.313 9.920 5.829 1.00 2.10 C ATOM 2222 NH1 ARG A 145 9.882 11.037 6.349 1.00 2.12 N ATOM 2223 NH2 ARG A 145 10.823 9.915 4.628 1.00 3.16 N ATOM 0 H ARG A 145 6.168 5.598 6.657 1.00 0.47 H new ATOM 0 HA ARG A 145 8.858 4.854 7.247 1.00 0.48 H new ATOM 0 HB2 ARG A 145 8.189 7.120 6.504 1.00 0.49 H new ATOM 0 HB3 ARG A 145 7.214 7.342 7.943 1.00 0.49 H new ATOM 0 HG2 ARG A 145 9.165 7.337 9.389 1.00 0.69 H new ATOM 0 HG3 ARG A 145 10.201 6.732 8.111 1.00 0.69 H new ATOM 0 HD2 ARG A 145 8.741 9.411 7.901 1.00 0.68 H new ATOM 0 HD3 ARG A 145 10.349 9.271 8.584 1.00 0.68 H new ATOM 0 HE ARG A 145 10.573 7.936 6.103 1.00 1.56 H new ATOM 0 HH11 ARG A 145 9.484 11.042 7.288 1.00 2.12 H new ATOM 0 HH12 ARG A 145 9.943 11.905 5.816 1.00 2.12 H new ATOM 0 HH21 ARG A 145 11.161 9.043 4.221 1.00 3.16 H new ATOM 0 HH22 ARG A 145 10.884 10.783 4.096 1.00 3.16 H new ATOM 2237 N GLU A 146 6.871 4.988 9.869 1.00 0.49 N ATOM 2238 CA GLU A 146 6.850 4.688 11.345 1.00 0.51 C ATOM 2239 C GLU A 146 6.762 3.177 11.635 1.00 0.53 C ATOM 2240 O GLU A 146 7.615 2.632 12.309 1.00 0.55 O ATOM 2241 CB GLU A 146 5.659 5.395 11.996 1.00 0.52 C ATOM 2242 CG GLU A 146 5.804 6.909 11.841 1.00 0.96 C ATOM 2243 CD GLU A 146 6.866 7.423 12.814 1.00 1.48 C ATOM 2244 OE1 GLU A 146 6.728 7.168 13.999 1.00 2.03 O ATOM 2245 OE2 GLU A 146 7.799 8.063 12.357 1.00 2.22 O ATOM 0 H GLU A 146 5.962 5.188 9.451 1.00 0.49 H new ATOM 0 HA GLU A 146 7.788 5.053 11.763 1.00 0.51 H new ATOM 0 HB2 GLU A 146 4.730 5.061 11.534 1.00 0.52 H new ATOM 0 HB3 GLU A 146 5.602 5.133 13.052 1.00 0.52 H new ATOM 0 HG2 GLU A 146 6.085 7.155 10.817 1.00 0.96 H new ATOM 0 HG3 GLU A 146 4.850 7.398 12.036 1.00 0.96 H new ATOM 2252 N ARG A 147 5.742 2.500 11.195 1.00 0.59 N ATOM 2253 CA ARG A 147 5.628 1.040 11.526 1.00 0.62 C ATOM 2254 C ARG A 147 6.534 0.186 10.632 1.00 0.58 C ATOM 2255 O ARG A 147 7.212 -0.712 11.090 1.00 0.62 O ATOM 2256 CB ARG A 147 4.176 0.602 11.344 1.00 0.63 C ATOM 2257 CG ARG A 147 3.268 1.437 12.257 1.00 0.73 C ATOM 2258 CD ARG A 147 3.547 1.114 13.733 1.00 1.11 C ATOM 2259 NE ARG A 147 2.340 1.439 14.543 1.00 1.75 N ATOM 2260 CZ ARG A 147 2.224 0.975 15.758 1.00 2.40 C ATOM 2261 NH1 ARG A 147 3.162 0.220 16.261 1.00 2.71 N ATOM 2262 NH2 ARG A 147 1.169 1.266 16.468 1.00 3.30 N ATOM 0 H ARG A 147 4.986 2.881 10.626 1.00 0.59 H new ATOM 0 HA ARG A 147 5.945 0.896 12.559 1.00 0.62 H new ATOM 0 HB2 ARG A 147 3.876 0.726 10.304 1.00 0.63 H new ATOM 0 HB3 ARG A 147 4.073 -0.457 11.581 1.00 0.63 H new ATOM 0 HG2 ARG A 147 3.434 2.498 12.073 1.00 0.73 H new ATOM 0 HG3 ARG A 147 2.223 1.233 12.025 1.00 0.73 H new ATOM 0 HD2 ARG A 147 3.802 0.060 13.845 1.00 1.11 H new ATOM 0 HD3 ARG A 147 4.403 1.688 14.088 1.00 1.11 H new ATOM 0 HE ARG A 147 1.604 2.024 14.148 1.00 1.75 H new ATOM 0 HH11 ARG A 147 3.986 -0.008 15.705 1.00 2.71 H new ATOM 0 HH12 ARG A 147 3.071 -0.142 17.210 1.00 2.71 H new ATOM 0 HH21 ARG A 147 0.436 1.855 16.074 1.00 3.30 H new ATOM 0 HH22 ARG A 147 1.077 0.904 17.417 1.00 3.30 H new ATOM 2276 N LEU A 148 6.536 0.451 9.364 1.00 0.53 N ATOM 2277 CA LEU A 148 7.377 -0.347 8.424 1.00 0.57 C ATOM 2278 C LEU A 148 8.758 0.291 8.290 1.00 0.67 C ATOM 2279 O LEU A 148 9.279 0.854 9.228 1.00 1.61 O ATOM 2280 CB LEU A 148 6.694 -0.365 7.064 1.00 0.59 C ATOM 2281 CG LEU A 148 5.219 -0.784 7.225 1.00 0.70 C ATOM 2282 CD1 LEU A 148 4.532 -0.874 5.847 1.00 1.29 C ATOM 2283 CD2 LEU A 148 5.144 -2.149 7.927 1.00 1.34 C ATOM 0 H LEU A 148 5.988 1.192 8.927 1.00 0.53 H new ATOM 0 HA LEU A 148 7.493 -1.362 8.803 1.00 0.57 H new ATOM 0 HB2 LEU A 148 6.753 0.622 6.604 1.00 0.59 H new ATOM 0 HB3 LEU A 148 7.208 -1.058 6.398 1.00 0.59 H new ATOM 0 HG LEU A 148 4.705 -0.034 7.826 1.00 0.70 H new ATOM 0 HD11 LEU A 148 3.491 -1.171 5.978 1.00 1.29 H new ATOM 0 HD12 LEU A 148 4.573 0.098 5.356 1.00 1.29 H new ATOM 0 HD13 LEU A 148 5.045 -1.613 5.232 1.00 1.29 H new ATOM 0 HD21 LEU A 148 4.101 -2.443 8.040 1.00 1.34 H new ATOM 0 HD22 LEU A 148 5.669 -2.895 7.330 1.00 1.34 H new ATOM 0 HD23 LEU A 148 5.609 -2.079 8.910 1.00 1.34 H new ATOM 2295 N LEU A 149 9.356 0.180 7.130 1.00 0.67 N ATOM 2296 CA LEU A 149 10.718 0.750 6.901 1.00 0.57 C ATOM 2297 C LEU A 149 11.754 -0.106 7.633 1.00 0.56 C ATOM 2298 O LEU A 149 12.532 -0.804 7.015 1.00 0.58 O ATOM 2299 CB LEU A 149 10.792 2.209 7.385 1.00 0.54 C ATOM 2300 CG LEU A 149 12.003 2.922 6.743 1.00 0.59 C ATOM 2301 CD1 LEU A 149 11.628 3.487 5.367 1.00 0.83 C ATOM 2302 CD2 LEU A 149 12.452 4.079 7.644 1.00 1.21 C ATOM 0 H LEU A 149 8.951 -0.289 6.320 1.00 0.67 H new ATOM 0 HA LEU A 149 10.929 0.742 5.832 1.00 0.57 H new ATOM 0 HB2 LEU A 149 9.872 2.733 7.125 1.00 0.54 H new ATOM 0 HB3 LEU A 149 10.879 2.236 8.471 1.00 0.54 H new ATOM 0 HG LEU A 149 12.809 2.197 6.627 1.00 0.59 H new ATOM 0 HD11 LEU A 149 12.493 3.986 4.930 1.00 0.83 H new ATOM 0 HD12 LEU A 149 11.310 2.674 4.714 1.00 0.83 H new ATOM 0 HD13 LEU A 149 10.814 4.203 5.477 1.00 0.83 H new ATOM 0 HD21 LEU A 149 13.306 4.582 7.191 1.00 1.21 H new ATOM 0 HD22 LEU A 149 11.633 4.789 7.760 1.00 1.21 H new ATOM 0 HD23 LEU A 149 12.736 3.690 8.622 1.00 1.21 H new ATOM 2314 N GLY A 150 11.783 -0.065 8.940 1.00 0.56 N ATOM 2315 CA GLY A 150 12.784 -0.891 9.675 1.00 0.58 C ATOM 2316 C GLY A 150 12.699 -2.345 9.202 1.00 0.62 C ATOM 2317 O GLY A 150 13.654 -2.908 8.704 1.00 0.70 O ATOM 0 H GLY A 150 11.164 0.498 9.524 1.00 0.56 H new ATOM 0 HA2 GLY A 150 13.787 -0.501 9.505 1.00 0.58 H new ATOM 0 HA3 GLY A 150 12.598 -0.836 10.748 1.00 0.58 H new ATOM 2321 N TRP A 151 11.566 -2.966 9.401 1.00 0.63 N ATOM 2322 CA TRP A 151 11.406 -4.400 9.015 1.00 0.69 C ATOM 2323 C TRP A 151 11.702 -4.604 7.526 1.00 0.70 C ATOM 2324 O TRP A 151 12.203 -5.636 7.127 1.00 0.72 O ATOM 2325 CB TRP A 151 9.974 -4.851 9.324 1.00 0.73 C ATOM 2326 CG TRP A 151 9.612 -4.502 10.741 1.00 1.25 C ATOM 2327 CD1 TRP A 151 10.450 -4.562 11.808 1.00 2.17 C ATOM 2328 CD2 TRP A 151 8.327 -4.049 11.263 1.00 1.86 C ATOM 2329 NE1 TRP A 151 9.761 -4.172 12.941 1.00 2.65 N ATOM 2330 CE2 TRP A 151 8.451 -3.846 12.658 1.00 2.43 C ATOM 2331 CE3 TRP A 151 7.078 -3.794 10.667 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 7.377 -3.408 13.434 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 5.995 -3.354 11.446 1.00 3.62 C ATOM 2334 CH2 TRP A 151 6.145 -3.161 12.826 1.00 3.67 C ATOM 0 H TRP A 151 10.739 -2.539 9.817 1.00 0.63 H new ATOM 0 HA TRP A 151 12.116 -4.996 9.588 1.00 0.69 H new ATOM 0 HB2 TRP A 151 9.278 -4.372 8.635 1.00 0.73 H new ATOM 0 HB3 TRP A 151 9.883 -5.927 9.173 1.00 0.73 H new ATOM 0 HD1 TRP A 151 11.486 -4.865 11.776 1.00 2.17 H new ATOM 0 HE1 TRP A 151 10.172 -4.130 13.874 1.00 2.65 H new ATOM 0 HE3 TRP A 151 6.951 -3.937 9.604 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 7.498 -3.261 14.497 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 5.040 -3.163 10.978 1.00 3.62 H new ATOM 0 HH2 TRP A 151 5.308 -2.822 13.418 1.00 3.67 H new ATOM 2345 N ILE A 152 11.410 -3.640 6.701 1.00 0.73 N ATOM 2346 CA ILE A 152 11.696 -3.814 5.245 1.00 0.76 C ATOM 2347 C ILE A 152 13.213 -3.821 5.035 1.00 0.79 C ATOM 2348 O ILE A 152 13.731 -4.475 4.152 1.00 0.89 O ATOM 2349 CB ILE A 152 11.063 -2.670 4.452 1.00 0.78 C ATOM 2350 CG1 ILE A 152 9.549 -2.678 4.682 1.00 0.83 C ATOM 2351 CG2 ILE A 152 11.354 -2.863 2.960 1.00 0.92 C ATOM 2352 CD1 ILE A 152 8.919 -1.453 4.017 1.00 0.94 C ATOM 0 H ILE A 152 10.991 -2.748 6.964 1.00 0.73 H new ATOM 0 HA ILE A 152 11.274 -4.756 4.896 1.00 0.76 H new ATOM 0 HB ILE A 152 11.479 -1.718 4.782 1.00 0.78 H new ATOM 0 HG12 ILE A 152 9.114 -3.590 4.272 1.00 0.83 H new ATOM 0 HG13 ILE A 152 9.334 -2.674 5.751 1.00 0.83 H new ATOM 0 HG21 ILE A 152 10.903 -2.048 2.393 1.00 0.92 H new ATOM 0 HG22 ILE A 152 12.432 -2.866 2.797 1.00 0.92 H new ATOM 0 HG23 ILE A 152 10.934 -3.812 2.627 1.00 0.92 H new ATOM 0 HD11 ILE A 152 7.842 -1.463 4.183 1.00 0.94 H new ATOM 0 HD12 ILE A 152 9.344 -0.546 4.447 1.00 0.94 H new ATOM 0 HD13 ILE A 152 9.121 -1.476 2.946 1.00 0.94 H new ATOM 2364 N GLN A 153 13.923 -3.112 5.863 1.00 0.77 N ATOM 2365 CA GLN A 153 15.411 -3.083 5.746 1.00 0.80 C ATOM 2366 C GLN A 153 15.953 -4.485 6.073 1.00 0.81 C ATOM 2367 O GLN A 153 16.846 -4.976 5.412 1.00 0.82 O ATOM 2368 CB GLN A 153 15.982 -2.021 6.717 1.00 0.82 C ATOM 2369 CG GLN A 153 16.847 -0.992 5.977 1.00 1.09 C ATOM 2370 CD GLN A 153 17.165 0.159 6.932 1.00 1.98 C ATOM 2371 OE1 GLN A 153 16.457 0.380 7.894 1.00 2.66 O ATOM 2372 NE2 GLN A 153 18.214 0.902 6.706 1.00 2.77 N ATOM 0 H GLN A 153 13.538 -2.548 6.620 1.00 0.77 H new ATOM 0 HA GLN A 153 15.715 -2.813 4.734 1.00 0.80 H new ATOM 0 HB2 GLN A 153 15.163 -1.512 7.224 1.00 0.82 H new ATOM 0 HB3 GLN A 153 16.577 -2.512 7.487 1.00 0.82 H new ATOM 0 HG2 GLN A 153 17.768 -1.456 5.625 1.00 1.09 H new ATOM 0 HG3 GLN A 153 16.322 -0.619 5.098 1.00 1.09 H new ATOM 0 HE21 GLN A 153 18.807 0.715 5.898 1.00 2.77 H new ATOM 0 HE22 GLN A 153 18.441 1.670 7.338 1.00 2.77 H new ATOM 2381 N ASP A 154 15.431 -5.132 7.076 1.00 0.83 N ATOM 2382 CA ASP A 154 15.938 -6.494 7.414 1.00 0.86 C ATOM 2383 C ASP A 154 15.643 -7.460 6.260 1.00 0.85 C ATOM 2384 O ASP A 154 16.258 -8.501 6.139 1.00 0.94 O ATOM 2385 CB ASP A 154 15.253 -6.996 8.685 1.00 0.90 C ATOM 2386 CG ASP A 154 15.869 -8.334 9.096 1.00 1.28 C ATOM 2387 OD1 ASP A 154 16.917 -8.668 8.568 1.00 1.84 O ATOM 2388 OD2 ASP A 154 15.284 -9.003 9.932 1.00 1.99 O ATOM 0 H ASP A 154 14.682 -4.782 7.673 1.00 0.83 H new ATOM 0 HA ASP A 154 17.015 -6.444 7.576 1.00 0.86 H new ATOM 0 HB2 ASP A 154 15.370 -6.267 9.487 1.00 0.90 H new ATOM 0 HB3 ASP A 154 14.183 -7.113 8.513 1.00 0.90 H new ATOM 2393 N GLN A 155 14.715 -7.120 5.406 1.00 0.79 N ATOM 2394 CA GLN A 155 14.385 -8.008 4.257 1.00 0.79 C ATOM 2395 C GLN A 155 15.333 -7.708 3.098 1.00 0.72 C ATOM 2396 O GLN A 155 15.935 -8.594 2.525 1.00 1.03 O ATOM 2397 CB GLN A 155 12.938 -7.744 3.820 1.00 0.90 C ATOM 2398 CG GLN A 155 12.539 -8.701 2.687 1.00 1.37 C ATOM 2399 CD GLN A 155 12.590 -10.150 3.181 1.00 2.01 C ATOM 2400 OE1 GLN A 155 13.128 -11.012 2.516 1.00 2.72 O ATOM 2401 NE2 GLN A 155 12.049 -10.456 4.329 1.00 2.54 N ATOM 0 H GLN A 155 14.169 -6.260 5.457 1.00 0.79 H new ATOM 0 HA GLN A 155 14.494 -9.052 4.551 1.00 0.79 H new ATOM 0 HB2 GLN A 155 12.266 -7.874 4.668 1.00 0.90 H new ATOM 0 HB3 GLN A 155 12.835 -6.712 3.486 1.00 0.90 H new ATOM 0 HG2 GLN A 155 11.535 -8.463 2.336 1.00 1.37 H new ATOM 0 HG3 GLN A 155 13.212 -8.574 1.839 1.00 1.37 H new ATOM 0 HE21 GLN A 155 11.597 -9.733 4.889 1.00 2.54 H new ATOM 0 HE22 GLN A 155 12.079 -11.418 4.666 1.00 2.54 H new ATOM 2410 N GLY A 156 15.464 -6.459 2.745 1.00 0.63 N ATOM 2411 CA GLY A 156 16.365 -6.078 1.619 1.00 0.72 C ATOM 2412 C GLY A 156 15.753 -4.885 0.890 1.00 0.87 C ATOM 2413 O GLY A 156 16.367 -3.846 0.747 1.00 1.38 O ATOM 0 H GLY A 156 14.982 -5.679 3.192 1.00 0.63 H new ATOM 0 HA2 GLY A 156 17.356 -5.824 1.996 1.00 0.72 H new ATOM 0 HA3 GLY A 156 16.490 -6.917 0.934 1.00 0.72 H new ATOM 2417 N GLY A 157 14.549 -5.036 0.412 1.00 0.81 N ATOM 2418 CA GLY A 157 13.891 -3.921 -0.325 1.00 1.10 C ATOM 2419 C GLY A 157 12.608 -4.434 -0.987 1.00 0.84 C ATOM 2420 O GLY A 157 12.137 -5.520 -0.708 1.00 0.88 O ATOM 0 H GLY A 157 13.991 -5.885 0.500 1.00 0.81 H new ATOM 0 HA2 GLY A 157 13.659 -3.105 0.360 1.00 1.10 H new ATOM 0 HA3 GLY A 157 14.568 -3.521 -1.080 1.00 1.10 H new ATOM 2424 N TRP A 158 12.023 -3.632 -1.831 1.00 0.67 N ATOM 2425 CA TRP A 158 10.747 -4.031 -2.499 1.00 0.50 C ATOM 2426 C TRP A 158 10.939 -5.304 -3.332 1.00 0.51 C ATOM 2427 O TRP A 158 9.975 -5.948 -3.707 1.00 0.53 O ATOM 2428 CB TRP A 158 10.257 -2.896 -3.397 1.00 0.51 C ATOM 2429 CG TRP A 158 9.834 -1.737 -2.554 1.00 0.46 C ATOM 2430 CD1 TRP A 158 10.560 -0.614 -2.352 1.00 0.59 C ATOM 2431 CD2 TRP A 158 8.601 -1.568 -1.800 1.00 0.46 C ATOM 2432 NE1 TRP A 158 9.848 0.235 -1.523 1.00 0.55 N ATOM 2433 CE2 TRP A 158 8.633 -0.309 -1.156 1.00 0.47 C ATOM 2434 CE3 TRP A 158 7.470 -2.378 -1.616 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 7.577 0.130 -0.357 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 6.404 -1.942 -0.813 1.00 0.84 C ATOM 2437 CH2 TRP A 158 6.457 -0.689 -0.185 1.00 0.78 C ATOM 0 H TRP A 158 12.374 -2.710 -2.091 1.00 0.67 H new ATOM 0 HA TRP A 158 10.004 -4.234 -1.727 1.00 0.50 H new ATOM 0 HB2 TRP A 158 11.050 -2.591 -4.080 1.00 0.51 H new ATOM 0 HB3 TRP A 158 9.422 -3.237 -4.009 1.00 0.51 H new ATOM 0 HD1 TRP A 158 11.536 -0.413 -2.769 1.00 0.59 H new ATOM 0 HE1 TRP A 158 10.180 1.151 -1.220 1.00 0.55 H new ATOM 0 HE3 TRP A 158 7.419 -3.344 -2.096 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 7.624 1.095 0.125 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 5.539 -2.575 -0.678 1.00 0.84 H new ATOM 0 HH2 TRP A 158 5.634 -0.357 0.431 1.00 0.78 H new ATOM 2448 N ASP A 159 12.146 -5.685 -3.640 1.00 0.50 N ATOM 2449 CA ASP A 159 12.335 -6.917 -4.454 1.00 0.51 C ATOM 2450 C ASP A 159 11.583 -8.077 -3.795 1.00 0.51 C ATOM 2451 O ASP A 159 11.082 -8.962 -4.460 1.00 0.51 O ATOM 2452 CB ASP A 159 13.829 -7.242 -4.539 1.00 0.54 C ATOM 2453 CG ASP A 159 14.041 -8.485 -5.405 1.00 1.66 C ATOM 2454 OD1 ASP A 159 13.690 -8.437 -6.572 1.00 2.37 O ATOM 2455 OD2 ASP A 159 14.555 -9.463 -4.886 1.00 2.46 O ATOM 0 H ASP A 159 13.002 -5.203 -3.367 1.00 0.50 H new ATOM 0 HA ASP A 159 11.945 -6.762 -5.460 1.00 0.51 H new ATOM 0 HB2 ASP A 159 14.371 -6.396 -4.962 1.00 0.54 H new ATOM 0 HB3 ASP A 159 14.231 -7.411 -3.540 1.00 0.54 H new ATOM 2460 N GLY A 160 11.496 -8.077 -2.491 1.00 0.52 N ATOM 2461 CA GLY A 160 10.770 -9.176 -1.789 1.00 0.54 C ATOM 2462 C GLY A 160 9.292 -9.129 -2.183 1.00 0.53 C ATOM 2463 O GLY A 160 8.630 -10.144 -2.265 1.00 0.54 O ATOM 0 H GLY A 160 11.896 -7.364 -1.882 1.00 0.52 H new ATOM 0 HA2 GLY A 160 11.200 -10.141 -2.056 1.00 0.54 H new ATOM 0 HA3 GLY A 160 10.875 -9.067 -0.710 1.00 0.54 H new ATOM 2467 N LEU A 161 8.777 -7.960 -2.445 1.00 0.54 N ATOM 2468 CA LEU A 161 7.350 -7.847 -2.852 1.00 0.56 C ATOM 2469 C LEU A 161 7.132 -8.636 -4.146 1.00 0.56 C ATOM 2470 O LEU A 161 6.173 -9.365 -4.301 1.00 0.62 O ATOM 2471 CB LEU A 161 7.011 -6.365 -3.108 1.00 0.58 C ATOM 2472 CG LEU A 161 5.473 -6.177 -3.089 1.00 0.74 C ATOM 2473 CD1 LEU A 161 4.900 -6.454 -1.674 1.00 1.63 C ATOM 2474 CD2 LEU A 161 5.121 -4.747 -3.517 1.00 1.56 C ATOM 0 H LEU A 161 9.285 -7.077 -2.394 1.00 0.54 H new ATOM 0 HA LEU A 161 6.711 -8.243 -2.062 1.00 0.56 H new ATOM 0 HB2 LEU A 161 7.474 -5.738 -2.346 1.00 0.58 H new ATOM 0 HB3 LEU A 161 7.415 -6.049 -4.070 1.00 0.58 H new ATOM 0 HG LEU A 161 5.030 -6.888 -3.787 1.00 0.74 H new ATOM 0 HD11 LEU A 161 3.819 -6.316 -1.686 1.00 1.63 H new ATOM 0 HD12 LEU A 161 5.132 -7.478 -1.382 1.00 1.63 H new ATOM 0 HD13 LEU A 161 5.346 -5.763 -0.959 1.00 1.63 H new ATOM 0 HD21 LEU A 161 4.039 -4.619 -3.502 1.00 1.56 H new ATOM 0 HD22 LEU A 161 5.580 -4.038 -2.828 1.00 1.56 H new ATOM 0 HD23 LEU A 161 5.494 -4.567 -4.525 1.00 1.56 H new ATOM 2486 N LEU A 162 8.021 -8.452 -5.093 1.00 0.53 N ATOM 2487 CA LEU A 162 7.893 -9.141 -6.411 1.00 0.56 C ATOM 2488 C LEU A 162 8.451 -10.564 -6.322 1.00 0.55 C ATOM 2489 O LEU A 162 7.924 -11.479 -6.924 1.00 0.57 O ATOM 2490 CB LEU A 162 8.675 -8.334 -7.467 1.00 0.61 C ATOM 2491 CG LEU A 162 8.756 -9.096 -8.800 1.00 0.80 C ATOM 2492 CD1 LEU A 162 7.347 -9.344 -9.347 1.00 1.56 C ATOM 2493 CD2 LEU A 162 9.551 -8.262 -9.809 1.00 1.33 C ATOM 0 H LEU A 162 8.837 -7.847 -5.005 1.00 0.53 H new ATOM 0 HA LEU A 162 6.842 -9.202 -6.692 1.00 0.56 H new ATOM 0 HB2 LEU A 162 8.190 -7.370 -7.625 1.00 0.61 H new ATOM 0 HB3 LEU A 162 9.681 -8.129 -7.100 1.00 0.61 H new ATOM 0 HG LEU A 162 9.251 -10.054 -8.638 1.00 0.80 H new ATOM 0 HD11 LEU A 162 7.413 -9.884 -10.291 1.00 1.56 H new ATOM 0 HD12 LEU A 162 6.777 -9.935 -8.630 1.00 1.56 H new ATOM 0 HD13 LEU A 162 6.847 -8.389 -9.509 1.00 1.56 H new ATOM 0 HD21 LEU A 162 9.612 -8.798 -10.756 1.00 1.33 H new ATOM 0 HD22 LEU A 162 9.052 -7.306 -9.964 1.00 1.33 H new ATOM 0 HD23 LEU A 162 10.556 -8.088 -9.425 1.00 1.33 H new ATOM 2505 N SER A 163 9.515 -10.763 -5.596 1.00 0.54 N ATOM 2506 CA SER A 163 10.094 -12.134 -5.503 1.00 0.56 C ATOM 2507 C SER A 163 9.130 -13.047 -4.743 1.00 0.53 C ATOM 2508 O SER A 163 9.106 -14.246 -4.941 1.00 0.60 O ATOM 2509 CB SER A 163 11.432 -12.078 -4.770 1.00 0.63 C ATOM 2510 OG SER A 163 12.259 -11.096 -5.379 1.00 1.32 O ATOM 0 H SER A 163 10.006 -10.043 -5.066 1.00 0.54 H new ATOM 0 HA SER A 163 10.250 -12.528 -6.507 1.00 0.56 H new ATOM 0 HB2 SER A 163 11.274 -11.836 -3.719 1.00 0.63 H new ATOM 0 HB3 SER A 163 11.919 -13.052 -4.803 1.00 0.63 H new ATOM 0 HG SER A 163 12.116 -10.231 -4.942 1.00 1.32 H new ATOM 2516 N TYR A 164 8.330 -12.488 -3.879 1.00 0.59 N ATOM 2517 CA TYR A 164 7.364 -13.322 -3.110 1.00 0.64 C ATOM 2518 C TYR A 164 6.143 -13.606 -3.987 1.00 0.63 C ATOM 2519 O TYR A 164 5.612 -14.698 -4.002 1.00 0.68 O ATOM 2520 CB TYR A 164 6.934 -12.567 -1.848 1.00 0.69 C ATOM 2521 CG TYR A 164 5.968 -13.414 -1.052 1.00 0.72 C ATOM 2522 CD1 TYR A 164 6.450 -14.445 -0.236 1.00 1.34 C ATOM 2523 CD2 TYR A 164 4.592 -13.166 -1.127 1.00 1.50 C ATOM 2524 CE1 TYR A 164 5.555 -15.229 0.503 1.00 1.35 C ATOM 2525 CE2 TYR A 164 3.698 -13.949 -0.387 1.00 1.57 C ATOM 2526 CZ TYR A 164 4.180 -14.981 0.428 1.00 0.87 C ATOM 2527 OH TYR A 164 3.298 -15.753 1.156 1.00 0.97 O ATOM 0 H TYR A 164 8.303 -11.490 -3.672 1.00 0.59 H new ATOM 0 HA TYR A 164 7.831 -14.263 -2.821 1.00 0.64 H new ATOM 0 HB2 TYR A 164 7.807 -12.326 -1.241 1.00 0.69 H new ATOM 0 HB3 TYR A 164 6.465 -11.622 -2.120 1.00 0.69 H new ATOM 0 HD1 TYR A 164 7.511 -14.636 -0.177 1.00 1.34 H new ATOM 0 HD2 TYR A 164 4.220 -12.371 -1.756 1.00 1.50 H new ATOM 0 HE1 TYR A 164 5.926 -16.025 1.131 1.00 1.35 H new ATOM 0 HE2 TYR A 164 2.637 -13.757 -0.445 1.00 1.57 H new ATOM 0 HH TYR A 164 2.382 -15.447 0.990 1.00 0.97 H new ATOM 2537 N PHE A 165 5.689 -12.618 -4.705 1.00 0.64 N ATOM 2538 CA PHE A 165 4.495 -12.808 -5.577 1.00 0.72 C ATOM 2539 C PHE A 165 4.728 -14.004 -6.508 1.00 0.82 C ATOM 2540 O PHE A 165 4.246 -15.092 -6.263 1.00 1.56 O ATOM 2541 CB PHE A 165 4.262 -11.532 -6.411 1.00 0.74 C ATOM 2542 CG PHE A 165 3.431 -10.533 -5.627 1.00 0.84 C ATOM 2543 CD1 PHE A 165 3.675 -10.324 -4.261 1.00 1.65 C ATOM 2544 CD2 PHE A 165 2.413 -9.816 -6.269 1.00 1.42 C ATOM 2545 CE1 PHE A 165 2.906 -9.403 -3.545 1.00 1.96 C ATOM 2546 CE2 PHE A 165 1.644 -8.894 -5.548 1.00 1.71 C ATOM 2547 CZ PHE A 165 1.891 -8.688 -4.187 1.00 1.66 C ATOM 0 H PHE A 165 6.095 -11.682 -4.726 1.00 0.64 H new ATOM 0 HA PHE A 165 3.617 -13.000 -4.960 1.00 0.72 H new ATOM 0 HB2 PHE A 165 5.219 -11.086 -6.681 1.00 0.74 H new ATOM 0 HB3 PHE A 165 3.755 -11.786 -7.342 1.00 0.74 H new ATOM 0 HD1 PHE A 165 4.458 -10.876 -3.762 1.00 1.65 H new ATOM 0 HD2 PHE A 165 2.221 -9.974 -7.320 1.00 1.42 H new ATOM 0 HE1 PHE A 165 3.096 -9.243 -2.494 1.00 1.96 H new ATOM 0 HE2 PHE A 165 0.859 -8.341 -6.044 1.00 1.71 H new ATOM 0 HZ PHE A 165 1.298 -7.977 -3.632 1.00 1.66 H new ATOM 2557 N GLY A 166 5.458 -13.815 -7.573 1.00 0.94 N ATOM 2558 CA GLY A 166 5.709 -14.948 -8.507 1.00 1.01 C ATOM 2559 C GLY A 166 4.449 -15.218 -9.332 1.00 1.23 C ATOM 2560 O GLY A 166 3.370 -14.766 -9.004 1.00 1.85 O ATOM 0 H GLY A 166 5.890 -12.929 -7.836 1.00 0.94 H new ATOM 0 HA2 GLY A 166 6.544 -14.712 -9.166 1.00 1.01 H new ATOM 0 HA3 GLY A 166 5.988 -15.840 -7.947 1.00 1.01 H new ATOM 2564 N THR A 167 4.578 -15.957 -10.399 1.00 1.51 N ATOM 2565 CA THR A 167 3.395 -16.269 -11.246 1.00 2.01 C ATOM 2566 C THR A 167 2.561 -17.404 -10.610 1.00 1.65 C ATOM 2567 O THR A 167 1.352 -17.298 -10.550 1.00 2.06 O ATOM 2568 CB THR A 167 3.876 -16.678 -12.665 1.00 3.10 C ATOM 2569 OG1 THR A 167 5.293 -16.598 -12.713 1.00 3.65 O ATOM 2570 CG2 THR A 167 3.284 -15.739 -13.727 1.00 3.92 C ATOM 0 H THR A 167 5.458 -16.360 -10.722 1.00 1.51 H new ATOM 0 HA THR A 167 2.761 -15.385 -11.321 1.00 2.01 H new ATOM 0 HB THR A 167 3.545 -17.696 -12.871 1.00 3.10 H new ATOM 0 HG1 THR A 167 5.605 -16.856 -13.605 1.00 3.65 H new ATOM 0 HG21 THR A 167 3.632 -16.041 -14.715 1.00 3.92 H new ATOM 0 HG22 THR A 167 2.196 -15.792 -13.694 1.00 3.92 H new ATOM 0 HG23 THR A 167 3.603 -14.716 -13.527 1.00 3.92 H new ATOM 2578 N PRO A 168 3.208 -18.470 -10.172 1.00 1.84 N ATOM 2579 CA PRO A 168 2.482 -19.607 -9.576 1.00 2.36 C ATOM 2580 C PRO A 168 1.744 -19.160 -8.305 1.00 1.79 C ATOM 2581 O PRO A 168 1.930 -18.062 -7.818 1.00 2.00 O ATOM 2582 CB PRO A 168 3.572 -20.661 -9.260 1.00 3.35 C ATOM 2583 CG PRO A 168 4.942 -20.062 -9.696 1.00 3.48 C ATOM 2584 CD PRO A 168 4.680 -18.635 -10.230 1.00 2.53 C ATOM 0 HA PRO A 168 1.721 -20.013 -10.243 1.00 2.36 H new ATOM 0 HB2 PRO A 168 3.579 -20.899 -8.196 1.00 3.35 H new ATOM 0 HB3 PRO A 168 3.373 -21.591 -9.793 1.00 3.35 H new ATOM 0 HG2 PRO A 168 5.633 -20.035 -8.854 1.00 3.48 H new ATOM 0 HG3 PRO A 168 5.403 -20.681 -10.466 1.00 3.48 H new ATOM 0 HD2 PRO A 168 5.186 -17.886 -9.621 1.00 2.53 H new ATOM 0 HD3 PRO A 168 5.051 -18.520 -11.249 1.00 2.53 H new ATOM 2592 N THR A 169 0.914 -20.012 -7.769 1.00 1.73 N ATOM 2593 CA THR A 169 0.163 -19.656 -6.532 1.00 1.33 C ATOM 2594 C THR A 169 -0.466 -18.269 -6.686 1.00 1.05 C ATOM 2595 O THR A 169 -0.453 -17.467 -5.773 1.00 1.06 O ATOM 2596 CB THR A 169 1.122 -19.656 -5.339 1.00 1.53 C ATOM 2597 OG1 THR A 169 2.120 -18.664 -5.535 1.00 1.94 O ATOM 2598 CG2 THR A 169 1.783 -21.030 -5.214 1.00 2.40 C ATOM 0 H THR A 169 0.723 -20.944 -8.137 1.00 1.73 H new ATOM 0 HA THR A 169 -0.627 -20.388 -6.366 1.00 1.33 H new ATOM 0 HB THR A 169 0.567 -19.438 -4.426 1.00 1.53 H new ATOM 0 HG1 THR A 169 1.832 -18.044 -6.237 1.00 1.94 H new ATOM 0 HG21 THR A 169 2.466 -21.029 -4.364 1.00 2.40 H new ATOM 0 HG22 THR A 169 1.017 -21.790 -5.063 1.00 2.40 H new ATOM 0 HG23 THR A 169 2.338 -21.251 -6.126 1.00 2.40 H new ATOM 2606 N TRP A 170 -1.024 -17.982 -7.831 1.00 1.04 N ATOM 2607 CA TRP A 170 -1.658 -16.650 -8.038 1.00 1.01 C ATOM 2608 C TRP A 170 -3.042 -16.637 -7.384 1.00 0.92 C ATOM 2609 O TRP A 170 -3.377 -15.743 -6.632 1.00 0.95 O ATOM 2610 CB TRP A 170 -1.804 -16.381 -9.537 1.00 1.32 C ATOM 2611 CG TRP A 170 -2.401 -15.026 -9.747 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -1.763 -13.854 -9.527 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -3.738 -14.683 -10.214 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -2.622 -12.813 -9.828 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -3.852 -13.273 -10.256 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -4.852 -15.450 -10.601 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -5.029 -12.646 -10.667 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -6.039 -14.822 -11.015 1.00 4.37 C ATOM 2619 CH2 TRP A 170 -6.126 -13.423 -11.049 1.00 4.64 C ATOM 0 H TRP A 170 -1.068 -18.613 -8.631 1.00 1.04 H new ATOM 0 HA TRP A 170 -1.034 -15.878 -7.588 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -0.831 -16.440 -10.024 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -2.436 -17.143 -9.994 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -0.748 -13.748 -9.174 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -2.377 -11.826 -9.744 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -4.795 -16.528 -10.580 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -5.092 -11.568 -10.690 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 -6.889 -15.420 -11.309 1.00 4.37 H new ATOM 0 HH2 TRP A 170 -7.040 -12.946 -11.370 1.00 4.64 H new ATOM 2630 N GLN A 171 -3.850 -17.622 -7.667 1.00 0.88 N ATOM 2631 CA GLN A 171 -5.213 -17.667 -7.065 1.00 0.84 C ATOM 2632 C GLN A 171 -5.087 -17.742 -5.537 1.00 0.75 C ATOM 2633 O GLN A 171 -5.972 -17.323 -4.816 1.00 0.75 O ATOM 2634 CB GLN A 171 -5.966 -18.898 -7.616 1.00 0.88 C ATOM 2635 CG GLN A 171 -7.469 -18.611 -7.752 1.00 1.57 C ATOM 2636 CD GLN A 171 -8.110 -18.563 -6.366 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -8.256 -17.505 -5.786 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -8.501 -19.675 -5.809 1.00 2.34 N ATOM 0 H GLN A 171 -3.625 -18.398 -8.289 1.00 0.88 H new ATOM 0 HA GLN A 171 -5.774 -16.769 -7.324 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -5.556 -19.174 -8.587 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -5.814 -19.749 -6.952 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -7.623 -17.663 -8.268 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -7.944 -19.384 -8.357 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -8.377 -20.561 -6.298 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -8.931 -19.659 -4.884 1.00 2.34 H new ATOM 2647 N THR A 172 -3.990 -18.235 -5.032 1.00 0.67 N ATOM 2648 CA THR A 172 -3.829 -18.282 -3.554 1.00 0.60 C ATOM 2649 C THR A 172 -3.566 -16.847 -3.076 1.00 0.59 C ATOM 2650 O THR A 172 -4.330 -16.305 -2.301 1.00 0.74 O ATOM 2651 CB THR A 172 -2.670 -19.224 -3.192 1.00 0.59 C ATOM 2652 OG1 THR A 172 -3.117 -20.566 -3.320 1.00 0.81 O ATOM 2653 CG2 THR A 172 -2.212 -18.989 -1.751 1.00 0.92 C ATOM 0 H THR A 172 -3.207 -18.603 -5.572 1.00 0.67 H new ATOM 0 HA THR A 172 -4.723 -18.669 -3.065 1.00 0.60 H new ATOM 0 HB THR A 172 -1.833 -19.030 -3.862 1.00 0.59 H new ATOM 0 HG1 THR A 172 -2.386 -21.177 -3.093 1.00 0.81 H new ATOM 0 HG21 THR A 172 -1.391 -19.666 -1.515 1.00 0.92 H new ATOM 0 HG22 THR A 172 -1.876 -17.958 -1.640 1.00 0.92 H new ATOM 0 HG23 THR A 172 -3.043 -19.175 -1.070 1.00 0.92 H new ATOM 2661 N VAL A 173 -2.500 -16.225 -3.506 1.00 0.59 N ATOM 2662 CA VAL A 173 -2.213 -14.829 -3.058 1.00 0.58 C ATOM 2663 C VAL A 173 -3.470 -13.957 -3.186 1.00 0.57 C ATOM 2664 O VAL A 173 -3.683 -13.057 -2.399 1.00 0.60 O ATOM 2665 CB VAL A 173 -1.096 -14.258 -3.938 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -0.899 -12.769 -3.644 1.00 1.13 C ATOM 2667 CG2 VAL A 173 0.205 -15.009 -3.649 1.00 1.01 C ATOM 0 H VAL A 173 -1.815 -16.623 -4.148 1.00 0.59 H new ATOM 0 HA VAL A 173 -1.905 -14.836 -2.012 1.00 0.58 H new ATOM 0 HB VAL A 173 -1.371 -14.378 -4.986 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -0.103 -12.376 -4.276 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -1.825 -12.232 -3.850 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -0.629 -12.638 -2.596 1.00 1.13 H new ATOM 0 HG21 VAL A 173 1.003 -14.607 -4.273 1.00 1.01 H new ATOM 0 HG22 VAL A 173 0.469 -14.888 -2.598 1.00 1.01 H new ATOM 0 HG23 VAL A 173 0.071 -16.068 -3.870 1.00 1.01 H new ATOM 2677 N THR A 174 -4.307 -14.206 -4.153 1.00 0.55 N ATOM 2678 CA THR A 174 -5.541 -13.374 -4.292 1.00 0.56 C ATOM 2679 C THR A 174 -6.440 -13.600 -3.070 1.00 0.53 C ATOM 2680 O THR A 174 -7.035 -12.677 -2.549 1.00 0.55 O ATOM 2681 CB THR A 174 -6.291 -13.791 -5.560 1.00 0.59 C ATOM 2682 OG1 THR A 174 -5.384 -13.835 -6.653 1.00 1.37 O ATOM 2683 CG2 THR A 174 -7.402 -12.783 -5.855 1.00 1.27 C ATOM 0 H THR A 174 -4.195 -14.943 -4.850 1.00 0.55 H new ATOM 0 HA THR A 174 -5.271 -12.320 -4.358 1.00 0.56 H new ATOM 0 HB THR A 174 -6.731 -14.778 -5.413 1.00 0.59 H new ATOM 0 HG1 THR A 174 -4.836 -14.645 -6.591 1.00 1.37 H new ATOM 0 HG21 THR A 174 -7.934 -13.082 -6.758 1.00 1.27 H new ATOM 0 HG22 THR A 174 -8.098 -12.753 -5.017 1.00 1.27 H new ATOM 0 HG23 THR A 174 -6.967 -11.794 -6.001 1.00 1.27 H new ATOM 2691 N ILE A 175 -6.542 -14.811 -2.608 1.00 0.51 N ATOM 2692 CA ILE A 175 -7.401 -15.094 -1.419 1.00 0.50 C ATOM 2693 C ILE A 175 -6.650 -14.691 -0.148 1.00 0.49 C ATOM 2694 O ILE A 175 -7.232 -14.537 0.907 1.00 0.49 O ATOM 2695 CB ILE A 175 -7.677 -16.593 -1.390 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -8.524 -16.985 -2.601 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -8.400 -17.014 -0.108 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -8.474 -18.505 -2.785 1.00 0.89 C ATOM 0 H ILE A 175 -6.067 -15.624 -3.001 1.00 0.51 H new ATOM 0 HA ILE A 175 -8.335 -14.534 -1.476 1.00 0.50 H new ATOM 0 HB ILE A 175 -6.716 -17.107 -1.420 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -9.554 -16.658 -2.459 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -8.152 -16.487 -3.496 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -8.578 -18.089 -0.127 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -7.785 -16.763 0.756 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -9.353 -16.490 -0.039 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -9.077 -18.787 -3.648 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -7.442 -18.818 -2.945 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -8.867 -18.993 -1.893 1.00 0.89 H new ATOM 2710 N PHE A 176 -5.363 -14.498 -0.248 1.00 0.48 N ATOM 2711 CA PHE A 176 -4.575 -14.084 0.945 1.00 0.49 C ATOM 2712 C PHE A 176 -4.886 -12.616 1.252 1.00 0.49 C ATOM 2713 O PHE A 176 -5.593 -12.308 2.180 1.00 0.56 O ATOM 2714 CB PHE A 176 -3.082 -14.223 0.625 1.00 0.51 C ATOM 2715 CG PHE A 176 -2.282 -14.118 1.904 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -1.850 -12.866 2.358 1.00 1.23 C ATOM 2717 CD2 PHE A 176 -1.978 -15.272 2.639 1.00 1.41 C ATOM 2718 CE1 PHE A 176 -1.114 -12.768 3.545 1.00 1.22 C ATOM 2719 CE2 PHE A 176 -1.241 -15.173 3.826 1.00 1.52 C ATOM 2720 CZ PHE A 176 -0.809 -13.921 4.279 1.00 0.76 C ATOM 0 H PHE A 176 -4.823 -14.610 -1.106 1.00 0.48 H new ATOM 0 HA PHE A 176 -4.830 -14.708 1.802 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -2.890 -15.181 0.141 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -2.775 -13.445 -0.074 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -2.084 -11.976 1.793 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -2.312 -16.238 2.290 1.00 1.41 H new ATOM 0 HE1 PHE A 176 -0.781 -11.802 3.895 1.00 1.22 H new ATOM 0 HE2 PHE A 176 -1.006 -16.063 4.392 1.00 1.52 H new ATOM 0 HZ PHE A 176 -0.241 -13.844 5.194 1.00 0.76 H new ATOM 2730 N VAL A 177 -4.356 -11.704 0.490 1.00 0.46 N ATOM 2731 CA VAL A 177 -4.615 -10.261 0.771 1.00 0.48 C ATOM 2732 C VAL A 177 -6.120 -9.985 0.815 1.00 0.44 C ATOM 2733 O VAL A 177 -6.563 -9.044 1.444 1.00 0.57 O ATOM 2734 CB VAL A 177 -3.972 -9.409 -0.325 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -2.467 -9.680 -0.363 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -4.591 -9.760 -1.682 1.00 1.24 C ATOM 0 H VAL A 177 -3.756 -11.891 -0.313 1.00 0.46 H new ATOM 0 HA VAL A 177 -4.184 -10.007 1.740 1.00 0.48 H new ATOM 0 HB VAL A 177 -4.147 -8.354 -0.112 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -2.008 -9.074 -1.144 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -2.027 -9.425 0.601 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -2.293 -10.735 -0.574 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -4.131 -9.151 -2.460 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -4.420 -10.815 -1.898 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -5.663 -9.564 -1.655 1.00 1.24 H new ATOM 2746 N ALA A 178 -6.912 -10.792 0.171 1.00 0.45 N ATOM 2747 CA ALA A 178 -8.385 -10.559 0.197 1.00 0.43 C ATOM 2748 C ALA A 178 -8.985 -11.130 1.487 1.00 0.40 C ATOM 2749 O ALA A 178 -9.738 -10.474 2.180 1.00 0.40 O ATOM 2750 CB ALA A 178 -9.024 -11.256 -1.004 1.00 0.46 C ATOM 0 H ALA A 178 -6.607 -11.601 -0.371 1.00 0.45 H new ATOM 0 HA ALA A 178 -8.579 -9.487 0.155 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -10.101 -11.089 -0.991 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -8.605 -10.850 -1.925 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -8.822 -12.326 -0.954 1.00 0.46 H new ATOM 2756 N GLY A 179 -8.676 -12.359 1.794 1.00 0.41 N ATOM 2757 CA GLY A 179 -9.242 -13.001 3.016 1.00 0.43 C ATOM 2758 C GLY A 179 -8.888 -12.204 4.274 1.00 0.43 C ATOM 2759 O GLY A 179 -9.732 -11.941 5.108 1.00 0.48 O ATOM 0 H GLY A 179 -8.051 -12.951 1.247 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -10.325 -13.076 2.922 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -8.859 -14.018 3.107 1.00 0.43 H new ATOM 2763 N VAL A 180 -7.647 -11.846 4.440 1.00 0.42 N ATOM 2764 CA VAL A 180 -7.256 -11.104 5.669 1.00 0.45 C ATOM 2765 C VAL A 180 -7.851 -9.693 5.662 1.00 0.45 C ATOM 2766 O VAL A 180 -8.210 -9.143 6.690 1.00 0.43 O ATOM 2767 CB VAL A 180 -5.718 -11.048 5.789 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -5.136 -12.404 5.383 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -5.133 -9.971 4.864 1.00 1.41 C ATOM 0 H VAL A 180 -6.890 -12.034 3.782 1.00 0.42 H new ATOM 0 HA VAL A 180 -7.653 -11.632 6.536 1.00 0.45 H new ATOM 0 HB VAL A 180 -5.462 -10.807 6.821 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -4.050 -12.373 5.465 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -5.527 -13.180 6.041 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -5.416 -12.626 4.353 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -4.048 -9.952 4.968 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -5.395 -10.198 3.830 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -5.540 -8.997 5.136 1.00 1.41 H new ATOM 2779 N LEU A 181 -7.944 -9.098 4.495 1.00 0.49 N ATOM 2780 CA LEU A 181 -8.495 -7.720 4.397 1.00 0.50 C ATOM 2781 C LEU A 181 -9.965 -7.735 4.820 1.00 0.49 C ATOM 2782 O LEU A 181 -10.451 -6.854 5.503 1.00 0.51 O ATOM 2783 CB LEU A 181 -8.379 -7.259 2.940 1.00 0.56 C ATOM 2784 CG LEU A 181 -9.078 -5.910 2.723 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -8.507 -4.847 3.664 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -8.863 -5.485 1.268 1.00 1.20 C ATOM 0 H LEU A 181 -7.660 -9.514 3.608 1.00 0.49 H new ATOM 0 HA LEU A 181 -7.944 -7.040 5.047 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -7.327 -7.174 2.666 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -8.820 -8.009 2.283 1.00 0.56 H new ATOM 0 HG LEU A 181 -10.142 -6.012 2.936 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -9.016 -3.899 3.493 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -8.656 -5.158 4.698 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -7.441 -4.726 3.472 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -9.353 -4.527 1.093 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -7.795 -5.388 1.071 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -9.288 -6.237 0.603 1.00 1.20 H new ATOM 2798 N THR A 182 -10.673 -8.751 4.389 1.00 0.49 N ATOM 2799 CA THR A 182 -12.119 -8.872 4.721 1.00 0.51 C ATOM 2800 C THR A 182 -12.274 -9.064 6.229 1.00 0.48 C ATOM 2801 O THR A 182 -13.197 -8.563 6.839 1.00 0.51 O ATOM 2802 CB THR A 182 -12.715 -10.074 3.976 1.00 0.54 C ATOM 2803 OG1 THR A 182 -12.256 -10.069 2.630 1.00 1.16 O ATOM 2804 CG2 THR A 182 -14.243 -9.988 3.989 1.00 1.07 C ATOM 0 H THR A 182 -10.302 -9.508 3.815 1.00 0.49 H new ATOM 0 HA THR A 182 -12.645 -7.967 4.417 1.00 0.51 H new ATOM 0 HB THR A 182 -12.402 -10.994 4.470 1.00 0.54 H new ATOM 0 HG1 THR A 182 -11.402 -10.547 2.574 1.00 1.16 H new ATOM 0 HG21 THR A 182 -14.660 -10.844 3.459 1.00 1.07 H new ATOM 0 HG22 THR A 182 -14.599 -9.991 5.019 1.00 1.07 H new ATOM 0 HG23 THR A 182 -14.560 -9.068 3.498 1.00 1.07 H new ATOM 2812 N ALA A 183 -11.380 -9.801 6.831 1.00 0.45 N ATOM 2813 CA ALA A 183 -11.479 -10.040 8.296 1.00 0.44 C ATOM 2814 C ALA A 183 -11.589 -8.695 9.023 1.00 0.44 C ATOM 2815 O ALA A 183 -12.409 -8.512 9.902 1.00 0.50 O ATOM 2816 CB ALA A 183 -10.232 -10.786 8.776 1.00 0.46 C ATOM 0 H ALA A 183 -10.587 -10.247 6.370 1.00 0.45 H new ATOM 0 HA ALA A 183 -12.363 -10.641 8.511 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -10.304 -10.962 9.849 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -10.157 -11.741 8.256 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -9.346 -10.187 8.565 1.00 0.46 H new ATOM 2822 N SER A 184 -10.762 -7.751 8.654 1.00 0.47 N ATOM 2823 CA SER A 184 -10.804 -6.406 9.309 1.00 0.51 C ATOM 2824 C SER A 184 -12.154 -5.727 9.028 1.00 0.54 C ATOM 2825 O SER A 184 -12.707 -5.048 9.869 1.00 0.56 O ATOM 2826 CB SER A 184 -9.669 -5.541 8.759 1.00 0.62 C ATOM 2827 OG SER A 184 -9.554 -4.362 9.546 1.00 1.55 O ATOM 0 H SER A 184 -10.056 -7.853 7.925 1.00 0.47 H new ATOM 0 HA SER A 184 -10.685 -6.525 10.386 1.00 0.51 H new ATOM 0 HB2 SER A 184 -8.731 -6.097 8.776 1.00 0.62 H new ATOM 0 HB3 SER A 184 -9.866 -5.280 7.719 1.00 0.62 H new ATOM 0 HG SER A 184 -8.665 -3.970 9.420 1.00 1.55 H new ATOM 2833 N LEU A 185 -12.685 -5.923 7.853 1.00 0.58 N ATOM 2834 CA LEU A 185 -14.003 -5.318 7.486 1.00 0.69 C ATOM 2835 C LEU A 185 -15.138 -6.113 8.136 1.00 0.69 C ATOM 2836 O LEU A 185 -16.144 -5.576 8.552 1.00 0.79 O ATOM 2837 CB LEU A 185 -14.147 -5.393 5.962 1.00 0.71 C ATOM 2838 CG LEU A 185 -12.980 -4.641 5.292 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -13.118 -4.749 3.772 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -12.989 -3.154 5.697 1.00 1.18 C ATOM 0 H LEU A 185 -12.257 -6.485 7.118 1.00 0.58 H new ATOM 0 HA LEU A 185 -14.051 -4.285 7.830 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -14.155 -6.434 5.639 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -15.097 -4.957 5.655 1.00 0.71 H new ATOM 0 HG LEU A 185 -12.041 -5.088 5.618 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -12.295 -4.219 3.293 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -13.093 -5.798 3.478 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -14.064 -4.307 3.460 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -12.158 -2.640 5.214 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -13.928 -2.698 5.385 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -12.887 -3.071 6.779 1.00 1.18 H new ATOM 2852 N THR A 186 -14.945 -7.397 8.240 1.00 0.62 N ATOM 2853 CA THR A 186 -15.949 -8.294 8.875 1.00 0.68 C ATOM 2854 C THR A 186 -16.046 -8.021 10.370 1.00 0.62 C ATOM 2855 O THR A 186 -17.117 -8.068 10.944 1.00 0.64 O ATOM 2856 CB THR A 186 -15.486 -9.744 8.702 1.00 0.73 C ATOM 2857 OG1 THR A 186 -15.213 -9.983 7.328 1.00 0.89 O ATOM 2858 CG2 THR A 186 -16.599 -10.693 9.175 1.00 1.00 C ATOM 0 H THR A 186 -14.110 -7.875 7.902 1.00 0.62 H new ATOM 0 HA THR A 186 -16.917 -8.119 8.406 1.00 0.68 H new ATOM 0 HB THR A 186 -14.586 -9.918 9.291 1.00 0.73 H new ATOM 0 HG1 THR A 186 -14.516 -9.366 7.021 1.00 0.89 H new ATOM 0 HG21 THR A 186 -16.273 -11.726 9.053 1.00 1.00 H new ATOM 0 HG22 THR A 186 -16.817 -10.503 10.226 1.00 1.00 H new ATOM 0 HG23 THR A 186 -17.498 -10.524 8.582 1.00 1.00 H new ATOM 2866 N ILE A 187 -14.938 -7.779 11.034 1.00 0.64 N ATOM 2867 CA ILE A 187 -15.016 -7.566 12.505 1.00 0.66 C ATOM 2868 C ILE A 187 -15.605 -6.187 12.797 1.00 0.66 C ATOM 2869 O ILE A 187 -16.280 -6.000 13.791 1.00 0.75 O ATOM 2870 CB ILE A 187 -13.614 -7.706 13.138 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -13.765 -8.053 14.629 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -12.839 -6.376 13.057 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -12.387 -8.052 15.311 1.00 0.87 C ATOM 0 H ILE A 187 -14.005 -7.722 10.626 1.00 0.64 H new ATOM 0 HA ILE A 187 -15.666 -8.323 12.943 1.00 0.66 H new ATOM 0 HB ILE A 187 -13.076 -8.484 12.596 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -14.421 -7.330 15.114 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -14.233 -9.031 14.738 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -11.855 -6.500 13.509 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -12.724 -6.085 12.013 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -13.389 -5.601 13.592 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -12.503 -8.299 16.366 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -11.744 -8.792 14.834 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -11.935 -7.065 15.217 1.00 0.87 H new ATOM 2885 N TRP A 188 -15.315 -5.200 11.992 1.00 0.64 N ATOM 2886 CA TRP A 188 -15.832 -3.841 12.312 1.00 0.70 C ATOM 2887 C TRP A 188 -17.314 -3.756 11.930 1.00 0.81 C ATOM 2888 O TRP A 188 -17.988 -2.783 12.208 1.00 1.06 O ATOM 2889 CB TRP A 188 -15.009 -2.801 11.542 1.00 0.85 C ATOM 2890 CG TRP A 188 -15.656 -1.458 11.626 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -16.192 -0.789 10.580 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -15.837 -0.610 12.793 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -16.693 0.417 11.032 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -16.498 0.574 12.391 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -15.495 -0.753 14.149 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -16.809 1.582 13.302 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -15.807 0.260 15.070 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -16.463 1.425 14.647 1.00 1.71 C ATOM 0 H TRP A 188 -14.754 -5.273 11.143 1.00 0.64 H new ATOM 0 HA TRP A 188 -15.740 -3.643 13.380 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -14.000 -2.752 11.951 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -14.916 -3.102 10.499 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -16.223 -1.140 9.559 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -17.151 1.107 10.436 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -14.990 -1.647 14.484 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -17.314 2.478 12.971 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -15.540 0.141 16.110 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -16.701 2.200 15.360 1.00 1.71 H new ATOM 2909 N LYS A 189 -17.821 -4.778 11.292 1.00 0.95 N ATOM 2910 CA LYS A 189 -19.253 -4.778 10.883 1.00 1.23 C ATOM 2911 C LYS A 189 -20.130 -4.447 12.093 1.00 1.53 C ATOM 2912 O LYS A 189 -20.788 -3.427 12.133 1.00 2.02 O ATOM 2913 CB LYS A 189 -19.626 -6.161 10.340 1.00 1.90 C ATOM 2914 CG LYS A 189 -21.048 -6.124 9.769 1.00 2.68 C ATOM 2915 CD LYS A 189 -21.427 -7.506 9.196 1.00 3.60 C ATOM 2916 CE LYS A 189 -20.996 -7.607 7.728 1.00 4.51 C ATOM 2917 NZ LYS A 189 -21.853 -6.712 6.899 1.00 5.09 N ATOM 0 H LYS A 189 -17.300 -5.617 11.036 1.00 0.95 H new ATOM 0 HA LYS A 189 -19.411 -4.029 10.107 1.00 1.23 H new ATOM 0 HB2 LYS A 189 -18.920 -6.461 9.565 1.00 1.90 H new ATOM 0 HB3 LYS A 189 -19.562 -6.904 11.135 1.00 1.90 H new ATOM 0 HG2 LYS A 189 -21.754 -5.839 10.549 1.00 2.68 H new ATOM 0 HG3 LYS A 189 -21.115 -5.367 8.987 1.00 2.68 H new ATOM 0 HD2 LYS A 189 -20.948 -8.293 9.778 1.00 3.60 H new ATOM 0 HD3 LYS A 189 -22.503 -7.659 9.278 1.00 3.60 H new ATOM 0 HE2 LYS A 189 -19.948 -7.324 7.625 1.00 4.51 H new ATOM 0 HE3 LYS A 189 -21.084 -8.637 7.381 1.00 4.51 H new ATOM 0 HZ1 LYS A 189 -21.918 -7.091 5.933 1.00 5.09 H new ATOM 0 HZ2 LYS A 189 -22.805 -6.659 7.315 1.00 5.09 H new ATOM 0 HZ3 LYS A 189 -21.435 -5.760 6.870 1.00 5.09 H new ATOM 2931 N LYS A 190 -20.148 -5.301 13.081 1.00 2.36 N ATOM 2932 CA LYS A 190 -20.985 -5.028 14.281 1.00 3.37 C ATOM 2933 C LYS A 190 -20.639 -6.027 15.387 1.00 3.71 C ATOM 2934 O LYS A 190 -20.652 -7.225 15.187 1.00 4.35 O ATOM 2935 CB LYS A 190 -22.470 -5.139 13.900 1.00 4.30 C ATOM 2936 CG LYS A 190 -23.369 -5.076 15.162 1.00 5.08 C ATOM 2937 CD LYS A 190 -23.833 -6.477 15.576 1.00 5.78 C ATOM 2938 CE LYS A 190 -24.718 -6.362 16.819 1.00 6.76 C ATOM 2939 NZ LYS A 190 -25.940 -5.574 16.488 1.00 7.40 N ATOM 0 H LYS A 190 -19.620 -6.173 13.108 1.00 2.36 H new ATOM 0 HA LYS A 190 -20.788 -4.021 14.648 1.00 3.37 H new ATOM 0 HB2 LYS A 190 -22.736 -4.332 13.218 1.00 4.30 H new ATOM 0 HB3 LYS A 190 -22.645 -6.075 13.370 1.00 4.30 H new ATOM 0 HG2 LYS A 190 -22.819 -4.614 15.982 1.00 5.08 H new ATOM 0 HG3 LYS A 190 -24.236 -4.445 14.964 1.00 5.08 H new ATOM 0 HD2 LYS A 190 -24.386 -6.946 14.762 1.00 5.78 H new ATOM 0 HD3 LYS A 190 -22.972 -7.112 15.784 1.00 5.78 H new ATOM 0 HE2 LYS A 190 -24.997 -7.354 17.173 1.00 6.76 H new ATOM 0 HE3 LYS A 190 -24.168 -5.879 17.627 1.00 6.76 H new ATOM 0 HZ1 LYS A 190 -26.692 -5.797 17.170 1.00 7.40 H new ATOM 0 HZ2 LYS A 190 -25.721 -4.558 16.534 1.00 7.40 H new ATOM 0 HZ3 LYS A 190 -26.260 -5.816 15.529 1.00 7.40 H new ATOM 2953 N MET A 191 -20.319 -5.533 16.552 1.00 3.81 N ATOM 2954 CA MET A 191 -19.959 -6.434 17.682 1.00 4.63 C ATOM 2955 C MET A 191 -21.055 -7.482 17.877 1.00 4.97 C ATOM 2956 O MET A 191 -22.101 -7.209 18.432 1.00 5.27 O ATOM 2957 CB MET A 191 -19.809 -5.606 18.962 1.00 5.48 C ATOM 2958 CG MET A 191 -19.173 -6.461 20.058 1.00 5.71 C ATOM 2959 SD MET A 191 -17.430 -6.751 19.662 1.00 7.00 S ATOM 2960 CE MET A 191 -16.825 -6.862 21.364 1.00 7.52 C ATOM 0 H MET A 191 -20.292 -4.537 16.770 1.00 3.81 H new ATOM 0 HA MET A 191 -19.018 -6.937 17.458 1.00 4.63 H new ATOM 0 HB2 MET A 191 -19.192 -4.728 18.768 1.00 5.48 H new ATOM 0 HB3 MET A 191 -20.784 -5.245 19.289 1.00 5.48 H new ATOM 0 HG2 MET A 191 -19.259 -5.959 21.022 1.00 5.71 H new ATOM 0 HG3 MET A 191 -19.700 -7.411 20.145 1.00 5.71 H new ATOM 0 HE1 MET A 191 -15.750 -7.042 21.357 1.00 7.52 H new ATOM 0 HE2 MET A 191 -17.033 -5.928 21.886 1.00 7.52 H new ATOM 0 HE3 MET A 191 -17.327 -7.683 21.876 1.00 7.52 H new ATOM 2970 N GLY A 192 -20.821 -8.683 17.421 1.00 5.37 N ATOM 2971 CA GLY A 192 -21.843 -9.763 17.572 1.00 6.15 C ATOM 2972 C GLY A 192 -22.758 -9.775 16.346 1.00 6.68 C ATOM 2973 O GLY A 192 -23.908 -10.154 16.493 1.00 7.01 O ATOM 2974 OXT GLY A 192 -22.292 -9.406 15.280 1.00 7.06 O ATOM 0 H GLY A 192 -19.963 -8.965 16.948 1.00 5.37 H new ATOM 0 HA2 GLY A 192 -21.352 -10.730 17.682 1.00 6.15 H new ATOM 0 HA3 GLY A 192 -22.430 -9.599 18.476 1.00 6.15 H new TER 2978 GLY A 192