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 -164:sc= 0 (180deg=-0.0394) USER MOD Set 1.2: A 186 THR OG1 : rot 50:sc= 0.593 USER MOD Set 2.1: A 28 GLN : amide:sc= -1.09 K(o=-1.1,f=-5.4!) USER MOD Set 2.2: A 137 MET CE :methyl -112:sc= 0 (180deg=-0.186) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= -0.344 USER MOD Single : A 7 GLN : amide:sc= -0.0556 X(o=-0.056,f=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 150:sc= -0.791 USER MOD Single : A 16 SER OG : rot 180:sc= -0.104 USER MOD Single : A 18 GLN : amide:sc= -2.49! K(o=-2.5!,f=-0.15) USER MOD Single : A 20 MET CE :methyl 180:sc= -0.0207 (180deg=-0.0207) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 109:sc= 1.22 USER MOD Single : A 32 GLN : amide:sc= -2.91! C(o=-2.9!,f=-2.7!) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -0.0298 X(o=-0.03,f=-0.022) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 13:sc= 0.751 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -162:sc=-0.00405 (180deg=-0.457) USER MOD Single : A 60 SER OG : rot -33:sc= 0.684 USER MOD Single : A 62 CYS SG : rot 65:sc= 0.044 USER MOD Single : A 64 LYS NZ :NH3+ -162:sc=-0.00573 (180deg=-0.295) USER MOD Single : A 72 SER OG : rot 180:sc= -0.298 USER MOD Single : A 73 ASN : amide:sc= -6.64! K(o=-6.6!,f=-0.3) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -1.06 X(o=-1.1,f=-1.3) USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.0197 USER MOD Single : A 87 SER OG : rot -151:sc= -0.074 USER MOD Single : A 99 MET CE :methyl -161:sc= -0.124 (180deg=-1.05) USER MOD Single : A 101 SER OG : rot 180:sc= -0.0453 USER MOD Single : A 104 ASN : amide:sc= -2.07! C(o=-2.1!,f=-3.8!) USER MOD Single : A 106 ASN : amide:sc= -0.166 X(o=-0.17,f=-0.026) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot -61:sc= 0.599 USER MOD Single : A 119 LYS NZ :NH3+ 146:sc= -2.59! (180deg=-3.64!) USER MOD Single : A 123 LYS NZ :NH3+ -162:sc= -0.288 (180deg=-1.03) USER MOD Single : A 126 CYS SG : rot -59:sc= 0.253 USER MOD Single : A 127 THR OG1 : rot 11:sc= 0.426 USER MOD Single : A 128 LYS NZ :NH3+ 165:sc= -0.0102 (180deg=-0.201) USER MOD Single : A 135 THR OG1 : rot 87:sc= 0.304 USER MOD Single : A 140 THR OG1 : rot -41:sc= -0.41 USER MOD Single : A 153 GLN : amide:sc=-0.00597 X(o=-0.006,f=0) USER MOD Single : A 155 GLN : amide:sc= -0.149 K(o=-0.15,f=-1) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 GLN : amide:sc= -0.34 X(o=-0.34,f=-0.17) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 THR OG1 : rot 109:sc= 1.28 USER MOD Single : A 182 THR OG1 : rot -11:sc= 0.198 USER MOD Single : A 184 SER OG : rot -130:sc= -1.77! USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 LYS NZ :NH3+ 161:sc= -0.0384 (180deg=-0.622) USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.981 3.314 -4.982 1.00 17.15 N ATOM 2 CA MET A 1 32.617 3.584 -5.517 1.00 16.73 C ATOM 3 C MET A 1 32.723 4.487 -6.749 1.00 16.39 C ATOM 4 O MET A 1 32.386 4.094 -7.848 1.00 16.40 O ATOM 5 CB MET A 1 31.778 4.281 -4.444 1.00 16.98 C ATOM 6 CG MET A 1 30.338 4.430 -4.939 1.00 17.51 C ATOM 7 SD MET A 1 29.303 5.071 -3.599 1.00 17.69 S ATOM 8 CE MET A 1 27.700 4.713 -4.358 1.00 17.86 C ATOM 0 H1 MET A 1 33.911 2.701 -4.145 1.00 17.15 H new ATOM 0 H2 MET A 1 34.552 2.841 -5.711 1.00 17.15 H new ATOM 0 H3 MET A 1 34.434 4.212 -4.716 1.00 17.15 H new ATOM 0 HA MET A 1 32.142 2.643 -5.795 1.00 16.73 H new ATOM 0 HB2 MET A 1 31.798 3.704 -3.520 1.00 16.98 H new ATOM 0 HB3 MET A 1 32.199 5.260 -4.217 1.00 16.98 H new ATOM 0 HG2 MET A 1 30.304 5.105 -5.794 1.00 17.51 H new ATOM 0 HG3 MET A 1 29.957 3.467 -5.278 1.00 17.51 H new ATOM 0 HE1 MET A 1 26.901 5.034 -3.689 1.00 17.86 H new ATOM 0 HE2 MET A 1 27.618 5.248 -5.304 1.00 17.86 H new ATOM 0 HE3 MET A 1 27.614 3.641 -4.538 1.00 17.86 H new ATOM 20 N ASP A 2 33.188 5.693 -6.574 1.00 16.24 N ATOM 21 CA ASP A 2 33.316 6.619 -7.734 1.00 16.07 C ATOM 22 C ASP A 2 34.528 6.218 -8.577 1.00 15.50 C ATOM 23 O ASP A 2 34.394 5.743 -9.688 1.00 15.56 O ATOM 24 CB ASP A 2 33.501 8.051 -7.225 1.00 16.42 C ATOM 25 CG ASP A 2 33.611 9.006 -8.415 1.00 16.67 C ATOM 26 OD1 ASP A 2 34.694 9.113 -8.965 1.00 16.88 O ATOM 27 OD2 ASP A 2 32.610 9.615 -8.755 1.00 16.77 O ATOM 0 H ASP A 2 33.485 6.077 -5.677 1.00 16.24 H new ATOM 0 HA ASP A 2 32.415 6.563 -8.344 1.00 16.07 H new ATOM 0 HB2 ASP A 2 32.659 8.335 -6.594 1.00 16.42 H new ATOM 0 HB3 ASP A 2 34.398 8.116 -6.609 1.00 16.42 H new ATOM 32 N GLY A 3 35.711 6.405 -8.059 1.00 15.11 N ATOM 33 CA GLY A 3 36.931 6.034 -8.831 1.00 14.72 C ATOM 34 C GLY A 3 36.880 4.547 -9.187 1.00 14.60 C ATOM 35 O GLY A 3 37.181 4.154 -10.297 1.00 14.88 O ATOM 0 H GLY A 3 35.886 6.799 -7.134 1.00 15.11 H new ATOM 0 HA2 GLY A 3 36.996 6.634 -9.739 1.00 14.72 H new ATOM 0 HA3 GLY A 3 37.824 6.247 -8.244 1.00 14.72 H new ATOM 39 N SER A 4 36.502 3.717 -8.253 1.00 14.34 N ATOM 40 CA SER A 4 36.429 2.252 -8.531 1.00 14.41 C ATOM 41 C SER A 4 37.758 1.771 -9.121 1.00 13.79 C ATOM 42 O SER A 4 38.020 1.934 -10.296 1.00 14.02 O ATOM 43 CB SER A 4 35.297 1.975 -9.522 1.00 14.82 C ATOM 44 OG SER A 4 35.501 0.704 -10.124 1.00 14.88 O ATOM 0 H SER A 4 36.240 3.990 -7.306 1.00 14.34 H new ATOM 0 HA SER A 4 36.235 1.718 -7.601 1.00 14.41 H new ATOM 0 HB2 SER A 4 34.335 1.997 -9.009 1.00 14.82 H new ATOM 0 HB3 SER A 4 35.269 2.752 -10.286 1.00 14.82 H new ATOM 0 HG SER A 4 34.777 0.523 -10.759 1.00 14.88 H new ATOM 50 N GLY A 5 38.598 1.177 -8.315 1.00 13.15 N ATOM 51 CA GLY A 5 39.909 0.682 -8.832 1.00 12.67 C ATOM 52 C GLY A 5 40.420 -0.447 -7.942 1.00 12.31 C ATOM 53 O GLY A 5 41.589 -0.510 -7.616 1.00 12.37 O ATOM 0 H GLY A 5 38.434 1.013 -7.322 1.00 13.15 H new ATOM 0 HA2 GLY A 5 39.796 0.328 -9.857 1.00 12.67 H new ATOM 0 HA3 GLY A 5 40.633 1.497 -8.854 1.00 12.67 H new ATOM 57 N GLU A 6 39.559 -1.341 -7.546 1.00 12.14 N ATOM 58 CA GLU A 6 40.007 -2.461 -6.676 1.00 12.01 C ATOM 59 C GLU A 6 38.884 -3.494 -6.546 1.00 11.53 C ATOM 60 O GLU A 6 39.045 -4.647 -6.895 1.00 11.57 O ATOM 61 CB GLU A 6 40.360 -1.910 -5.294 1.00 12.39 C ATOM 62 CG GLU A 6 41.131 -2.964 -4.505 1.00 12.94 C ATOM 63 CD GLU A 6 42.547 -3.098 -5.070 1.00 13.31 C ATOM 64 OE1 GLU A 6 43.281 -2.125 -5.012 1.00 13.50 O ATOM 65 OE2 GLU A 6 42.874 -4.172 -5.549 1.00 13.55 O ATOM 0 H GLU A 6 38.568 -1.345 -7.786 1.00 12.14 H new ATOM 0 HA GLU A 6 40.882 -2.939 -7.116 1.00 12.01 H new ATOM 0 HB2 GLU A 6 40.960 -1.005 -5.394 1.00 12.39 H new ATOM 0 HB3 GLU A 6 39.452 -1.633 -4.759 1.00 12.39 H new ATOM 0 HG2 GLU A 6 41.174 -2.685 -3.452 1.00 12.94 H new ATOM 0 HG3 GLU A 6 40.615 -3.923 -4.560 1.00 12.94 H new ATOM 72 N GLN A 7 37.748 -3.089 -6.044 1.00 11.25 N ATOM 73 CA GLN A 7 36.610 -4.041 -5.883 1.00 10.97 C ATOM 74 C GLN A 7 35.285 -3.272 -6.016 1.00 10.29 C ATOM 75 O GLN A 7 34.610 -3.052 -5.030 1.00 10.41 O ATOM 76 CB GLN A 7 36.687 -4.692 -4.497 1.00 11.52 C ATOM 77 CG GLN A 7 37.067 -3.640 -3.453 1.00 12.08 C ATOM 78 CD GLN A 7 36.817 -4.198 -2.050 1.00 12.56 C ATOM 79 OE1 GLN A 7 37.734 -4.334 -1.265 1.00 12.91 O ATOM 80 NE2 GLN A 7 35.605 -4.530 -1.700 1.00 12.77 N ATOM 0 H GLN A 7 37.558 -2.135 -5.737 1.00 11.25 H new ATOM 0 HA GLN A 7 36.663 -4.813 -6.651 1.00 10.97 H new ATOM 0 HB2 GLN A 7 35.727 -5.141 -4.242 1.00 11.52 H new ATOM 0 HB3 GLN A 7 37.424 -5.495 -4.502 1.00 11.52 H new ATOM 0 HG2 GLN A 7 38.116 -3.364 -3.564 1.00 12.08 H new ATOM 0 HG3 GLN A 7 36.481 -2.734 -3.605 1.00 12.08 H new ATOM 0 HE21 GLN A 7 34.835 -4.416 -2.359 1.00 12.77 H new ATOM 0 HE22 GLN A 7 35.428 -4.904 -0.768 1.00 12.77 H new ATOM 89 N PRO A 8 34.947 -2.870 -7.225 1.00 9.81 N ATOM 90 CA PRO A 8 33.704 -2.113 -7.464 1.00 9.37 C ATOM 91 C PRO A 8 32.492 -2.940 -7.016 1.00 9.09 C ATOM 92 O PRO A 8 32.075 -3.862 -7.689 1.00 9.07 O ATOM 93 CB PRO A 8 33.682 -1.849 -8.989 1.00 9.20 C ATOM 94 CG PRO A 8 34.988 -2.450 -9.587 1.00 9.57 C ATOM 95 CD PRO A 8 35.759 -3.134 -8.435 1.00 9.93 C ATOM 0 HA PRO A 8 33.663 -1.180 -6.902 1.00 9.37 H new ATOM 0 HB2 PRO A 8 32.805 -2.308 -9.445 1.00 9.20 H new ATOM 0 HB3 PRO A 8 33.624 -0.780 -9.192 1.00 9.20 H new ATOM 0 HG2 PRO A 8 34.754 -3.170 -10.371 1.00 9.57 H new ATOM 0 HG3 PRO A 8 35.595 -1.668 -10.043 1.00 9.57 H new ATOM 0 HD2 PRO A 8 35.867 -4.204 -8.613 1.00 9.93 H new ATOM 0 HD3 PRO A 8 36.764 -2.724 -8.334 1.00 9.93 H new ATOM 103 N ARG A 9 31.925 -2.614 -5.887 1.00 9.13 N ATOM 104 CA ARG A 9 30.744 -3.380 -5.401 1.00 9.14 C ATOM 105 C ARG A 9 29.585 -3.201 -6.382 1.00 8.60 C ATOM 106 O ARG A 9 28.834 -4.121 -6.640 1.00 8.68 O ATOM 107 CB ARG A 9 30.332 -2.871 -4.017 1.00 10.09 C ATOM 108 CG ARG A 9 30.019 -1.374 -4.091 1.00 10.67 C ATOM 109 CD ARG A 9 29.800 -0.827 -2.678 1.00 11.51 C ATOM 110 NE ARG A 9 31.107 -0.757 -1.964 1.00 12.05 N ATOM 111 CZ ARG A 9 31.214 -0.063 -0.863 1.00 12.65 C ATOM 112 NH1 ARG A 9 30.175 0.563 -0.382 1.00 12.79 N ATOM 113 NH2 ARG A 9 32.360 0.002 -0.242 1.00 13.27 N ATOM 0 H ARG A 9 32.228 -1.851 -5.281 1.00 9.13 H new ATOM 0 HA ARG A 9 31.001 -4.437 -5.331 1.00 9.14 H new ATOM 0 HB2 ARG A 9 29.458 -3.418 -3.663 1.00 10.09 H new ATOM 0 HB3 ARG A 9 31.133 -3.050 -3.300 1.00 10.09 H new ATOM 0 HG2 ARG A 9 30.839 -0.844 -4.574 1.00 10.67 H new ATOM 0 HG3 ARG A 9 29.130 -1.207 -4.699 1.00 10.67 H new ATOM 0 HD2 ARG A 9 29.346 0.163 -2.726 1.00 11.51 H new ATOM 0 HD3 ARG A 9 29.109 -1.468 -2.131 1.00 11.51 H new ATOM 0 HE ARG A 9 31.918 -1.251 -2.336 1.00 12.05 H new ATOM 0 HH11 ARG A 9 29.279 0.510 -0.866 1.00 12.79 H new ATOM 0 HH12 ARG A 9 30.259 1.105 0.478 1.00 12.79 H new ATOM 0 HH21 ARG A 9 33.172 -0.489 -0.617 1.00 13.27 H new ATOM 0 HH22 ARG A 9 32.444 0.544 0.618 1.00 13.27 H new ATOM 127 N GLY A 10 29.437 -2.023 -6.937 1.00 8.29 N ATOM 128 CA GLY A 10 28.331 -1.777 -7.913 1.00 8.00 C ATOM 129 C GLY A 10 27.649 -0.442 -7.610 1.00 7.45 C ATOM 130 O GLY A 10 27.615 0.456 -8.426 1.00 7.68 O ATOM 0 H GLY A 10 30.037 -1.219 -6.755 1.00 8.29 H new ATOM 0 HA2 GLY A 10 28.727 -1.770 -8.929 1.00 8.00 H new ATOM 0 HA3 GLY A 10 27.603 -2.586 -7.861 1.00 8.00 H new ATOM 134 N GLY A 11 27.115 -0.308 -6.424 1.00 7.01 N ATOM 135 CA GLY A 11 26.439 0.964 -6.039 1.00 6.74 C ATOM 136 C GLY A 11 25.985 0.872 -4.579 1.00 5.83 C ATOM 137 O GLY A 11 26.748 0.510 -3.706 1.00 6.06 O ATOM 0 H GLY A 11 27.119 -1.029 -5.703 1.00 7.01 H new ATOM 0 HA2 GLY A 11 27.120 1.805 -6.168 1.00 6.74 H new ATOM 0 HA3 GLY A 11 25.582 1.145 -6.688 1.00 6.74 H new ATOM 141 N GLY A 12 24.746 1.179 -4.309 1.00 5.12 N ATOM 142 CA GLY A 12 24.245 1.088 -2.908 1.00 4.52 C ATOM 143 C GLY A 12 22.708 1.041 -2.894 1.00 3.52 C ATOM 144 O GLY A 12 22.082 1.851 -2.239 1.00 3.54 O ATOM 0 H GLY A 12 24.059 1.489 -4.997 1.00 5.12 H new ATOM 0 HA2 GLY A 12 24.647 0.196 -2.428 1.00 4.52 H new ATOM 0 HA3 GLY A 12 24.595 1.945 -2.333 1.00 4.52 H new ATOM 148 N PRO A 13 22.135 0.090 -3.605 1.00 3.15 N ATOM 149 CA PRO A 13 20.667 -0.059 -3.654 1.00 2.77 C ATOM 150 C PRO A 13 20.096 -0.219 -2.237 1.00 2.05 C ATOM 151 O PRO A 13 18.923 0.003 -2.009 1.00 2.37 O ATOM 152 CB PRO A 13 20.426 -1.340 -4.492 1.00 3.47 C ATOM 153 CG PRO A 13 21.812 -1.846 -4.992 1.00 3.99 C ATOM 154 CD PRO A 13 22.886 -0.900 -4.409 1.00 3.79 C ATOM 0 HA PRO A 13 20.177 0.812 -4.089 1.00 2.77 H new ATOM 0 HB2 PRO A 13 19.934 -2.104 -3.890 1.00 3.47 H new ATOM 0 HB3 PRO A 13 19.769 -1.127 -5.336 1.00 3.47 H new ATOM 0 HG2 PRO A 13 21.986 -2.872 -4.667 1.00 3.99 H new ATOM 0 HG3 PRO A 13 21.851 -1.846 -6.081 1.00 3.99 H new ATOM 0 HD2 PRO A 13 23.600 -1.447 -3.794 1.00 3.79 H new ATOM 0 HD3 PRO A 13 23.455 -0.414 -5.202 1.00 3.79 H new ATOM 162 N THR A 14 20.905 -0.607 -1.287 1.00 1.59 N ATOM 163 CA THR A 14 20.386 -0.782 0.103 1.00 1.24 C ATOM 164 C THR A 14 20.404 0.563 0.837 1.00 1.07 C ATOM 165 O THR A 14 20.723 0.638 2.007 1.00 1.20 O ATOM 166 CB THR A 14 21.245 -1.797 0.857 1.00 1.43 C ATOM 167 OG1 THR A 14 22.588 -1.335 0.897 1.00 2.16 O ATOM 168 CG2 THR A 14 21.190 -3.148 0.143 1.00 1.78 C ATOM 0 H THR A 14 21.897 -0.809 -1.411 1.00 1.59 H new ATOM 0 HA THR A 14 19.361 -1.150 0.056 1.00 1.24 H new ATOM 0 HB THR A 14 20.867 -1.912 1.873 1.00 1.43 H new ATOM 0 HG1 THR A 14 23.142 -1.982 1.381 1.00 2.16 H new ATOM 0 HG21 THR A 14 21.803 -3.870 0.682 1.00 1.78 H new ATOM 0 HG22 THR A 14 20.159 -3.500 0.110 1.00 1.78 H new ATOM 0 HG23 THR A 14 21.569 -3.038 -0.873 1.00 1.78 H new ATOM 176 N SER A 15 20.030 1.620 0.164 1.00 1.07 N ATOM 177 CA SER A 15 19.985 2.962 0.821 1.00 0.91 C ATOM 178 C SER A 15 18.551 3.216 1.297 1.00 0.75 C ATOM 179 O SER A 15 17.604 3.073 0.550 1.00 0.78 O ATOM 180 CB SER A 15 20.395 4.042 -0.184 1.00 0.99 C ATOM 181 OG SER A 15 19.264 4.423 -0.955 1.00 1.38 O ATOM 0 H SER A 15 19.752 1.612 -0.817 1.00 1.07 H new ATOM 0 HA SER A 15 20.672 2.991 1.667 1.00 0.91 H new ATOM 0 HB2 SER A 15 20.800 4.908 0.341 1.00 0.99 H new ATOM 0 HB3 SER A 15 21.184 3.667 -0.836 1.00 0.99 H new ATOM 0 HG SER A 15 19.353 5.361 -1.225 1.00 1.38 H new ATOM 187 N SER A 16 18.382 3.571 2.541 1.00 0.72 N ATOM 188 CA SER A 16 17.008 3.810 3.070 1.00 0.82 C ATOM 189 C SER A 16 16.295 4.882 2.242 1.00 0.81 C ATOM 190 O SER A 16 15.124 4.761 1.935 1.00 0.92 O ATOM 191 CB SER A 16 17.100 4.275 4.524 1.00 1.06 C ATOM 192 OG SER A 16 17.717 5.555 4.570 1.00 1.64 O ATOM 0 H SER A 16 19.136 3.706 3.215 1.00 0.72 H new ATOM 0 HA SER A 16 16.441 2.881 3.009 1.00 0.82 H new ATOM 0 HB2 SER A 16 16.105 4.322 4.966 1.00 1.06 H new ATOM 0 HB3 SER A 16 17.676 3.560 5.111 1.00 1.06 H new ATOM 0 HG SER A 16 17.776 5.857 5.501 1.00 1.64 H new ATOM 198 N GLU A 17 16.975 5.934 1.886 1.00 0.80 N ATOM 199 CA GLU A 17 16.317 7.009 1.090 1.00 0.94 C ATOM 200 C GLU A 17 15.805 6.460 -0.246 1.00 0.85 C ATOM 201 O GLU A 17 14.824 6.941 -0.776 1.00 0.89 O ATOM 202 CB GLU A 17 17.299 8.157 0.846 1.00 1.13 C ATOM 203 CG GLU A 17 18.542 7.617 0.134 1.00 1.71 C ATOM 204 CD GLU A 17 19.600 8.717 0.039 1.00 2.26 C ATOM 205 OE1 GLU A 17 19.267 9.793 -0.429 1.00 2.68 O ATOM 206 OE2 GLU A 17 20.726 8.465 0.436 1.00 2.90 O ATOM 0 H GLU A 17 17.956 6.097 2.111 1.00 0.80 H new ATOM 0 HA GLU A 17 15.464 7.384 1.656 1.00 0.94 H new ATOM 0 HB2 GLU A 17 16.827 8.932 0.242 1.00 1.13 H new ATOM 0 HB3 GLU A 17 17.580 8.618 1.793 1.00 1.13 H new ATOM 0 HG2 GLU A 17 18.941 6.761 0.678 1.00 1.71 H new ATOM 0 HG3 GLU A 17 18.278 7.266 -0.864 1.00 1.71 H new ATOM 213 N GLN A 18 16.432 5.460 -0.800 1.00 0.80 N ATOM 214 CA GLN A 18 15.920 4.918 -2.093 1.00 0.83 C ATOM 215 C GLN A 18 14.517 4.342 -1.859 1.00 0.68 C ATOM 216 O GLN A 18 13.688 4.326 -2.748 1.00 0.69 O ATOM 217 CB GLN A 18 16.868 3.817 -2.614 1.00 0.96 C ATOM 218 CG GLN A 18 17.934 4.434 -3.535 1.00 1.53 C ATOM 219 CD GLN A 18 17.346 4.649 -4.933 1.00 2.23 C ATOM 220 OE1 GLN A 18 18.074 4.789 -5.896 1.00 2.69 O ATOM 221 NE2 GLN A 18 16.051 4.682 -5.084 1.00 3.07 N ATOM 0 H GLN A 18 17.261 5.001 -0.424 1.00 0.80 H new ATOM 0 HA GLN A 18 15.873 5.712 -2.838 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.348 3.312 -1.776 1.00 0.96 H new ATOM 0 HB3 GLN A 18 16.299 3.062 -3.157 1.00 0.96 H new ATOM 0 HG2 GLN A 18 18.278 5.383 -3.125 1.00 1.53 H new ATOM 0 HG3 GLN A 18 18.803 3.778 -3.592 1.00 1.53 H new ATOM 0 HE21 GLN A 18 15.440 4.564 -4.276 1.00 3.07 H new ATOM 0 HE22 GLN A 18 15.649 4.825 -6.010 1.00 3.07 H new ATOM 230 N ILE A 19 14.245 3.876 -0.667 1.00 0.59 N ATOM 231 CA ILE A 19 12.896 3.311 -0.377 1.00 0.58 C ATOM 232 C ILE A 19 11.886 4.451 -0.275 1.00 0.52 C ATOM 233 O ILE A 19 10.736 4.330 -0.645 1.00 0.59 O ATOM 234 CB ILE A 19 12.931 2.529 0.932 1.00 0.64 C ATOM 235 CG1 ILE A 19 13.951 1.394 0.808 1.00 0.74 C ATOM 236 CG2 ILE A 19 11.545 1.944 1.213 1.00 0.73 C ATOM 237 CD1 ILE A 19 14.165 0.746 2.176 1.00 0.81 C ATOM 0 H ILE A 19 14.899 3.863 0.116 1.00 0.59 H new ATOM 0 HA ILE A 19 12.603 2.636 -1.181 1.00 0.58 H new ATOM 0 HB ILE A 19 13.215 3.191 1.750 1.00 0.64 H new ATOM 0 HG12 ILE A 19 13.598 0.651 0.093 1.00 0.74 H new ATOM 0 HG13 ILE A 19 14.896 1.780 0.425 1.00 0.74 H new ATOM 0 HG21 ILE A 19 11.569 1.385 2.148 1.00 0.73 H new ATOM 0 HG22 ILE A 19 10.818 2.752 1.292 1.00 0.73 H new ATOM 0 HG23 ILE A 19 11.260 1.278 0.399 1.00 0.73 H new ATOM 0 HD11 ILE A 19 14.891 -0.062 2.086 1.00 0.81 H new ATOM 0 HD12 ILE A 19 14.537 1.492 2.878 1.00 0.81 H new ATOM 0 HD13 ILE A 19 13.219 0.345 2.541 1.00 0.81 H new ATOM 249 N MET A 20 12.334 5.573 0.211 1.00 0.51 N ATOM 250 CA MET A 20 11.466 6.769 0.340 1.00 0.60 C ATOM 251 C MET A 20 11.033 7.272 -1.037 1.00 0.55 C ATOM 252 O MET A 20 9.867 7.452 -1.321 1.00 0.59 O ATOM 253 CB MET A 20 12.313 7.879 1.019 1.00 0.82 C ATOM 254 CG MET A 20 11.390 8.877 1.753 1.00 1.07 C ATOM 255 SD MET A 20 10.637 8.078 3.200 1.00 1.43 S ATOM 256 CE MET A 20 9.022 8.898 3.121 1.00 0.93 C ATOM 0 H MET A 20 13.292 5.712 0.532 1.00 0.51 H new ATOM 0 HA MET A 20 10.576 6.519 0.918 1.00 0.60 H new ATOM 0 HB2 MET A 20 13.013 7.432 1.725 1.00 0.82 H new ATOM 0 HB3 MET A 20 12.906 8.404 0.270 1.00 0.82 H new ATOM 0 HG2 MET A 20 11.961 9.751 2.066 1.00 1.07 H new ATOM 0 HG3 MET A 20 10.612 9.231 1.077 1.00 1.07 H new ATOM 0 HE1 MET A 20 8.393 8.543 3.937 1.00 0.93 H new ATOM 0 HE2 MET A 20 9.157 9.976 3.209 1.00 0.93 H new ATOM 0 HE3 MET A 20 8.544 8.669 2.169 1.00 0.93 H new ATOM 266 N LYS A 21 11.999 7.499 -1.891 1.00 0.57 N ATOM 267 CA LYS A 21 11.715 7.992 -3.268 1.00 0.61 C ATOM 268 C LYS A 21 11.007 6.919 -4.093 1.00 0.53 C ATOM 269 O LYS A 21 9.973 7.166 -4.680 1.00 0.51 O ATOM 270 CB LYS A 21 13.035 8.348 -3.957 1.00 0.72 C ATOM 271 CG LYS A 21 13.619 9.620 -3.333 1.00 1.09 C ATOM 272 CD LYS A 21 15.075 9.822 -3.810 1.00 1.24 C ATOM 273 CE LYS A 21 16.048 9.132 -2.848 1.00 1.80 C ATOM 274 NZ LYS A 21 17.433 9.242 -3.385 1.00 2.40 N ATOM 0 H LYS A 21 12.988 7.360 -1.686 1.00 0.57 H new ATOM 0 HA LYS A 21 11.070 8.868 -3.196 1.00 0.61 H new ATOM 0 HB2 LYS A 21 13.742 7.525 -3.856 1.00 0.72 H new ATOM 0 HB3 LYS A 21 12.870 8.498 -5.024 1.00 0.72 H new ATOM 0 HG2 LYS A 21 13.013 10.483 -3.611 1.00 1.09 H new ATOM 0 HG3 LYS A 21 13.590 9.548 -2.246 1.00 1.09 H new ATOM 0 HD2 LYS A 21 15.196 9.416 -4.814 1.00 1.24 H new ATOM 0 HD3 LYS A 21 15.302 10.887 -3.867 1.00 1.24 H new ATOM 0 HE2 LYS A 21 15.990 9.593 -1.862 1.00 1.80 H new ATOM 0 HE3 LYS A 21 15.775 8.084 -2.726 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 18.096 8.774 -2.734 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 17.481 8.783 -4.317 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 17.690 10.245 -3.479 1.00 2.40 H new ATOM 288 N THR A 22 11.538 5.729 -4.153 1.00 0.53 N ATOM 289 CA THR A 22 10.873 4.667 -4.960 1.00 0.52 C ATOM 290 C THR A 22 9.442 4.455 -4.470 1.00 0.45 C ATOM 291 O THR A 22 8.526 4.351 -5.251 1.00 0.48 O ATOM 292 CB THR A 22 11.659 3.359 -4.825 1.00 0.55 C ATOM 293 OG1 THR A 22 13.033 3.604 -5.092 1.00 0.64 O ATOM 294 CG2 THR A 22 11.120 2.331 -5.822 1.00 0.62 C ATOM 0 H THR A 22 12.398 5.447 -3.682 1.00 0.53 H new ATOM 0 HA THR A 22 10.848 4.975 -6.005 1.00 0.52 H new ATOM 0 HB THR A 22 11.548 2.972 -3.812 1.00 0.55 H new ATOM 0 HG1 THR A 22 13.544 3.545 -4.258 1.00 0.64 H new ATOM 0 HG21 THR A 22 11.680 1.401 -5.725 1.00 0.62 H new ATOM 0 HG22 THR A 22 10.066 2.143 -5.617 1.00 0.62 H new ATOM 0 HG23 THR A 22 11.229 2.716 -6.836 1.00 0.62 H new ATOM 302 N GLY A 23 9.245 4.405 -3.184 1.00 0.42 N ATOM 303 CA GLY A 23 7.869 4.202 -2.634 1.00 0.43 C ATOM 304 C GLY A 23 6.941 5.336 -3.083 1.00 0.41 C ATOM 305 O GLY A 23 5.922 5.095 -3.708 1.00 0.47 O ATOM 0 H GLY A 23 9.980 4.496 -2.482 1.00 0.42 H new ATOM 0 HA2 GLY A 23 7.473 3.244 -2.972 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.908 4.165 -1.545 1.00 0.43 H new ATOM 309 N ALA A 24 7.270 6.562 -2.795 1.00 0.40 N ATOM 310 CA ALA A 24 6.394 7.686 -3.235 1.00 0.41 C ATOM 311 C ALA A 24 6.091 7.565 -4.735 1.00 0.41 C ATOM 312 O ALA A 24 5.101 8.068 -5.221 1.00 0.41 O ATOM 313 CB ALA A 24 7.129 9.008 -2.998 1.00 0.42 C ATOM 0 H ALA A 24 8.104 6.836 -2.276 1.00 0.40 H new ATOM 0 HA ALA A 24 5.462 7.653 -2.670 1.00 0.41 H new ATOM 0 HB1 ALA A 24 6.498 9.838 -3.316 1.00 0.42 H new ATOM 0 HB2 ALA A 24 7.358 9.112 -1.937 1.00 0.42 H new ATOM 0 HB3 ALA A 24 8.056 9.017 -3.571 1.00 0.42 H new ATOM 319 N LEU A 25 6.953 6.904 -5.469 1.00 0.42 N ATOM 320 CA LEU A 25 6.735 6.755 -6.938 1.00 0.44 C ATOM 321 C LEU A 25 5.673 5.674 -7.201 1.00 0.44 C ATOM 322 O LEU A 25 4.783 5.856 -8.007 1.00 0.46 O ATOM 323 CB LEU A 25 8.075 6.382 -7.618 1.00 0.47 C ATOM 324 CG LEU A 25 8.698 7.608 -8.302 1.00 0.77 C ATOM 325 CD1 LEU A 25 9.181 8.604 -7.247 1.00 1.58 C ATOM 326 CD2 LEU A 25 9.883 7.161 -9.160 1.00 1.67 C ATOM 0 H LEU A 25 7.799 6.461 -5.111 1.00 0.42 H new ATOM 0 HA LEU A 25 6.377 7.696 -7.355 1.00 0.44 H new ATOM 0 HB2 LEU A 25 8.766 5.983 -6.876 1.00 0.47 H new ATOM 0 HB3 LEU A 25 7.908 5.595 -8.353 1.00 0.47 H new ATOM 0 HG LEU A 25 7.948 8.089 -8.931 1.00 0.77 H new ATOM 0 HD11 LEU A 25 9.622 9.471 -7.740 1.00 1.58 H new ATOM 0 HD12 LEU A 25 8.337 8.924 -6.636 1.00 1.58 H new ATOM 0 HD13 LEU A 25 9.929 8.128 -6.613 1.00 1.58 H new ATOM 0 HD21 LEU A 25 10.328 8.029 -9.647 1.00 1.67 H new ATOM 0 HD22 LEU A 25 10.628 6.678 -8.528 1.00 1.67 H new ATOM 0 HD23 LEU A 25 9.539 6.457 -9.917 1.00 1.67 H new ATOM 338 N LEU A 26 5.784 4.537 -6.566 1.00 0.45 N ATOM 339 CA LEU A 26 4.798 3.447 -6.831 1.00 0.47 C ATOM 340 C LEU A 26 3.374 3.997 -6.739 1.00 0.49 C ATOM 341 O LEU A 26 2.581 3.826 -7.644 1.00 0.52 O ATOM 342 CB LEU A 26 4.973 2.302 -5.826 1.00 0.51 C ATOM 343 CG LEU A 26 6.453 1.935 -5.693 1.00 0.69 C ATOM 344 CD1 LEU A 26 6.597 0.677 -4.836 1.00 1.17 C ATOM 345 CD2 LEU A 26 7.065 1.689 -7.080 1.00 1.35 C ATOM 0 H LEU A 26 6.507 4.316 -5.881 1.00 0.45 H new ATOM 0 HA LEU A 26 4.974 3.061 -7.835 1.00 0.47 H new ATOM 0 HB2 LEU A 26 4.576 2.597 -4.855 1.00 0.51 H new ATOM 0 HB3 LEU A 26 4.403 1.432 -6.152 1.00 0.51 H new ATOM 0 HG LEU A 26 6.980 2.761 -5.216 1.00 0.69 H new ATOM 0 HD11 LEU A 26 7.652 0.419 -4.743 1.00 1.17 H new ATOM 0 HD12 LEU A 26 6.180 0.862 -3.846 1.00 1.17 H new ATOM 0 HD13 LEU A 26 6.062 -0.147 -5.307 1.00 1.17 H new ATOM 0 HD21 LEU A 26 8.118 1.429 -6.972 1.00 1.35 H new ATOM 0 HD22 LEU A 26 6.537 0.871 -7.571 1.00 1.35 H new ATOM 0 HD23 LEU A 26 6.974 2.592 -7.683 1.00 1.35 H new ATOM 357 N LEU A 27 3.024 4.637 -5.655 1.00 0.50 N ATOM 358 CA LEU A 27 1.629 5.156 -5.549 1.00 0.56 C ATOM 359 C LEU A 27 1.379 6.165 -6.673 1.00 0.56 C ATOM 360 O LEU A 27 0.428 6.049 -7.420 1.00 0.60 O ATOM 361 CB LEU A 27 1.397 5.820 -4.190 1.00 0.64 C ATOM 362 CG LEU A 27 1.938 4.930 -3.074 1.00 0.95 C ATOM 363 CD1 LEU A 27 1.681 5.603 -1.724 1.00 1.66 C ATOM 364 CD2 LEU A 27 1.233 3.568 -3.113 1.00 1.42 C ATOM 0 H LEU A 27 3.629 4.820 -4.854 1.00 0.50 H new ATOM 0 HA LEU A 27 0.934 4.321 -5.642 1.00 0.56 H new ATOM 0 HB2 LEU A 27 1.890 6.792 -4.162 1.00 0.64 H new ATOM 0 HB3 LEU A 27 0.332 5.998 -4.040 1.00 0.64 H new ATOM 0 HG LEU A 27 3.009 4.783 -3.211 1.00 0.95 H new ATOM 0 HD11 LEU A 27 2.066 4.971 -0.923 1.00 1.66 H new ATOM 0 HD12 LEU A 27 2.185 6.569 -1.697 1.00 1.66 H new ATOM 0 HD13 LEU A 27 0.609 5.749 -1.588 1.00 1.66 H new ATOM 0 HD21 LEU A 27 1.621 2.934 -2.315 1.00 1.42 H new ATOM 0 HD22 LEU A 27 0.161 3.709 -2.975 1.00 1.42 H new ATOM 0 HD23 LEU A 27 1.415 3.091 -4.076 1.00 1.42 H new ATOM 376 N GLN A 28 2.219 7.156 -6.798 1.00 0.55 N ATOM 377 CA GLN A 28 2.025 8.174 -7.873 1.00 0.58 C ATOM 378 C GLN A 28 1.728 7.472 -9.201 1.00 0.54 C ATOM 379 O GLN A 28 0.877 7.886 -9.962 1.00 0.58 O ATOM 380 CB GLN A 28 3.311 8.995 -8.012 1.00 0.60 C ATOM 381 CG GLN A 28 3.535 9.826 -6.738 1.00 1.00 C ATOM 382 CD GLN A 28 2.756 11.143 -6.826 1.00 1.40 C ATOM 383 OE1 GLN A 28 1.813 11.255 -7.584 1.00 2.09 O ATOM 384 NE2 GLN A 28 3.116 12.151 -6.079 1.00 1.91 N ATOM 0 H GLN A 28 3.033 7.306 -6.202 1.00 0.55 H new ATOM 0 HA GLN A 28 1.189 8.825 -7.616 1.00 0.58 H new ATOM 0 HB2 GLN A 28 4.160 8.333 -8.180 1.00 0.60 H new ATOM 0 HB3 GLN A 28 3.243 9.652 -8.879 1.00 0.60 H new ATOM 0 HG2 GLN A 28 3.212 9.261 -5.864 1.00 1.00 H new ATOM 0 HG3 GLN A 28 4.598 10.031 -6.610 1.00 1.00 H new ATOM 0 HE21 GLN A 28 3.908 12.057 -5.443 1.00 1.91 H new ATOM 0 HE22 GLN A 28 2.606 13.033 -6.132 1.00 1.91 H new ATOM 393 N GLY A 29 2.446 6.418 -9.486 1.00 0.50 N ATOM 394 CA GLY A 29 2.235 5.684 -10.765 1.00 0.48 C ATOM 395 C GLY A 29 1.021 4.760 -10.649 1.00 0.44 C ATOM 396 O GLY A 29 0.154 4.757 -11.501 1.00 0.50 O ATOM 0 H GLY A 29 3.173 6.033 -8.883 1.00 0.50 H new ATOM 0 HA2 GLY A 29 2.085 6.393 -11.579 1.00 0.48 H new ATOM 0 HA3 GLY A 29 3.123 5.101 -11.009 1.00 0.48 H new ATOM 400 N PHE A 30 0.948 3.971 -9.611 1.00 0.44 N ATOM 401 CA PHE A 30 -0.219 3.051 -9.472 1.00 0.43 C ATOM 402 C PHE A 30 -1.500 3.884 -9.362 1.00 0.40 C ATOM 403 O PHE A 30 -2.537 3.502 -9.869 1.00 0.43 O ATOM 404 CB PHE A 30 -0.048 2.163 -8.224 1.00 0.47 C ATOM 405 CG PHE A 30 -1.390 1.598 -7.795 1.00 0.47 C ATOM 406 CD1 PHE A 30 -2.123 0.800 -8.681 1.00 1.20 C ATOM 407 CD2 PHE A 30 -1.905 1.883 -6.522 1.00 1.39 C ATOM 408 CE1 PHE A 30 -3.366 0.285 -8.297 1.00 1.21 C ATOM 409 CE2 PHE A 30 -3.148 1.365 -6.138 1.00 1.42 C ATOM 410 CZ PHE A 30 -3.879 0.567 -7.026 1.00 0.58 C ATOM 0 H PHE A 30 1.637 3.923 -8.861 1.00 0.44 H new ATOM 0 HA PHE A 30 -0.282 2.403 -10.346 1.00 0.43 H new ATOM 0 HB2 PHE A 30 0.645 1.350 -8.440 1.00 0.47 H new ATOM 0 HB3 PHE A 30 0.386 2.745 -7.411 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -1.729 0.581 -9.662 1.00 1.20 H new ATOM 0 HD2 PHE A 30 -1.343 2.502 -5.838 1.00 1.39 H new ATOM 0 HE1 PHE A 30 -3.930 -0.331 -8.982 1.00 1.21 H new ATOM 0 HE2 PHE A 30 -3.543 1.581 -5.156 1.00 1.42 H new ATOM 0 HZ PHE A 30 -4.839 0.169 -6.730 1.00 0.58 H new ATOM 420 N ILE A 31 -1.447 5.014 -8.719 1.00 0.40 N ATOM 421 CA ILE A 31 -2.674 5.846 -8.604 1.00 0.40 C ATOM 422 C ILE A 31 -2.934 6.550 -9.942 1.00 0.40 C ATOM 423 O ILE A 31 -3.998 6.435 -10.519 1.00 0.43 O ATOM 424 CB ILE A 31 -2.493 6.893 -7.495 1.00 0.41 C ATOM 425 CG1 ILE A 31 -2.346 6.184 -6.147 1.00 0.53 C ATOM 426 CG2 ILE A 31 -3.726 7.799 -7.477 1.00 0.72 C ATOM 427 CD1 ILE A 31 -1.870 7.183 -5.091 1.00 0.48 C ATOM 0 H ILE A 31 -0.614 5.396 -8.271 1.00 0.40 H new ATOM 0 HA ILE A 31 -3.522 5.209 -8.355 1.00 0.40 H new ATOM 0 HB ILE A 31 -1.600 7.490 -7.679 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -3.300 5.749 -5.847 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -1.634 5.363 -6.232 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -3.615 8.550 -6.694 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -3.828 8.294 -8.443 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -4.615 7.200 -7.281 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -1.766 6.676 -4.132 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -0.907 7.597 -5.389 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -2.598 7.989 -4.998 1.00 0.48 H new ATOM 439 N GLN A 32 -1.975 7.289 -10.432 1.00 0.42 N ATOM 440 CA GLN A 32 -2.166 8.016 -11.722 1.00 0.47 C ATOM 441 C GLN A 32 -2.516 7.038 -12.844 1.00 0.50 C ATOM 442 O GLN A 32 -3.427 7.260 -13.617 1.00 0.61 O ATOM 443 CB GLN A 32 -0.874 8.758 -12.082 1.00 0.57 C ATOM 444 CG GLN A 32 -1.099 9.649 -13.313 1.00 1.19 C ATOM 445 CD GLN A 32 -1.057 8.801 -14.588 1.00 1.59 C ATOM 446 OE1 GLN A 32 -0.099 8.093 -14.829 1.00 2.16 O ATOM 447 NE2 GLN A 32 -2.060 8.846 -15.422 1.00 2.21 N ATOM 0 H GLN A 32 -1.064 7.421 -9.993 1.00 0.42 H new ATOM 0 HA GLN A 32 -2.985 8.726 -11.606 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -0.548 9.366 -11.238 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -0.078 8.041 -12.284 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -2.061 10.155 -13.235 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -0.334 10.424 -13.356 1.00 1.19 H new ATOM 0 HE21 GLN A 32 -2.864 9.440 -15.221 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -2.039 8.287 -16.275 1.00 2.21 H new ATOM 456 N ASP A 33 -1.795 5.953 -12.943 1.00 0.49 N ATOM 457 CA ASP A 33 -2.073 4.957 -14.017 1.00 0.58 C ATOM 458 C ASP A 33 -3.536 4.526 -13.979 1.00 0.61 C ATOM 459 O ASP A 33 -4.189 4.420 -14.998 1.00 0.70 O ATOM 460 CB ASP A 33 -1.194 3.723 -13.792 1.00 0.61 C ATOM 461 CG ASP A 33 0.270 4.080 -14.055 1.00 1.10 C ATOM 462 OD1 ASP A 33 0.595 5.254 -13.983 1.00 1.78 O ATOM 463 OD2 ASP A 33 1.041 3.174 -14.325 1.00 1.89 O ATOM 0 H ASP A 33 -1.022 5.713 -12.323 1.00 0.49 H new ATOM 0 HA ASP A 33 -1.858 5.412 -14.984 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -1.313 3.361 -12.771 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -1.507 2.916 -14.455 1.00 0.61 H new ATOM 468 N ARG A 34 -4.049 4.240 -12.814 1.00 0.58 N ATOM 469 CA ARG A 34 -5.461 3.774 -12.717 1.00 0.71 C ATOM 470 C ARG A 34 -6.447 4.939 -12.681 1.00 0.65 C ATOM 471 O ARG A 34 -7.483 4.831 -13.312 1.00 0.85 O ATOM 472 CB ARG A 34 -5.654 2.891 -11.480 1.00 0.85 C ATOM 473 CG ARG A 34 -7.101 2.386 -11.423 1.00 1.25 C ATOM 474 CD ARG A 34 -7.255 1.399 -10.265 1.00 1.31 C ATOM 475 NE ARG A 34 -8.691 1.025 -10.122 1.00 1.58 N ATOM 476 CZ ARG A 34 -9.029 -0.004 -9.394 1.00 2.09 C ATOM 477 NH1 ARG A 34 -8.111 -0.699 -8.782 1.00 2.58 N ATOM 478 NH2 ARG A 34 -10.286 -0.336 -9.277 1.00 2.75 N ATOM 0 H ARG A 34 -3.552 4.309 -11.926 1.00 0.58 H new ATOM 0 HA ARG A 34 -5.667 3.189 -13.614 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -4.966 2.047 -11.514 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -5.421 3.457 -10.578 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -7.785 3.225 -11.292 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -7.365 1.903 -12.364 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -6.652 0.509 -10.448 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -6.890 1.846 -9.340 1.00 1.31 H new ATOM 0 HE ARG A 34 -9.410 1.574 -10.594 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -7.129 -0.438 -8.872 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -8.375 -1.503 -8.213 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -11.004 0.209 -9.755 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -10.550 -1.140 -8.708 1.00 2.75 H new ATOM 492 N ALA A 35 -6.219 6.046 -11.987 1.00 0.59 N ATOM 493 CA ALA A 35 -7.293 7.111 -12.027 1.00 0.66 C ATOM 494 C ALA A 35 -7.096 7.910 -13.320 1.00 0.80 C ATOM 495 O ALA A 35 -7.930 8.697 -13.718 1.00 0.88 O ATOM 496 CB ALA A 35 -7.229 8.002 -10.789 1.00 0.94 C ATOM 0 H ALA A 35 -5.391 6.251 -11.428 1.00 0.59 H new ATOM 0 HA ALA A 35 -8.285 6.659 -12.020 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -8.012 8.758 -10.844 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -7.374 7.394 -9.896 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -6.256 8.490 -10.742 1.00 0.94 H new ATOM 502 N GLY A 36 -5.996 7.675 -13.984 1.00 1.15 N ATOM 503 CA GLY A 36 -5.710 8.369 -15.273 1.00 1.62 C ATOM 504 C GLY A 36 -6.489 7.691 -16.401 1.00 1.54 C ATOM 505 O GLY A 36 -6.429 8.101 -17.543 1.00 2.10 O ATOM 0 H GLY A 36 -5.273 7.022 -13.683 1.00 1.15 H new ATOM 0 HA2 GLY A 36 -5.991 9.420 -15.203 1.00 1.62 H new ATOM 0 HA3 GLY A 36 -4.641 8.339 -15.485 1.00 1.62 H new ATOM 509 N ARG A 37 -7.243 6.669 -16.088 1.00 2.07 N ATOM 510 CA ARG A 37 -8.050 5.985 -17.142 1.00 2.87 C ATOM 511 C ARG A 37 -9.310 6.818 -17.386 1.00 3.46 C ATOM 512 O ARG A 37 -9.964 6.694 -18.403 1.00 4.10 O ATOM 513 CB ARG A 37 -8.438 4.580 -16.664 1.00 3.63 C ATOM 514 CG ARG A 37 -9.379 3.924 -17.689 1.00 4.34 C ATOM 515 CD ARG A 37 -9.610 2.438 -17.341 1.00 5.18 C ATOM 516 NE ARG A 37 -9.732 1.638 -18.601 1.00 5.74 N ATOM 517 CZ ARG A 37 -10.508 2.027 -19.579 1.00 6.53 C ATOM 518 NH1 ARG A 37 -11.313 3.042 -19.423 1.00 6.88 N ATOM 519 NH2 ARG A 37 -10.515 1.364 -20.703 1.00 7.21 N ATOM 0 H ARG A 37 -7.335 6.279 -15.150 1.00 2.07 H new ATOM 0 HA ARG A 37 -7.475 5.892 -18.063 1.00 2.87 H new ATOM 0 HB2 ARG A 37 -7.544 3.970 -16.534 1.00 3.63 H new ATOM 0 HB3 ARG A 37 -8.928 4.639 -15.692 1.00 3.63 H new ATOM 0 HG2 ARG A 37 -10.333 4.452 -17.705 1.00 4.34 H new ATOM 0 HG3 ARG A 37 -8.952 4.007 -18.688 1.00 4.34 H new ATOM 0 HD2 ARG A 37 -8.782 2.063 -16.739 1.00 5.18 H new ATOM 0 HD3 ARG A 37 -10.514 2.331 -16.742 1.00 5.18 H new ATOM 0 HE ARG A 37 -9.200 0.773 -18.698 1.00 5.74 H new ATOM 0 HH11 ARG A 37 -11.340 3.539 -18.533 1.00 6.88 H new ATOM 0 HH12 ARG A 37 -11.915 3.338 -20.191 1.00 6.88 H new ATOM 0 HH21 ARG A 37 -9.917 0.546 -20.816 1.00 7.21 H new ATOM 0 HH22 ARG A 37 -11.119 1.664 -21.468 1.00 7.21 H new ATOM 533 N MET A 38 -9.644 7.674 -16.461 1.00 3.74 N ATOM 534 CA MET A 38 -10.850 8.533 -16.627 1.00 4.68 C ATOM 535 C MET A 38 -10.796 9.242 -17.982 1.00 4.70 C ATOM 536 O MET A 38 -11.664 9.076 -18.816 1.00 5.17 O ATOM 537 CB MET A 38 -10.875 9.582 -15.512 1.00 5.62 C ATOM 538 CG MET A 38 -11.102 8.890 -14.166 1.00 5.93 C ATOM 539 SD MET A 38 -12.818 8.305 -14.072 1.00 6.79 S ATOM 540 CE MET A 38 -12.475 6.551 -13.774 1.00 7.04 C ATOM 0 H MET A 38 -9.130 7.816 -15.592 1.00 3.74 H new ATOM 0 HA MET A 38 -11.746 7.914 -16.577 1.00 4.68 H new ATOM 0 HB2 MET A 38 -9.935 10.133 -15.496 1.00 5.62 H new ATOM 0 HB3 MET A 38 -11.667 10.308 -15.698 1.00 5.62 H new ATOM 0 HG2 MET A 38 -10.414 8.052 -14.054 1.00 5.93 H new ATOM 0 HG3 MET A 38 -10.897 9.582 -13.349 1.00 5.93 H new ATOM 0 HE1 MET A 38 -13.415 6.007 -13.685 1.00 7.04 H new ATOM 0 HE2 MET A 38 -11.899 6.146 -14.606 1.00 7.04 H new ATOM 0 HE3 MET A 38 -11.904 6.443 -12.852 1.00 7.04 H new ATOM 550 N GLY A 39 -9.781 10.032 -18.206 1.00 4.57 N ATOM 551 CA GLY A 39 -9.668 10.754 -19.506 1.00 4.85 C ATOM 552 C GLY A 39 -8.402 11.612 -19.506 1.00 4.67 C ATOM 553 O GLY A 39 -7.683 11.668 -20.484 1.00 4.95 O ATOM 0 H GLY A 39 -9.025 10.209 -17.545 1.00 4.57 H new ATOM 0 HA2 GLY A 39 -9.636 10.040 -20.329 1.00 4.85 H new ATOM 0 HA3 GLY A 39 -10.545 11.382 -19.663 1.00 4.85 H new ATOM 557 N GLY A 40 -8.115 12.275 -18.420 1.00 4.58 N ATOM 558 CA GLY A 40 -6.887 13.120 -18.368 1.00 4.69 C ATOM 559 C GLY A 40 -6.809 13.831 -17.017 1.00 4.20 C ATOM 560 O GLY A 40 -7.030 15.022 -16.918 1.00 4.34 O ATOM 0 H GLY A 40 -8.676 12.269 -17.568 1.00 4.58 H new ATOM 0 HA2 GLY A 40 -6.002 12.502 -18.516 1.00 4.69 H new ATOM 0 HA3 GLY A 40 -6.903 13.852 -19.175 1.00 4.69 H new ATOM 564 N GLU A 41 -6.496 13.111 -15.971 1.00 4.01 N ATOM 565 CA GLU A 41 -6.404 13.745 -14.623 1.00 3.88 C ATOM 566 C GLU A 41 -4.989 14.302 -14.418 1.00 3.63 C ATOM 567 O GLU A 41 -4.590 14.613 -13.314 1.00 4.16 O ATOM 568 CB GLU A 41 -6.718 12.693 -13.547 1.00 4.26 C ATOM 569 CG GLU A 41 -7.182 13.382 -12.259 1.00 4.51 C ATOM 570 CD GLU A 41 -8.587 13.955 -12.461 1.00 4.90 C ATOM 571 OE1 GLU A 41 -9.503 13.173 -12.657 1.00 5.28 O ATOM 572 OE2 GLU A 41 -8.723 15.166 -12.414 1.00 5.19 O ATOM 0 H GLU A 41 -6.300 12.110 -15.993 1.00 4.01 H new ATOM 0 HA GLU A 41 -7.122 14.561 -14.547 1.00 3.88 H new ATOM 0 HB2 GLU A 41 -7.492 12.014 -13.905 1.00 4.26 H new ATOM 0 HB3 GLU A 41 -5.833 12.089 -13.348 1.00 4.26 H new ATOM 0 HG2 GLU A 41 -7.184 12.670 -11.434 1.00 4.51 H new ATOM 0 HG3 GLU A 41 -6.488 14.179 -11.991 1.00 4.51 H new ATOM 579 N ALA A 42 -4.228 14.418 -15.479 1.00 3.19 N ATOM 580 CA ALA A 42 -2.834 14.946 -15.361 1.00 3.24 C ATOM 581 C ALA A 42 -2.787 16.149 -14.387 1.00 2.77 C ATOM 582 O ALA A 42 -2.021 16.117 -13.445 1.00 3.06 O ATOM 583 CB ALA A 42 -2.313 15.365 -16.756 1.00 4.08 C ATOM 0 H ALA A 42 -4.514 14.168 -16.426 1.00 3.19 H new ATOM 0 HA ALA A 42 -2.194 14.159 -14.962 1.00 3.24 H new ATOM 0 HB1 ALA A 42 -1.297 15.749 -16.665 1.00 4.08 H new ATOM 0 HB2 ALA A 42 -2.316 14.501 -17.420 1.00 4.08 H new ATOM 0 HB3 ALA A 42 -2.959 16.141 -17.167 1.00 4.08 H new ATOM 589 N PRO A 43 -3.580 17.184 -14.626 1.00 2.70 N ATOM 590 CA PRO A 43 -3.568 18.360 -13.734 1.00 3.03 C ATOM 591 C PRO A 43 -3.929 17.944 -12.295 1.00 2.67 C ATOM 592 O PRO A 43 -5.021 18.182 -11.818 1.00 2.87 O ATOM 593 CB PRO A 43 -4.612 19.332 -14.334 1.00 3.84 C ATOM 594 CG PRO A 43 -5.250 18.633 -15.567 1.00 3.86 C ATOM 595 CD PRO A 43 -4.531 17.283 -15.764 1.00 3.12 C ATOM 0 HA PRO A 43 -2.586 18.830 -13.672 1.00 3.03 H new ATOM 0 HB2 PRO A 43 -5.375 19.578 -13.596 1.00 3.84 H new ATOM 0 HB3 PRO A 43 -4.139 20.269 -14.627 1.00 3.84 H new ATOM 0 HG2 PRO A 43 -6.317 18.478 -15.409 1.00 3.86 H new ATOM 0 HG3 PRO A 43 -5.146 19.255 -16.456 1.00 3.86 H new ATOM 0 HD2 PRO A 43 -5.239 16.454 -15.760 1.00 3.12 H new ATOM 0 HD3 PRO A 43 -4.008 17.250 -16.720 1.00 3.12 H new ATOM 603 N GLU A 44 -3.011 17.331 -11.600 1.00 2.45 N ATOM 604 CA GLU A 44 -3.290 16.911 -10.200 1.00 2.23 C ATOM 605 C GLU A 44 -1.994 16.401 -9.569 1.00 1.75 C ATOM 606 O GLU A 44 -1.451 17.008 -8.666 1.00 2.00 O ATOM 607 CB GLU A 44 -4.345 15.795 -10.197 1.00 2.55 C ATOM 608 CG GLU A 44 -4.560 15.270 -8.772 1.00 2.70 C ATOM 609 CD GLU A 44 -4.954 16.422 -7.845 1.00 3.17 C ATOM 610 OE1 GLU A 44 -5.593 17.347 -8.318 1.00 3.42 O ATOM 611 OE2 GLU A 44 -4.609 16.359 -6.676 1.00 3.77 O ATOM 0 H GLU A 44 -2.078 17.103 -11.943 1.00 2.45 H new ATOM 0 HA GLU A 44 -3.669 17.758 -9.627 1.00 2.23 H new ATOM 0 HB2 GLU A 44 -5.285 16.173 -10.598 1.00 2.55 H new ATOM 0 HB3 GLU A 44 -4.025 14.981 -10.847 1.00 2.55 H new ATOM 0 HG2 GLU A 44 -5.339 14.508 -8.770 1.00 2.70 H new ATOM 0 HG3 GLU A 44 -3.648 14.795 -8.409 1.00 2.70 H new ATOM 618 N LEU A 45 -1.494 15.289 -10.035 1.00 1.80 N ATOM 619 CA LEU A 45 -0.235 14.741 -9.458 1.00 1.80 C ATOM 620 C LEU A 45 0.967 15.505 -10.017 1.00 2.29 C ATOM 621 O LEU A 45 1.957 14.923 -10.412 1.00 3.01 O ATOM 622 CB LEU A 45 -0.112 13.253 -9.810 1.00 2.23 C ATOM 623 CG LEU A 45 -1.393 12.492 -9.363 1.00 2.52 C ATOM 624 CD1 LEU A 45 -2.275 12.181 -10.579 1.00 3.22 C ATOM 625 CD2 LEU A 45 -1.010 11.174 -8.675 1.00 3.00 C ATOM 0 H LEU A 45 -1.903 14.737 -10.789 1.00 1.80 H new ATOM 0 HA LEU A 45 -0.258 14.854 -8.374 1.00 1.80 H new ATOM 0 HB2 LEU A 45 0.034 13.136 -10.884 1.00 2.23 H new ATOM 0 HB3 LEU A 45 0.764 12.826 -9.321 1.00 2.23 H new ATOM 0 HG LEU A 45 -1.943 13.124 -8.665 1.00 2.52 H new ATOM 0 HD11 LEU A 45 -3.169 11.648 -10.254 1.00 3.22 H new ATOM 0 HD12 LEU A 45 -2.565 13.112 -11.066 1.00 3.22 H new ATOM 0 HD13 LEU A 45 -1.719 11.561 -11.283 1.00 3.22 H new ATOM 0 HD21 LEU A 45 -1.914 10.649 -8.366 1.00 3.00 H new ATOM 0 HD22 LEU A 45 -0.448 10.551 -9.370 1.00 3.00 H new ATOM 0 HD23 LEU A 45 -0.396 11.386 -7.800 1.00 3.00 H new ATOM 637 N ALA A 46 0.894 16.807 -10.029 1.00 2.46 N ATOM 638 CA ALA A 46 2.036 17.620 -10.536 1.00 3.15 C ATOM 639 C ALA A 46 3.198 17.490 -9.547 1.00 2.91 C ATOM 640 O ALA A 46 3.456 18.389 -8.771 1.00 3.07 O ATOM 641 CB ALA A 46 1.626 19.092 -10.585 1.00 4.05 C ATOM 0 H ALA A 46 0.089 17.346 -9.708 1.00 2.46 H new ATOM 0 HA ALA A 46 2.323 17.274 -11.529 1.00 3.15 H new ATOM 0 HB1 ALA A 46 2.459 19.690 -10.955 1.00 4.05 H new ATOM 0 HB2 ALA A 46 0.771 19.210 -11.251 1.00 4.05 H new ATOM 0 HB3 ALA A 46 1.355 19.428 -9.584 1.00 4.05 H new ATOM 647 N LEU A 47 3.890 16.385 -9.538 1.00 3.18 N ATOM 648 CA LEU A 47 5.005 16.239 -8.560 1.00 3.43 C ATOM 649 C LEU A 47 5.871 15.020 -8.905 1.00 3.14 C ATOM 650 O LEU A 47 6.363 14.343 -8.024 1.00 3.51 O ATOM 651 CB LEU A 47 4.390 16.057 -7.149 1.00 4.05 C ATOM 652 CG LEU A 47 5.212 16.825 -6.098 1.00 4.77 C ATOM 653 CD1 LEU A 47 4.513 16.746 -4.742 1.00 5.26 C ATOM 654 CD2 LEU A 47 6.608 16.207 -5.990 1.00 5.35 C ATOM 0 H LEU A 47 3.736 15.588 -10.155 1.00 3.18 H new ATOM 0 HA LEU A 47 5.638 17.126 -8.592 1.00 3.43 H new ATOM 0 HB2 LEU A 47 3.360 16.415 -7.146 1.00 4.05 H new ATOM 0 HB3 LEU A 47 4.360 14.998 -6.893 1.00 4.05 H new ATOM 0 HG LEU A 47 5.299 17.869 -6.399 1.00 4.77 H new ATOM 0 HD11 LEU A 47 5.097 17.290 -4.000 1.00 5.26 H new ATOM 0 HD12 LEU A 47 3.520 17.188 -4.818 1.00 5.26 H new ATOM 0 HD13 LEU A 47 4.423 15.703 -4.439 1.00 5.26 H new ATOM 0 HD21 LEU A 47 7.190 16.751 -5.246 1.00 5.35 H new ATOM 0 HD22 LEU A 47 6.521 15.163 -5.691 1.00 5.35 H new ATOM 0 HD23 LEU A 47 7.108 16.267 -6.957 1.00 5.35 H new ATOM 666 N ASP A 48 6.059 14.718 -10.163 1.00 3.02 N ATOM 667 CA ASP A 48 6.892 13.527 -10.505 1.00 3.07 C ATOM 668 C ASP A 48 7.498 13.665 -11.927 1.00 2.77 C ATOM 669 O ASP A 48 7.073 13.006 -12.851 1.00 2.85 O ATOM 670 CB ASP A 48 6.025 12.251 -10.381 1.00 3.61 C ATOM 671 CG ASP A 48 5.208 11.994 -11.653 1.00 4.22 C ATOM 672 OD1 ASP A 48 4.410 12.848 -12.002 1.00 4.68 O ATOM 673 OD2 ASP A 48 5.402 10.953 -12.259 1.00 4.69 O ATOM 0 H ASP A 48 5.679 15.234 -10.957 1.00 3.02 H new ATOM 0 HA ASP A 48 7.727 13.456 -9.808 1.00 3.07 H new ATOM 0 HB2 ASP A 48 6.667 11.393 -10.181 1.00 3.61 H new ATOM 0 HB3 ASP A 48 5.351 12.350 -9.530 1.00 3.61 H new ATOM 678 N PRO A 49 8.496 14.513 -12.069 1.00 3.11 N ATOM 679 CA PRO A 49 9.161 14.702 -13.379 1.00 3.40 C ATOM 680 C PRO A 49 9.900 13.398 -13.740 1.00 3.08 C ATOM 681 O PRO A 49 11.067 13.384 -14.076 1.00 3.32 O ATOM 682 CB PRO A 49 10.150 15.875 -13.145 1.00 4.36 C ATOM 683 CG PRO A 49 10.058 16.278 -11.642 1.00 4.66 C ATOM 684 CD PRO A 49 9.031 15.343 -10.968 1.00 3.86 C ATOM 0 HA PRO A 49 8.478 14.925 -14.199 1.00 3.40 H new ATOM 0 HB2 PRO A 49 11.167 15.575 -13.399 1.00 4.36 H new ATOM 0 HB3 PRO A 49 9.898 16.721 -13.784 1.00 4.36 H new ATOM 0 HG2 PRO A 49 11.032 16.187 -11.161 1.00 4.66 H new ATOM 0 HG3 PRO A 49 9.750 17.319 -11.543 1.00 4.66 H new ATOM 0 HD2 PRO A 49 9.500 14.727 -10.201 1.00 3.86 H new ATOM 0 HD3 PRO A 49 8.239 15.911 -10.480 1.00 3.86 H new ATOM 692 N VAL A 50 9.186 12.310 -13.711 1.00 3.08 N ATOM 693 CA VAL A 50 9.762 10.987 -14.071 1.00 3.10 C ATOM 694 C VAL A 50 8.648 10.144 -14.756 1.00 2.75 C ATOM 695 O VAL A 50 7.658 9.835 -14.124 1.00 2.91 O ATOM 696 CB VAL A 50 10.246 10.269 -12.804 1.00 3.88 C ATOM 697 CG1 VAL A 50 11.646 10.768 -12.440 1.00 4.44 C ATOM 698 CG2 VAL A 50 9.291 10.562 -11.645 1.00 4.50 C ATOM 0 H VAL A 50 8.201 12.282 -13.446 1.00 3.08 H new ATOM 0 HA VAL A 50 10.609 11.116 -14.745 1.00 3.10 H new ATOM 0 HB VAL A 50 10.273 9.195 -12.989 1.00 3.88 H new ATOM 0 HG11 VAL A 50 11.991 10.259 -11.540 1.00 4.44 H new ATOM 0 HG12 VAL A 50 12.332 10.559 -13.261 1.00 4.44 H new ATOM 0 HG13 VAL A 50 11.614 11.842 -12.259 1.00 4.44 H new ATOM 0 HG21 VAL A 50 9.639 10.050 -10.748 1.00 4.50 H new ATOM 0 HG22 VAL A 50 9.261 11.636 -11.461 1.00 4.50 H new ATOM 0 HG23 VAL A 50 8.291 10.209 -11.899 1.00 4.50 H new ATOM 708 N PRO A 51 8.810 9.801 -16.037 1.00 2.91 N ATOM 709 CA PRO A 51 7.780 9.020 -16.753 1.00 3.22 C ATOM 710 C PRO A 51 7.577 7.648 -16.097 1.00 2.93 C ATOM 711 O PRO A 51 6.566 7.395 -15.476 1.00 3.37 O ATOM 712 CB PRO A 51 8.315 8.866 -18.198 1.00 4.09 C ATOM 713 CG PRO A 51 9.711 9.545 -18.256 1.00 4.27 C ATOM 714 CD PRO A 51 9.993 10.148 -16.868 1.00 3.50 C ATOM 0 HA PRO A 51 6.810 9.516 -16.731 1.00 3.22 H new ATOM 0 HB2 PRO A 51 8.390 7.813 -18.469 1.00 4.09 H new ATOM 0 HB3 PRO A 51 7.633 9.330 -18.910 1.00 4.09 H new ATOM 0 HG2 PRO A 51 10.479 8.819 -18.521 1.00 4.27 H new ATOM 0 HG3 PRO A 51 9.728 10.321 -19.021 1.00 4.27 H new ATOM 0 HD2 PRO A 51 10.907 9.737 -16.440 1.00 3.50 H new ATOM 0 HD3 PRO A 51 10.127 11.228 -16.929 1.00 3.50 H new ATOM 722 N GLN A 52 8.537 6.768 -16.229 1.00 2.70 N ATOM 723 CA GLN A 52 8.392 5.419 -15.615 1.00 2.85 C ATOM 724 C GLN A 52 9.692 4.620 -15.767 1.00 2.14 C ATOM 725 O GLN A 52 10.281 4.558 -16.828 1.00 2.38 O ATOM 726 CB GLN A 52 7.256 4.663 -16.314 1.00 3.67 C ATOM 727 CG GLN A 52 7.084 3.289 -15.667 1.00 4.37 C ATOM 728 CD GLN A 52 5.827 2.615 -16.223 1.00 5.22 C ATOM 729 OE1 GLN A 52 4.994 2.147 -15.473 1.00 5.74 O ATOM 730 NE2 GLN A 52 5.654 2.546 -17.515 1.00 5.74 N ATOM 0 H GLN A 52 9.409 6.926 -16.733 1.00 2.70 H new ATOM 0 HA GLN A 52 8.168 5.538 -14.555 1.00 2.85 H new ATOM 0 HB2 GLN A 52 6.328 5.230 -16.240 1.00 3.67 H new ATOM 0 HB3 GLN A 52 7.478 4.552 -17.375 1.00 3.67 H new ATOM 0 HG2 GLN A 52 7.959 2.670 -15.865 1.00 4.37 H new ATOM 0 HG3 GLN A 52 7.005 3.392 -14.585 1.00 4.37 H new ATOM 0 HE21 GLN A 52 6.353 2.939 -18.145 1.00 5.74 H new ATOM 0 HE22 GLN A 52 4.819 2.099 -17.895 1.00 5.74 H new ATOM 739 N ASP A 53 10.121 3.990 -14.709 1.00 1.78 N ATOM 740 CA ASP A 53 11.362 3.158 -14.751 1.00 1.30 C ATOM 741 C ASP A 53 10.972 1.691 -14.959 1.00 1.07 C ATOM 742 O ASP A 53 9.917 1.246 -14.554 1.00 1.19 O ATOM 743 CB ASP A 53 12.127 3.302 -13.434 1.00 1.65 C ATOM 744 CG ASP A 53 12.311 4.784 -13.108 1.00 2.27 C ATOM 745 OD1 ASP A 53 11.355 5.395 -12.659 1.00 2.91 O ATOM 746 OD2 ASP A 53 13.405 5.284 -13.313 1.00 2.80 O ATOM 0 H ASP A 53 9.658 4.016 -13.801 1.00 1.78 H new ATOM 0 HA ASP A 53 11.998 3.492 -15.571 1.00 1.30 H new ATOM 0 HB2 ASP A 53 11.583 2.807 -12.630 1.00 1.65 H new ATOM 0 HB3 ASP A 53 13.098 2.813 -13.510 1.00 1.65 H new ATOM 751 N ALA A 54 11.822 0.947 -15.624 1.00 0.91 N ATOM 752 CA ALA A 54 11.522 -0.487 -15.907 1.00 0.84 C ATOM 753 C ALA A 54 11.350 -1.264 -14.603 1.00 0.76 C ATOM 754 O ALA A 54 10.517 -2.142 -14.502 1.00 0.75 O ATOM 755 CB ALA A 54 12.673 -1.096 -16.711 1.00 0.95 C ATOM 0 H ALA A 54 12.717 1.277 -15.985 1.00 0.91 H new ATOM 0 HA ALA A 54 10.595 -0.547 -16.478 1.00 0.84 H new ATOM 0 HB1 ALA A 54 12.457 -2.144 -16.919 1.00 0.95 H new ATOM 0 HB2 ALA A 54 12.787 -0.555 -17.650 1.00 0.95 H new ATOM 0 HB3 ALA A 54 13.596 -1.023 -16.137 1.00 0.95 H new ATOM 761 N SER A 55 12.113 -0.943 -13.596 1.00 0.75 N ATOM 762 CA SER A 55 11.969 -1.663 -12.300 1.00 0.71 C ATOM 763 C SER A 55 10.580 -1.382 -11.733 1.00 0.66 C ATOM 764 O SER A 55 9.894 -2.267 -11.260 1.00 0.66 O ATOM 765 CB SER A 55 13.027 -1.158 -11.318 1.00 0.76 C ATOM 766 OG SER A 55 14.321 -1.451 -11.829 1.00 1.37 O ATOM 0 H SER A 55 12.828 -0.216 -13.614 1.00 0.75 H new ATOM 0 HA SER A 55 12.099 -2.734 -12.454 1.00 0.71 H new ATOM 0 HB2 SER A 55 12.917 -0.084 -11.168 1.00 0.76 H new ATOM 0 HB3 SER A 55 12.892 -1.631 -10.345 1.00 0.76 H new ATOM 0 HG SER A 55 15.001 -1.127 -11.202 1.00 1.37 H new ATOM 772 N THR A 56 10.168 -0.147 -11.771 1.00 0.65 N ATOM 773 CA THR A 56 8.833 0.215 -11.228 1.00 0.62 C ATOM 774 C THR A 56 7.732 -0.181 -12.217 1.00 0.59 C ATOM 775 O THR A 56 6.581 -0.306 -11.850 1.00 0.57 O ATOM 776 CB THR A 56 8.767 1.731 -11.015 1.00 0.67 C ATOM 777 OG1 THR A 56 9.239 2.388 -12.182 1.00 1.09 O ATOM 778 CG2 THR A 56 9.626 2.146 -9.819 1.00 1.06 C ATOM 0 H THR A 56 10.703 0.631 -12.157 1.00 0.65 H new ATOM 0 HA THR A 56 8.685 -0.312 -10.285 1.00 0.62 H new ATOM 0 HB THR A 56 7.733 2.013 -10.817 1.00 0.67 H new ATOM 0 HG1 THR A 56 9.299 1.744 -12.918 1.00 1.09 H new ATOM 0 HG21 THR A 56 9.565 3.226 -9.685 1.00 1.06 H new ATOM 0 HG22 THR A 56 9.263 1.648 -8.920 1.00 1.06 H new ATOM 0 HG23 THR A 56 10.662 1.860 -9.999 1.00 1.06 H new ATOM 786 N LYS A 57 8.058 -0.350 -13.473 1.00 0.61 N ATOM 787 CA LYS A 57 6.994 -0.698 -14.459 1.00 0.59 C ATOM 788 C LYS A 57 6.455 -2.100 -14.169 1.00 0.54 C ATOM 789 O LYS A 57 5.263 -2.334 -14.208 1.00 0.52 O ATOM 790 CB LYS A 57 7.561 -0.624 -15.882 1.00 0.65 C ATOM 791 CG LYS A 57 6.500 -1.058 -16.911 1.00 1.20 C ATOM 792 CD LYS A 57 6.401 -2.608 -17.006 1.00 1.33 C ATOM 793 CE LYS A 57 6.316 -3.041 -18.475 1.00 1.94 C ATOM 794 NZ LYS A 57 6.101 -4.512 -18.548 1.00 2.73 N ATOM 0 H LYS A 57 9.000 -0.264 -13.853 1.00 0.61 H new ATOM 0 HA LYS A 57 6.174 0.015 -14.372 1.00 0.59 H new ATOM 0 HB2 LYS A 57 7.889 0.393 -16.096 1.00 0.65 H new ATOM 0 HB3 LYS A 57 8.438 -1.265 -15.964 1.00 0.65 H new ATOM 0 HG2 LYS A 57 5.530 -0.647 -16.631 1.00 1.20 H new ATOM 0 HG3 LYS A 57 6.750 -0.647 -17.889 1.00 1.20 H new ATOM 0 HD2 LYS A 57 7.270 -3.065 -16.534 1.00 1.33 H new ATOM 0 HD3 LYS A 57 5.522 -2.958 -16.464 1.00 1.33 H new ATOM 0 HE2 LYS A 57 5.499 -2.518 -18.972 1.00 1.94 H new ATOM 0 HE3 LYS A 57 7.233 -2.770 -18.998 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 6.043 -4.805 -19.544 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 6.895 -5.002 -18.088 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 5.214 -4.758 -18.063 1.00 2.73 H new ATOM 808 N LYS A 58 7.313 -3.034 -13.869 1.00 0.55 N ATOM 809 CA LYS A 58 6.825 -4.410 -13.570 1.00 0.53 C ATOM 810 C LYS A 58 6.156 -4.394 -12.188 1.00 0.48 C ATOM 811 O LYS A 58 5.128 -5.012 -11.978 1.00 0.46 O ATOM 812 CB LYS A 58 8.015 -5.389 -13.591 1.00 0.56 C ATOM 813 CG LYS A 58 7.567 -6.768 -14.095 1.00 0.78 C ATOM 814 CD LYS A 58 6.460 -7.319 -13.190 1.00 0.96 C ATOM 815 CE LYS A 58 6.311 -8.826 -13.420 1.00 0.85 C ATOM 816 NZ LYS A 58 6.243 -9.102 -14.883 1.00 1.75 N ATOM 0 H LYS A 58 8.324 -2.907 -13.818 1.00 0.55 H new ATOM 0 HA LYS A 58 6.101 -4.735 -14.317 1.00 0.53 H new ATOM 0 HB2 LYS A 58 8.804 -4.999 -14.234 1.00 0.56 H new ATOM 0 HB3 LYS A 58 8.436 -5.480 -12.590 1.00 0.56 H new ATOM 0 HG2 LYS A 58 7.206 -6.690 -15.120 1.00 0.78 H new ATOM 0 HG3 LYS A 58 8.414 -7.454 -14.107 1.00 0.78 H new ATOM 0 HD2 LYS A 58 6.699 -7.122 -12.145 1.00 0.96 H new ATOM 0 HD3 LYS A 58 5.518 -6.814 -13.402 1.00 0.96 H new ATOM 0 HE2 LYS A 58 7.154 -9.357 -12.978 1.00 0.85 H new ATOM 0 HE3 LYS A 58 5.410 -9.192 -12.928 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 5.844 -10.050 -15.039 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 5.638 -8.392 -15.342 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 7.199 -9.057 -15.290 1.00 1.75 H new ATOM 830 N LEU A 59 6.732 -3.704 -11.242 1.00 0.50 N ATOM 831 CA LEU A 59 6.121 -3.674 -9.883 1.00 0.47 C ATOM 832 C LEU A 59 4.782 -2.919 -9.954 1.00 0.43 C ATOM 833 O LEU A 59 3.884 -3.146 -9.167 1.00 0.42 O ATOM 834 CB LEU A 59 7.092 -2.974 -8.901 1.00 0.53 C ATOM 835 CG LEU A 59 7.455 -3.888 -7.722 1.00 0.71 C ATOM 836 CD1 LEU A 59 8.608 -3.247 -6.945 1.00 1.07 C ATOM 837 CD2 LEU A 59 6.250 -4.020 -6.787 1.00 1.34 C ATOM 0 H LEU A 59 7.591 -3.165 -11.349 1.00 0.50 H new ATOM 0 HA LEU A 59 5.938 -4.688 -9.527 1.00 0.47 H new ATOM 0 HB2 LEU A 59 7.999 -2.683 -9.430 1.00 0.53 H new ATOM 0 HB3 LEU A 59 6.635 -2.059 -8.526 1.00 0.53 H new ATOM 0 HG LEU A 59 7.742 -4.872 -8.093 1.00 0.71 H new ATOM 0 HD11 LEU A 59 8.878 -3.884 -6.103 1.00 1.07 H new ATOM 0 HD12 LEU A 59 9.469 -3.130 -7.603 1.00 1.07 H new ATOM 0 HD13 LEU A 59 8.298 -2.270 -6.575 1.00 1.07 H new ATOM 0 HD21 LEU A 59 6.508 -4.669 -5.950 1.00 1.34 H new ATOM 0 HD22 LEU A 59 5.972 -3.036 -6.410 1.00 1.34 H new ATOM 0 HD23 LEU A 59 5.411 -4.450 -7.334 1.00 1.34 H new ATOM 849 N SER A 60 4.639 -2.045 -10.915 1.00 0.43 N ATOM 850 CA SER A 60 3.356 -1.300 -11.062 1.00 0.42 C ATOM 851 C SER A 60 2.301 -2.260 -11.610 1.00 0.39 C ATOM 852 O SER A 60 1.126 -2.128 -11.326 1.00 0.41 O ATOM 853 CB SER A 60 3.546 -0.145 -12.048 1.00 0.47 C ATOM 854 OG SER A 60 3.823 -0.666 -13.340 1.00 1.36 O ATOM 0 H SER A 60 5.355 -1.815 -11.604 1.00 0.43 H new ATOM 0 HA SER A 60 3.042 -0.902 -10.097 1.00 0.42 H new ATOM 0 HB2 SER A 60 2.649 0.473 -12.078 1.00 0.47 H new ATOM 0 HB3 SER A 60 4.364 0.497 -11.720 1.00 0.47 H new ATOM 0 HG SER A 60 4.325 -1.504 -13.254 1.00 1.36 H new ATOM 860 N GLU A 61 2.704 -3.223 -12.394 1.00 0.38 N ATOM 861 CA GLU A 61 1.712 -4.184 -12.954 1.00 0.38 C ATOM 862 C GLU A 61 1.206 -5.086 -11.827 1.00 0.38 C ATOM 863 O GLU A 61 0.097 -5.580 -11.869 1.00 0.41 O ATOM 864 CB GLU A 61 2.363 -5.022 -14.056 1.00 0.39 C ATOM 865 CG GLU A 61 1.374 -6.072 -14.565 1.00 1.06 C ATOM 866 CD GLU A 61 1.952 -6.752 -15.807 1.00 1.67 C ATOM 867 OE1 GLU A 61 3.135 -7.052 -15.798 1.00 2.25 O ATOM 868 OE2 GLU A 61 1.203 -6.962 -16.747 1.00 2.40 O ATOM 0 H GLU A 61 3.673 -3.385 -12.670 1.00 0.38 H new ATOM 0 HA GLU A 61 0.873 -3.640 -13.387 1.00 0.38 H new ATOM 0 HB2 GLU A 61 2.677 -4.378 -14.877 1.00 0.39 H new ATOM 0 HB3 GLU A 61 3.259 -5.510 -13.673 1.00 0.39 H new ATOM 0 HG2 GLU A 61 1.180 -6.812 -13.788 1.00 1.06 H new ATOM 0 HG3 GLU A 61 0.419 -5.603 -14.804 1.00 1.06 H new ATOM 875 N CYS A 62 1.989 -5.275 -10.801 1.00 0.37 N ATOM 876 CA CYS A 62 1.517 -6.113 -9.664 1.00 0.39 C ATOM 877 C CYS A 62 0.388 -5.359 -8.956 1.00 0.38 C ATOM 878 O CYS A 62 -0.638 -5.919 -8.623 1.00 0.44 O ATOM 879 CB CYS A 62 2.668 -6.352 -8.685 1.00 0.41 C ATOM 880 SG CYS A 62 3.967 -7.308 -9.505 1.00 1.62 S ATOM 0 H CYS A 62 2.928 -4.889 -10.701 1.00 0.37 H new ATOM 0 HA CYS A 62 1.161 -7.077 -10.027 1.00 0.39 H new ATOM 0 HB2 CYS A 62 3.067 -5.399 -8.337 1.00 0.41 H new ATOM 0 HB3 CYS A 62 2.307 -6.887 -7.806 1.00 0.41 H new ATOM 0 HG CYS A 62 4.483 -6.602 -10.467 1.00 1.62 H new ATOM 886 N LEU A 63 0.563 -4.081 -8.758 1.00 0.35 N ATOM 887 CA LEU A 63 -0.500 -3.260 -8.109 1.00 0.36 C ATOM 888 C LEU A 63 -1.699 -3.149 -9.058 1.00 0.36 C ATOM 889 O LEU A 63 -2.828 -3.006 -8.632 1.00 0.41 O ATOM 890 CB LEU A 63 0.058 -1.863 -7.821 1.00 0.38 C ATOM 891 CG LEU A 63 1.271 -1.971 -6.882 1.00 0.69 C ATOM 892 CD1 LEU A 63 1.890 -0.582 -6.697 1.00 1.39 C ATOM 893 CD2 LEU A 63 0.829 -2.509 -5.507 1.00 1.11 C ATOM 0 H LEU A 63 1.403 -3.566 -9.020 1.00 0.35 H new ATOM 0 HA LEU A 63 -0.817 -3.727 -7.177 1.00 0.36 H new ATOM 0 HB2 LEU A 63 0.350 -1.379 -8.753 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -0.712 -1.240 -7.365 1.00 0.38 H new ATOM 0 HG LEU A 63 2.000 -2.653 -7.319 1.00 0.69 H new ATOM 0 HD11 LEU A 63 2.751 -0.653 -6.032 1.00 1.39 H new ATOM 0 HD12 LEU A 63 2.210 -0.194 -7.664 1.00 1.39 H new ATOM 0 HD13 LEU A 63 1.151 0.091 -6.263 1.00 1.39 H new ATOM 0 HD21 LEU A 63 1.695 -2.582 -4.849 1.00 1.11 H new ATOM 0 HD22 LEU A 63 0.097 -1.831 -5.069 1.00 1.11 H new ATOM 0 HD23 LEU A 63 0.382 -3.496 -5.629 1.00 1.11 H new ATOM 905 N LYS A 64 -1.459 -3.200 -10.339 1.00 0.35 N ATOM 906 CA LYS A 64 -2.582 -3.087 -11.315 1.00 0.37 C ATOM 907 C LYS A 64 -3.336 -4.420 -11.402 1.00 0.39 C ATOM 908 O LYS A 64 -4.550 -4.456 -11.446 1.00 0.43 O ATOM 909 CB LYS A 64 -2.020 -2.731 -12.698 1.00 0.38 C ATOM 910 CG LYS A 64 -3.164 -2.316 -13.653 1.00 0.82 C ATOM 911 CD LYS A 64 -3.321 -0.790 -13.661 1.00 1.35 C ATOM 912 CE LYS A 64 -4.478 -0.400 -14.583 1.00 1.38 C ATOM 913 NZ LYS A 64 -4.472 1.075 -14.791 1.00 2.09 N ATOM 0 H LYS A 64 -0.534 -3.315 -10.753 1.00 0.35 H new ATOM 0 HA LYS A 64 -3.268 -2.308 -10.983 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -1.300 -1.917 -12.607 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -1.484 -3.586 -13.111 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -2.953 -2.672 -14.661 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -4.097 -2.783 -13.339 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -3.510 -0.428 -12.650 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -2.398 -0.321 -14.000 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -4.383 -0.913 -15.540 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -5.426 -0.713 -14.146 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -5.400 1.379 -15.148 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -4.275 1.552 -13.888 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -3.736 1.325 -15.482 1.00 2.09 H new ATOM 927 N ARG A 65 -2.624 -5.512 -11.448 1.00 0.43 N ATOM 928 CA ARG A 65 -3.293 -6.843 -11.555 1.00 0.47 C ATOM 929 C ARG A 65 -4.099 -7.150 -10.287 1.00 0.50 C ATOM 930 O ARG A 65 -5.171 -7.717 -10.355 1.00 0.54 O ATOM 931 CB ARG A 65 -2.227 -7.940 -11.761 1.00 0.45 C ATOM 932 CG ARG A 65 -1.834 -8.038 -13.246 1.00 0.94 C ATOM 933 CD ARG A 65 -1.156 -9.386 -13.509 1.00 1.55 C ATOM 934 NE ARG A 65 -0.445 -9.350 -14.829 1.00 1.86 N ATOM 935 CZ ARG A 65 -1.066 -9.018 -15.932 1.00 2.39 C ATOM 936 NH1 ARG A 65 -2.366 -8.910 -15.956 1.00 2.94 N ATOM 937 NH2 ARG A 65 -0.386 -8.856 -17.033 1.00 2.92 N ATOM 0 H ARG A 65 -1.605 -5.542 -11.416 1.00 0.43 H new ATOM 0 HA ARG A 65 -3.974 -6.821 -12.405 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -1.346 -7.717 -11.160 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -2.613 -8.900 -11.417 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -2.719 -7.935 -13.874 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -1.160 -7.223 -13.509 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -0.448 -9.609 -12.711 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -1.899 -10.183 -13.508 1.00 1.55 H new ATOM 0 HE ARG A 65 0.546 -9.590 -14.868 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -2.908 -9.085 -15.110 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -2.840 -8.651 -16.821 1.00 2.94 H new ATOM 0 HH21 ARG A 65 0.625 -8.988 -17.032 1.00 2.92 H new ATOM 0 HH22 ARG A 65 -0.866 -8.597 -17.895 1.00 2.92 H new ATOM 951 N ILE A 66 -3.607 -6.789 -9.133 1.00 0.49 N ATOM 952 CA ILE A 66 -4.376 -7.084 -7.889 1.00 0.53 C ATOM 953 C ILE A 66 -5.522 -6.077 -7.762 1.00 0.54 C ATOM 954 O ILE A 66 -6.607 -6.403 -7.331 1.00 0.60 O ATOM 955 CB ILE A 66 -3.443 -6.972 -6.672 1.00 0.52 C ATOM 956 CG1 ILE A 66 -2.499 -8.179 -6.634 1.00 1.22 C ATOM 957 CG2 ILE A 66 -4.261 -6.925 -5.374 1.00 1.29 C ATOM 958 CD1 ILE A 66 -1.362 -7.930 -5.631 1.00 1.25 C ATOM 0 H ILE A 66 -2.717 -6.309 -8.997 1.00 0.49 H new ATOM 0 HA ILE A 66 -4.783 -8.094 -7.933 1.00 0.53 H new ATOM 0 HB ILE A 66 -2.863 -6.053 -6.759 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -3.053 -9.075 -6.353 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -2.086 -8.358 -7.627 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -3.586 -6.846 -4.521 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -4.925 -6.061 -5.393 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -4.854 -7.835 -5.284 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -0.698 -8.794 -5.612 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -0.799 -7.046 -5.931 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -1.781 -7.773 -4.637 1.00 1.25 H new ATOM 970 N GLY A 67 -5.292 -4.864 -8.173 1.00 0.52 N ATOM 971 CA GLY A 67 -6.364 -3.833 -8.111 1.00 0.55 C ATOM 972 C GLY A 67 -7.549 -4.266 -8.975 1.00 0.53 C ATOM 973 O GLY A 67 -8.688 -4.224 -8.548 1.00 0.63 O ATOM 0 H GLY A 67 -4.402 -4.539 -8.552 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -6.687 -3.692 -7.079 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -5.980 -2.874 -8.459 1.00 0.55 H new ATOM 977 N ASP A 68 -7.300 -4.676 -10.188 1.00 0.54 N ATOM 978 CA ASP A 68 -8.417 -5.100 -11.079 1.00 0.54 C ATOM 979 C ASP A 68 -8.934 -6.482 -10.670 1.00 0.52 C ATOM 980 O ASP A 68 -10.047 -6.850 -10.991 1.00 0.56 O ATOM 981 CB ASP A 68 -7.909 -5.166 -12.522 1.00 0.60 C ATOM 982 CG ASP A 68 -7.499 -3.767 -12.986 1.00 1.43 C ATOM 983 OD1 ASP A 68 -6.609 -3.199 -12.375 1.00 2.20 O ATOM 984 OD2 ASP A 68 -8.082 -3.289 -13.945 1.00 2.12 O ATOM 0 H ASP A 68 -6.370 -4.736 -10.602 1.00 0.54 H new ATOM 0 HA ASP A 68 -9.229 -4.378 -10.994 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -7.059 -5.846 -12.588 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -8.687 -5.563 -13.174 1.00 0.60 H new ATOM 989 N GLU A 69 -8.137 -7.261 -9.980 1.00 0.56 N ATOM 990 CA GLU A 69 -8.591 -8.630 -9.571 1.00 0.56 C ATOM 991 C GLU A 69 -9.158 -8.583 -8.149 1.00 0.55 C ATOM 992 O GLU A 69 -9.965 -9.414 -7.780 1.00 0.73 O ATOM 993 CB GLU A 69 -7.405 -9.595 -9.629 1.00 0.61 C ATOM 994 CG GLU A 69 -7.909 -11.038 -9.556 1.00 0.84 C ATOM 995 CD GLU A 69 -8.587 -11.411 -10.875 1.00 1.65 C ATOM 996 OE1 GLU A 69 -7.952 -11.268 -11.907 1.00 2.48 O ATOM 997 OE2 GLU A 69 -9.730 -11.836 -10.831 1.00 2.23 O ATOM 0 H GLU A 69 -7.194 -7.010 -9.682 1.00 0.56 H new ATOM 0 HA GLU A 69 -9.370 -8.975 -10.251 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -6.844 -9.442 -10.551 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -6.722 -9.396 -8.803 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -7.078 -11.715 -9.358 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -8.612 -11.147 -8.730 1.00 0.84 H new ATOM 1004 N LEU A 70 -8.746 -7.649 -7.334 1.00 0.53 N ATOM 1005 CA LEU A 70 -9.282 -7.614 -5.939 1.00 0.52 C ATOM 1006 C LEU A 70 -10.689 -7.009 -5.941 1.00 0.54 C ATOM 1007 O LEU A 70 -11.514 -7.337 -5.111 1.00 0.60 O ATOM 1008 CB LEU A 70 -8.350 -6.790 -5.039 1.00 0.61 C ATOM 1009 CG LEU A 70 -8.686 -7.028 -3.554 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -8.121 -8.378 -3.080 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -8.067 -5.907 -2.711 1.00 1.61 C ATOM 0 H LEU A 70 -8.073 -6.919 -7.567 1.00 0.53 H new ATOM 0 HA LEU A 70 -9.334 -8.631 -5.549 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -7.313 -7.064 -5.232 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -8.449 -5.731 -5.275 1.00 0.61 H new ATOM 0 HG LEU A 70 -9.770 -7.037 -3.438 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -8.369 -8.527 -2.029 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -8.555 -9.183 -3.673 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -7.038 -8.382 -3.201 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -8.302 -6.071 -1.659 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -6.985 -5.906 -2.845 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -8.473 -4.947 -3.028 1.00 1.61 H new ATOM 1023 N ASP A 71 -10.986 -6.152 -6.884 1.00 0.67 N ATOM 1024 CA ASP A 71 -12.357 -5.568 -6.940 1.00 0.91 C ATOM 1025 C ASP A 71 -13.341 -6.684 -7.300 1.00 1.02 C ATOM 1026 O ASP A 71 -14.541 -6.499 -7.330 1.00 1.29 O ATOM 1027 CB ASP A 71 -12.414 -4.457 -7.997 1.00 1.09 C ATOM 1028 CG ASP A 71 -12.294 -5.061 -9.398 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -13.303 -5.509 -9.918 1.00 2.25 O ATOM 1030 OD2 ASP A 71 -11.195 -5.064 -9.928 1.00 2.36 O ATOM 0 H ASP A 71 -10.344 -5.835 -7.611 1.00 0.67 H new ATOM 0 HA ASP A 71 -12.618 -5.136 -5.974 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -13.351 -3.907 -7.908 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -11.608 -3.743 -7.830 1.00 1.09 H new ATOM 1035 N SER A 72 -12.817 -7.850 -7.563 1.00 0.90 N ATOM 1036 CA SER A 72 -13.653 -9.012 -7.911 1.00 1.20 C ATOM 1037 C SER A 72 -14.649 -9.285 -6.787 1.00 0.98 C ATOM 1038 O SER A 72 -15.612 -8.568 -6.607 1.00 1.02 O ATOM 1039 CB SER A 72 -12.722 -10.223 -8.058 1.00 1.57 C ATOM 1040 OG SER A 72 -13.505 -11.399 -8.229 1.00 2.09 O ATOM 0 H SER A 72 -11.815 -8.041 -7.548 1.00 0.90 H new ATOM 0 HA SER A 72 -14.202 -8.823 -8.834 1.00 1.20 H new ATOM 0 HB2 SER A 72 -12.060 -10.086 -8.913 1.00 1.57 H new ATOM 0 HB3 SER A 72 -12.089 -10.319 -7.176 1.00 1.57 H new ATOM 0 HG SER A 72 -12.914 -12.175 -8.325 1.00 2.09 H new ATOM 1046 N ASN A 73 -14.423 -10.372 -6.096 1.00 0.92 N ATOM 1047 CA ASN A 73 -15.324 -10.855 -4.990 1.00 0.83 C ATOM 1048 C ASN A 73 -16.359 -9.794 -4.589 1.00 0.75 C ATOM 1049 O ASN A 73 -16.014 -8.744 -4.084 1.00 1.07 O ATOM 1050 CB ASN A 73 -14.472 -11.216 -3.773 1.00 0.91 C ATOM 1051 CG ASN A 73 -15.328 -11.971 -2.757 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -14.854 -12.341 -1.701 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -16.579 -12.216 -3.032 1.00 1.90 N ATOM 0 H ASN A 73 -13.616 -10.975 -6.257 1.00 0.92 H new ATOM 0 HA ASN A 73 -15.866 -11.728 -5.353 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -13.625 -11.830 -4.078 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -14.064 -10.312 -3.320 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -17.160 -12.718 -2.361 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -16.977 -11.905 -3.918 1.00 1.90 H new ATOM 1060 N MET A 74 -17.617 -10.045 -4.827 1.00 0.71 N ATOM 1061 CA MET A 74 -18.656 -9.033 -4.472 1.00 0.67 C ATOM 1062 C MET A 74 -18.826 -8.969 -2.951 1.00 0.67 C ATOM 1063 O MET A 74 -19.460 -8.075 -2.427 1.00 0.71 O ATOM 1064 CB MET A 74 -19.986 -9.400 -5.140 1.00 0.75 C ATOM 1065 CG MET A 74 -19.803 -9.532 -6.673 1.00 1.20 C ATOM 1066 SD MET A 74 -20.607 -8.143 -7.517 1.00 1.92 S ATOM 1067 CE MET A 74 -19.795 -8.350 -9.120 1.00 1.96 C ATOM 0 H MET A 74 -17.971 -10.903 -5.250 1.00 0.71 H new ATOM 0 HA MET A 74 -18.339 -8.053 -4.830 1.00 0.67 H new ATOM 0 HB2 MET A 74 -20.359 -10.338 -4.730 1.00 0.75 H new ATOM 0 HB3 MET A 74 -20.733 -8.637 -4.921 1.00 0.75 H new ATOM 0 HG2 MET A 74 -18.742 -9.553 -6.920 1.00 1.20 H new ATOM 0 HG3 MET A 74 -20.229 -10.474 -7.018 1.00 1.20 H new ATOM 0 HE1 MET A 74 -20.149 -7.583 -9.809 1.00 1.96 H new ATOM 0 HE2 MET A 74 -18.716 -8.256 -8.996 1.00 1.96 H new ATOM 0 HE3 MET A 74 -20.030 -9.336 -9.522 1.00 1.96 H new ATOM 1077 N GLU A 75 -18.233 -9.883 -2.238 1.00 0.70 N ATOM 1078 CA GLU A 75 -18.324 -9.849 -0.749 1.00 0.75 C ATOM 1079 C GLU A 75 -17.354 -8.782 -0.231 1.00 0.73 C ATOM 1080 O GLU A 75 -17.640 -8.081 0.720 1.00 0.78 O ATOM 1081 CB GLU A 75 -17.942 -11.221 -0.176 1.00 0.87 C ATOM 1082 CG GLU A 75 -19.142 -12.170 -0.259 1.00 1.15 C ATOM 1083 CD GLU A 75 -19.667 -12.215 -1.695 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -20.517 -11.403 -2.020 1.00 2.29 O ATOM 1085 OE2 GLU A 75 -19.211 -13.063 -2.445 1.00 2.21 O ATOM 0 H GLU A 75 -17.687 -10.655 -2.621 1.00 0.70 H new ATOM 0 HA GLU A 75 -19.342 -9.611 -0.440 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -17.100 -11.635 -0.730 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -17.621 -11.116 0.860 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -18.850 -13.170 0.063 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -19.930 -11.835 0.416 1.00 1.15 H new ATOM 1092 N LEU A 76 -16.220 -8.639 -0.857 1.00 0.74 N ATOM 1093 CA LEU A 76 -15.246 -7.603 -0.408 1.00 0.80 C ATOM 1094 C LEU A 76 -15.728 -6.222 -0.863 1.00 0.75 C ATOM 1095 O LEU A 76 -15.471 -5.227 -0.221 1.00 0.81 O ATOM 1096 CB LEU A 76 -13.861 -7.904 -0.995 1.00 0.92 C ATOM 1097 CG LEU A 76 -12.800 -6.942 -0.418 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -12.305 -7.451 0.941 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -11.612 -6.861 -1.383 1.00 1.51 C ATOM 0 H LEU A 76 -15.924 -9.194 -1.660 1.00 0.74 H new ATOM 0 HA LEU A 76 -15.174 -7.615 0.680 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -13.583 -8.934 -0.773 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -13.893 -7.809 -2.080 1.00 0.92 H new ATOM 0 HG LEU A 76 -13.249 -5.957 -0.290 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -11.557 -6.764 1.337 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -13.144 -7.513 1.634 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -11.861 -8.439 0.820 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -10.861 -6.183 -0.979 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -11.176 -7.852 -1.508 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -11.953 -6.490 -2.350 1.00 1.51 H new ATOM 1111 N GLN A 77 -16.452 -6.149 -1.946 1.00 0.76 N ATOM 1112 CA GLN A 77 -16.966 -4.824 -2.399 1.00 0.74 C ATOM 1113 C GLN A 77 -18.223 -4.491 -1.585 1.00 0.71 C ATOM 1114 O GLN A 77 -18.478 -3.346 -1.261 1.00 0.72 O ATOM 1115 CB GLN A 77 -17.302 -4.881 -3.905 1.00 0.71 C ATOM 1116 CG GLN A 77 -16.115 -4.374 -4.732 1.00 1.26 C ATOM 1117 CD GLN A 77 -14.855 -5.158 -4.360 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -13.872 -4.584 -3.936 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -14.843 -6.455 -4.503 1.00 2.03 N ATOM 0 H GLN A 77 -16.709 -6.942 -2.533 1.00 0.76 H new ATOM 0 HA GLN A 77 -16.212 -4.052 -2.245 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -17.544 -5.904 -4.192 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -18.184 -4.275 -4.111 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -16.325 -4.488 -5.795 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -15.960 -3.311 -4.550 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -15.669 -6.936 -4.859 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -14.008 -6.987 -4.259 1.00 2.03 H new ATOM 1128 N ARG A 78 -19.003 -5.477 -1.240 1.00 0.72 N ATOM 1129 CA ARG A 78 -20.228 -5.198 -0.444 1.00 0.73 C ATOM 1130 C ARG A 78 -19.836 -4.816 0.983 1.00 0.75 C ATOM 1131 O ARG A 78 -20.477 -3.998 1.613 1.00 0.79 O ATOM 1132 CB ARG A 78 -21.117 -6.441 -0.406 1.00 0.74 C ATOM 1133 CG ARG A 78 -22.453 -6.081 0.248 1.00 0.94 C ATOM 1134 CD ARG A 78 -23.387 -7.289 0.210 1.00 1.23 C ATOM 1135 NE ARG A 78 -23.734 -7.604 -1.205 1.00 1.80 N ATOM 1136 CZ ARG A 78 -24.275 -8.754 -1.505 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -24.515 -9.628 -0.566 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -24.577 -9.028 -2.744 1.00 3.41 N ATOM 0 H ARG A 78 -18.846 -6.457 -1.473 1.00 0.72 H new ATOM 0 HA ARG A 78 -20.774 -4.376 -0.907 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -21.282 -6.817 -1.416 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -20.627 -7.237 0.154 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -22.291 -5.767 1.279 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -22.909 -5.240 -0.274 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -22.907 -8.148 0.678 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -24.292 -7.080 0.780 1.00 1.23 H new ATOM 0 HE ARG A 78 -23.549 -6.921 -1.939 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -24.280 -9.413 0.403 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -24.938 -10.526 -0.801 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -24.391 -8.344 -3.478 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -25.000 -9.926 -2.979 1.00 3.41 H new ATOM 1152 N MET A 79 -18.783 -5.394 1.502 1.00 0.75 N ATOM 1153 CA MET A 79 -18.354 -5.053 2.887 1.00 0.77 C ATOM 1154 C MET A 79 -17.819 -3.621 2.898 1.00 0.77 C ATOM 1155 O MET A 79 -18.232 -2.800 3.693 1.00 0.78 O ATOM 1156 CB MET A 79 -17.249 -6.022 3.337 1.00 0.81 C ATOM 1157 CG MET A 79 -17.870 -7.342 3.805 1.00 1.08 C ATOM 1158 SD MET A 79 -16.566 -8.436 4.424 1.00 1.07 S ATOM 1159 CE MET A 79 -16.577 -7.864 6.142 1.00 0.81 C ATOM 0 H MET A 79 -18.204 -6.086 1.026 1.00 0.75 H new ATOM 0 HA MET A 79 -19.200 -5.137 3.569 1.00 0.77 H new ATOM 0 HB2 MET A 79 -16.558 -6.207 2.514 1.00 0.81 H new ATOM 0 HB3 MET A 79 -16.670 -5.576 4.145 1.00 0.81 H new ATOM 0 HG2 MET A 79 -18.604 -7.153 4.589 1.00 1.08 H new ATOM 0 HG3 MET A 79 -18.400 -7.820 2.981 1.00 1.08 H new ATOM 0 HE1 MET A 79 -15.667 -8.196 6.642 1.00 0.81 H new ATOM 0 HE2 MET A 79 -16.626 -6.775 6.163 1.00 0.81 H new ATOM 0 HE3 MET A 79 -17.445 -8.276 6.657 1.00 0.81 H new ATOM 1169 N ILE A 80 -16.912 -3.309 2.010 1.00 0.77 N ATOM 1170 CA ILE A 80 -16.366 -1.924 1.962 1.00 0.80 C ATOM 1171 C ILE A 80 -17.540 -0.939 1.938 1.00 0.80 C ATOM 1172 O ILE A 80 -17.429 0.188 2.381 1.00 0.83 O ATOM 1173 CB ILE A 80 -15.496 -1.758 0.713 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -14.244 -2.629 0.857 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -15.075 -0.293 0.564 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -13.528 -2.730 -0.491 1.00 1.10 C ATOM 0 H ILE A 80 -16.528 -3.953 1.318 1.00 0.77 H new ATOM 0 HA ILE A 80 -15.747 -1.728 2.838 1.00 0.80 H new ATOM 0 HB ILE A 80 -16.064 -2.061 -0.167 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -13.575 -2.201 1.604 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -14.519 -3.623 1.209 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -14.456 -0.181 -0.326 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -15.962 0.333 0.470 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -14.506 0.013 1.442 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -12.638 -3.350 -0.385 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -14.197 -3.178 -1.226 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -13.238 -1.734 -0.825 1.00 1.10 H new ATOM 1188 N ALA A 81 -18.667 -1.356 1.424 1.00 0.78 N ATOM 1189 CA ALA A 81 -19.850 -0.447 1.380 1.00 0.80 C ATOM 1190 C ALA A 81 -20.514 -0.393 2.763 1.00 0.81 C ATOM 1191 O ALA A 81 -21.301 0.488 3.049 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.858 -0.979 0.362 1.00 0.79 C ATOM 0 H ALA A 81 -18.819 -2.286 1.033 1.00 0.78 H new ATOM 0 HA ALA A 81 -19.525 0.553 1.093 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -21.724 -0.317 0.327 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -20.393 -1.020 -0.623 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -21.177 -1.979 0.655 1.00 0.79 H new ATOM 1198 N ALA A 82 -20.215 -1.336 3.615 1.00 0.78 N ATOM 1199 CA ALA A 82 -20.838 -1.354 4.974 1.00 0.80 C ATOM 1200 C ALA A 82 -20.063 -0.446 5.936 1.00 0.79 C ATOM 1201 O ALA A 82 -20.546 -0.111 7.000 1.00 0.83 O ATOM 1202 CB ALA A 82 -20.822 -2.785 5.514 1.00 0.87 C ATOM 0 H ALA A 82 -19.564 -2.099 3.429 1.00 0.78 H new ATOM 0 HA ALA A 82 -21.862 -0.990 4.895 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -21.275 -2.805 6.505 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -21.387 -3.433 4.844 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -19.793 -3.138 5.578 1.00 0.87 H new ATOM 1208 N VAL A 83 -18.871 -0.044 5.584 1.00 0.80 N ATOM 1209 CA VAL A 83 -18.079 0.843 6.497 1.00 0.85 C ATOM 1210 C VAL A 83 -18.376 2.309 6.156 1.00 0.99 C ATOM 1211 O VAL A 83 -17.825 2.886 5.241 1.00 1.36 O ATOM 1212 CB VAL A 83 -16.577 0.531 6.354 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -16.220 0.337 4.883 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -15.733 1.670 6.942 1.00 1.40 C ATOM 0 H VAL A 83 -18.409 -0.288 4.708 1.00 0.80 H new ATOM 0 HA VAL A 83 -18.363 0.662 7.534 1.00 0.85 H new ATOM 0 HB VAL A 83 -16.363 -0.387 6.902 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -15.156 0.117 4.793 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -16.798 -0.492 4.475 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -16.450 1.247 4.330 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -14.675 1.433 6.832 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -15.954 2.597 6.413 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -15.970 1.790 7.999 1.00 1.40 H new ATOM 1224 N ASP A 84 -19.246 2.909 6.919 1.00 1.46 N ATOM 1225 CA ASP A 84 -19.602 4.339 6.700 1.00 1.71 C ATOM 1226 C ASP A 84 -18.415 5.227 7.081 1.00 1.39 C ATOM 1227 O ASP A 84 -17.503 4.802 7.761 1.00 1.80 O ATOM 1228 CB ASP A 84 -20.797 4.699 7.586 1.00 2.38 C ATOM 1229 CG ASP A 84 -21.285 6.107 7.238 1.00 2.99 C ATOM 1230 OD1 ASP A 84 -20.770 7.050 7.815 1.00 3.57 O ATOM 1231 OD2 ASP A 84 -22.166 6.217 6.401 1.00 3.45 O ATOM 0 H ASP A 84 -19.733 2.463 7.696 1.00 1.46 H new ATOM 0 HA ASP A 84 -19.854 4.494 5.651 1.00 1.71 H new ATOM 0 HB2 ASP A 84 -21.601 3.978 7.441 1.00 2.38 H new ATOM 0 HB3 ASP A 84 -20.512 4.651 8.637 1.00 2.38 H new ATOM 1236 N THR A 85 -18.422 6.461 6.649 1.00 1.68 N ATOM 1237 CA THR A 85 -17.296 7.383 6.986 1.00 1.97 C ATOM 1238 C THR A 85 -17.601 8.095 8.307 1.00 1.67 C ATOM 1239 O THR A 85 -18.735 8.163 8.739 1.00 2.28 O ATOM 1240 CB THR A 85 -17.136 8.420 5.871 1.00 3.20 C ATOM 1241 OG1 THR A 85 -16.067 9.299 6.195 1.00 3.80 O ATOM 1242 CG2 THR A 85 -18.430 9.222 5.723 1.00 3.87 C ATOM 0 H THR A 85 -19.160 6.871 6.076 1.00 1.68 H new ATOM 0 HA THR A 85 -16.373 6.812 7.085 1.00 1.97 H new ATOM 0 HB THR A 85 -16.919 7.911 4.932 1.00 3.20 H new ATOM 0 HG1 THR A 85 -15.962 9.963 5.482 1.00 3.80 H new ATOM 0 HG21 THR A 85 -18.312 9.959 4.929 1.00 3.87 H new ATOM 0 HG22 THR A 85 -19.249 8.548 5.474 1.00 3.87 H new ATOM 0 HG23 THR A 85 -18.652 9.732 6.661 1.00 3.87 H new ATOM 1250 N ASP A 86 -16.598 8.626 8.952 1.00 1.51 N ATOM 1251 CA ASP A 86 -16.829 9.331 10.244 1.00 1.98 C ATOM 1252 C ASP A 86 -15.523 9.978 10.711 1.00 1.78 C ATOM 1253 O ASP A 86 -15.487 11.124 11.112 1.00 2.48 O ATOM 1254 CB ASP A 86 -17.309 8.324 11.293 1.00 2.56 C ATOM 1255 CG ASP A 86 -16.457 7.057 11.213 1.00 3.06 C ATOM 1256 OD1 ASP A 86 -15.346 7.082 11.717 1.00 3.50 O ATOM 1257 OD2 ASP A 86 -16.929 6.084 10.650 1.00 3.57 O ATOM 0 H ASP A 86 -15.627 8.602 8.639 1.00 1.51 H new ATOM 0 HA ASP A 86 -17.587 10.103 10.110 1.00 1.98 H new ATOM 0 HB2 ASP A 86 -17.238 8.760 12.290 1.00 2.56 H new ATOM 0 HB3 ASP A 86 -18.358 8.080 11.125 1.00 2.56 H new ATOM 1262 N SER A 87 -14.446 9.242 10.650 1.00 1.11 N ATOM 1263 CA SER A 87 -13.123 9.785 11.074 1.00 0.93 C ATOM 1264 C SER A 87 -12.026 8.982 10.350 1.00 0.84 C ATOM 1265 O SER A 87 -11.578 7.978 10.867 1.00 0.97 O ATOM 1266 CB SER A 87 -12.964 9.615 12.584 1.00 0.88 C ATOM 1267 OG SER A 87 -13.937 10.408 13.250 1.00 1.63 O ATOM 0 H SER A 87 -14.426 8.277 10.321 1.00 1.11 H new ATOM 0 HA SER A 87 -13.048 10.844 10.825 1.00 0.93 H new ATOM 0 HB2 SER A 87 -13.083 8.567 12.858 1.00 0.88 H new ATOM 0 HB3 SER A 87 -11.962 9.914 12.892 1.00 0.88 H new ATOM 0 HG SER A 87 -13.591 10.685 14.124 1.00 1.63 H new ATOM 1273 N PRO A 88 -11.642 9.408 9.160 1.00 0.77 N ATOM 1274 CA PRO A 88 -10.631 8.673 8.378 1.00 0.83 C ATOM 1275 C PRO A 88 -9.281 8.667 9.108 1.00 0.73 C ATOM 1276 O PRO A 88 -8.485 7.767 8.936 1.00 0.72 O ATOM 1277 CB PRO A 88 -10.548 9.421 7.025 1.00 1.01 C ATOM 1278 CG PRO A 88 -11.504 10.645 7.109 1.00 1.07 C ATOM 1279 CD PRO A 88 -12.160 10.631 8.505 1.00 0.83 C ATOM 0 HA PRO A 88 -10.896 7.625 8.236 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -9.526 9.745 6.828 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -10.837 8.764 6.205 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -10.953 11.573 6.955 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -12.263 10.592 6.329 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -11.898 11.524 9.073 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -13.247 10.608 8.430 1.00 0.83 H new ATOM 1287 N ARG A 89 -9.009 9.659 9.914 1.00 0.75 N ATOM 1288 CA ARG A 89 -7.700 9.679 10.630 1.00 0.73 C ATOM 1289 C ARG A 89 -7.738 8.670 11.783 1.00 0.67 C ATOM 1290 O ARG A 89 -6.830 7.882 11.959 1.00 0.68 O ATOM 1291 CB ARG A 89 -7.424 11.084 11.173 1.00 0.79 C ATOM 1292 CG ARG A 89 -7.086 12.029 10.015 1.00 1.63 C ATOM 1293 CD ARG A 89 -7.146 13.484 10.494 1.00 1.65 C ATOM 1294 NE ARG A 89 -8.474 13.767 11.136 1.00 2.07 N ATOM 1295 CZ ARG A 89 -9.599 13.578 10.498 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -9.602 13.326 9.218 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -10.731 13.701 11.134 1.00 3.10 N ATOM 0 H ARG A 89 -9.628 10.447 10.106 1.00 0.75 H new ATOM 0 HA ARG A 89 -6.903 9.408 9.938 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -8.296 11.453 11.713 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -6.598 11.054 11.883 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -6.091 11.805 9.630 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -7.787 11.878 9.194 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -6.343 13.673 11.206 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -6.991 14.158 9.652 1.00 1.65 H new ATOM 0 HE ARG A 89 -8.499 14.116 12.094 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -8.721 13.275 8.706 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -10.485 13.180 8.729 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -10.736 13.944 12.125 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -11.612 13.555 10.641 1.00 3.10 H new ATOM 1311 N GLU A 90 -8.784 8.682 12.568 1.00 0.65 N ATOM 1312 CA GLU A 90 -8.877 7.717 13.704 1.00 0.65 C ATOM 1313 C GLU A 90 -8.966 6.292 13.152 1.00 0.64 C ATOM 1314 O GLU A 90 -8.240 5.414 13.577 1.00 0.67 O ATOM 1315 CB GLU A 90 -10.127 8.022 14.531 1.00 0.71 C ATOM 1316 CG GLU A 90 -10.032 9.439 15.100 1.00 1.32 C ATOM 1317 CD GLU A 90 -11.296 9.751 15.903 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -11.665 8.934 16.732 1.00 2.46 O ATOM 1319 OE2 GLU A 90 -11.875 10.801 15.676 1.00 2.78 O ATOM 0 H GLU A 90 -9.576 9.317 12.472 1.00 0.65 H new ATOM 0 HA GLU A 90 -7.993 7.810 14.335 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -11.018 7.927 13.910 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -10.225 7.300 15.341 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -9.152 9.528 15.737 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -9.915 10.160 14.291 1.00 1.32 H new ATOM 1326 N VAL A 91 -9.845 6.042 12.222 1.00 0.64 N ATOM 1327 CA VAL A 91 -9.963 4.662 11.670 1.00 0.67 C ATOM 1328 C VAL A 91 -8.633 4.256 11.029 1.00 0.66 C ATOM 1329 O VAL A 91 -8.160 3.150 11.206 1.00 0.67 O ATOM 1330 CB VAL A 91 -11.082 4.628 10.624 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -11.209 3.219 10.043 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -12.406 5.025 11.283 1.00 0.75 C ATOM 0 H VAL A 91 -10.484 6.729 11.822 1.00 0.64 H new ATOM 0 HA VAL A 91 -10.201 3.963 12.471 1.00 0.67 H new ATOM 0 HB VAL A 91 -10.844 5.327 9.823 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -12.006 3.202 9.300 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -10.268 2.933 9.572 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -11.443 2.516 10.842 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -13.204 5.001 10.540 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -12.637 4.325 12.086 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -12.321 6.032 11.692 1.00 0.75 H new ATOM 1342 N PHE A 92 -8.025 5.140 10.289 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.724 4.809 9.640 1.00 0.65 C ATOM 1344 C PHE A 92 -5.761 4.203 10.670 1.00 0.62 C ATOM 1345 O PHE A 92 -5.181 3.161 10.439 1.00 0.67 O ATOM 1346 CB PHE A 92 -6.114 6.085 9.045 1.00 0.65 C ATOM 1347 CG PHE A 92 -4.693 5.820 8.594 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -4.455 5.152 7.387 1.00 1.31 C ATOM 1349 CD2 PHE A 92 -3.615 6.243 9.383 1.00 1.44 C ATOM 1350 CE1 PHE A 92 -3.141 4.906 6.970 1.00 1.31 C ATOM 1351 CE2 PHE A 92 -2.302 5.997 8.965 1.00 1.47 C ATOM 1352 CZ PHE A 92 -2.065 5.328 7.759 1.00 0.73 C ATOM 0 H PHE A 92 -8.373 6.081 10.104 1.00 0.64 H new ATOM 0 HA PHE A 92 -6.892 4.081 8.846 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -6.714 6.425 8.201 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -6.126 6.883 9.787 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -5.285 4.826 6.777 1.00 1.31 H new ATOM 0 HD2 PHE A 92 -3.797 6.759 10.314 1.00 1.44 H new ATOM 0 HE1 PHE A 92 -2.958 4.390 6.039 1.00 1.31 H new ATOM 0 HE2 PHE A 92 -1.472 6.324 9.573 1.00 1.47 H new ATOM 0 HZ PHE A 92 -1.052 5.137 7.437 1.00 0.73 H new ATOM 1362 N PHE A 93 -5.567 4.840 11.794 1.00 0.58 N ATOM 1363 CA PHE A 93 -4.620 4.273 12.801 1.00 0.57 C ATOM 1364 C PHE A 93 -5.285 3.106 13.534 1.00 0.59 C ATOM 1365 O PHE A 93 -4.628 2.175 13.956 1.00 0.60 O ATOM 1366 CB PHE A 93 -4.216 5.357 13.803 1.00 0.57 C ATOM 1367 CG PHE A 93 -3.206 4.797 14.777 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -1.873 4.631 14.381 1.00 1.47 C ATOM 1369 CD2 PHE A 93 -3.599 4.444 16.075 1.00 1.15 C ATOM 1370 CE1 PHE A 93 -0.934 4.113 15.282 1.00 1.58 C ATOM 1371 CE2 PHE A 93 -2.659 3.926 16.975 1.00 1.07 C ATOM 1372 CZ PHE A 93 -1.327 3.761 16.578 1.00 0.70 C ATOM 0 H PHE A 93 -6.016 5.717 12.058 1.00 0.58 H new ATOM 0 HA PHE A 93 -3.727 3.912 12.291 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -3.793 6.213 13.277 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -5.094 5.715 14.340 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -1.569 4.902 13.381 1.00 1.47 H new ATOM 0 HD2 PHE A 93 -4.627 4.571 16.381 1.00 1.15 H new ATOM 0 HE1 PHE A 93 0.094 3.985 14.976 1.00 1.58 H new ATOM 0 HE2 PHE A 93 -2.962 3.654 17.975 1.00 1.07 H new ATOM 0 HZ PHE A 93 -0.602 3.362 17.272 1.00 0.70 H new ATOM 1382 N ARG A 94 -6.581 3.139 13.685 1.00 0.62 N ATOM 1383 CA ARG A 94 -7.272 2.019 14.384 1.00 0.67 C ATOM 1384 C ARG A 94 -7.197 0.766 13.512 1.00 0.66 C ATOM 1385 O ARG A 94 -6.726 -0.267 13.948 1.00 0.67 O ATOM 1386 CB ARG A 94 -8.740 2.394 14.652 1.00 0.72 C ATOM 1387 CG ARG A 94 -9.281 1.623 15.866 1.00 0.89 C ATOM 1388 CD ARG A 94 -9.332 0.118 15.569 1.00 1.00 C ATOM 1389 NE ARG A 94 -10.266 -0.536 16.529 1.00 1.95 N ATOM 1390 CZ ARG A 94 -10.687 -1.751 16.311 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -10.280 -2.405 15.258 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -11.514 -2.315 17.149 1.00 3.65 N ATOM 0 H ARG A 94 -7.189 3.889 13.356 1.00 0.62 H new ATOM 0 HA ARG A 94 -6.785 1.825 15.340 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -8.821 3.466 14.830 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -9.345 2.170 13.773 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -8.647 1.807 16.733 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -10.278 1.984 16.118 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -9.665 -0.052 14.545 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -8.336 -0.317 15.657 1.00 1.00 H new ATOM 0 HE ARG A 94 -10.577 -0.032 17.359 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -9.632 -1.966 14.604 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -10.610 -3.355 15.089 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -11.831 -1.805 17.974 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -11.843 -3.265 16.979 1.00 3.65 H new ATOM 1406 N VAL A 95 -7.650 0.825 12.290 1.00 0.65 N ATOM 1407 CA VAL A 95 -7.590 -0.384 11.423 1.00 0.66 C ATOM 1408 C VAL A 95 -6.128 -0.767 11.172 1.00 0.66 C ATOM 1409 O VAL A 95 -5.768 -1.927 11.226 1.00 0.67 O ATOM 1410 CB VAL A 95 -8.286 -0.074 10.086 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -7.941 -1.145 9.042 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -9.803 -0.041 10.299 1.00 1.08 C ATOM 0 H VAL A 95 -8.057 1.654 11.857 1.00 0.65 H new ATOM 0 HA VAL A 95 -8.094 -1.217 11.914 1.00 0.66 H new ATOM 0 HB VAL A 95 -7.941 0.895 9.724 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -8.441 -0.911 8.102 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -6.863 -1.165 8.884 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -8.274 -2.120 9.397 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -10.299 0.178 9.353 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -10.140 -1.009 10.669 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -10.052 0.732 11.027 1.00 1.08 H new ATOM 1422 N ALA A 96 -5.286 0.183 10.869 1.00 0.65 N ATOM 1423 CA ALA A 96 -3.869 -0.168 10.591 1.00 0.68 C ATOM 1424 C ALA A 96 -3.286 -0.949 11.763 1.00 0.70 C ATOM 1425 O ALA A 96 -2.438 -1.804 11.600 1.00 0.76 O ATOM 1426 CB ALA A 96 -3.057 1.100 10.306 1.00 0.69 C ATOM 0 H ALA A 96 -5.516 1.175 10.803 1.00 0.65 H new ATOM 0 HA ALA A 96 -3.822 -0.802 9.706 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -2.020 0.830 10.104 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -3.474 1.612 9.439 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -3.098 1.760 11.172 1.00 0.69 H new ATOM 1432 N ALA A 97 -3.754 -0.665 12.948 1.00 0.74 N ATOM 1433 CA ALA A 97 -3.254 -1.389 14.149 1.00 0.78 C ATOM 1434 C ALA A 97 -4.004 -2.717 14.274 1.00 0.79 C ATOM 1435 O ALA A 97 -3.515 -3.668 14.849 1.00 0.83 O ATOM 1436 CB ALA A 97 -3.511 -0.542 15.399 1.00 0.77 C ATOM 0 H ALA A 97 -4.465 0.042 13.136 1.00 0.74 H new ATOM 0 HA ALA A 97 -2.184 -1.574 14.051 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -3.145 -1.071 16.279 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -2.990 0.411 15.306 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -4.581 -0.362 15.503 1.00 0.77 H new ATOM 1442 N ASP A 98 -5.188 -2.786 13.726 1.00 0.78 N ATOM 1443 CA ASP A 98 -5.974 -4.049 13.796 1.00 0.82 C ATOM 1444 C ASP A 98 -5.369 -5.062 12.831 1.00 0.83 C ATOM 1445 O ASP A 98 -5.042 -6.173 13.198 1.00 0.88 O ATOM 1446 CB ASP A 98 -7.422 -3.761 13.392 1.00 0.82 C ATOM 1447 CG ASP A 98 -8.284 -4.995 13.666 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -8.307 -5.876 12.822 1.00 2.13 O ATOM 1449 OD2 ASP A 98 -8.908 -5.038 14.714 1.00 2.19 O ATOM 0 H ASP A 98 -5.645 -2.019 13.232 1.00 0.78 H new ATOM 0 HA ASP A 98 -5.951 -4.448 14.810 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -7.803 -2.907 13.951 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -7.470 -3.498 12.335 1.00 0.82 H new ATOM 1454 N MET A 99 -5.244 -4.688 11.584 1.00 0.81 N ATOM 1455 CA MET A 99 -4.686 -5.626 10.572 1.00 0.85 C ATOM 1456 C MET A 99 -3.395 -6.242 11.112 1.00 0.97 C ATOM 1457 O MET A 99 -3.149 -7.422 10.962 1.00 1.14 O ATOM 1458 CB MET A 99 -4.406 -4.859 9.273 1.00 0.79 C ATOM 1459 CG MET A 99 -4.252 -5.839 8.108 1.00 0.81 C ATOM 1460 SD MET A 99 -3.469 -4.993 6.710 1.00 0.97 S ATOM 1461 CE MET A 99 -4.676 -3.653 6.540 1.00 0.48 C ATOM 0 H MET A 99 -5.506 -3.770 11.225 1.00 0.81 H new ATOM 0 HA MET A 99 -5.401 -6.423 10.368 1.00 0.85 H new ATOM 0 HB2 MET A 99 -5.221 -4.164 9.069 1.00 0.79 H new ATOM 0 HB3 MET A 99 -3.499 -4.264 9.381 1.00 0.79 H new ATOM 0 HG2 MET A 99 -3.649 -6.694 8.414 1.00 0.81 H new ATOM 0 HG3 MET A 99 -5.227 -6.227 7.813 1.00 0.81 H new ATOM 0 HE1 MET A 99 -4.588 -3.208 5.549 1.00 0.48 H new ATOM 0 HE2 MET A 99 -5.682 -4.051 6.671 1.00 0.48 H new ATOM 0 HE3 MET A 99 -4.485 -2.893 7.298 1.00 0.48 H new ATOM 1471 N PHE A 100 -2.574 -5.454 11.757 1.00 0.98 N ATOM 1472 CA PHE A 100 -1.312 -6.007 12.320 1.00 1.14 C ATOM 1473 C PHE A 100 -1.678 -7.119 13.305 1.00 1.28 C ATOM 1474 O PHE A 100 -0.991 -8.100 13.391 1.00 1.67 O ATOM 1475 CB PHE A 100 -0.521 -4.891 13.031 1.00 1.19 C ATOM 1476 CG PHE A 100 0.442 -4.241 12.056 1.00 1.15 C ATOM 1477 CD1 PHE A 100 -0.009 -3.845 10.791 1.00 1.64 C ATOM 1478 CD2 PHE A 100 1.782 -4.042 12.414 1.00 1.67 C ATOM 1479 CE1 PHE A 100 0.878 -3.249 9.886 1.00 1.69 C ATOM 1480 CE2 PHE A 100 2.668 -3.446 11.509 1.00 1.79 C ATOM 1481 CZ PHE A 100 2.216 -3.050 10.245 1.00 1.38 C ATOM 0 H PHE A 100 -2.724 -4.458 11.916 1.00 0.98 H new ATOM 0 HA PHE A 100 -0.684 -6.410 11.525 1.00 1.14 H new ATOM 0 HB2 PHE A 100 -1.207 -4.144 13.430 1.00 1.19 H new ATOM 0 HB3 PHE A 100 0.028 -5.304 13.877 1.00 1.19 H new ATOM 0 HD1 PHE A 100 -1.041 -3.999 10.513 1.00 1.64 H new ATOM 0 HD2 PHE A 100 2.131 -4.349 13.389 1.00 1.67 H new ATOM 0 HE1 PHE A 100 0.529 -2.943 8.911 1.00 1.69 H new ATOM 0 HE2 PHE A 100 3.700 -3.292 11.786 1.00 1.79 H new ATOM 0 HZ PHE A 100 2.900 -2.591 9.547 1.00 1.38 H new ATOM 1491 N SER A 101 -2.809 -7.004 13.958 1.00 1.34 N ATOM 1492 CA SER A 101 -3.291 -8.092 14.875 1.00 1.52 C ATOM 1493 C SER A 101 -2.147 -8.846 15.589 1.00 1.61 C ATOM 1494 O SER A 101 -1.842 -8.613 16.740 1.00 1.99 O ATOM 1495 CB SER A 101 -4.035 -9.098 14.001 1.00 1.79 C ATOM 1496 OG SER A 101 -4.299 -10.274 14.757 1.00 2.21 O ATOM 0 H SER A 101 -3.427 -6.195 13.896 1.00 1.34 H new ATOM 0 HA SER A 101 -3.908 -7.637 15.650 1.00 1.52 H new ATOM 0 HB2 SER A 101 -4.969 -8.665 13.643 1.00 1.79 H new ATOM 0 HB3 SER A 101 -3.439 -9.343 13.122 1.00 1.79 H new ATOM 0 HG SER A 101 -4.778 -10.921 14.199 1.00 2.21 H new ATOM 1502 N ASP A 102 -1.529 -9.753 14.872 1.00 1.99 N ATOM 1503 CA ASP A 102 -0.403 -10.565 15.440 1.00 2.34 C ATOM 1504 C ASP A 102 0.944 -9.971 15.019 1.00 2.07 C ATOM 1505 O ASP A 102 1.987 -10.545 15.259 1.00 2.62 O ATOM 1506 CB ASP A 102 -0.503 -12.002 14.929 1.00 3.15 C ATOM 1507 CG ASP A 102 -1.836 -12.611 15.369 1.00 3.78 C ATOM 1508 OD1 ASP A 102 -2.071 -12.673 16.564 1.00 4.10 O ATOM 1509 OD2 ASP A 102 -2.599 -13.005 14.502 1.00 4.42 O ATOM 0 H ASP A 102 -1.760 -9.969 13.902 1.00 1.99 H new ATOM 0 HA ASP A 102 -0.473 -10.553 16.528 1.00 2.34 H new ATOM 0 HB2 ASP A 102 -0.425 -12.018 13.842 1.00 3.15 H new ATOM 0 HB3 ASP A 102 0.325 -12.595 15.317 1.00 3.15 H new ATOM 1514 N GLY A 103 0.930 -8.833 14.382 1.00 2.05 N ATOM 1515 CA GLY A 103 2.200 -8.194 13.924 1.00 2.45 C ATOM 1516 C GLY A 103 2.412 -8.504 12.440 1.00 2.44 C ATOM 1517 O GLY A 103 2.044 -7.735 11.574 1.00 3.08 O ATOM 0 H GLY A 103 0.083 -8.311 14.156 1.00 2.05 H new ATOM 0 HA2 GLY A 103 2.156 -7.116 14.080 1.00 2.45 H new ATOM 0 HA3 GLY A 103 3.041 -8.567 14.509 1.00 2.45 H new ATOM 1521 N ASN A 104 3.001 -9.629 12.146 1.00 2.29 N ATOM 1522 CA ASN A 104 3.244 -10.007 10.724 1.00 2.55 C ATOM 1523 C ASN A 104 4.097 -8.932 10.040 1.00 2.17 C ATOM 1524 O ASN A 104 5.299 -9.074 9.935 1.00 2.54 O ATOM 1525 CB ASN A 104 1.908 -10.171 9.997 1.00 3.20 C ATOM 1526 CG ASN A 104 0.955 -10.995 10.866 1.00 3.72 C ATOM 1527 OD1 ASN A 104 1.370 -11.606 11.831 1.00 4.05 O ATOM 1528 ND2 ASN A 104 -0.313 -11.039 10.563 1.00 4.31 N ATOM 0 H ASN A 104 3.327 -10.308 12.834 1.00 2.29 H new ATOM 0 HA ASN A 104 3.781 -10.955 10.688 1.00 2.55 H new ATOM 0 HB2 ASN A 104 1.473 -9.194 9.787 1.00 3.20 H new ATOM 0 HB3 ASN A 104 2.062 -10.665 9.037 1.00 3.20 H new ATOM 0 HD21 ASN A 104 -0.956 -11.586 11.136 1.00 4.31 H new ATOM 0 HD22 ASN A 104 -0.662 -10.526 9.753 1.00 4.31 H new ATOM 1535 N PHE A 105 3.492 -7.891 9.517 1.00 1.90 N ATOM 1536 CA PHE A 105 4.270 -6.834 8.792 1.00 1.74 C ATOM 1537 C PHE A 105 5.235 -7.485 7.801 1.00 1.59 C ATOM 1538 O PHE A 105 6.370 -7.073 7.672 1.00 1.88 O ATOM 1539 CB PHE A 105 5.038 -5.919 9.770 1.00 2.03 C ATOM 1540 CG PHE A 105 5.731 -6.717 10.851 1.00 1.75 C ATOM 1541 CD1 PHE A 105 7.018 -7.230 10.636 1.00 2.14 C ATOM 1542 CD2 PHE A 105 5.088 -6.938 12.074 1.00 2.28 C ATOM 1543 CE1 PHE A 105 7.657 -7.963 11.642 1.00 2.60 C ATOM 1544 CE2 PHE A 105 5.728 -7.672 13.080 1.00 2.84 C ATOM 1545 CZ PHE A 105 7.012 -8.185 12.864 1.00 2.84 C ATOM 0 H PHE A 105 2.486 -7.727 9.561 1.00 1.90 H new ATOM 0 HA PHE A 105 3.562 -6.209 8.248 1.00 1.74 H new ATOM 0 HB2 PHE A 105 5.775 -5.334 9.219 1.00 2.03 H new ATOM 0 HB3 PHE A 105 4.346 -5.211 10.226 1.00 2.03 H new ATOM 0 HD1 PHE A 105 7.516 -7.059 9.693 1.00 2.14 H new ATOM 0 HD2 PHE A 105 4.097 -6.542 12.242 1.00 2.28 H new ATOM 0 HE1 PHE A 105 8.648 -8.358 11.475 1.00 2.60 H new ATOM 0 HE2 PHE A 105 5.230 -7.842 14.023 1.00 2.84 H new ATOM 0 HZ PHE A 105 7.505 -8.752 13.640 1.00 2.84 H new ATOM 1555 N ASN A 106 4.795 -8.512 7.101 1.00 1.85 N ATOM 1556 CA ASN A 106 5.694 -9.210 6.121 1.00 1.93 C ATOM 1557 C ASN A 106 5.241 -8.957 4.674 1.00 1.72 C ATOM 1558 O ASN A 106 6.001 -8.446 3.876 1.00 2.31 O ATOM 1559 CB ASN A 106 5.671 -10.715 6.401 1.00 2.62 C ATOM 1560 CG ASN A 106 6.428 -11.007 7.697 1.00 3.11 C ATOM 1561 OD1 ASN A 106 7.605 -10.725 7.804 1.00 3.46 O ATOM 1562 ND2 ASN A 106 5.798 -11.564 8.695 1.00 3.79 N ATOM 0 H ASN A 106 3.852 -8.895 7.168 1.00 1.85 H new ATOM 0 HA ASN A 106 6.704 -8.817 6.239 1.00 1.93 H new ATOM 0 HB2 ASN A 106 4.642 -11.064 6.483 1.00 2.62 H new ATOM 0 HB3 ASN A 106 6.127 -11.256 5.572 1.00 2.62 H new ATOM 0 HD21 ASN A 106 6.294 -11.762 9.564 1.00 3.79 H new ATOM 0 HD22 ASN A 106 4.810 -11.801 8.606 1.00 3.79 H new ATOM 1569 N TRP A 107 4.034 -9.338 4.308 1.00 1.54 N ATOM 1570 CA TRP A 107 3.588 -9.140 2.884 1.00 1.68 C ATOM 1571 C TRP A 107 2.133 -8.652 2.795 1.00 1.47 C ATOM 1572 O TRP A 107 1.841 -7.688 2.115 1.00 1.49 O ATOM 1573 CB TRP A 107 3.708 -10.473 2.138 1.00 2.30 C ATOM 1574 CG TRP A 107 5.009 -11.126 2.482 1.00 2.32 C ATOM 1575 CD1 TRP A 107 5.142 -12.241 3.237 1.00 2.69 C ATOM 1576 CD2 TRP A 107 6.359 -10.729 2.098 1.00 2.77 C ATOM 1577 NE1 TRP A 107 6.486 -12.553 3.341 1.00 3.12 N ATOM 1578 CE2 TRP A 107 7.275 -11.651 2.657 1.00 3.35 C ATOM 1579 CE3 TRP A 107 6.871 -9.669 1.328 1.00 3.24 C ATOM 1580 CZ2 TRP A 107 8.651 -11.527 2.458 1.00 4.31 C ATOM 1581 CZ3 TRP A 107 8.255 -9.541 1.126 1.00 4.29 C ATOM 1582 CH2 TRP A 107 9.143 -10.468 1.690 1.00 4.80 C ATOM 0 H TRP A 107 3.347 -9.772 4.924 1.00 1.54 H new ATOM 0 HA TRP A 107 4.226 -8.377 2.437 1.00 1.68 H new ATOM 0 HB2 TRP A 107 2.879 -11.128 2.407 1.00 2.30 H new ATOM 0 HB3 TRP A 107 3.647 -10.306 1.063 1.00 2.30 H new ATOM 0 HD1 TRP A 107 4.332 -12.797 3.685 1.00 2.69 H new ATOM 0 HE1 TRP A 107 6.849 -13.352 3.860 1.00 3.12 H new ATOM 0 HE3 TRP A 107 6.196 -8.949 0.889 1.00 3.24 H new ATOM 0 HZ2 TRP A 107 9.331 -12.244 2.894 1.00 4.31 H new ATOM 0 HZ3 TRP A 107 8.638 -8.724 0.533 1.00 4.29 H new ATOM 0 HH2 TRP A 107 10.206 -10.364 1.531 1.00 4.80 H new ATOM 1593 N GLY A 108 1.221 -9.286 3.484 1.00 1.41 N ATOM 1594 CA GLY A 108 -0.201 -8.822 3.428 1.00 1.47 C ATOM 1595 C GLY A 108 -0.249 -7.369 3.894 1.00 1.05 C ATOM 1596 O GLY A 108 -0.623 -6.472 3.163 1.00 1.02 O ATOM 0 H GLY A 108 1.394 -10.097 4.078 1.00 1.41 H new ATOM 0 HA2 GLY A 108 -0.589 -8.908 2.413 1.00 1.47 H new ATOM 0 HA3 GLY A 108 -0.829 -9.446 4.064 1.00 1.47 H new ATOM 1600 N ARG A 109 0.184 -7.136 5.094 1.00 0.86 N ATOM 1601 CA ARG A 109 0.250 -5.760 5.657 1.00 0.87 C ATOM 1602 C ARG A 109 0.775 -4.769 4.611 1.00 0.70 C ATOM 1603 O ARG A 109 0.268 -3.674 4.466 1.00 0.81 O ATOM 1604 CB ARG A 109 1.268 -5.819 6.814 1.00 1.08 C ATOM 1605 CG ARG A 109 0.574 -6.280 8.109 1.00 1.48 C ATOM 1606 CD ARG A 109 -0.145 -7.612 7.873 1.00 1.96 C ATOM 1607 NE ARG A 109 0.801 -8.581 7.253 1.00 2.74 N ATOM 1608 CZ ARG A 109 0.487 -9.844 7.170 1.00 3.19 C ATOM 1609 NH1 ARG A 109 -0.662 -10.264 7.626 1.00 3.19 N ATOM 1610 NH2 ARG A 109 1.320 -10.689 6.626 1.00 4.08 N ATOM 0 H ARG A 109 0.506 -7.864 5.731 1.00 0.86 H new ATOM 0 HA ARG A 109 -0.739 -5.433 5.977 1.00 0.87 H new ATOM 0 HB2 ARG A 109 2.077 -6.505 6.562 1.00 1.08 H new ATOM 0 HB3 ARG A 109 1.718 -4.837 6.963 1.00 1.08 H new ATOM 0 HG2 ARG A 109 1.309 -6.391 8.906 1.00 1.48 H new ATOM 0 HG3 ARG A 109 -0.140 -5.525 8.437 1.00 1.48 H new ATOM 0 HD2 ARG A 109 -0.521 -8.007 8.817 1.00 1.96 H new ATOM 0 HD3 ARG A 109 -1.007 -7.462 7.224 1.00 1.96 H new ATOM 0 HE ARG A 109 1.698 -8.256 6.892 1.00 2.74 H new ATOM 0 HH11 ARG A 109 -1.315 -9.604 8.048 1.00 3.19 H new ATOM 0 HH12 ARG A 109 -0.906 -11.252 7.560 1.00 3.19 H new ATOM 0 HH21 ARG A 109 2.216 -10.361 6.266 1.00 4.08 H new ATOM 0 HH22 ARG A 109 1.075 -11.677 6.561 1.00 4.08 H new ATOM 1624 N VAL A 110 1.821 -5.133 3.922 1.00 0.60 N ATOM 1625 CA VAL A 110 2.425 -4.206 2.925 1.00 0.68 C ATOM 1626 C VAL A 110 1.454 -3.904 1.782 1.00 0.56 C ATOM 1627 O VAL A 110 1.226 -2.759 1.447 1.00 0.60 O ATOM 1628 CB VAL A 110 3.696 -4.836 2.352 1.00 0.88 C ATOM 1629 CG1 VAL A 110 4.473 -3.787 1.553 1.00 1.27 C ATOM 1630 CG2 VAL A 110 4.569 -5.352 3.498 1.00 1.73 C ATOM 0 H VAL A 110 2.285 -6.037 4.007 1.00 0.60 H new ATOM 0 HA VAL A 110 2.659 -3.270 3.431 1.00 0.68 H new ATOM 0 HB VAL A 110 3.426 -5.664 1.697 1.00 0.88 H new ATOM 0 HG11 VAL A 110 5.378 -4.237 1.145 1.00 1.27 H new ATOM 0 HG12 VAL A 110 3.852 -3.418 0.737 1.00 1.27 H new ATOM 0 HG13 VAL A 110 4.743 -2.958 2.207 1.00 1.27 H new ATOM 0 HG21 VAL A 110 5.475 -5.801 3.091 1.00 1.73 H new ATOM 0 HG22 VAL A 110 4.837 -4.523 4.153 1.00 1.73 H new ATOM 0 HG23 VAL A 110 4.017 -6.100 4.067 1.00 1.73 H new ATOM 1640 N VAL A 111 0.895 -4.910 1.153 1.00 0.51 N ATOM 1641 CA VAL A 111 -0.030 -4.629 0.010 1.00 0.50 C ATOM 1642 C VAL A 111 -1.435 -4.317 0.537 1.00 0.46 C ATOM 1643 O VAL A 111 -2.121 -3.458 0.021 1.00 0.47 O ATOM 1644 CB VAL A 111 -0.074 -5.829 -0.934 1.00 0.58 C ATOM 1645 CG1 VAL A 111 1.340 -6.147 -1.425 1.00 1.41 C ATOM 1646 CG2 VAL A 111 -0.641 -7.040 -0.188 1.00 1.36 C ATOM 0 H VAL A 111 1.035 -5.895 1.376 1.00 0.51 H new ATOM 0 HA VAL A 111 0.338 -3.763 -0.540 1.00 0.50 H new ATOM 0 HB VAL A 111 -0.709 -5.597 -1.789 1.00 0.58 H new ATOM 0 HG11 VAL A 111 1.307 -7.003 -2.098 1.00 1.41 H new ATOM 0 HG12 VAL A 111 1.744 -5.284 -1.955 1.00 1.41 H new ATOM 0 HG13 VAL A 111 1.977 -6.380 -0.572 1.00 1.41 H new ATOM 0 HG21 VAL A 111 -0.674 -7.898 -0.859 1.00 1.36 H new ATOM 0 HG22 VAL A 111 -0.005 -7.272 0.666 1.00 1.36 H new ATOM 0 HG23 VAL A 111 -1.649 -6.814 0.161 1.00 1.36 H new ATOM 1656 N ALA A 112 -1.861 -4.988 1.576 1.00 0.45 N ATOM 1657 CA ALA A 112 -3.213 -4.702 2.141 1.00 0.47 C ATOM 1658 C ALA A 112 -3.248 -3.248 2.620 1.00 0.46 C ATOM 1659 O ALA A 112 -4.281 -2.609 2.619 1.00 0.54 O ATOM 1660 CB ALA A 112 -3.507 -5.651 3.306 1.00 0.53 C ATOM 0 H ALA A 112 -1.334 -5.718 2.055 1.00 0.45 H new ATOM 0 HA ALA A 112 -3.974 -4.854 1.375 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -4.495 -5.434 3.711 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -3.478 -6.682 2.952 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -2.757 -5.514 4.085 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.123 -2.710 2.989 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.078 -1.284 3.423 1.00 0.43 C ATOM 1668 C LEU A 113 -2.122 -0.403 2.173 1.00 0.42 C ATOM 1669 O LEU A 113 -2.888 0.535 2.076 1.00 0.45 O ATOM 1670 CB LEU A 113 -0.759 -1.034 4.172 1.00 0.44 C ATOM 1671 CG LEU A 113 -0.615 0.454 4.539 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -1.813 0.916 5.385 1.00 1.45 C ATOM 1673 CD2 LEU A 113 0.678 0.645 5.338 1.00 1.27 C ATOM 0 H LEU A 113 -1.227 -3.196 3.010 1.00 0.43 H new ATOM 0 HA LEU A 113 -2.919 -1.055 4.077 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -0.728 -1.641 5.077 1.00 0.44 H new ATOM 0 HB3 LEU A 113 0.082 -1.344 3.551 1.00 0.44 H new ATOM 0 HG LEU A 113 -0.584 1.048 3.625 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -1.696 1.970 5.636 1.00 1.45 H new ATOM 0 HD12 LEU A 113 -2.734 0.778 4.818 1.00 1.45 H new ATOM 0 HD13 LEU A 113 -1.860 0.328 6.301 1.00 1.45 H new ATOM 0 HD21 LEU A 113 0.790 1.696 5.603 1.00 1.27 H new ATOM 0 HD22 LEU A 113 0.637 0.044 6.246 1.00 1.27 H new ATOM 0 HD23 LEU A 113 1.529 0.331 4.734 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.286 -0.708 1.223 1.00 0.40 N ATOM 1686 CA PHE A 114 -1.225 0.083 -0.038 1.00 0.40 C ATOM 1687 C PHE A 114 -2.607 0.147 -0.692 1.00 0.39 C ATOM 1688 O PHE A 114 -3.036 1.176 -1.171 1.00 0.41 O ATOM 1689 CB PHE A 114 -0.245 -0.594 -1.003 1.00 0.41 C ATOM 1690 CG PHE A 114 1.204 -0.403 -0.559 1.00 0.44 C ATOM 1691 CD1 PHE A 114 1.540 -0.061 0.771 1.00 1.27 C ATOM 1692 CD2 PHE A 114 2.227 -0.588 -1.499 1.00 1.29 C ATOM 1693 CE1 PHE A 114 2.880 0.089 1.138 1.00 1.27 C ATOM 1694 CE2 PHE A 114 3.567 -0.432 -1.123 1.00 1.38 C ATOM 1695 CZ PHE A 114 3.892 -0.096 0.194 1.00 0.68 C ATOM 0 H PHE A 114 -0.629 -1.487 1.267 1.00 0.40 H new ATOM 0 HA PHE A 114 -0.893 1.096 0.191 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -0.470 -1.659 -1.064 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -0.377 -0.183 -2.004 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.760 0.084 1.504 1.00 1.27 H new ATOM 0 HD2 PHE A 114 1.981 -0.852 -2.517 1.00 1.29 H new ATOM 0 HE1 PHE A 114 3.134 0.349 2.155 1.00 1.27 H new ATOM 0 HE2 PHE A 114 4.351 -0.572 -1.853 1.00 1.38 H new ATOM 0 HZ PHE A 114 4.926 0.021 0.482 1.00 0.68 H new ATOM 1705 N TYR A 115 -3.303 -0.960 -0.724 1.00 0.40 N ATOM 1706 CA TYR A 115 -4.651 -0.975 -1.357 1.00 0.41 C ATOM 1707 C TYR A 115 -5.667 -0.274 -0.458 1.00 0.41 C ATOM 1708 O TYR A 115 -6.521 0.455 -0.921 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.102 -2.422 -1.583 1.00 0.44 C ATOM 1710 CG TYR A 115 -6.462 -2.422 -2.241 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -7.622 -2.409 -1.456 1.00 1.28 C ATOM 1712 CD2 TYR A 115 -6.564 -2.430 -3.638 1.00 1.24 C ATOM 1713 CE1 TYR A 115 -8.882 -2.403 -2.067 1.00 1.32 C ATOM 1714 CE2 TYR A 115 -7.824 -2.426 -4.248 1.00 1.26 C ATOM 1715 CZ TYR A 115 -8.983 -2.411 -3.463 1.00 0.61 C ATOM 1716 OH TYR A 115 -10.225 -2.404 -4.065 1.00 0.70 O ATOM 0 H TYR A 115 -2.994 -1.853 -0.339 1.00 0.40 H new ATOM 0 HA TYR A 115 -4.591 -0.452 -2.311 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -4.381 -2.946 -2.211 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.144 -2.955 -0.633 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -7.545 -2.404 -0.379 1.00 1.28 H new ATOM 0 HD2 TYR A 115 -5.670 -2.439 -4.245 1.00 1.24 H new ATOM 0 HE1 TYR A 115 -9.776 -2.392 -1.461 1.00 1.32 H new ATOM 0 HE2 TYR A 115 -7.902 -2.434 -5.325 1.00 1.26 H new ATOM 0 HH TYR A 115 -10.116 -2.410 -5.039 1.00 0.70 H new ATOM 1726 N PHE A 116 -5.583 -0.486 0.826 1.00 0.38 N ATOM 1727 CA PHE A 116 -6.550 0.171 1.745 1.00 0.38 C ATOM 1728 C PHE A 116 -6.500 1.686 1.535 1.00 0.36 C ATOM 1729 O PHE A 116 -7.514 2.340 1.427 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.181 -0.157 3.197 1.00 0.40 C ATOM 1731 CG PHE A 116 -7.089 0.604 4.144 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.469 0.351 4.151 1.00 1.35 C ATOM 1733 CD2 PHE A 116 -6.552 1.563 5.017 1.00 1.17 C ATOM 1734 CE1 PHE A 116 -9.306 1.053 5.027 1.00 1.37 C ATOM 1735 CE2 PHE A 116 -7.392 2.263 5.892 1.00 1.18 C ATOM 1736 CZ PHE A 116 -8.768 2.008 5.897 1.00 0.45 C ATOM 0 H PHE A 116 -4.889 -1.083 1.276 1.00 0.38 H new ATOM 0 HA PHE A 116 -7.556 -0.193 1.536 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.274 -1.229 3.372 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.140 0.107 3.386 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -8.886 -0.386 3.480 1.00 1.35 H new ATOM 0 HD2 PHE A 116 -5.490 1.761 5.014 1.00 1.17 H new ATOM 0 HE1 PHE A 116 -10.368 0.857 5.031 1.00 1.37 H new ATOM 0 HE2 PHE A 116 -6.978 3.000 6.564 1.00 1.18 H new ATOM 0 HZ PHE A 116 -9.415 2.548 6.572 1.00 0.45 H new ATOM 1746 N ALA A 117 -5.331 2.258 1.465 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.253 3.727 1.254 1.00 0.34 C ATOM 1748 C ALA A 117 -5.798 4.067 -0.135 1.00 0.34 C ATOM 1749 O ALA A 117 -6.389 5.107 -0.340 1.00 0.34 O ATOM 1750 CB ALA A 117 -3.801 4.194 1.371 1.00 0.37 C ATOM 0 H ALA A 117 -4.435 1.777 1.544 1.00 0.35 H new ATOM 0 HA ALA A 117 -5.848 4.235 2.013 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -3.752 5.272 1.215 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -3.420 3.953 2.363 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.195 3.690 0.618 1.00 0.37 H new ATOM 1756 N SER A 118 -5.612 3.198 -1.093 1.00 0.35 N ATOM 1757 CA SER A 118 -6.123 3.477 -2.464 1.00 0.37 C ATOM 1758 C SER A 118 -7.602 3.869 -2.416 1.00 0.36 C ATOM 1759 O SER A 118 -8.029 4.801 -3.066 1.00 0.36 O ATOM 1760 CB SER A 118 -5.962 2.227 -3.332 1.00 0.42 C ATOM 1761 OG SER A 118 -7.044 1.339 -3.083 1.00 1.25 O ATOM 0 H SER A 118 -5.128 2.307 -0.984 1.00 0.35 H new ATOM 0 HA SER A 118 -5.552 4.302 -2.888 1.00 0.37 H new ATOM 0 HB2 SER A 118 -5.938 2.503 -4.386 1.00 0.42 H new ATOM 0 HB3 SER A 118 -5.015 1.736 -3.110 1.00 0.42 H new ATOM 0 HG SER A 118 -7.041 1.076 -2.139 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.386 3.181 -1.624 1.00 0.37 N ATOM 1768 CA LYS A 119 -9.829 3.541 -1.517 1.00 0.39 C ATOM 1769 C LYS A 119 -9.937 4.939 -0.893 1.00 0.36 C ATOM 1770 O LYS A 119 -10.722 5.754 -1.330 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.579 2.480 -0.677 1.00 0.46 C ATOM 1772 CG LYS A 119 -10.495 2.796 0.830 1.00 1.29 C ATOM 1773 CD LYS A 119 -10.700 1.522 1.654 1.00 1.84 C ATOM 1774 CE LYS A 119 -12.110 0.978 1.425 1.00 2.48 C ATOM 1775 NZ LYS A 119 -12.427 -0.026 2.480 1.00 3.36 N ATOM 0 H LYS A 119 -8.090 2.391 -1.051 1.00 0.37 H new ATOM 0 HA LYS A 119 -10.293 3.559 -2.503 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -11.624 2.442 -0.985 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -10.154 1.495 -0.868 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -9.525 3.235 1.063 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -11.251 3.535 1.096 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -9.961 0.772 1.371 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -10.550 1.735 2.712 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -12.835 1.792 1.451 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -12.180 0.520 0.438 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -13.439 0.023 2.713 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -12.197 -0.979 2.133 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -11.866 0.177 3.332 1.00 3.36 H new ATOM 1789 N LEU A 120 -9.140 5.245 0.091 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.201 6.612 0.682 1.00 0.35 C ATOM 1791 C LEU A 120 -8.862 7.616 -0.427 1.00 0.33 C ATOM 1792 O LEU A 120 -9.483 8.651 -0.562 1.00 0.39 O ATOM 1793 CB LEU A 120 -8.176 6.712 1.832 1.00 0.36 C ATOM 1794 CG LEU A 120 -8.875 6.568 3.192 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -9.554 5.197 3.298 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -7.833 6.689 4.304 1.00 1.28 C ATOM 0 H LEU A 120 -8.455 4.616 0.509 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.192 6.824 1.083 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -7.420 5.935 1.721 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -7.658 7.670 1.783 1.00 0.36 H new ATOM 0 HG LEU A 120 -9.628 7.350 3.289 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -10.046 5.108 4.267 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -10.295 5.095 2.505 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -8.805 4.411 3.198 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -8.322 6.588 5.273 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -7.086 5.903 4.190 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -7.347 7.663 4.243 1.00 1.28 H new ATOM 1808 N VAL A 121 -7.891 7.288 -1.232 1.00 0.33 N ATOM 1809 CA VAL A 121 -7.497 8.174 -2.361 1.00 0.39 C ATOM 1810 C VAL A 121 -8.582 8.153 -3.442 1.00 0.36 C ATOM 1811 O VAL A 121 -9.239 9.141 -3.699 1.00 0.39 O ATOM 1812 CB VAL A 121 -6.178 7.679 -2.956 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -5.762 8.600 -4.105 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.093 7.700 -1.874 1.00 1.18 C ATOM 0 H VAL A 121 -7.345 6.430 -1.154 1.00 0.33 H new ATOM 0 HA VAL A 121 -7.376 9.193 -1.994 1.00 0.39 H new ATOM 0 HB VAL A 121 -6.305 6.663 -3.329 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -4.822 8.249 -4.531 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -6.534 8.593 -4.875 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -5.634 9.615 -3.729 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.152 7.348 -2.296 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -4.967 8.718 -1.505 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -5.388 7.050 -1.051 1.00 1.18 H new ATOM 1824 N LEU A 122 -8.760 7.032 -4.090 1.00 0.37 N ATOM 1825 CA LEU A 122 -9.786 6.943 -5.169 1.00 0.39 C ATOM 1826 C LEU A 122 -11.141 7.451 -4.672 1.00 0.40 C ATOM 1827 O LEU A 122 -11.938 7.958 -5.436 1.00 0.40 O ATOM 1828 CB LEU A 122 -9.941 5.485 -5.616 1.00 0.42 C ATOM 1829 CG LEU A 122 -8.601 4.938 -6.123 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -8.715 3.422 -6.302 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -8.234 5.586 -7.470 1.00 1.24 C ATOM 0 H LEU A 122 -8.238 6.173 -3.918 1.00 0.37 H new ATOM 0 HA LEU A 122 -9.456 7.561 -6.004 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -10.298 4.878 -4.784 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -10.691 5.417 -6.404 1.00 0.42 H new ATOM 0 HG LEU A 122 -7.822 5.171 -5.397 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -7.766 3.026 -6.662 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -8.961 2.960 -5.346 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -9.499 3.199 -7.025 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -7.281 5.188 -7.817 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -9.009 5.364 -8.204 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -8.152 6.666 -7.344 1.00 1.24 H new ATOM 1843 N LYS A 123 -11.403 7.350 -3.396 1.00 0.51 N ATOM 1844 CA LYS A 123 -12.701 7.855 -2.868 1.00 0.55 C ATOM 1845 C LYS A 123 -12.629 9.379 -2.758 1.00 0.54 C ATOM 1846 O LYS A 123 -13.596 10.071 -2.992 1.00 0.55 O ATOM 1847 CB LYS A 123 -12.983 7.240 -1.491 1.00 0.59 C ATOM 1848 CG LYS A 123 -14.342 7.727 -0.965 1.00 0.97 C ATOM 1849 CD LYS A 123 -14.551 7.236 0.474 1.00 1.37 C ATOM 1850 CE LYS A 123 -14.640 5.705 0.516 1.00 1.74 C ATOM 1851 NZ LYS A 123 -15.458 5.212 -0.628 1.00 2.32 N ATOM 0 H LYS A 123 -10.778 6.942 -2.701 1.00 0.51 H new ATOM 0 HA LYS A 123 -13.508 7.573 -3.544 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -12.980 6.152 -1.562 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -12.193 7.516 -0.792 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -14.385 8.816 -0.997 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -15.143 7.357 -1.605 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -13.728 7.575 1.103 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -15.464 7.670 0.883 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -13.640 5.273 0.472 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -15.085 5.384 1.458 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -15.770 4.238 -0.437 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -16.289 5.825 -0.750 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -14.886 5.228 -1.496 1.00 2.32 H new ATOM 1865 N ALA A 124 -11.490 9.907 -2.398 1.00 0.52 N ATOM 1866 CA ALA A 124 -11.371 11.386 -2.273 1.00 0.52 C ATOM 1867 C ALA A 124 -11.320 12.010 -3.664 1.00 0.51 C ATOM 1868 O ALA A 124 -11.735 13.130 -3.880 1.00 0.54 O ATOM 1869 CB ALA A 124 -10.108 11.744 -1.500 1.00 0.51 C ATOM 0 H ALA A 124 -10.642 9.381 -2.186 1.00 0.52 H new ATOM 0 HA ALA A 124 -12.236 11.772 -1.733 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -10.029 12.828 -1.414 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -10.153 11.303 -0.504 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -9.236 11.358 -2.028 1.00 0.51 H new ATOM 1875 N LEU A 125 -10.828 11.268 -4.617 1.00 0.47 N ATOM 1876 CA LEU A 125 -10.756 11.765 -6.004 1.00 0.47 C ATOM 1877 C LEU A 125 -12.171 11.890 -6.564 1.00 0.48 C ATOM 1878 O LEU A 125 -12.520 12.876 -7.183 1.00 0.48 O ATOM 1879 CB LEU A 125 -9.967 10.751 -6.844 1.00 0.51 C ATOM 1880 CG LEU A 125 -9.895 11.229 -8.318 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -8.466 11.084 -8.857 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -10.843 10.397 -9.193 1.00 1.21 C ATOM 0 H LEU A 125 -10.469 10.323 -4.483 1.00 0.47 H new ATOM 0 HA LEU A 125 -10.266 12.738 -6.032 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -8.961 10.636 -6.440 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -10.445 9.773 -6.793 1.00 0.51 H new ATOM 0 HG LEU A 125 -10.192 12.277 -8.350 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -8.431 11.423 -9.892 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -7.787 11.687 -8.255 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -8.163 10.038 -8.808 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -10.783 10.743 -10.225 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -10.555 9.347 -9.145 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -11.865 10.510 -8.831 1.00 1.21 H new ATOM 1894 N CYS A 126 -12.977 10.879 -6.393 1.00 0.52 N ATOM 1895 CA CYS A 126 -14.359 10.922 -6.956 1.00 0.57 C ATOM 1896 C CYS A 126 -15.225 11.941 -6.205 1.00 0.57 C ATOM 1897 O CYS A 126 -16.321 12.259 -6.622 1.00 0.68 O ATOM 1898 CB CYS A 126 -14.994 9.519 -6.844 1.00 0.66 C ATOM 1899 SG CYS A 126 -15.826 9.321 -5.240 1.00 1.67 S ATOM 0 H CYS A 126 -12.740 10.025 -5.888 1.00 0.52 H new ATOM 0 HA CYS A 126 -14.303 11.226 -8.001 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -15.711 9.372 -7.652 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -14.225 8.755 -6.958 1.00 0.66 H new ATOM 0 HG CYS A 126 -14.963 9.478 -4.281 1.00 1.67 H new ATOM 1905 N THR A 127 -14.748 12.445 -5.094 1.00 0.57 N ATOM 1906 CA THR A 127 -15.555 13.431 -4.310 1.00 0.60 C ATOM 1907 C THR A 127 -15.186 14.845 -4.729 1.00 0.62 C ATOM 1908 O THR A 127 -15.773 15.804 -4.278 1.00 0.70 O ATOM 1909 CB THR A 127 -15.316 13.195 -2.800 1.00 0.60 C ATOM 1910 OG1 THR A 127 -13.922 13.180 -2.538 1.00 1.14 O ATOM 1911 CG2 THR A 127 -15.937 11.830 -2.480 1.00 1.19 C ATOM 0 H THR A 127 -13.837 12.217 -4.696 1.00 0.57 H new ATOM 0 HA THR A 127 -16.618 13.297 -4.510 1.00 0.60 H new ATOM 0 HB THR A 127 -15.760 13.980 -2.188 1.00 0.60 H new ATOM 0 HG1 THR A 127 -13.437 13.492 -3.330 1.00 1.14 H new ATOM 0 HG21 THR A 127 -15.799 11.607 -1.422 1.00 1.19 H new ATOM 0 HG22 THR A 127 -17.002 11.852 -2.711 1.00 1.19 H new ATOM 0 HG23 THR A 127 -15.452 11.060 -3.080 1.00 1.19 H new ATOM 1919 N LYS A 128 -14.220 14.972 -5.611 1.00 0.60 N ATOM 1920 CA LYS A 128 -13.821 16.323 -6.096 1.00 0.70 C ATOM 1921 C LYS A 128 -13.118 17.113 -5.001 1.00 0.61 C ATOM 1922 O LYS A 128 -13.339 18.302 -4.865 1.00 0.60 O ATOM 1923 CB LYS A 128 -15.051 17.103 -6.595 1.00 0.87 C ATOM 1924 CG LYS A 128 -15.960 16.178 -7.424 1.00 1.12 C ATOM 1925 CD LYS A 128 -16.834 17.015 -8.363 1.00 1.43 C ATOM 1926 CE LYS A 128 -17.802 16.099 -9.116 1.00 1.83 C ATOM 1927 NZ LYS A 128 -18.867 15.629 -8.185 1.00 2.47 N ATOM 0 H LYS A 128 -13.694 14.195 -6.012 1.00 0.60 H new ATOM 0 HA LYS A 128 -13.126 16.186 -6.924 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -15.605 17.506 -5.747 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -14.733 17.952 -7.200 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -15.354 15.480 -8.002 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -16.588 15.582 -6.762 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -17.391 17.758 -7.792 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -16.208 17.559 -9.070 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -18.247 16.634 -9.955 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -17.264 15.246 -9.531 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -19.653 15.225 -8.733 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -18.478 14.903 -7.551 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -19.214 16.431 -7.621 1.00 2.47 H new ATOM 1941 N VAL A 129 -12.236 16.497 -4.243 1.00 0.60 N ATOM 1942 CA VAL A 129 -11.476 17.253 -3.194 1.00 0.53 C ATOM 1943 C VAL A 129 -9.999 16.840 -3.328 1.00 0.53 C ATOM 1944 O VAL A 129 -9.509 16.073 -2.525 1.00 0.56 O ATOM 1945 CB VAL A 129 -11.992 16.869 -1.807 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -11.397 17.803 -0.757 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -13.518 16.964 -1.785 1.00 1.22 C ATOM 0 H VAL A 129 -12.011 15.504 -4.307 1.00 0.60 H new ATOM 0 HA VAL A 129 -11.597 18.329 -3.321 1.00 0.53 H new ATOM 0 HB VAL A 129 -11.693 15.846 -1.581 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -11.768 17.525 0.229 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -10.310 17.722 -0.772 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -11.687 18.830 -0.977 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -13.885 16.690 -0.796 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -13.822 17.985 -2.015 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -13.936 16.285 -2.528 1.00 1.22 H new ATOM 1957 N PRO A 130 -9.337 17.312 -4.370 1.00 0.62 N ATOM 1958 CA PRO A 130 -7.937 16.930 -4.629 1.00 0.73 C ATOM 1959 C PRO A 130 -7.009 17.336 -3.473 1.00 0.65 C ATOM 1960 O PRO A 130 -5.958 16.740 -3.285 1.00 0.64 O ATOM 1961 CB PRO A 130 -7.553 17.654 -5.942 1.00 1.00 C ATOM 1962 CG PRO A 130 -8.788 18.486 -6.393 1.00 1.00 C ATOM 1963 CD PRO A 130 -9.912 18.255 -5.358 1.00 0.75 C ATOM 0 HA PRO A 130 -7.830 15.849 -4.716 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -6.690 18.302 -5.785 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -7.275 16.933 -6.711 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -8.535 19.545 -6.453 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -9.114 18.179 -7.387 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -10.210 19.190 -4.884 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -10.802 17.839 -5.829 1.00 0.75 H new ATOM 1971 N GLU A 131 -7.339 18.351 -2.707 1.00 0.73 N ATOM 1972 CA GLU A 131 -6.390 18.745 -1.617 1.00 0.82 C ATOM 1973 C GLU A 131 -6.353 17.601 -0.598 1.00 0.72 C ATOM 1974 O GLU A 131 -5.449 17.484 0.204 1.00 0.73 O ATOM 1975 CB GLU A 131 -6.841 20.060 -0.982 1.00 1.09 C ATOM 1976 CG GLU A 131 -5.792 20.556 0.007 1.00 1.55 C ATOM 1977 CD GLU A 131 -6.266 21.875 0.621 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -7.398 21.922 1.075 1.00 2.86 O ATOM 1979 OE2 GLU A 131 -5.491 22.817 0.623 1.00 2.52 O ATOM 0 H GLU A 131 -8.192 18.905 -2.784 1.00 0.73 H new ATOM 0 HA GLU A 131 -5.386 18.910 -2.008 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -7.003 20.809 -1.757 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -7.794 19.918 -0.472 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -5.632 19.814 0.789 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -4.837 20.698 -0.498 1.00 1.55 H new ATOM 1986 N LEU A 132 -7.334 16.741 -0.667 1.00 0.71 N ATOM 1987 CA LEU A 132 -7.402 15.562 0.241 1.00 0.69 C ATOM 1988 C LEU A 132 -6.583 14.418 -0.373 1.00 0.58 C ATOM 1989 O LEU A 132 -6.092 13.559 0.332 1.00 0.59 O ATOM 1990 CB LEU A 132 -8.869 15.156 0.436 1.00 0.80 C ATOM 1991 CG LEU A 132 -8.988 13.985 1.421 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -8.456 14.389 2.810 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -10.464 13.580 1.531 1.00 0.77 C ATOM 0 H LEU A 132 -8.107 16.809 -1.329 1.00 0.71 H new ATOM 0 HA LEU A 132 -6.985 15.804 1.218 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -9.440 16.007 0.807 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -9.303 14.875 -0.523 1.00 0.80 H new ATOM 0 HG LEU A 132 -8.394 13.147 1.056 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -8.549 13.546 3.495 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -7.408 14.677 2.729 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -9.035 15.231 3.191 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -10.562 12.748 2.229 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -11.048 14.427 1.892 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -10.832 13.277 0.551 1.00 0.77 H new ATOM 2005 N ILE A 133 -6.408 14.397 -1.665 1.00 0.52 N ATOM 2006 CA ILE A 133 -5.590 13.310 -2.286 1.00 0.46 C ATOM 2007 C ILE A 133 -4.173 13.382 -1.706 1.00 0.43 C ATOM 2008 O ILE A 133 -3.617 12.397 -1.262 1.00 0.46 O ATOM 2009 CB ILE A 133 -5.543 13.514 -3.813 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -6.908 13.139 -4.408 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -4.450 12.626 -4.433 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -6.953 13.491 -5.899 1.00 1.19 C ATOM 0 H ILE A 133 -6.792 15.080 -2.317 1.00 0.52 H new ATOM 0 HA ILE A 133 -6.029 12.335 -2.074 1.00 0.46 H new ATOM 0 HB ILE A 133 -5.314 14.557 -4.032 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -7.091 12.073 -4.273 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -7.701 13.667 -3.878 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -4.426 12.778 -5.512 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -3.482 12.890 -4.008 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -4.667 11.579 -4.219 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -7.926 13.220 -6.308 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -6.792 14.562 -6.025 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -6.172 12.942 -6.426 1.00 1.19 H new ATOM 2024 N ARG A 134 -3.596 14.553 -1.698 1.00 0.42 N ATOM 2025 CA ARG A 134 -2.218 14.723 -1.139 1.00 0.43 C ATOM 2026 C ARG A 134 -2.220 14.493 0.379 1.00 0.40 C ATOM 2027 O ARG A 134 -1.353 13.828 0.908 1.00 0.39 O ATOM 2028 CB ARG A 134 -1.724 16.143 -1.431 1.00 0.51 C ATOM 2029 CG ARG A 134 -0.234 16.246 -1.094 1.00 1.26 C ATOM 2030 CD ARG A 134 0.248 17.682 -1.316 1.00 1.57 C ATOM 2031 NE ARG A 134 0.261 17.981 -2.776 1.00 2.30 N ATOM 2032 CZ ARG A 134 0.370 19.214 -3.191 1.00 2.86 C ATOM 2033 NH1 ARG A 134 0.480 20.187 -2.328 1.00 2.98 N ATOM 2034 NH2 ARG A 134 0.373 19.474 -4.470 1.00 3.71 N ATOM 0 H ARG A 134 -4.021 15.408 -2.057 1.00 0.42 H new ATOM 0 HA ARG A 134 -1.558 13.992 -1.606 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -1.888 16.388 -2.480 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -2.291 16.865 -0.843 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -0.064 15.951 -0.058 1.00 1.26 H new ATOM 0 HG3 ARG A 134 0.338 15.560 -1.718 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -0.407 18.381 -0.796 1.00 1.57 H new ATOM 0 HD3 ARG A 134 1.247 17.810 -0.899 1.00 1.57 H new ATOM 0 HE ARG A 134 0.185 17.221 -3.452 1.00 2.30 H new ATOM 0 HH11 ARG A 134 0.481 19.984 -1.328 1.00 2.98 H new ATOM 0 HH12 ARG A 134 0.565 21.150 -2.653 1.00 2.98 H new ATOM 0 HH21 ARG A 134 0.290 18.714 -5.145 1.00 3.71 H new ATOM 0 HH22 ARG A 134 0.458 20.437 -4.794 1.00 3.71 H new ATOM 2048 N THR A 135 -3.168 15.044 1.088 1.00 0.41 N ATOM 2049 CA THR A 135 -3.181 14.851 2.568 1.00 0.41 C ATOM 2050 C THR A 135 -3.186 13.357 2.909 1.00 0.39 C ATOM 2051 O THR A 135 -2.554 12.920 3.851 1.00 0.52 O ATOM 2052 CB THR A 135 -4.409 15.526 3.177 1.00 0.42 C ATOM 2053 OG1 THR A 135 -4.304 16.931 3.003 1.00 0.89 O ATOM 2054 CG2 THR A 135 -4.491 15.205 4.673 1.00 0.88 C ATOM 0 H THR A 135 -3.926 15.613 0.713 1.00 0.41 H new ATOM 0 HA THR A 135 -2.282 15.306 2.985 1.00 0.41 H new ATOM 0 HB THR A 135 -5.307 15.157 2.681 1.00 0.42 H new ATOM 0 HG1 THR A 135 -4.668 17.180 2.128 1.00 0.89 H new ATOM 0 HG21 THR A 135 -5.369 15.689 5.101 1.00 0.88 H new ATOM 0 HG22 THR A 135 -4.568 14.126 4.810 1.00 0.88 H new ATOM 0 HG23 THR A 135 -3.594 15.571 5.173 1.00 0.88 H new ATOM 2062 N ILE A 136 -3.853 12.561 2.116 1.00 0.35 N ATOM 2063 CA ILE A 136 -3.861 11.089 2.352 1.00 0.36 C ATOM 2064 C ILE A 136 -2.447 10.559 2.117 1.00 0.35 C ATOM 2065 O ILE A 136 -1.790 10.138 3.049 1.00 0.51 O ATOM 2066 CB ILE A 136 -4.863 10.433 1.389 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -6.291 10.803 1.831 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -4.697 8.910 1.419 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -7.271 10.620 0.669 1.00 0.64 C ATOM 0 H ILE A 136 -4.396 12.870 1.310 1.00 0.35 H new ATOM 0 HA ILE A 136 -4.164 10.857 3.373 1.00 0.36 H new ATOM 0 HB ILE A 136 -4.682 10.788 0.375 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -6.592 10.178 2.672 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -6.316 11.836 2.177 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -5.411 8.453 0.734 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -3.683 8.648 1.115 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -4.879 8.544 2.430 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -8.276 10.885 0.996 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -6.977 11.264 -0.160 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -7.258 9.580 0.342 1.00 0.64 H new ATOM 2081 N MET A 137 -1.970 10.555 0.895 1.00 0.35 N ATOM 2082 CA MET A 137 -0.587 10.043 0.621 1.00 0.33 C ATOM 2083 C MET A 137 0.370 10.485 1.737 1.00 0.31 C ATOM 2084 O MET A 137 1.367 9.858 2.025 1.00 0.34 O ATOM 2085 CB MET A 137 -0.104 10.598 -0.722 1.00 0.36 C ATOM 2086 CG MET A 137 -0.999 10.072 -1.849 1.00 0.67 C ATOM 2087 SD MET A 137 -0.811 11.125 -3.309 1.00 1.13 S ATOM 2088 CE MET A 137 0.852 10.584 -3.775 1.00 0.67 C ATOM 0 H MET A 137 -2.478 10.884 0.074 1.00 0.35 H new ATOM 0 HA MET A 137 -0.605 8.954 0.585 1.00 0.33 H new ATOM 0 HB2 MET A 137 -0.126 11.688 -0.705 1.00 0.36 H new ATOM 0 HB3 MET A 137 0.930 10.303 -0.898 1.00 0.36 H new ATOM 0 HG2 MET A 137 -0.730 9.044 -2.092 1.00 0.67 H new ATOM 0 HG3 MET A 137 -2.040 10.062 -1.526 1.00 0.67 H new ATOM 0 HE1 MET A 137 1.556 11.402 -3.625 1.00 0.67 H new ATOM 0 HE2 MET A 137 1.145 9.735 -3.157 1.00 0.67 H new ATOM 0 HE3 MET A 137 0.858 10.288 -4.824 1.00 0.67 H new ATOM 2098 N GLY A 138 0.033 11.576 2.370 1.00 0.31 N ATOM 2099 CA GLY A 138 0.856 12.114 3.490 1.00 0.33 C ATOM 2100 C GLY A 138 0.824 11.124 4.658 1.00 0.33 C ATOM 2101 O GLY A 138 1.841 10.786 5.227 1.00 0.34 O ATOM 0 H GLY A 138 -0.796 12.128 2.152 1.00 0.31 H new ATOM 0 HA2 GLY A 138 1.883 12.272 3.160 1.00 0.33 H new ATOM 0 HA3 GLY A 138 0.471 13.083 3.808 1.00 0.33 H new ATOM 2105 N TRP A 139 -0.342 10.653 5.011 1.00 0.34 N ATOM 2106 CA TRP A 139 -0.442 9.677 6.133 1.00 0.37 C ATOM 2107 C TRP A 139 0.165 8.330 5.719 1.00 0.35 C ATOM 2108 O TRP A 139 0.523 7.523 6.553 1.00 0.39 O ATOM 2109 CB TRP A 139 -1.902 9.473 6.541 1.00 0.43 C ATOM 2110 CG TRP A 139 -2.558 10.786 6.842 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -1.925 11.918 7.242 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -3.976 11.114 6.781 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -2.867 12.914 7.427 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -4.145 12.467 7.155 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -5.120 10.372 6.439 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -5.406 13.064 7.189 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -6.391 10.969 6.471 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -6.533 12.312 6.846 1.00 0.78 C ATOM 0 H TRP A 139 -1.228 10.902 4.571 1.00 0.34 H new ATOM 0 HA TRP A 139 0.111 10.078 6.983 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -2.441 8.967 5.740 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -1.953 8.827 7.417 1.00 0.43 H new ATOM 0 HD1 TRP A 139 -0.861 12.024 7.391 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -2.645 13.863 7.728 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -5.021 9.336 6.150 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -5.510 14.099 7.478 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -7.263 10.390 6.205 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -7.513 12.766 6.870 1.00 0.78 H new ATOM 2129 N THR A 140 0.290 8.074 4.442 1.00 0.34 N ATOM 2130 CA THR A 140 0.881 6.774 4.005 1.00 0.36 C ATOM 2131 C THR A 140 2.398 6.814 4.215 1.00 0.34 C ATOM 2132 O THR A 140 2.945 6.054 4.990 1.00 0.39 O ATOM 2133 CB THR A 140 0.568 6.530 2.526 1.00 0.38 C ATOM 2134 OG1 THR A 140 1.184 7.537 1.737 1.00 1.20 O ATOM 2135 CG2 THR A 140 -0.946 6.562 2.311 1.00 1.17 C ATOM 0 H THR A 140 0.011 8.703 3.689 1.00 0.34 H new ATOM 0 HA THR A 140 0.452 5.964 4.594 1.00 0.36 H new ATOM 0 HB THR A 140 0.954 5.554 2.230 1.00 0.38 H new ATOM 0 HG1 THR A 140 1.091 8.405 2.183 1.00 1.20 H new ATOM 0 HG21 THR A 140 -1.168 6.388 1.258 1.00 1.17 H new ATOM 0 HG22 THR A 140 -1.416 5.785 2.914 1.00 1.17 H new ATOM 0 HG23 THR A 140 -1.335 7.536 2.608 1.00 1.17 H new ATOM 2143 N LEU A 141 3.081 7.700 3.541 1.00 0.33 N ATOM 2144 CA LEU A 141 4.560 7.796 3.716 1.00 0.34 C ATOM 2145 C LEU A 141 4.889 8.037 5.195 1.00 0.33 C ATOM 2146 O LEU A 141 5.951 7.683 5.665 1.00 0.33 O ATOM 2147 CB LEU A 141 5.123 8.931 2.856 1.00 0.35 C ATOM 2148 CG LEU A 141 4.809 8.678 1.374 1.00 0.41 C ATOM 2149 CD1 LEU A 141 5.154 9.930 0.564 1.00 0.99 C ATOM 2150 CD2 LEU A 141 5.626 7.485 0.851 1.00 0.80 C ATOM 0 H LEU A 141 2.679 8.362 2.877 1.00 0.33 H new ATOM 0 HA LEU A 141 5.019 6.860 3.396 1.00 0.34 H new ATOM 0 HB2 LEU A 141 4.693 9.882 3.169 1.00 0.35 H new ATOM 0 HB3 LEU A 141 6.201 9.006 2.999 1.00 0.35 H new ATOM 0 HG LEU A 141 3.748 8.450 1.269 1.00 0.41 H new ATOM 0 HD11 LEU A 141 4.933 9.755 -0.489 1.00 0.99 H new ATOM 0 HD12 LEU A 141 4.562 10.771 0.924 1.00 0.99 H new ATOM 0 HD13 LEU A 141 6.214 10.157 0.679 1.00 0.99 H new ATOM 0 HD21 LEU A 141 5.393 7.318 -0.201 1.00 0.80 H new ATOM 0 HD22 LEU A 141 6.690 7.698 0.958 1.00 0.80 H new ATOM 0 HD23 LEU A 141 5.375 6.593 1.425 1.00 0.80 H new ATOM 2162 N ASP A 142 3.989 8.621 5.938 1.00 0.36 N ATOM 2163 CA ASP A 142 4.268 8.852 7.386 1.00 0.37 C ATOM 2164 C ASP A 142 4.339 7.495 8.090 1.00 0.37 C ATOM 2165 O ASP A 142 5.343 7.130 8.669 1.00 0.42 O ATOM 2166 CB ASP A 142 3.138 9.680 8.001 1.00 0.37 C ATOM 2167 CG ASP A 142 3.208 11.114 7.471 1.00 0.78 C ATOM 2168 OD1 ASP A 142 4.107 11.396 6.695 1.00 1.32 O ATOM 2169 OD2 ASP A 142 2.362 11.907 7.851 1.00 1.59 O ATOM 0 H ASP A 142 3.080 8.946 5.610 1.00 0.36 H new ATOM 0 HA ASP A 142 5.210 9.388 7.502 1.00 0.37 H new ATOM 0 HB2 ASP A 142 2.173 9.237 7.755 1.00 0.37 H new ATOM 0 HB3 ASP A 142 3.222 9.678 9.088 1.00 0.37 H new ATOM 2174 N PHE A 143 3.273 6.743 8.027 1.00 0.41 N ATOM 2175 CA PHE A 143 3.249 5.398 8.669 1.00 0.43 C ATOM 2176 C PHE A 143 4.371 4.528 8.097 1.00 0.43 C ATOM 2177 O PHE A 143 5.068 3.854 8.831 1.00 0.45 O ATOM 2178 CB PHE A 143 1.896 4.732 8.387 1.00 0.44 C ATOM 2179 CG PHE A 143 1.906 3.310 8.901 1.00 0.47 C ATOM 2180 CD1 PHE A 143 2.468 2.289 8.124 1.00 1.16 C ATOM 2181 CD2 PHE A 143 1.351 3.012 10.152 1.00 1.29 C ATOM 2182 CE1 PHE A 143 2.476 0.972 8.597 1.00 1.22 C ATOM 2183 CE2 PHE A 143 1.360 1.693 10.625 1.00 1.35 C ATOM 2184 CZ PHE A 143 1.922 0.674 9.848 1.00 0.72 C ATOM 0 H PHE A 143 2.409 7.007 7.553 1.00 0.41 H new ATOM 0 HA PHE A 143 3.393 5.507 9.744 1.00 0.43 H new ATOM 0 HB2 PHE A 143 1.096 5.296 8.867 1.00 0.44 H new ATOM 0 HB3 PHE A 143 1.693 4.740 7.316 1.00 0.44 H new ATOM 0 HD1 PHE A 143 2.895 2.518 7.159 1.00 1.16 H new ATOM 0 HD2 PHE A 143 0.916 3.798 10.752 1.00 1.29 H new ATOM 0 HE1 PHE A 143 2.909 0.185 7.997 1.00 1.22 H new ATOM 0 HE2 PHE A 143 0.933 1.463 11.590 1.00 1.35 H new ATOM 0 HZ PHE A 143 1.928 -0.342 10.213 1.00 0.72 H new ATOM 2194 N LEU A 144 4.562 4.523 6.808 1.00 0.45 N ATOM 2195 CA LEU A 144 5.648 3.674 6.245 1.00 0.47 C ATOM 2196 C LEU A 144 6.982 4.139 6.845 1.00 0.47 C ATOM 2197 O LEU A 144 7.750 3.343 7.344 1.00 0.49 O ATOM 2198 CB LEU A 144 5.604 3.742 4.693 1.00 0.49 C ATOM 2199 CG LEU A 144 7.006 3.829 4.046 1.00 0.64 C ATOM 2200 CD1 LEU A 144 7.746 2.496 4.196 1.00 1.31 C ATOM 2201 CD2 LEU A 144 6.845 4.150 2.559 1.00 1.01 C ATOM 0 H LEU A 144 4.023 5.061 6.129 1.00 0.45 H new ATOM 0 HA LEU A 144 5.520 2.624 6.508 1.00 0.47 H new ATOM 0 HB2 LEU A 144 5.089 2.860 4.312 1.00 0.49 H new ATOM 0 HB3 LEU A 144 5.017 4.609 4.390 1.00 0.49 H new ATOM 0 HG LEU A 144 7.582 4.610 4.543 1.00 0.64 H new ATOM 0 HD11 LEU A 144 8.731 2.573 3.736 1.00 1.31 H new ATOM 0 HD12 LEU A 144 7.857 2.259 5.254 1.00 1.31 H new ATOM 0 HD13 LEU A 144 7.177 1.707 3.705 1.00 1.31 H new ATOM 0 HD21 LEU A 144 7.828 4.214 2.092 1.00 1.01 H new ATOM 0 HD22 LEU A 144 6.265 3.363 2.078 1.00 1.01 H new ATOM 0 HD23 LEU A 144 6.327 5.103 2.446 1.00 1.01 H new ATOM 2213 N ARG A 145 7.263 5.403 6.809 1.00 0.47 N ATOM 2214 CA ARG A 145 8.547 5.894 7.385 1.00 0.48 C ATOM 2215 C ARG A 145 8.602 5.636 8.899 1.00 0.49 C ATOM 2216 O ARG A 145 9.657 5.382 9.445 1.00 0.50 O ATOM 2217 CB ARG A 145 8.676 7.398 7.118 1.00 0.49 C ATOM 2218 CG ARG A 145 9.966 7.934 7.753 1.00 0.69 C ATOM 2219 CD ARG A 145 10.157 9.403 7.360 1.00 0.68 C ATOM 2220 NE ARG A 145 11.225 10.026 8.213 1.00 1.56 N ATOM 2221 CZ ARG A 145 11.129 10.065 9.517 1.00 2.10 C ATOM 2222 NH1 ARG A 145 10.022 9.711 10.111 1.00 2.12 N ATOM 2223 NH2 ARG A 145 12.130 10.507 10.227 1.00 3.16 N ATOM 0 H ARG A 145 6.663 6.123 6.407 1.00 0.47 H new ATOM 0 HA ARG A 145 9.370 5.357 6.914 1.00 0.48 H new ATOM 0 HB2 ARG A 145 8.684 7.586 6.044 1.00 0.49 H new ATOM 0 HB3 ARG A 145 7.813 7.924 7.527 1.00 0.49 H new ATOM 0 HG2 ARG A 145 9.916 7.840 8.838 1.00 0.69 H new ATOM 0 HG3 ARG A 145 10.820 7.344 7.421 1.00 0.69 H new ATOM 0 HD2 ARG A 145 10.432 9.474 6.308 1.00 0.68 H new ATOM 0 HD3 ARG A 145 9.220 9.946 7.482 1.00 0.68 H new ATOM 0 HE ARG A 145 12.047 10.429 7.763 1.00 1.56 H new ATOM 0 HH11 ARG A 145 9.223 9.401 9.558 1.00 2.12 H new ATOM 0 HH12 ARG A 145 9.956 9.744 11.128 1.00 2.12 H new ATOM 0 HH21 ARG A 145 12.984 10.821 9.765 1.00 3.16 H new ATOM 0 HH22 ARG A 145 12.059 10.539 11.244 1.00 3.16 H new ATOM 2237 N GLU A 146 7.503 5.753 9.597 1.00 0.49 N ATOM 2238 CA GLU A 146 7.551 5.567 11.084 1.00 0.51 C ATOM 2239 C GLU A 146 7.494 4.084 11.483 1.00 0.53 C ATOM 2240 O GLU A 146 8.326 3.631 12.245 1.00 0.55 O ATOM 2241 CB GLU A 146 6.387 6.319 11.732 1.00 0.52 C ATOM 2242 CG GLU A 146 6.582 7.825 11.546 1.00 0.96 C ATOM 2243 CD GLU A 146 5.357 8.570 12.081 1.00 1.48 C ATOM 2244 OE1 GLU A 146 5.192 8.606 13.289 1.00 2.22 O ATOM 2245 OE2 GLU A 146 4.606 9.092 11.274 1.00 2.03 O ATOM 0 H GLU A 146 6.583 5.967 9.211 1.00 0.49 H new ATOM 0 HA GLU A 146 8.501 5.967 11.437 1.00 0.51 H new ATOM 0 HB2 GLU A 146 5.444 6.006 11.284 1.00 0.52 H new ATOM 0 HB3 GLU A 146 6.331 6.078 12.793 1.00 0.52 H new ATOM 0 HG2 GLU A 146 7.479 8.154 12.072 1.00 0.96 H new ATOM 0 HG3 GLU A 146 6.729 8.056 10.491 1.00 0.96 H new ATOM 2252 N ARG A 147 6.524 3.326 11.038 1.00 0.59 N ATOM 2253 CA ARG A 147 6.451 1.890 11.480 1.00 0.62 C ATOM 2254 C ARG A 147 7.182 0.968 10.498 1.00 0.58 C ATOM 2255 O ARG A 147 7.935 0.097 10.884 1.00 0.62 O ATOM 2256 CB ARG A 147 4.979 1.475 11.568 1.00 0.63 C ATOM 2257 CG ARG A 147 4.253 2.331 12.621 1.00 0.73 C ATOM 2258 CD ARG A 147 4.520 1.787 14.032 1.00 1.11 C ATOM 2259 NE ARG A 147 3.674 2.522 15.014 1.00 1.75 N ATOM 2260 CZ ARG A 147 3.514 2.048 16.219 1.00 2.40 C ATOM 2261 NH1 ARG A 147 4.091 0.928 16.562 1.00 2.71 N ATOM 2262 NH2 ARG A 147 2.780 2.695 17.082 1.00 3.30 N ATOM 0 H ARG A 147 5.789 3.627 10.399 1.00 0.59 H new ATOM 0 HA ARG A 147 6.934 1.799 12.453 1.00 0.62 H new ATOM 0 HB2 ARG A 147 4.500 1.595 10.596 1.00 0.63 H new ATOM 0 HB3 ARG A 147 4.905 0.420 11.831 1.00 0.63 H new ATOM 0 HG2 ARG A 147 4.591 3.365 12.553 1.00 0.73 H new ATOM 0 HG3 ARG A 147 3.181 2.332 12.422 1.00 0.73 H new ATOM 0 HD2 ARG A 147 4.298 0.721 14.071 1.00 1.11 H new ATOM 0 HD3 ARG A 147 5.574 1.903 14.285 1.00 1.11 H new ATOM 0 HE ARG A 147 3.220 3.395 14.744 1.00 1.75 H new ATOM 0 HH11 ARG A 147 4.667 0.424 15.888 1.00 2.71 H new ATOM 0 HH12 ARG A 147 3.966 0.557 17.504 1.00 2.71 H new ATOM 0 HH21 ARG A 147 2.331 3.571 16.815 1.00 3.30 H new ATOM 0 HH22 ARG A 147 2.655 2.325 18.024 1.00 3.30 H new ATOM 2276 N LEU A 148 6.938 1.145 9.236 1.00 0.53 N ATOM 2277 CA LEU A 148 7.577 0.284 8.200 1.00 0.57 C ATOM 2278 C LEU A 148 8.924 0.890 7.757 1.00 0.67 C ATOM 2279 O LEU A 148 9.571 1.599 8.500 1.00 1.61 O ATOM 2280 CB LEU A 148 6.588 0.180 7.004 1.00 0.59 C ATOM 2281 CG LEU A 148 6.344 -1.294 6.609 1.00 0.70 C ATOM 2282 CD1 LEU A 148 5.536 -2.021 7.706 1.00 1.29 C ATOM 2283 CD2 LEU A 148 5.562 -1.336 5.293 1.00 1.34 C ATOM 0 H LEU A 148 6.312 1.861 8.867 1.00 0.53 H new ATOM 0 HA LEU A 148 7.787 -0.709 8.597 1.00 0.57 H new ATOM 0 HB2 LEU A 148 5.641 0.650 7.270 1.00 0.59 H new ATOM 0 HB3 LEU A 148 6.987 0.727 6.150 1.00 0.59 H new ATOM 0 HG LEU A 148 7.305 -1.794 6.492 1.00 0.70 H new ATOM 0 HD11 LEU A 148 5.373 -3.058 7.411 1.00 1.29 H new ATOM 0 HD12 LEU A 148 6.090 -1.993 8.644 1.00 1.29 H new ATOM 0 HD13 LEU A 148 4.574 -1.526 7.838 1.00 1.29 H new ATOM 0 HD21 LEU A 148 5.386 -2.373 5.007 1.00 1.34 H new ATOM 0 HD22 LEU A 148 4.606 -0.828 5.421 1.00 1.34 H new ATOM 0 HD23 LEU A 148 6.136 -0.837 4.512 1.00 1.34 H new ATOM 2295 N LEU A 149 9.352 0.588 6.560 1.00 0.67 N ATOM 2296 CA LEU A 149 10.662 1.104 6.049 1.00 0.57 C ATOM 2297 C LEU A 149 11.802 0.270 6.647 1.00 0.56 C ATOM 2298 O LEU A 149 12.527 -0.401 5.943 1.00 0.58 O ATOM 2299 CB LEU A 149 10.857 2.597 6.412 1.00 0.54 C ATOM 2300 CG LEU A 149 11.709 3.298 5.330 1.00 0.59 C ATOM 2301 CD1 LEU A 149 11.726 4.816 5.564 1.00 0.83 C ATOM 2302 CD2 LEU A 149 13.141 2.750 5.373 1.00 1.21 C ATOM 0 H LEU A 149 8.843 -0.003 5.903 1.00 0.67 H new ATOM 0 HA LEU A 149 10.668 1.019 4.962 1.00 0.57 H new ATOM 0 HB2 LEU A 149 9.888 3.088 6.498 1.00 0.54 H new ATOM 0 HB3 LEU A 149 11.345 2.683 7.383 1.00 0.54 H new ATOM 0 HG LEU A 149 11.272 3.101 4.351 1.00 0.59 H new ATOM 0 HD11 LEU A 149 12.330 5.296 4.794 1.00 0.83 H new ATOM 0 HD12 LEU A 149 10.708 5.202 5.520 1.00 0.83 H new ATOM 0 HD13 LEU A 149 12.152 5.028 6.544 1.00 0.83 H new ATOM 0 HD21 LEU A 149 13.743 3.244 4.610 1.00 1.21 H new ATOM 0 HD22 LEU A 149 13.574 2.939 6.355 1.00 1.21 H new ATOM 0 HD23 LEU A 149 13.126 1.677 5.184 1.00 1.21 H new ATOM 2314 N GLY A 150 11.963 0.311 7.947 1.00 0.56 N ATOM 2315 CA GLY A 150 13.057 -0.475 8.590 1.00 0.58 C ATOM 2316 C GLY A 150 12.957 -1.943 8.171 1.00 0.62 C ATOM 2317 O GLY A 150 13.940 -2.577 7.844 1.00 0.70 O ATOM 0 H GLY A 150 11.385 0.854 8.588 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.027 -0.070 8.300 1.00 0.58 H new ATOM 0 HA3 GLY A 150 12.988 -0.392 9.675 1.00 0.58 H new ATOM 2321 N TRP A 151 11.779 -2.499 8.213 1.00 0.63 N ATOM 2322 CA TRP A 151 11.622 -3.934 7.850 1.00 0.69 C ATOM 2323 C TRP A 151 11.879 -4.123 6.353 1.00 0.70 C ATOM 2324 O TRP A 151 12.310 -5.174 5.922 1.00 0.72 O ATOM 2325 CB TRP A 151 10.198 -4.394 8.204 1.00 0.73 C ATOM 2326 CG TRP A 151 10.113 -4.694 9.670 1.00 1.25 C ATOM 2327 CD1 TRP A 151 10.113 -5.936 10.208 1.00 2.17 C ATOM 2328 CD2 TRP A 151 10.020 -3.764 10.790 1.00 1.86 C ATOM 2329 NE1 TRP A 151 10.027 -5.828 11.584 1.00 2.65 N ATOM 2330 CE2 TRP A 151 9.968 -4.511 11.992 1.00 2.43 C ATOM 2331 CE3 TRP A 151 9.978 -2.361 10.881 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 9.877 -3.888 13.237 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 9.886 -1.731 12.133 1.00 3.62 C ATOM 2334 CH2 TRP A 151 9.836 -2.493 13.309 1.00 3.67 C ATOM 0 H TRP A 151 10.919 -2.022 8.483 1.00 0.63 H new ATOM 0 HA TRP A 151 12.343 -4.532 8.407 1.00 0.69 H new ATOM 0 HB2 TRP A 151 9.479 -3.619 7.939 1.00 0.73 H new ATOM 0 HB3 TRP A 151 9.938 -5.281 7.626 1.00 0.73 H new ATOM 0 HD1 TRP A 151 10.171 -6.861 9.653 1.00 2.17 H new ATOM 0 HE1 TRP A 151 10.009 -6.625 12.220 1.00 2.65 H new ATOM 0 HE3 TRP A 151 10.017 -1.764 9.982 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 9.838 -4.480 14.139 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 9.854 -0.653 12.190 1.00 3.62 H new ATOM 0 HH2 TRP A 151 9.766 -2.003 14.269 1.00 3.67 H new ATOM 2345 N ILE A 152 11.612 -3.128 5.552 1.00 0.73 N ATOM 2346 CA ILE A 152 11.839 -3.284 4.089 1.00 0.76 C ATOM 2347 C ILE A 152 13.342 -3.363 3.800 1.00 0.79 C ATOM 2348 O ILE A 152 13.812 -4.285 3.162 1.00 0.89 O ATOM 2349 CB ILE A 152 11.230 -2.088 3.346 1.00 0.78 C ATOM 2350 CG1 ILE A 152 9.756 -1.951 3.743 1.00 0.83 C ATOM 2351 CG2 ILE A 152 11.335 -2.311 1.832 1.00 0.92 C ATOM 2352 CD1 ILE A 152 9.117 -0.783 2.985 1.00 0.94 C ATOM 0 H ILE A 152 11.249 -2.221 5.845 1.00 0.73 H new ATOM 0 HA ILE A 152 11.363 -4.203 3.747 1.00 0.76 H new ATOM 0 HB ILE A 152 11.770 -1.179 3.611 1.00 0.78 H new ATOM 0 HG12 ILE A 152 9.223 -2.875 3.520 1.00 0.83 H new ATOM 0 HG13 ILE A 152 9.674 -1.787 4.817 1.00 0.83 H new ATOM 0 HG21 ILE A 152 10.901 -1.459 1.308 1.00 0.92 H new ATOM 0 HG22 ILE A 152 12.383 -2.414 1.551 1.00 0.92 H new ATOM 0 HG23 ILE A 152 10.795 -3.218 1.560 1.00 0.92 H new ATOM 0 HD11 ILE A 152 8.070 -0.692 3.273 1.00 0.94 H new ATOM 0 HD12 ILE A 152 9.642 0.140 3.230 1.00 0.94 H new ATOM 0 HD13 ILE A 152 9.184 -0.965 1.912 1.00 0.94 H new ATOM 2364 N GLN A 153 14.100 -2.397 4.250 1.00 0.77 N ATOM 2365 CA GLN A 153 15.567 -2.418 3.981 1.00 0.80 C ATOM 2366 C GLN A 153 16.153 -3.778 4.372 1.00 0.81 C ATOM 2367 O GLN A 153 17.015 -4.306 3.699 1.00 0.82 O ATOM 2368 CB GLN A 153 16.269 -1.300 4.761 1.00 0.82 C ATOM 2369 CG GLN A 153 15.803 -1.301 6.216 1.00 1.09 C ATOM 2370 CD GLN A 153 16.584 -0.245 7.001 1.00 1.98 C ATOM 2371 OE1 GLN A 153 17.601 -0.542 7.597 1.00 2.66 O ATOM 2372 NE2 GLN A 153 16.149 0.985 7.027 1.00 2.77 N ATOM 0 H GLN A 153 13.768 -1.598 4.790 1.00 0.77 H new ATOM 0 HA GLN A 153 15.728 -2.255 2.915 1.00 0.80 H new ATOM 0 HB2 GLN A 153 17.349 -1.439 4.717 1.00 0.82 H new ATOM 0 HB3 GLN A 153 16.053 -0.335 4.303 1.00 0.82 H new ATOM 0 HG2 GLN A 153 14.735 -1.092 6.267 1.00 1.09 H new ATOM 0 HG3 GLN A 153 15.956 -2.286 6.658 1.00 1.09 H new ATOM 0 HE21 GLN A 153 15.296 1.235 6.527 1.00 2.77 H new ATOM 0 HE22 GLN A 153 16.662 1.697 7.547 1.00 2.77 H new ATOM 2381 N ASP A 154 15.710 -4.346 5.465 1.00 0.83 N ATOM 2382 CA ASP A 154 16.269 -5.663 5.892 1.00 0.86 C ATOM 2383 C ASP A 154 16.226 -6.629 4.705 1.00 0.85 C ATOM 2384 O ASP A 154 17.206 -7.260 4.362 1.00 0.94 O ATOM 2385 CB ASP A 154 15.439 -6.221 7.052 1.00 0.90 C ATOM 2386 CG ASP A 154 16.053 -7.534 7.540 1.00 1.28 C ATOM 2387 OD1 ASP A 154 17.243 -7.716 7.347 1.00 1.84 O ATOM 2388 OD2 ASP A 154 15.322 -8.334 8.100 1.00 1.99 O ATOM 0 H ASP A 154 14.991 -3.958 6.076 1.00 0.83 H new ATOM 0 HA ASP A 154 17.300 -5.539 6.224 1.00 0.86 H new ATOM 0 HB2 ASP A 154 15.405 -5.499 7.868 1.00 0.90 H new ATOM 0 HB3 ASP A 154 14.411 -6.387 6.730 1.00 0.90 H new ATOM 2393 N GLN A 155 15.091 -6.731 4.071 1.00 0.79 N ATOM 2394 CA GLN A 155 14.963 -7.633 2.895 1.00 0.79 C ATOM 2395 C GLN A 155 16.070 -7.311 1.890 1.00 0.72 C ATOM 2396 O GLN A 155 16.675 -8.188 1.306 1.00 1.03 O ATOM 2397 CB GLN A 155 13.601 -7.415 2.233 1.00 0.90 C ATOM 2398 CG GLN A 155 12.491 -7.632 3.263 1.00 1.37 C ATOM 2399 CD GLN A 155 12.501 -9.090 3.729 1.00 2.01 C ATOM 2400 OE1 GLN A 155 12.754 -9.988 2.950 1.00 2.72 O ATOM 2401 NE2 GLN A 155 12.236 -9.365 4.977 1.00 2.54 N ATOM 0 H GLN A 155 14.241 -6.224 4.320 1.00 0.79 H new ATOM 0 HA GLN A 155 15.050 -8.670 3.219 1.00 0.79 H new ATOM 0 HB2 GLN A 155 13.541 -6.406 1.825 1.00 0.90 H new ATOM 0 HB3 GLN A 155 13.476 -8.104 1.398 1.00 0.90 H new ATOM 0 HG2 GLN A 155 12.636 -6.967 4.114 1.00 1.37 H new ATOM 0 HG3 GLN A 155 11.523 -7.386 2.827 1.00 1.37 H new ATOM 0 HE21 GLN A 155 12.024 -8.612 5.631 1.00 2.54 H new ATOM 0 HE22 GLN A 155 12.241 -10.333 5.298 1.00 2.54 H new ATOM 2410 N GLY A 156 16.338 -6.045 1.691 1.00 0.63 N ATOM 2411 CA GLY A 156 17.404 -5.627 0.729 1.00 0.72 C ATOM 2412 C GLY A 156 16.909 -4.420 -0.069 1.00 0.87 C ATOM 2413 O GLY A 156 17.614 -3.446 -0.246 1.00 1.38 O ATOM 0 H GLY A 156 15.859 -5.275 2.159 1.00 0.63 H new ATOM 0 HA2 GLY A 156 18.318 -5.374 1.266 1.00 0.72 H new ATOM 0 HA3 GLY A 156 17.647 -6.449 0.056 1.00 0.72 H new ATOM 2417 N GLY A 157 15.699 -4.478 -0.554 1.00 0.81 N ATOM 2418 CA GLY A 157 15.151 -3.337 -1.345 1.00 1.10 C ATOM 2419 C GLY A 157 13.833 -3.765 -1.992 1.00 0.84 C ATOM 2420 O GLY A 157 13.308 -4.825 -1.717 1.00 0.88 O ATOM 0 H GLY A 157 15.064 -5.268 -0.437 1.00 0.81 H new ATOM 0 HA2 GLY A 157 14.990 -2.474 -0.699 1.00 1.10 H new ATOM 0 HA3 GLY A 157 15.865 -3.033 -2.111 1.00 1.10 H new ATOM 2424 N TRP A 158 13.290 -2.939 -2.847 1.00 0.67 N ATOM 2425 CA TRP A 158 12.002 -3.288 -3.511 1.00 0.50 C ATOM 2426 C TRP A 158 12.179 -4.559 -4.343 1.00 0.51 C ATOM 2427 O TRP A 158 11.214 -5.133 -4.816 1.00 0.53 O ATOM 2428 CB TRP A 158 11.559 -2.139 -4.419 1.00 0.51 C ATOM 2429 CG TRP A 158 11.087 -0.988 -3.589 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.823 0.108 -3.292 1.00 0.59 C ATOM 2431 CD2 TRP A 158 9.791 -0.796 -2.955 1.00 0.46 C ATOM 2432 NE1 TRP A 158 11.059 0.960 -2.515 1.00 0.55 N ATOM 2433 CE2 TRP A 158 9.800 0.447 -2.279 1.00 0.47 C ATOM 2434 CE3 TRP A 158 8.620 -1.572 -2.900 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 8.687 0.905 -1.575 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 7.497 -1.115 -2.191 1.00 0.84 C ATOM 2437 CH2 TRP A 158 7.531 0.122 -1.531 1.00 0.78 C ATOM 0 H TRP A 158 13.684 -2.037 -3.114 1.00 0.67 H new ATOM 0 HA TRP A 158 11.242 -3.458 -2.749 1.00 0.50 H new ATOM 0 HB2 TRP A 158 12.388 -1.825 -5.054 1.00 0.51 H new ATOM 0 HB3 TRP A 158 10.760 -2.474 -5.080 1.00 0.51 H new ATOM 0 HD1 TRP A 158 12.840 0.288 -3.609 1.00 0.59 H new ATOM 0 HE1 TRP A 158 11.386 1.858 -2.160 1.00 0.55 H new ATOM 0 HE3 TRP A 158 8.584 -2.525 -3.406 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 8.718 1.858 -1.068 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 6.603 -1.719 -2.154 1.00 0.84 H new ATOM 0 HH2 TRP A 158 6.664 0.469 -0.989 1.00 0.78 H new ATOM 2448 N ASP A 159 13.384 -5.017 -4.534 1.00 0.50 N ATOM 2449 CA ASP A 159 13.567 -6.254 -5.342 1.00 0.51 C ATOM 2450 C ASP A 159 12.968 -7.434 -4.576 1.00 0.51 C ATOM 2451 O ASP A 159 12.431 -8.356 -5.157 1.00 0.51 O ATOM 2452 CB ASP A 159 15.058 -6.495 -5.591 1.00 0.54 C ATOM 2453 CG ASP A 159 15.657 -5.288 -6.316 1.00 1.66 C ATOM 2454 OD1 ASP A 159 16.058 -4.355 -5.640 1.00 2.37 O ATOM 2455 OD2 ASP A 159 15.704 -5.318 -7.535 1.00 2.46 O ATOM 0 H ASP A 159 14.239 -4.596 -4.171 1.00 0.50 H new ATOM 0 HA ASP A 159 13.066 -6.147 -6.304 1.00 0.51 H new ATOM 0 HB2 ASP A 159 15.574 -6.657 -4.645 1.00 0.54 H new ATOM 0 HB3 ASP A 159 15.197 -7.397 -6.188 1.00 0.54 H new ATOM 2460 N GLY A 160 13.039 -7.403 -3.271 1.00 0.52 N ATOM 2461 CA GLY A 160 12.455 -8.513 -2.466 1.00 0.54 C ATOM 2462 C GLY A 160 10.943 -8.530 -2.690 1.00 0.53 C ATOM 2463 O GLY A 160 10.311 -9.567 -2.676 1.00 0.54 O ATOM 0 H GLY A 160 13.476 -6.657 -2.729 1.00 0.52 H new ATOM 0 HA2 GLY A 160 12.893 -9.466 -2.762 1.00 0.54 H new ATOM 0 HA3 GLY A 160 12.680 -8.373 -1.409 1.00 0.54 H new ATOM 2467 N LEU A 161 10.366 -7.382 -2.914 1.00 0.54 N ATOM 2468 CA LEU A 161 8.900 -7.309 -3.160 1.00 0.56 C ATOM 2469 C LEU A 161 8.553 -8.178 -4.372 1.00 0.56 C ATOM 2470 O LEU A 161 7.731 -9.070 -4.308 1.00 0.62 O ATOM 2471 CB LEU A 161 8.527 -5.840 -3.457 1.00 0.58 C ATOM 2472 CG LEU A 161 7.065 -5.555 -3.043 1.00 0.74 C ATOM 2473 CD1 LEU A 161 6.130 -6.569 -3.716 1.00 1.63 C ATOM 2474 CD2 LEU A 161 6.905 -5.635 -1.505 1.00 1.56 C ATOM 0 H LEU A 161 10.852 -6.485 -2.937 1.00 0.54 H new ATOM 0 HA LEU A 161 8.350 -7.665 -2.289 1.00 0.56 H new ATOM 0 HB2 LEU A 161 9.200 -5.172 -2.919 1.00 0.58 H new ATOM 0 HB3 LEU A 161 8.656 -5.634 -4.520 1.00 0.58 H new ATOM 0 HG LEU A 161 6.803 -4.547 -3.366 1.00 0.74 H new ATOM 0 HD11 LEU A 161 5.100 -6.365 -3.422 1.00 1.63 H new ATOM 0 HD12 LEU A 161 6.222 -6.485 -4.799 1.00 1.63 H new ATOM 0 HD13 LEU A 161 6.403 -7.578 -3.406 1.00 1.63 H new ATOM 0 HD21 LEU A 161 5.869 -5.431 -1.236 1.00 1.56 H new ATOM 0 HD22 LEU A 161 7.179 -6.633 -1.162 1.00 1.56 H new ATOM 0 HD23 LEU A 161 7.554 -4.898 -1.033 1.00 1.56 H new ATOM 2486 N LEU A 162 9.176 -7.890 -5.486 1.00 0.53 N ATOM 2487 CA LEU A 162 8.904 -8.654 -6.736 1.00 0.56 C ATOM 2488 C LEU A 162 9.476 -10.070 -6.609 1.00 0.55 C ATOM 2489 O LEU A 162 8.939 -11.010 -7.161 1.00 0.57 O ATOM 2490 CB LEU A 162 9.559 -7.907 -7.912 1.00 0.61 C ATOM 2491 CG LEU A 162 9.559 -8.760 -9.187 1.00 0.80 C ATOM 2492 CD1 LEU A 162 8.123 -9.127 -9.571 1.00 1.56 C ATOM 2493 CD2 LEU A 162 10.200 -7.955 -10.323 1.00 1.33 C ATOM 0 H LEU A 162 9.870 -7.148 -5.581 1.00 0.53 H new ATOM 0 HA LEU A 162 7.831 -8.735 -6.909 1.00 0.56 H new ATOM 0 HB2 LEU A 162 9.024 -6.975 -8.096 1.00 0.61 H new ATOM 0 HB3 LEU A 162 10.583 -7.641 -7.651 1.00 0.61 H new ATOM 0 HG LEU A 162 10.124 -9.675 -9.012 1.00 0.80 H new ATOM 0 HD11 LEU A 162 8.132 -9.733 -10.477 1.00 1.56 H new ATOM 0 HD12 LEU A 162 7.663 -9.693 -8.761 1.00 1.56 H new ATOM 0 HD13 LEU A 162 7.550 -8.217 -9.749 1.00 1.56 H new ATOM 0 HD21 LEU A 162 10.205 -8.553 -11.235 1.00 1.33 H new ATOM 0 HD22 LEU A 162 9.628 -7.043 -10.490 1.00 1.33 H new ATOM 0 HD23 LEU A 162 11.224 -7.696 -10.053 1.00 1.33 H new ATOM 2505 N SER A 163 10.555 -10.238 -5.898 1.00 0.54 N ATOM 2506 CA SER A 163 11.137 -11.603 -5.760 1.00 0.56 C ATOM 2507 C SER A 163 10.121 -12.521 -5.074 1.00 0.53 C ATOM 2508 O SER A 163 10.159 -13.726 -5.220 1.00 0.60 O ATOM 2509 CB SER A 163 12.416 -11.535 -4.924 1.00 0.63 C ATOM 2510 OG SER A 163 13.147 -12.743 -5.085 1.00 1.32 O ATOM 0 H SER A 163 11.057 -9.496 -5.410 1.00 0.54 H new ATOM 0 HA SER A 163 11.375 -11.998 -6.747 1.00 0.56 H new ATOM 0 HB2 SER A 163 13.023 -10.685 -5.235 1.00 0.63 H new ATOM 0 HB3 SER A 163 12.170 -11.383 -3.873 1.00 0.63 H new ATOM 0 HG SER A 163 13.968 -12.702 -4.552 1.00 1.32 H new ATOM 2516 N TYR A 164 9.214 -11.955 -4.322 1.00 0.59 N ATOM 2517 CA TYR A 164 8.191 -12.783 -3.617 1.00 0.64 C ATOM 2518 C TYR A 164 7.014 -13.056 -4.557 1.00 0.63 C ATOM 2519 O TYR A 164 6.418 -14.114 -4.531 1.00 0.68 O ATOM 2520 CB TYR A 164 7.697 -12.027 -2.381 1.00 0.69 C ATOM 2521 CG TYR A 164 6.593 -12.813 -1.708 1.00 0.72 C ATOM 2522 CD1 TYR A 164 6.874 -14.059 -1.134 1.00 1.50 C ATOM 2523 CD2 TYR A 164 5.289 -12.297 -1.653 1.00 1.34 C ATOM 2524 CE1 TYR A 164 5.856 -14.789 -0.508 1.00 1.57 C ATOM 2525 CE2 TYR A 164 4.272 -13.028 -1.027 1.00 1.35 C ATOM 2526 CZ TYR A 164 4.556 -14.274 -0.454 1.00 0.87 C ATOM 2527 OH TYR A 164 3.553 -14.994 0.163 1.00 0.97 O ATOM 0 H TYR A 164 9.137 -10.950 -4.165 1.00 0.59 H new ATOM 0 HA TYR A 164 8.634 -13.731 -3.313 1.00 0.64 H new ATOM 0 HB2 TYR A 164 8.521 -11.871 -1.685 1.00 0.69 H new ATOM 0 HB3 TYR A 164 7.331 -11.041 -2.668 1.00 0.69 H new ATOM 0 HD1 TYR A 164 7.877 -14.457 -1.174 1.00 1.50 H new ATOM 0 HD2 TYR A 164 5.070 -11.336 -2.094 1.00 1.34 H new ATOM 0 HE1 TYR A 164 6.074 -15.750 -0.067 1.00 1.57 H new ATOM 0 HE2 TYR A 164 3.268 -12.631 -0.986 1.00 1.35 H new ATOM 0 HH TYR A 164 2.712 -14.493 0.113 1.00 0.97 H new ATOM 2537 N PHE A 165 6.668 -12.104 -5.380 1.00 0.64 N ATOM 2538 CA PHE A 165 5.523 -12.302 -6.315 1.00 0.72 C ATOM 2539 C PHE A 165 5.871 -13.382 -7.351 1.00 0.82 C ATOM 2540 O PHE A 165 5.200 -13.530 -8.352 1.00 1.56 O ATOM 2541 CB PHE A 165 5.211 -10.967 -7.026 1.00 0.74 C ATOM 2542 CG PHE A 165 4.098 -10.239 -6.301 1.00 0.84 C ATOM 2543 CD1 PHE A 165 4.373 -9.537 -5.121 1.00 1.65 C ATOM 2544 CD2 PHE A 165 2.793 -10.273 -6.807 1.00 1.42 C ATOM 2545 CE1 PHE A 165 3.343 -8.869 -4.449 1.00 1.96 C ATOM 2546 CE2 PHE A 165 1.763 -9.606 -6.135 1.00 1.71 C ATOM 2547 CZ PHE A 165 2.038 -8.903 -4.956 1.00 1.66 C ATOM 0 H PHE A 165 7.129 -11.197 -5.446 1.00 0.64 H new ATOM 0 HA PHE A 165 4.647 -12.627 -5.754 1.00 0.72 H new ATOM 0 HB2 PHE A 165 6.105 -10.344 -7.055 1.00 0.74 H new ATOM 0 HB3 PHE A 165 4.920 -11.156 -8.059 1.00 0.74 H new ATOM 0 HD1 PHE A 165 5.379 -9.511 -4.730 1.00 1.65 H new ATOM 0 HD2 PHE A 165 2.581 -10.815 -7.717 1.00 1.42 H new ATOM 0 HE1 PHE A 165 3.555 -8.327 -3.539 1.00 1.96 H new ATOM 0 HE2 PHE A 165 0.756 -9.633 -6.526 1.00 1.71 H new ATOM 0 HZ PHE A 165 1.244 -8.387 -4.437 1.00 1.66 H new ATOM 2557 N GLY A 166 6.911 -14.135 -7.119 1.00 0.94 N ATOM 2558 CA GLY A 166 7.290 -15.197 -8.091 1.00 1.01 C ATOM 2559 C GLY A 166 6.337 -16.385 -7.945 1.00 1.23 C ATOM 2560 O GLY A 166 6.502 -17.407 -8.583 1.00 1.85 O ATOM 0 H GLY A 166 7.513 -14.060 -6.299 1.00 0.94 H new ATOM 0 HA2 GLY A 166 7.248 -14.806 -9.108 1.00 1.01 H new ATOM 0 HA3 GLY A 166 8.317 -15.517 -7.914 1.00 1.01 H new ATOM 2564 N THR A 167 5.341 -16.262 -7.108 1.00 1.51 N ATOM 2565 CA THR A 167 4.383 -17.387 -6.922 1.00 2.01 C ATOM 2566 C THR A 167 3.490 -17.508 -8.180 1.00 1.65 C ATOM 2567 O THR A 167 2.821 -16.552 -8.522 1.00 2.06 O ATOM 2568 CB THR A 167 3.497 -17.099 -5.709 1.00 3.10 C ATOM 2569 OG1 THR A 167 4.317 -16.765 -4.598 1.00 3.65 O ATOM 2570 CG2 THR A 167 2.666 -18.340 -5.377 1.00 3.92 C ATOM 0 H THR A 167 5.151 -15.432 -6.547 1.00 1.51 H new ATOM 0 HA THR A 167 4.933 -18.315 -6.767 1.00 2.01 H new ATOM 0 HB THR A 167 2.829 -16.267 -5.933 1.00 3.10 H new ATOM 0 HG1 THR A 167 3.752 -16.578 -3.819 1.00 3.65 H new ATOM 0 HG21 THR A 167 2.035 -18.135 -4.513 1.00 3.92 H new ATOM 0 HG22 THR A 167 2.039 -18.597 -6.231 1.00 3.92 H new ATOM 0 HG23 THR A 167 3.331 -19.173 -5.151 1.00 3.92 H new ATOM 2578 N PRO A 168 3.483 -18.652 -8.850 1.00 1.84 N ATOM 2579 CA PRO A 168 2.648 -18.816 -10.058 1.00 2.36 C ATOM 2580 C PRO A 168 1.161 -18.661 -9.703 1.00 1.79 C ATOM 2581 O PRO A 168 0.441 -17.903 -10.322 1.00 2.00 O ATOM 2582 CB PRO A 168 2.952 -20.245 -10.568 1.00 3.35 C ATOM 2583 CG PRO A 168 3.938 -20.901 -9.561 1.00 3.48 C ATOM 2584 CD PRO A 168 4.277 -19.850 -8.486 1.00 2.53 C ATOM 0 HA PRO A 168 2.866 -18.065 -10.817 1.00 2.36 H new ATOM 0 HB2 PRO A 168 2.035 -20.829 -10.642 1.00 3.35 H new ATOM 0 HB3 PRO A 168 3.389 -20.211 -11.566 1.00 3.35 H new ATOM 0 HG2 PRO A 168 3.489 -21.783 -9.105 1.00 3.48 H new ATOM 0 HG3 PRO A 168 4.843 -21.232 -10.071 1.00 3.48 H new ATOM 0 HD2 PRO A 168 4.016 -20.207 -7.490 1.00 2.53 H new ATOM 0 HD3 PRO A 168 5.344 -19.627 -8.476 1.00 2.53 H new ATOM 2592 N THR A 169 0.697 -19.386 -8.722 1.00 1.73 N ATOM 2593 CA THR A 169 -0.741 -19.294 -8.340 1.00 1.33 C ATOM 2594 C THR A 169 -1.076 -17.868 -7.901 1.00 1.05 C ATOM 2595 O THR A 169 -0.579 -17.380 -6.905 1.00 1.06 O ATOM 2596 CB THR A 169 -1.025 -20.260 -7.188 1.00 1.53 C ATOM 2597 OG1 THR A 169 -0.622 -21.570 -7.560 1.00 1.94 O ATOM 2598 CG2 THR A 169 -2.522 -20.254 -6.873 1.00 2.40 C ATOM 0 H THR A 169 1.252 -20.038 -8.168 1.00 1.73 H new ATOM 0 HA THR A 169 -1.356 -19.557 -9.201 1.00 1.33 H new ATOM 0 HB THR A 169 -0.469 -19.946 -6.305 1.00 1.53 H new ATOM 0 HG1 THR A 169 -0.802 -22.189 -6.822 1.00 1.94 H new ATOM 0 HG21 THR A 169 -2.724 -20.942 -6.052 1.00 2.40 H new ATOM 0 HG22 THR A 169 -2.830 -19.248 -6.587 1.00 2.40 H new ATOM 0 HG23 THR A 169 -3.081 -20.567 -7.755 1.00 2.40 H new ATOM 2606 N TRP A 170 -1.927 -17.197 -8.634 1.00 1.04 N ATOM 2607 CA TRP A 170 -2.310 -15.803 -8.262 1.00 1.01 C ATOM 2608 C TRP A 170 -3.566 -15.843 -7.387 1.00 0.92 C ATOM 2609 O TRP A 170 -3.994 -14.840 -6.849 1.00 0.95 O ATOM 2610 CB TRP A 170 -2.603 -14.999 -9.531 1.00 1.32 C ATOM 2611 CG TRP A 170 -1.428 -15.075 -10.453 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -0.168 -14.696 -10.139 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -1.381 -15.550 -11.830 1.00 2.52 C ATOM 2614 NE1 TRP A 170 0.649 -14.908 -11.234 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -0.052 -15.434 -12.301 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -2.353 -16.066 -12.706 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 0.301 -15.816 -13.596 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -2.001 -16.452 -14.010 1.00 4.37 C ATOM 2619 CH2 TRP A 170 -0.677 -16.327 -14.454 1.00 4.64 C ATOM 0 H TRP A 170 -2.374 -17.557 -9.477 1.00 1.04 H new ATOM 0 HA TRP A 170 -1.493 -15.333 -7.714 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -3.492 -15.391 -10.025 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -2.812 -13.960 -9.276 1.00 1.32 H new ATOM 0 HD1 TRP A 170 0.148 -14.293 -9.188 1.00 2.30 H new ATOM 0 HE1 TRP A 170 1.648 -14.701 -11.252 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -3.376 -16.166 -12.374 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 1.322 -15.718 -13.933 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 -2.755 -16.847 -14.675 1.00 4.37 H new ATOM 0 HH2 TRP A 170 -0.413 -16.625 -15.458 1.00 4.64 H new ATOM 2630 N GLN A 171 -4.162 -16.997 -7.243 1.00 0.88 N ATOM 2631 CA GLN A 171 -5.392 -17.105 -6.406 1.00 0.84 C ATOM 2632 C GLN A 171 -5.011 -17.101 -4.924 1.00 0.75 C ATOM 2633 O GLN A 171 -5.811 -16.757 -4.076 1.00 0.75 O ATOM 2634 CB GLN A 171 -6.129 -18.404 -6.740 1.00 0.88 C ATOM 2635 CG GLN A 171 -6.581 -18.375 -8.200 1.00 1.57 C ATOM 2636 CD GLN A 171 -7.693 -17.339 -8.370 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -7.612 -16.479 -9.225 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -8.736 -17.384 -7.587 1.00 2.34 N ATOM 0 H GLN A 171 -3.850 -17.870 -7.669 1.00 0.88 H new ATOM 0 HA GLN A 171 -6.042 -16.255 -6.614 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -5.476 -19.259 -6.568 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -6.991 -18.524 -6.084 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -5.739 -18.130 -8.847 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -6.938 -19.360 -8.501 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -8.804 -18.106 -6.869 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -9.483 -16.698 -7.693 1.00 2.34 H new ATOM 2647 N THR A 172 -3.799 -17.450 -4.597 1.00 0.67 N ATOM 2648 CA THR A 172 -3.395 -17.428 -3.164 1.00 0.60 C ATOM 2649 C THR A 172 -3.238 -15.961 -2.748 1.00 0.59 C ATOM 2650 O THR A 172 -3.957 -15.476 -1.896 1.00 0.74 O ATOM 2651 CB THR A 172 -2.076 -18.203 -2.993 1.00 0.59 C ATOM 2652 OG1 THR A 172 -2.368 -19.591 -2.911 1.00 0.81 O ATOM 2653 CG2 THR A 172 -1.350 -17.769 -1.715 1.00 0.92 C ATOM 0 H THR A 172 -3.076 -17.747 -5.253 1.00 0.67 H new ATOM 0 HA THR A 172 -4.144 -17.906 -2.533 1.00 0.60 H new ATOM 0 HB THR A 172 -1.432 -17.995 -3.847 1.00 0.59 H new ATOM 0 HG1 THR A 172 -1.534 -20.095 -2.804 1.00 0.81 H new ATOM 0 HG21 THR A 172 -0.421 -18.330 -1.616 1.00 0.92 H new ATOM 0 HG22 THR A 172 -1.126 -16.703 -1.768 1.00 0.92 H new ATOM 0 HG23 THR A 172 -1.986 -17.964 -0.851 1.00 0.92 H new ATOM 2661 N VAL A 173 -2.300 -15.254 -3.312 1.00 0.59 N ATOM 2662 CA VAL A 173 -2.104 -13.827 -2.921 1.00 0.58 C ATOM 2663 C VAL A 173 -3.454 -13.093 -2.929 1.00 0.57 C ATOM 2664 O VAL A 173 -3.678 -12.188 -2.149 1.00 0.60 O ATOM 2665 CB VAL A 173 -1.126 -13.170 -3.917 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -1.862 -12.733 -5.192 1.00 1.13 C ATOM 2667 CG2 VAL A 173 -0.467 -11.945 -3.272 1.00 1.01 C ATOM 0 H VAL A 173 -1.660 -15.600 -4.027 1.00 0.59 H new ATOM 0 HA VAL A 173 -1.689 -13.769 -1.915 1.00 0.58 H new ATOM 0 HB VAL A 173 -0.364 -13.903 -4.180 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -1.154 -12.272 -5.881 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -2.316 -13.603 -5.666 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -2.639 -12.013 -4.935 1.00 1.13 H new ATOM 0 HG21 VAL A 173 0.222 -11.487 -3.981 1.00 1.01 H new ATOM 0 HG22 VAL A 173 -1.235 -11.223 -2.994 1.00 1.01 H new ATOM 0 HG23 VAL A 173 0.081 -12.253 -2.382 1.00 1.01 H new ATOM 2677 N THR A 174 -4.350 -13.468 -3.800 1.00 0.55 N ATOM 2678 CA THR A 174 -5.675 -12.782 -3.845 1.00 0.56 C ATOM 2679 C THR A 174 -6.498 -13.174 -2.613 1.00 0.53 C ATOM 2680 O THR A 174 -7.141 -12.343 -2.001 1.00 0.55 O ATOM 2681 CB THR A 174 -6.423 -13.205 -5.113 1.00 0.59 C ATOM 2682 OG1 THR A 174 -5.596 -12.979 -6.246 1.00 1.37 O ATOM 2683 CG2 THR A 174 -7.709 -12.389 -5.246 1.00 1.27 C ATOM 0 H THR A 174 -4.224 -14.217 -4.481 1.00 0.55 H new ATOM 0 HA THR A 174 -5.525 -11.702 -3.852 1.00 0.56 H new ATOM 0 HB THR A 174 -6.674 -14.264 -5.051 1.00 0.59 H new ATOM 0 HG1 THR A 174 -5.299 -13.839 -6.611 1.00 1.37 H new ATOM 0 HG21 THR A 174 -8.240 -12.691 -6.149 1.00 1.27 H new ATOM 0 HG22 THR A 174 -8.343 -12.564 -4.377 1.00 1.27 H new ATOM 0 HG23 THR A 174 -7.463 -11.329 -5.308 1.00 1.27 H new ATOM 2691 N ILE A 175 -6.484 -14.423 -2.240 1.00 0.51 N ATOM 2692 CA ILE A 175 -7.267 -14.853 -1.044 1.00 0.50 C ATOM 2693 C ILE A 175 -6.509 -14.447 0.222 1.00 0.49 C ATOM 2694 O ILE A 175 -7.087 -14.257 1.274 1.00 0.49 O ATOM 2695 CB ILE A 175 -7.432 -16.375 -1.075 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -8.247 -16.777 -2.313 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -8.158 -16.840 0.191 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -8.046 -18.267 -2.600 1.00 0.89 C ATOM 0 H ILE A 175 -5.965 -15.165 -2.710 1.00 0.51 H new ATOM 0 HA ILE A 175 -8.248 -14.379 -1.050 1.00 0.50 H new ATOM 0 HB ILE A 175 -6.449 -16.845 -1.120 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -9.304 -16.568 -2.148 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -7.935 -16.185 -3.174 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -8.274 -17.924 0.167 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -7.577 -16.557 1.069 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -9.141 -16.371 0.240 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -8.625 -18.550 -3.479 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -6.990 -18.463 -2.783 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -8.380 -18.851 -1.742 1.00 0.89 H new ATOM 2710 N PHE A 176 -5.222 -14.283 0.116 1.00 0.48 N ATOM 2711 CA PHE A 176 -4.411 -13.855 1.291 1.00 0.49 C ATOM 2712 C PHE A 176 -4.720 -12.389 1.599 1.00 0.49 C ATOM 2713 O PHE A 176 -5.050 -12.025 2.711 1.00 0.56 O ATOM 2714 CB PHE A 176 -2.924 -13.969 0.920 1.00 0.51 C ATOM 2715 CG PHE A 176 -2.090 -13.844 2.178 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -2.142 -14.853 3.150 1.00 1.23 C ATOM 2717 CD2 PHE A 176 -1.277 -12.721 2.381 1.00 1.41 C ATOM 2718 CE1 PHE A 176 -1.383 -14.739 4.321 1.00 1.22 C ATOM 2719 CE2 PHE A 176 -0.517 -12.609 3.552 1.00 1.52 C ATOM 2720 CZ PHE A 176 -0.571 -13.617 4.522 1.00 0.76 C ATOM 0 H PHE A 176 -4.690 -14.428 -0.742 1.00 0.48 H new ATOM 0 HA PHE A 176 -4.642 -14.478 2.155 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -2.730 -14.925 0.433 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -2.653 -13.188 0.209 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -2.768 -15.719 2.995 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -1.236 -11.942 1.634 1.00 1.41 H new ATOM 0 HE1 PHE A 176 -1.424 -15.517 5.069 1.00 1.22 H new ATOM 0 HE2 PHE A 176 0.111 -11.744 3.707 1.00 1.52 H new ATOM 0 HZ PHE A 176 0.014 -13.529 5.426 1.00 0.76 H new ATOM 2730 N VAL A 177 -4.577 -11.546 0.615 1.00 0.46 N ATOM 2731 CA VAL A 177 -4.818 -10.087 0.805 1.00 0.48 C ATOM 2732 C VAL A 177 -6.314 -9.805 0.960 1.00 0.44 C ATOM 2733 O VAL A 177 -6.704 -8.843 1.592 1.00 0.57 O ATOM 2734 CB VAL A 177 -4.289 -9.361 -0.434 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -4.629 -7.871 -0.372 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -2.773 -9.543 -0.510 1.00 1.24 C ATOM 0 H VAL A 177 -4.298 -11.811 -0.330 1.00 0.46 H new ATOM 0 HA VAL A 177 -4.311 -9.742 1.706 1.00 0.48 H new ATOM 0 HB VAL A 177 -4.759 -9.783 -1.322 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -4.244 -7.373 -1.262 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -5.711 -7.746 -0.325 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -4.174 -7.431 0.515 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -2.388 -9.028 -1.391 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -2.311 -9.126 0.385 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -2.537 -10.605 -0.578 1.00 1.24 H new ATOM 2746 N ALA A 178 -7.155 -10.627 0.404 1.00 0.45 N ATOM 2747 CA ALA A 178 -8.621 -10.388 0.538 1.00 0.43 C ATOM 2748 C ALA A 178 -9.106 -10.899 1.898 1.00 0.40 C ATOM 2749 O ALA A 178 -9.821 -10.221 2.609 1.00 0.40 O ATOM 2750 CB ALA A 178 -9.360 -11.132 -0.576 1.00 0.46 C ATOM 0 H ALA A 178 -6.895 -11.452 -0.136 1.00 0.45 H new ATOM 0 HA ALA A 178 -8.821 -9.319 0.462 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -10.432 -10.959 -0.480 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -9.019 -10.768 -1.545 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -9.157 -12.200 -0.497 1.00 0.46 H new ATOM 2756 N GLY A 179 -8.737 -12.097 2.255 1.00 0.41 N ATOM 2757 CA GLY A 179 -9.190 -12.667 3.556 1.00 0.43 C ATOM 2758 C GLY A 179 -8.728 -11.789 4.724 1.00 0.43 C ATOM 2759 O GLY A 179 -9.410 -11.673 5.726 1.00 0.48 O ATOM 0 H GLY A 179 -8.139 -12.709 1.700 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -10.277 -12.748 3.564 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -8.794 -13.676 3.674 1.00 0.43 H new ATOM 2763 N VAL A 180 -7.575 -11.185 4.626 1.00 0.42 N ATOM 2764 CA VAL A 180 -7.088 -10.346 5.754 1.00 0.45 C ATOM 2765 C VAL A 180 -7.772 -8.978 5.760 1.00 0.45 C ATOM 2766 O VAL A 180 -8.088 -8.427 6.801 1.00 0.43 O ATOM 2767 CB VAL A 180 -5.570 -10.162 5.653 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -5.232 -9.368 4.390 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -5.063 -9.400 6.882 1.00 1.41 C ATOM 0 H VAL A 180 -6.954 -11.236 3.819 1.00 0.42 H new ATOM 0 HA VAL A 180 -7.333 -10.857 6.685 1.00 0.45 H new ATOM 0 HB VAL A 180 -5.091 -11.140 5.607 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -4.152 -9.238 4.320 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -5.590 -9.908 3.514 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -5.713 -8.391 4.435 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -3.983 -9.270 6.809 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -5.544 -8.423 6.928 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -5.300 -9.965 7.784 1.00 1.41 H new ATOM 2779 N LEU A 181 -8.011 -8.415 4.601 1.00 0.49 N ATOM 2780 CA LEU A 181 -8.669 -7.083 4.564 1.00 0.50 C ATOM 2781 C LEU A 181 -10.042 -7.200 5.227 1.00 0.49 C ATOM 2782 O LEU A 181 -10.517 -6.297 5.885 1.00 0.51 O ATOM 2783 CB LEU A 181 -8.838 -6.619 3.105 1.00 0.56 C ATOM 2784 CG LEU A 181 -7.528 -6.009 2.574 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -7.588 -5.941 1.044 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -7.330 -4.587 3.129 1.00 1.20 C ATOM 0 H LEU A 181 -7.781 -8.818 3.693 1.00 0.49 H new ATOM 0 HA LEU A 181 -8.056 -6.354 5.094 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -9.131 -7.463 2.481 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -9.640 -5.883 3.043 1.00 0.56 H new ATOM 0 HG LEU A 181 -6.695 -6.635 2.894 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -6.663 -5.510 0.662 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -7.714 -6.945 0.640 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -8.430 -5.319 0.740 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -6.399 -4.172 2.743 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -8.164 -3.957 2.820 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -7.287 -4.624 4.218 1.00 1.20 H new ATOM 2798 N THR A 182 -10.682 -8.325 5.033 1.00 0.49 N ATOM 2799 CA THR A 182 -12.031 -8.540 5.621 1.00 0.51 C ATOM 2800 C THR A 182 -11.920 -8.669 7.138 1.00 0.48 C ATOM 2801 O THR A 182 -12.789 -8.242 7.870 1.00 0.51 O ATOM 2802 CB THR A 182 -12.642 -9.821 5.046 1.00 0.54 C ATOM 2803 OG1 THR A 182 -11.727 -10.895 5.209 1.00 1.16 O ATOM 2804 CG2 THR A 182 -12.942 -9.625 3.559 1.00 1.07 C ATOM 0 H THR A 182 -10.322 -9.108 4.487 1.00 0.49 H new ATOM 0 HA THR A 182 -12.667 -7.689 5.377 1.00 0.51 H new ATOM 0 HB THR A 182 -13.568 -10.049 5.573 1.00 0.54 H new ATOM 0 HG1 THR A 182 -10.856 -10.543 5.487 1.00 1.16 H new ATOM 0 HG21 THR A 182 -13.377 -10.538 3.152 1.00 1.07 H new ATOM 0 HG22 THR A 182 -13.645 -8.802 3.435 1.00 1.07 H new ATOM 0 HG23 THR A 182 -12.018 -9.395 3.029 1.00 1.07 H new ATOM 2812 N ALA A 183 -10.866 -9.273 7.621 1.00 0.45 N ATOM 2813 CA ALA A 183 -10.728 -9.439 9.095 1.00 0.44 C ATOM 2814 C ALA A 183 -10.882 -8.075 9.768 1.00 0.44 C ATOM 2815 O ALA A 183 -11.498 -7.945 10.807 1.00 0.50 O ATOM 2816 CB ALA A 183 -9.353 -10.027 9.419 1.00 0.46 C ATOM 0 H ALA A 183 -10.102 -9.655 7.063 1.00 0.45 H new ATOM 0 HA ALA A 183 -11.499 -10.116 9.464 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -9.254 -10.148 10.498 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -9.249 -10.998 8.934 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -8.575 -9.355 9.056 1.00 0.46 H new ATOM 2822 N SER A 184 -10.317 -7.054 9.176 1.00 0.47 N ATOM 2823 CA SER A 184 -10.420 -5.689 9.772 1.00 0.51 C ATOM 2824 C SER A 184 -11.849 -5.161 9.615 1.00 0.54 C ATOM 2825 O SER A 184 -12.397 -4.538 10.503 1.00 0.56 O ATOM 2826 CB SER A 184 -9.450 -4.746 9.058 1.00 0.62 C ATOM 2827 OG SER A 184 -9.930 -3.413 9.167 1.00 1.55 O ATOM 0 H SER A 184 -9.789 -7.107 8.305 1.00 0.47 H new ATOM 0 HA SER A 184 -10.168 -5.740 10.831 1.00 0.51 H new ATOM 0 HB2 SER A 184 -8.456 -4.825 9.499 1.00 0.62 H new ATOM 0 HB3 SER A 184 -9.356 -5.027 8.009 1.00 0.62 H new ATOM 0 HG SER A 184 -9.934 -2.993 8.281 1.00 1.55 H new ATOM 2833 N LEU A 185 -12.460 -5.424 8.493 1.00 0.58 N ATOM 2834 CA LEU A 185 -13.860 -4.966 8.253 1.00 0.69 C ATOM 2835 C LEU A 185 -14.829 -5.845 9.041 1.00 0.69 C ATOM 2836 O LEU A 185 -15.848 -5.402 9.531 1.00 0.79 O ATOM 2837 CB LEU A 185 -14.171 -5.123 6.762 1.00 0.71 C ATOM 2838 CG LEU A 185 -13.200 -4.268 5.933 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -13.389 -4.588 4.448 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -13.464 -2.769 6.174 1.00 1.18 C ATOM 0 H LEU A 185 -12.044 -5.944 7.721 1.00 0.58 H new ATOM 0 HA LEU A 185 -13.966 -3.927 8.566 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -14.086 -6.170 6.472 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -15.199 -4.819 6.562 1.00 0.71 H new ATOM 0 HG LEU A 185 -12.178 -4.497 6.235 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -12.702 -3.984 3.855 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -13.185 -5.645 4.275 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -14.415 -4.364 4.155 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -12.768 -2.177 5.580 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -14.486 -2.528 5.882 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -13.325 -2.540 7.231 1.00 1.18 H new ATOM 2852 N THR A 186 -14.498 -7.100 9.155 1.00 0.62 N ATOM 2853 CA THR A 186 -15.356 -8.062 9.895 1.00 0.68 C ATOM 2854 C THR A 186 -15.398 -7.714 11.380 1.00 0.62 C ATOM 2855 O THR A 186 -16.430 -7.803 12.016 1.00 0.64 O ATOM 2856 CB THR A 186 -14.761 -9.465 9.748 1.00 0.73 C ATOM 2857 OG1 THR A 186 -14.582 -9.758 8.369 1.00 0.89 O ATOM 2858 CG2 THR A 186 -15.713 -10.490 10.369 1.00 1.00 C ATOM 0 H THR A 186 -13.651 -7.506 8.758 1.00 0.62 H new ATOM 0 HA THR A 186 -16.366 -8.018 9.487 1.00 0.68 H new ATOM 0 HB THR A 186 -13.799 -9.509 10.258 1.00 0.73 H new ATOM 0 HG1 THR A 186 -14.113 -9.015 7.935 1.00 0.89 H new ATOM 0 HG21 THR A 186 -15.290 -11.489 10.265 1.00 1.00 H new ATOM 0 HG22 THR A 186 -15.852 -10.263 11.426 1.00 1.00 H new ATOM 0 HG23 THR A 186 -16.675 -10.448 9.859 1.00 1.00 H new ATOM 2866 N ILE A 187 -14.278 -7.356 11.957 1.00 0.64 N ATOM 2867 CA ILE A 187 -14.270 -7.053 13.419 1.00 0.66 C ATOM 2868 C ILE A 187 -14.840 -5.651 13.667 1.00 0.66 C ATOM 2869 O ILE A 187 -15.408 -5.392 14.710 1.00 0.75 O ATOM 2870 CB ILE A 187 -12.827 -7.167 13.955 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -12.859 -7.531 15.448 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -12.079 -5.831 13.785 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -11.446 -7.436 16.041 1.00 0.87 C ATOM 0 H ILE A 187 -13.379 -7.261 11.485 1.00 0.64 H new ATOM 0 HA ILE A 187 -14.898 -7.770 13.948 1.00 0.66 H new ATOM 0 HB ILE A 187 -12.310 -7.942 13.390 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -13.532 -6.859 15.980 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -13.249 -8.541 15.577 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -11.064 -5.931 14.169 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -12.043 -5.566 12.728 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -12.600 -5.049 14.338 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -11.477 -7.695 17.099 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -10.785 -8.126 15.518 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -11.072 -6.419 15.928 1.00 0.87 H new ATOM 2885 N TRP A 188 -14.636 -4.724 12.773 1.00 0.64 N ATOM 2886 CA TRP A 188 -15.116 -3.339 13.044 1.00 0.70 C ATOM 2887 C TRP A 188 -16.587 -3.367 13.471 1.00 0.81 C ATOM 2888 O TRP A 188 -16.916 -3.046 14.597 1.00 1.06 O ATOM 2889 CB TRP A 188 -14.942 -2.486 11.781 1.00 0.85 C ATOM 2890 CG TRP A 188 -15.557 -1.139 11.983 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -16.623 -0.662 11.300 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -15.160 -0.087 12.909 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -16.907 0.615 11.749 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -16.033 1.014 12.741 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -14.138 0.016 13.869 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -15.896 2.177 13.500 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -13.998 1.185 14.634 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -14.875 2.263 14.450 1.00 1.71 C ATOM 0 H TRP A 188 -14.165 -4.861 11.879 1.00 0.64 H new ATOM 0 HA TRP A 188 -14.531 -2.903 13.854 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -13.883 -2.380 11.548 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -15.407 -2.983 10.930 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -17.164 -1.192 10.530 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -17.669 1.191 11.391 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -13.457 -0.809 14.019 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -16.574 3.005 13.354 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -13.210 1.254 15.369 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -14.762 3.159 15.042 1.00 1.71 H new ATOM 2909 N LYS A 189 -17.480 -3.741 12.589 1.00 0.95 N ATOM 2910 CA LYS A 189 -18.923 -3.780 12.955 1.00 1.23 C ATOM 2911 C LYS A 189 -19.617 -4.911 12.181 1.00 1.53 C ATOM 2912 O LYS A 189 -19.128 -6.022 12.131 1.00 2.02 O ATOM 2913 CB LYS A 189 -19.539 -2.410 12.624 1.00 1.90 C ATOM 2914 CG LYS A 189 -20.636 -2.066 13.642 1.00 2.68 C ATOM 2915 CD LYS A 189 -21.515 -0.921 13.116 1.00 3.60 C ATOM 2916 CE LYS A 189 -20.803 0.420 13.314 1.00 4.51 C ATOM 2917 NZ LYS A 189 -21.639 1.513 12.740 1.00 5.09 N ATOM 0 H LYS A 189 -17.269 -4.021 11.631 1.00 0.95 H new ATOM 0 HA LYS A 189 -19.052 -3.979 14.019 1.00 1.23 H new ATOM 0 HB2 LYS A 189 -18.766 -1.642 12.637 1.00 1.90 H new ATOM 0 HB3 LYS A 189 -19.957 -2.424 11.618 1.00 1.90 H new ATOM 0 HG2 LYS A 189 -21.250 -2.945 13.835 1.00 2.68 H new ATOM 0 HG3 LYS A 189 -20.183 -1.779 14.591 1.00 2.68 H new ATOM 0 HD2 LYS A 189 -21.732 -1.074 12.059 1.00 3.60 H new ATOM 0 HD3 LYS A 189 -22.471 -0.915 13.640 1.00 3.60 H new ATOM 0 HE2 LYS A 189 -20.629 0.599 14.375 1.00 4.51 H new ATOM 0 HE3 LYS A 189 -19.827 0.401 12.830 1.00 4.51 H new ATOM 0 HZ1 LYS A 189 -21.157 2.425 12.873 1.00 5.09 H new ATOM 0 HZ2 LYS A 189 -21.783 1.343 11.724 1.00 5.09 H new ATOM 0 HZ3 LYS A 189 -22.561 1.535 13.222 1.00 5.09 H new ATOM 2931 N LYS A 190 -20.749 -4.650 11.587 1.00 2.36 N ATOM 2932 CA LYS A 190 -21.455 -5.721 10.838 1.00 3.37 C ATOM 2933 C LYS A 190 -22.642 -5.112 10.087 1.00 3.71 C ATOM 2934 O LYS A 190 -23.322 -4.234 10.578 1.00 4.35 O ATOM 2935 CB LYS A 190 -21.943 -6.790 11.830 1.00 4.30 C ATOM 2936 CG LYS A 190 -22.966 -7.716 11.158 1.00 5.08 C ATOM 2937 CD LYS A 190 -23.159 -8.973 12.011 1.00 5.78 C ATOM 2938 CE LYS A 190 -24.246 -9.853 11.388 1.00 6.76 C ATOM 2939 NZ LYS A 190 -23.868 -10.193 9.987 1.00 7.40 N ATOM 0 H LYS A 190 -21.213 -3.742 11.589 1.00 2.36 H new ATOM 0 HA LYS A 190 -20.780 -6.184 10.118 1.00 3.37 H new ATOM 0 HB2 LYS A 190 -21.096 -7.374 12.191 1.00 4.30 H new ATOM 0 HB3 LYS A 190 -22.393 -6.310 12.699 1.00 4.30 H new ATOM 0 HG2 LYS A 190 -23.917 -7.197 11.037 1.00 5.08 H new ATOM 0 HG3 LYS A 190 -22.623 -7.990 10.160 1.00 5.08 H new ATOM 0 HD2 LYS A 190 -22.223 -9.527 12.078 1.00 5.78 H new ATOM 0 HD3 LYS A 190 -23.439 -8.696 13.027 1.00 5.78 H new ATOM 0 HE2 LYS A 190 -24.371 -10.764 11.973 1.00 6.76 H new ATOM 0 HE3 LYS A 190 -25.203 -9.331 11.401 1.00 6.76 H new ATOM 0 HZ1 LYS A 190 -24.410 -11.023 9.673 1.00 7.40 H new ATOM 0 HZ2 LYS A 190 -24.079 -9.387 9.365 1.00 7.40 H new ATOM 0 HZ3 LYS A 190 -22.851 -10.407 9.944 1.00 7.40 H new ATOM 2953 N MET A 191 -22.881 -5.580 8.898 1.00 3.81 N ATOM 2954 CA MET A 191 -24.015 -5.059 8.080 1.00 4.63 C ATOM 2955 C MET A 191 -25.342 -5.278 8.824 1.00 4.97 C ATOM 2956 O MET A 191 -25.467 -4.966 9.990 1.00 5.27 O ATOM 2957 CB MET A 191 -24.040 -5.801 6.738 1.00 5.48 C ATOM 2958 CG MET A 191 -24.009 -7.314 6.975 1.00 5.71 C ATOM 2959 SD MET A 191 -24.116 -8.170 5.381 1.00 7.00 S ATOM 2960 CE MET A 191 -25.090 -9.591 5.936 1.00 7.52 C ATOM 0 H MET A 191 -22.332 -6.313 8.448 1.00 3.81 H new ATOM 0 HA MET A 191 -23.884 -3.991 7.908 1.00 4.63 H new ATOM 0 HB2 MET A 191 -24.936 -5.530 6.180 1.00 5.48 H new ATOM 0 HB3 MET A 191 -23.185 -5.502 6.132 1.00 5.48 H new ATOM 0 HG2 MET A 191 -23.091 -7.594 7.491 1.00 5.71 H new ATOM 0 HG3 MET A 191 -24.839 -7.611 7.617 1.00 5.71 H new ATOM 0 HE1 MET A 191 -25.273 -10.258 5.094 1.00 7.52 H new ATOM 0 HE2 MET A 191 -24.542 -10.127 6.711 1.00 7.52 H new ATOM 0 HE3 MET A 191 -26.042 -9.245 6.338 1.00 7.52 H new ATOM 2970 N GLY A 192 -26.335 -5.810 8.162 1.00 5.37 N ATOM 2971 CA GLY A 192 -27.644 -6.042 8.839 1.00 6.15 C ATOM 2972 C GLY A 192 -28.439 -4.736 8.877 1.00 6.68 C ATOM 2973 O GLY A 192 -29.536 -4.748 9.412 1.00 7.01 O ATOM 2974 OXT GLY A 192 -27.938 -3.745 8.370 1.00 7.06 O ATOM 0 H GLY A 192 -26.296 -6.094 7.183 1.00 5.37 H new ATOM 0 HA2 GLY A 192 -28.209 -6.808 8.308 1.00 6.15 H new ATOM 0 HA3 GLY A 192 -27.481 -6.410 9.852 1.00 6.15 H new TER 2978 GLY A 192