USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 786 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: B 34 GLN : amide:sc= 1.86 K(o=2.8,f=1.2) USER MOD Set 1.2: B 38 TYR OH : rot 58:sc= 0.984 USER MOD Set 2.1: A 34 GLN : amide:sc= 0.847 X(o=1.6,f=1.1) USER MOD Set 2.2: A 38 TYR OH : rot 165:sc= 0.753 USER MOD Set 3.1: A 35 THR OG1 : rot -171:sc= 2.21 USER MOD Set 3.2: A 36 LYS NZ :NH3+ 170:sc= 1.28 (180deg=0.139) USER MOD Single : A 1 GLY N :NH3+ -119:sc= 0.089 (180deg=0) USER MOD Single : A 2 SER OG : rot 150:sc= 0.0849 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 174:sc= 0.762 USER MOD Single : A 16 GLN : amide:sc= 0.413 X(o=0.41,f=-0.063) USER MOD Single : A 17 MET CE :methyl -165:sc= -0.0168 (180deg=-0.306) USER MOD Single : A 19 SER OG : rot 74:sc= 0.233 USER MOD Single : A 20 MET CE :methyl -158:sc= -0.137 (180deg=-1.19) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -0.176 K(o=-0.18,f=-4!) USER MOD Single : A 46 THR OG1 : rot 59:sc= 1.3 USER MOD Single : A 48 GLN : amide:sc= -2.35! C(o=-2.3!,f=-7.2!) USER MOD Single : A 49 TYR OH : rot 180:sc= 0.13 USER MOD Single : A 50 SER OG : rot -47:sc= 0.0192 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HD1:sc= 0 X(o=0,f=-0.066) USER MOD Single : B 1 GLY N :NH3+ -127:sc= 0.105 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 13 SER OG : rot 91:sc= 0.125 USER MOD Single : B 15 SER OG : rot 174:sc= 0.769 USER MOD Single : B 16 GLN : amide:sc= -0.0748 K(o=-0.075,f=-0.6) USER MOD Single : B 17 MET CE :methyl -178:sc= 0 (180deg=-0.00367) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 MET CE :methyl -161:sc= -0.127 (180deg=-0.556) USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 THR OG1 : rot 140:sc= 1.27 USER MOD Single : B 36 LYS NZ :NH3+ -179:sc= -0.215 (180deg=-0.28) USER MOD Single : B 37 ASN : amide:sc= -0.134 K(o=-0.13,f=-4!) USER MOD Single : B 46 THR OG1 : rot 54:sc= 1.28 USER MOD Single : B 48 GLN : amide:sc= -0.141 K(o=-0.14,f=-1.3) USER MOD Single : B 49 TYR OH : rot 174:sc=0.000393 USER MOD Single : B 50 SER OG : rot 66:sc= 0.54 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.681 19.374 -3.021 1.00 10.00 N ATOM 2 CA GLY A 1 19.177 18.004 -3.277 1.00 10.00 C ATOM 3 C GLY A 1 19.840 17.416 -2.055 1.00 10.00 C ATOM 4 O GLY A 1 20.026 18.111 -1.057 1.00 10.00 O ATOM 0 H1 GLY A 1 17.650 19.400 -3.153 1.00 10.00 H new ATOM 0 H2 GLY A 1 18.913 19.650 -2.046 1.00 10.00 H new ATOM 0 H3 GLY A 1 19.131 20.036 -3.685 1.00 10.00 H new ATOM 0 HA2 GLY A 1 18.347 17.367 -3.583 1.00 10.00 H new ATOM 0 HA3 GLY A 1 19.887 18.022 -4.104 1.00 10.00 H new ATOM 10 N SER A 2 20.199 16.145 -2.125 1.00 10.00 N ATOM 11 CA SER A 2 20.843 15.474 -1.009 1.00 10.00 C ATOM 12 C SER A 2 22.296 15.918 -0.881 1.00 10.00 C ATOM 13 O SER A 2 23.065 15.835 -1.841 1.00 10.00 O ATOM 14 CB SER A 2 20.767 13.961 -1.207 1.00 10.00 C ATOM 15 OG SER A 2 20.882 13.632 -2.580 1.00 10.00 O ATOM 0 H SER A 2 20.055 15.556 -2.945 1.00 10.00 H new ATOM 0 HA SER A 2 20.323 15.742 -0.089 1.00 10.00 H new ATOM 0 HB2 SER A 2 21.563 13.474 -0.643 1.00 10.00 H new ATOM 0 HB3 SER A 2 19.822 13.584 -0.815 1.00 10.00 H new ATOM 0 HG SER A 2 21.302 12.751 -2.671 1.00 10.00 H new ATOM 21 N PRO A 3 22.681 16.424 0.297 1.00 10.00 N ATOM 22 CA PRO A 3 24.047 16.872 0.553 1.00 10.00 C ATOM 23 C PRO A 3 24.978 15.697 0.846 1.00 10.00 C ATOM 24 O PRO A 3 24.512 14.585 1.089 1.00 10.00 O ATOM 25 CB PRO A 3 23.887 17.756 1.791 1.00 10.00 C ATOM 26 CG PRO A 3 22.733 17.164 2.524 1.00 10.00 C ATOM 27 CD PRO A 3 21.810 16.603 1.476 1.00 10.00 C ATOM 0 HA PRO A 3 24.491 17.386 -0.299 1.00 10.00 H new ATOM 0 HB2 PRO A 3 24.790 17.751 2.402 1.00 10.00 H new ATOM 0 HB3 PRO A 3 23.693 18.793 1.516 1.00 10.00 H new ATOM 0 HG2 PRO A 3 23.066 16.383 3.207 1.00 10.00 H new ATOM 0 HG3 PRO A 3 22.226 17.919 3.125 1.00 10.00 H new ATOM 0 HD2 PRO A 3 21.370 15.658 1.795 1.00 10.00 H new ATOM 0 HD3 PRO A 3 20.985 17.283 1.264 1.00 10.00 H new ATOM 35 N PRO A 4 26.304 15.924 0.827 1.00 10.00 N ATOM 36 CA PRO A 4 27.295 14.874 1.110 1.00 10.00 C ATOM 37 C PRO A 4 27.079 14.215 2.472 1.00 10.00 C ATOM 38 O PRO A 4 27.582 13.125 2.734 1.00 10.00 O ATOM 39 CB PRO A 4 28.627 15.628 1.090 1.00 10.00 C ATOM 40 CG PRO A 4 28.377 16.826 0.249 1.00 10.00 C ATOM 41 CD PRO A 4 26.946 17.211 0.499 1.00 10.00 C ATOM 0 HA PRO A 4 27.237 14.059 0.389 1.00 10.00 H new ATOM 0 HB2 PRO A 4 28.936 15.910 2.096 1.00 10.00 H new ATOM 0 HB3 PRO A 4 29.423 15.012 0.673 1.00 10.00 H new ATOM 0 HG2 PRO A 4 29.053 17.639 0.516 1.00 10.00 H new ATOM 0 HG3 PRO A 4 28.544 16.605 -0.805 1.00 10.00 H new ATOM 0 HD2 PRO A 4 26.858 17.925 1.318 1.00 10.00 H new ATOM 0 HD3 PRO A 4 26.494 17.674 -0.378 1.00 10.00 H new ATOM 49 N GLU A 5 26.320 14.888 3.335 1.00 10.00 N ATOM 50 CA GLU A 5 26.023 14.379 4.668 1.00 10.00 C ATOM 51 C GLU A 5 25.069 13.188 4.611 1.00 10.00 C ATOM 52 O GLU A 5 24.973 12.416 5.568 1.00 10.00 O ATOM 53 CB GLU A 5 25.428 15.491 5.533 1.00 10.00 C ATOM 54 CG GLU A 5 26.474 16.437 6.100 1.00 10.00 C ATOM 55 CD GLU A 5 27.539 15.702 6.885 1.00 10.00 C ATOM 56 OE1 GLU A 5 27.190 15.027 7.877 1.00 10.00 O ATOM 57 OE2 GLU A 5 28.727 15.787 6.509 1.00 10.00 O ATOM 0 H GLU A 5 25.898 15.794 3.130 1.00 10.00 H new ATOM 0 HA GLU A 5 26.957 14.037 5.114 1.00 10.00 H new ATOM 0 HB2 GLU A 5 24.716 16.063 4.938 1.00 10.00 H new ATOM 0 HB3 GLU A 5 24.870 15.043 6.355 1.00 10.00 H new ATOM 0 HG2 GLU A 5 26.941 16.990 5.286 1.00 10.00 H new ATOM 0 HG3 GLU A 5 25.989 17.169 6.745 1.00 10.00 H new ATOM 64 N ALA A 6 24.365 13.046 3.496 1.00 10.00 N ATOM 65 CA ALA A 6 23.437 11.944 3.320 1.00 10.00 C ATOM 66 C ALA A 6 24.192 10.696 2.891 1.00 10.00 C ATOM 67 O ALA A 6 25.047 10.750 2.005 1.00 10.00 O ATOM 68 CB ALA A 6 22.361 12.304 2.302 1.00 10.00 C ATOM 0 H ALA A 6 24.421 13.682 2.701 1.00 10.00 H new ATOM 0 HA ALA A 6 22.943 11.744 4.271 1.00 10.00 H new ATOM 0 HB1 ALA A 6 21.676 11.465 2.185 1.00 10.00 H new ATOM 0 HB2 ALA A 6 21.809 13.177 2.649 1.00 10.00 H new ATOM 0 HB3 ALA A 6 22.828 12.528 1.343 1.00 10.00 H new ATOM 74 N ASP A 7 23.892 9.583 3.543 1.00 10.00 N ATOM 75 CA ASP A 7 24.544 8.319 3.237 1.00 10.00 C ATOM 76 C ASP A 7 24.164 7.840 1.842 1.00 10.00 C ATOM 77 O ASP A 7 22.977 7.727 1.520 1.00 10.00 O ATOM 78 CB ASP A 7 24.169 7.262 4.274 1.00 10.00 C ATOM 79 CG ASP A 7 25.074 6.050 4.220 1.00 10.00 C ATOM 80 OD1 ASP A 7 24.914 5.218 3.305 1.00 10.00 O ATOM 81 OD2 ASP A 7 25.942 5.913 5.104 1.00 10.00 O ATOM 0 H ASP A 7 23.199 9.530 4.290 1.00 10.00 H new ATOM 0 HA ASP A 7 25.622 8.476 3.267 1.00 10.00 H new ATOM 0 HB2 ASP A 7 24.216 7.702 5.270 1.00 10.00 H new ATOM 0 HB3 ASP A 7 23.138 6.949 4.112 1.00 10.00 H new ATOM 86 N PRO A 8 25.172 7.544 1.001 1.00 10.00 N ATOM 87 CA PRO A 8 24.956 7.085 -0.376 1.00 10.00 C ATOM 88 C PRO A 8 24.216 5.750 -0.450 1.00 10.00 C ATOM 89 O PRO A 8 23.627 5.420 -1.478 1.00 10.00 O ATOM 90 CB PRO A 8 26.373 6.948 -0.946 1.00 10.00 C ATOM 91 CG PRO A 8 27.262 6.835 0.244 1.00 10.00 C ATOM 92 CD PRO A 8 26.606 7.635 1.330 1.00 10.00 C ATOM 0 HA PRO A 8 24.327 7.781 -0.931 1.00 10.00 H new ATOM 0 HB2 PRO A 8 26.457 6.069 -1.586 1.00 10.00 H new ATOM 0 HB3 PRO A 8 26.638 7.812 -1.555 1.00 10.00 H new ATOM 0 HG2 PRO A 8 27.381 5.794 0.544 1.00 10.00 H new ATOM 0 HG3 PRO A 8 28.258 7.219 0.024 1.00 10.00 H new ATOM 0 HD2 PRO A 8 26.819 7.224 2.317 1.00 10.00 H new ATOM 0 HD3 PRO A 8 26.953 8.668 1.334 1.00 10.00 H new ATOM 100 N ARG A 9 24.235 4.995 0.638 1.00 10.00 N ATOM 101 CA ARG A 9 23.562 3.706 0.676 1.00 10.00 C ATOM 102 C ARG A 9 22.114 3.868 1.117 1.00 10.00 C ATOM 103 O ARG A 9 21.214 3.233 0.570 1.00 10.00 O ATOM 104 CB ARG A 9 24.279 2.752 1.627 1.00 10.00 C ATOM 105 CG ARG A 9 25.714 2.449 1.231 1.00 10.00 C ATOM 106 CD ARG A 9 26.518 1.959 2.422 1.00 10.00 C ATOM 107 NE ARG A 9 26.622 2.980 3.466 1.00 10.00 N ATOM 108 CZ ARG A 9 27.401 2.868 4.540 1.00 10.00 C ATOM 109 NH1 ARG A 9 28.109 1.765 4.735 1.00 10.00 N ATOM 110 NH2 ARG A 9 27.470 3.854 5.420 1.00 10.00 N ATOM 0 H ARG A 9 24.708 5.252 1.504 1.00 10.00 H new ATOM 0 HA ARG A 9 23.583 3.289 -0.331 1.00 10.00 H new ATOM 0 HB2 ARG A 9 24.272 3.181 2.629 1.00 10.00 H new ATOM 0 HB3 ARG A 9 23.721 1.817 1.676 1.00 10.00 H new ATOM 0 HG2 ARG A 9 25.726 1.694 0.445 1.00 10.00 H new ATOM 0 HG3 ARG A 9 26.178 3.345 0.819 1.00 10.00 H new ATOM 0 HD2 ARG A 9 26.050 1.065 2.834 1.00 10.00 H new ATOM 0 HD3 ARG A 9 27.517 1.673 2.093 1.00 10.00 H new ATOM 0 HE ARG A 9 26.064 3.828 3.365 1.00 10.00 H new ATOM 0 HH11 ARG A 9 28.058 1.000 4.062 1.00 10.00 H new ATOM 0 HH12 ARG A 9 28.705 1.681 5.558 1.00 10.00 H new ATOM 0 HH21 ARG A 9 26.925 4.704 5.277 1.00 10.00 H new ATOM 0 HH22 ARG A 9 28.068 3.764 6.241 1.00 10.00 H new ATOM 124 N LEU A 10 21.896 4.720 2.111 1.00 10.00 N ATOM 125 CA LEU A 10 20.556 4.961 2.635 1.00 10.00 C ATOM 126 C LEU A 10 19.651 5.578 1.573 1.00 10.00 C ATOM 127 O LEU A 10 18.472 5.242 1.482 1.00 10.00 O ATOM 128 CB LEU A 10 20.606 5.871 3.867 1.00 10.00 C ATOM 129 CG LEU A 10 21.226 5.249 5.123 1.00 10.00 C ATOM 130 CD1 LEU A 10 21.259 6.265 6.256 1.00 10.00 C ATOM 131 CD2 LEU A 10 20.455 4.006 5.545 1.00 10.00 C ATOM 0 H LEU A 10 22.631 5.257 2.572 1.00 10.00 H new ATOM 0 HA LEU A 10 20.141 3.996 2.926 1.00 10.00 H new ATOM 0 HB2 LEU A 10 21.169 6.768 3.611 1.00 10.00 H new ATOM 0 HB3 LEU A 10 19.591 6.189 4.104 1.00 10.00 H new ATOM 0 HG LEU A 10 22.249 4.954 4.891 1.00 10.00 H new ATOM 0 HD11 LEU A 10 21.702 5.809 7.141 1.00 10.00 H new ATOM 0 HD12 LEU A 10 21.855 7.126 5.955 1.00 10.00 H new ATOM 0 HD13 LEU A 10 20.243 6.589 6.484 1.00 10.00 H new ATOM 0 HD21 LEU A 10 20.912 3.580 6.438 1.00 10.00 H new ATOM 0 HD22 LEU A 10 19.421 4.275 5.759 1.00 10.00 H new ATOM 0 HD23 LEU A 10 20.480 3.272 4.740 1.00 10.00 H new ATOM 143 N ILE A 11 20.210 6.461 0.756 1.00 10.00 N ATOM 144 CA ILE A 11 19.436 7.116 -0.290 1.00 10.00 C ATOM 145 C ILE A 11 19.179 6.160 -1.456 1.00 10.00 C ATOM 146 O ILE A 11 18.216 6.325 -2.206 1.00 10.00 O ATOM 147 CB ILE A 11 20.134 8.401 -0.798 1.00 10.00 C ATOM 148 CG1 ILE A 11 19.206 9.182 -1.732 1.00 10.00 C ATOM 149 CG2 ILE A 11 21.448 8.069 -1.498 1.00 10.00 C ATOM 150 CD1 ILE A 11 19.761 10.520 -2.166 1.00 10.00 C ATOM 0 H ILE A 11 21.191 6.739 0.797 1.00 10.00 H new ATOM 0 HA ILE A 11 18.480 7.403 0.147 1.00 10.00 H new ATOM 0 HB ILE A 11 20.362 9.027 0.065 1.00 10.00 H new ATOM 0 HG12 ILE A 11 19.005 8.578 -2.617 1.00 10.00 H new ATOM 0 HG13 ILE A 11 18.251 9.341 -1.231 1.00 10.00 H new ATOM 0 HG21 ILE A 11 21.918 8.989 -1.845 1.00 10.00 H new ATOM 0 HG22 ILE A 11 22.114 7.562 -0.800 1.00 10.00 H new ATOM 0 HG23 ILE A 11 21.252 7.418 -2.350 1.00 10.00 H new ATOM 0 HD11 ILE A 11 19.047 11.013 -2.826 1.00 10.00 H new ATOM 0 HD12 ILE A 11 19.936 11.143 -1.289 1.00 10.00 H new ATOM 0 HD13 ILE A 11 20.701 10.369 -2.697 1.00 10.00 H new ATOM 162 N GLU A 12 20.025 5.141 -1.581 1.00 10.00 N ATOM 163 CA GLU A 12 19.893 4.165 -2.654 1.00 10.00 C ATOM 164 C GLU A 12 18.755 3.184 -2.381 1.00 10.00 C ATOM 165 O GLU A 12 18.338 2.448 -3.276 1.00 10.00 O ATOM 166 CB GLU A 12 21.206 3.412 -2.873 1.00 10.00 C ATOM 167 CG GLU A 12 22.121 4.088 -3.879 1.00 10.00 C ATOM 168 CD GLU A 12 21.446 4.307 -5.216 1.00 10.00 C ATOM 169 OE1 GLU A 12 21.365 3.347 -6.010 1.00 10.00 O ATOM 170 OE2 GLU A 12 20.992 5.438 -5.482 1.00 10.00 O ATOM 0 H GLU A 12 20.809 4.971 -0.951 1.00 10.00 H new ATOM 0 HA GLU A 12 19.652 4.713 -3.565 1.00 10.00 H new ATOM 0 HB2 GLU A 12 21.728 3.320 -1.921 1.00 10.00 H new ATOM 0 HB3 GLU A 12 20.985 2.401 -3.214 1.00 10.00 H new ATOM 0 HG2 GLU A 12 22.450 5.047 -3.480 1.00 10.00 H new ATOM 0 HG3 GLU A 12 23.014 3.479 -4.021 1.00 10.00 H new ATOM 177 N SER A 13 18.258 3.170 -1.147 1.00 10.00 N ATOM 178 CA SER A 13 17.155 2.289 -0.786 1.00 10.00 C ATOM 179 C SER A 13 15.923 2.627 -1.627 1.00 10.00 C ATOM 180 O SER A 13 15.103 1.760 -1.929 1.00 10.00 O ATOM 181 CB SER A 13 16.841 2.411 0.708 1.00 10.00 C ATOM 182 OG SER A 13 17.955 2.018 1.493 1.00 10.00 O ATOM 0 H SER A 13 18.600 3.756 -0.385 1.00 10.00 H new ATOM 0 HA SER A 13 17.444 1.258 -0.989 1.00 10.00 H new ATOM 0 HB2 SER A 13 16.570 3.440 0.944 1.00 10.00 H new ATOM 0 HB3 SER A 13 15.980 1.790 0.955 1.00 10.00 H new ATOM 0 HG SER A 13 17.733 2.106 2.443 1.00 10.00 H new ATOM 188 N LEU A 14 15.815 3.891 -2.025 1.00 10.00 N ATOM 189 CA LEU A 14 14.702 4.338 -2.847 1.00 10.00 C ATOM 190 C LEU A 14 14.869 3.814 -4.268 1.00 10.00 C ATOM 191 O LEU A 14 13.936 3.259 -4.855 1.00 10.00 O ATOM 192 CB LEU A 14 14.617 5.867 -2.857 1.00 10.00 C ATOM 193 CG LEU A 14 13.991 6.499 -1.612 1.00 10.00 C ATOM 194 CD1 LEU A 14 14.152 8.011 -1.647 1.00 10.00 C ATOM 195 CD2 LEU A 14 12.522 6.126 -1.506 1.00 10.00 C ATOM 0 H LEU A 14 16.486 4.622 -1.790 1.00 10.00 H new ATOM 0 HA LEU A 14 13.777 3.946 -2.425 1.00 10.00 H new ATOM 0 HB2 LEU A 14 15.623 6.269 -2.981 1.00 10.00 H new ATOM 0 HB3 LEU A 14 14.041 6.176 -3.729 1.00 10.00 H new ATOM 0 HG LEU A 14 14.509 6.114 -0.733 1.00 10.00 H new ATOM 0 HD11 LEU A 14 13.702 8.446 -0.755 1.00 10.00 H new ATOM 0 HD12 LEU A 14 15.212 8.263 -1.678 1.00 10.00 H new ATOM 0 HD13 LEU A 14 13.658 8.409 -2.533 1.00 10.00 H new ATOM 0 HD21 LEU A 14 12.094 6.584 -0.615 1.00 10.00 H new ATOM 0 HD22 LEU A 14 11.991 6.483 -2.389 1.00 10.00 H new ATOM 0 HD23 LEU A 14 12.426 5.042 -1.439 1.00 10.00 H new ATOM 207 N SER A 15 16.075 3.975 -4.802 1.00 10.00 N ATOM 208 CA SER A 15 16.395 3.522 -6.147 1.00 10.00 C ATOM 209 C SER A 15 16.255 2.004 -6.251 1.00 10.00 C ATOM 210 O SER A 15 15.788 1.480 -7.259 1.00 10.00 O ATOM 211 CB SER A 15 17.819 3.954 -6.506 1.00 10.00 C ATOM 212 OG SER A 15 18.296 4.928 -5.584 1.00 10.00 O ATOM 0 H SER A 15 16.853 4.421 -4.316 1.00 10.00 H new ATOM 0 HA SER A 15 15.696 3.974 -6.850 1.00 10.00 H new ATOM 0 HB2 SER A 15 18.480 3.087 -6.501 1.00 10.00 H new ATOM 0 HB3 SER A 15 17.837 4.363 -7.516 1.00 10.00 H new ATOM 0 HG SER A 15 19.240 5.116 -5.766 1.00 10.00 H new ATOM 218 N GLN A 16 16.650 1.310 -5.188 1.00 10.00 N ATOM 219 CA GLN A 16 16.572 -0.144 -5.140 1.00 10.00 C ATOM 220 C GLN A 16 15.132 -0.622 -5.335 1.00 10.00 C ATOM 221 O GLN A 16 14.885 -1.600 -6.040 1.00 10.00 O ATOM 222 CB GLN A 16 17.126 -0.661 -3.810 1.00 10.00 C ATOM 223 CG GLN A 16 17.094 -2.174 -3.681 1.00 10.00 C ATOM 224 CD GLN A 16 17.945 -2.869 -4.725 1.00 10.00 C ATOM 225 OE1 GLN A 16 19.134 -3.111 -4.519 1.00 10.00 O ATOM 226 NE2 GLN A 16 17.340 -3.192 -5.855 1.00 10.00 N ATOM 0 H GLN A 16 17.030 1.736 -4.343 1.00 10.00 H new ATOM 0 HA GLN A 16 17.176 -0.544 -5.954 1.00 10.00 H new ATOM 0 HB2 GLN A 16 18.154 -0.317 -3.697 1.00 10.00 H new ATOM 0 HB3 GLN A 16 16.552 -0.224 -2.993 1.00 10.00 H new ATOM 0 HG2 GLN A 16 17.442 -2.457 -2.688 1.00 10.00 H new ATOM 0 HG3 GLN A 16 16.064 -2.520 -3.769 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.352 -2.973 -5.985 1.00 10.00 H new ATOM 0 HE22 GLN A 16 17.861 -3.660 -6.597 1.00 10.00 H new ATOM 235 N MET A 17 14.187 0.083 -4.718 1.00 10.00 N ATOM 236 CA MET A 17 12.776 -0.271 -4.835 1.00 10.00 C ATOM 237 C MET A 17 12.302 -0.072 -6.269 1.00 10.00 C ATOM 238 O MET A 17 11.564 -0.896 -6.815 1.00 10.00 O ATOM 239 CB MET A 17 11.922 0.562 -3.877 1.00 10.00 C ATOM 240 CG MET A 17 12.245 0.329 -2.406 1.00 10.00 C ATOM 241 SD MET A 17 12.000 -1.385 -1.892 1.00 10.00 S ATOM 242 CE MET A 17 10.222 -1.530 -2.049 1.00 10.00 C ATOM 0 H MET A 17 14.372 0.899 -4.135 1.00 10.00 H new ATOM 0 HA MET A 17 12.664 -1.321 -4.566 1.00 10.00 H new ATOM 0 HB2 MET A 17 12.060 1.619 -4.107 1.00 10.00 H new ATOM 0 HB3 MET A 17 10.870 0.333 -4.049 1.00 10.00 H new ATOM 0 HG2 MET A 17 13.280 0.615 -2.217 1.00 10.00 H new ATOM 0 HG3 MET A 17 11.619 0.979 -1.795 1.00 10.00 H new ATOM 0 HE1 MET A 17 9.882 -2.423 -1.525 1.00 10.00 H new ATOM 0 HE2 MET A 17 9.746 -0.651 -1.615 1.00 10.00 H new ATOM 0 HE3 MET A 17 9.955 -1.604 -3.103 1.00 10.00 H new ATOM 252 N LEU A 18 12.755 1.016 -6.883 1.00 10.00 N ATOM 253 CA LEU A 18 12.391 1.330 -8.258 1.00 10.00 C ATOM 254 C LEU A 18 12.967 0.290 -9.211 1.00 10.00 C ATOM 255 O LEU A 18 12.298 -0.153 -10.148 1.00 10.00 O ATOM 256 CB LEU A 18 12.895 2.726 -8.636 1.00 10.00 C ATOM 257 CG LEU A 18 12.580 3.169 -10.067 1.00 10.00 C ATOM 258 CD1 LEU A 18 11.079 3.332 -10.258 1.00 10.00 C ATOM 259 CD2 LEU A 18 13.305 4.463 -10.392 1.00 10.00 C ATOM 0 H LEU A 18 13.377 1.697 -6.447 1.00 10.00 H new ATOM 0 HA LEU A 18 11.304 1.315 -8.339 1.00 10.00 H new ATOM 0 HB2 LEU A 18 12.462 3.450 -7.945 1.00 10.00 H new ATOM 0 HB3 LEU A 18 13.975 2.755 -8.493 1.00 10.00 H new ATOM 0 HG LEU A 18 12.929 2.397 -10.753 1.00 10.00 H new ATOM 0 HD11 LEU A 18 10.875 3.647 -11.281 1.00 10.00 H new ATOM 0 HD12 LEU A 18 10.582 2.381 -10.065 1.00 10.00 H new ATOM 0 HD13 LEU A 18 10.704 4.085 -9.565 1.00 10.00 H new ATOM 0 HD21 LEU A 18 13.071 4.765 -11.413 1.00 10.00 H new ATOM 0 HD22 LEU A 18 12.985 5.243 -9.701 1.00 10.00 H new ATOM 0 HD23 LEU A 18 14.380 4.312 -10.296 1.00 10.00 H new ATOM 271 N SER A 19 14.210 -0.113 -8.960 1.00 10.00 N ATOM 272 CA SER A 19 14.881 -1.109 -9.785 1.00 10.00 C ATOM 273 C SER A 19 14.244 -2.490 -9.612 1.00 10.00 C ATOM 274 O SER A 19 14.494 -3.404 -10.399 1.00 10.00 O ATOM 275 CB SER A 19 16.366 -1.175 -9.427 1.00 10.00 C ATOM 276 OG SER A 19 17.014 0.059 -9.685 1.00 10.00 O ATOM 0 H SER A 19 14.774 0.239 -8.186 1.00 10.00 H new ATOM 0 HA SER A 19 14.773 -0.810 -10.828 1.00 10.00 H new ATOM 0 HB2 SER A 19 16.477 -1.433 -8.374 1.00 10.00 H new ATOM 0 HB3 SER A 19 16.846 -1.967 -10.002 1.00 10.00 H new ATOM 0 HG SER A 19 16.759 0.712 -9.000 1.00 10.00 H new ATOM 282 N MET A 20 13.432 -2.637 -8.572 1.00 10.00 N ATOM 283 CA MET A 20 12.761 -3.901 -8.303 1.00 10.00 C ATOM 284 C MET A 20 11.410 -3.935 -9.008 1.00 10.00 C ATOM 285 O MET A 20 10.687 -4.932 -8.958 1.00 10.00 O ATOM 286 CB MET A 20 12.581 -4.097 -6.795 1.00 10.00 C ATOM 287 CG MET A 20 12.354 -5.546 -6.393 1.00 10.00 C ATOM 288 SD MET A 20 12.167 -5.747 -4.611 1.00 10.00 S ATOM 289 CE MET A 20 13.769 -5.190 -4.030 1.00 10.00 C ATOM 0 H MET A 20 13.223 -1.897 -7.902 1.00 10.00 H new ATOM 0 HA MET A 20 13.377 -4.715 -8.686 1.00 10.00 H new ATOM 0 HB2 MET A 20 13.464 -3.720 -6.280 1.00 10.00 H new ATOM 0 HB3 MET A 20 11.735 -3.498 -6.457 1.00 10.00 H new ATOM 0 HG2 MET A 20 11.462 -5.923 -6.893 1.00 10.00 H new ATOM 0 HG3 MET A 20 13.193 -6.151 -6.738 1.00 10.00 H new ATOM 0 HE1 MET A 20 13.961 -5.603 -3.040 1.00 10.00 H new ATOM 0 HE2 MET A 20 14.543 -5.526 -4.720 1.00 10.00 H new ATOM 0 HE3 MET A 20 13.778 -4.101 -3.977 1.00 10.00 H new ATOM 299 N GLY A 21 11.072 -2.828 -9.657 1.00 10.00 N ATOM 300 CA GLY A 21 9.821 -2.742 -10.378 1.00 10.00 C ATOM 301 C GLY A 21 8.680 -2.230 -9.524 1.00 10.00 C ATOM 302 O GLY A 21 7.515 -2.367 -9.898 1.00 10.00 O ATOM 0 H GLY A 21 11.646 -1.986 -9.696 1.00 10.00 H new ATOM 0 HA2 GLY A 21 9.948 -2.084 -11.238 1.00 10.00 H new ATOM 0 HA3 GLY A 21 9.563 -3.727 -10.766 1.00 10.00 H new ATOM 306 N PHE A 22 9.002 -1.632 -8.385 1.00 10.00 N ATOM 307 CA PHE A 22 7.978 -1.107 -7.497 1.00 10.00 C ATOM 308 C PHE A 22 7.991 0.414 -7.508 1.00 10.00 C ATOM 309 O PHE A 22 9.018 1.042 -7.247 1.00 10.00 O ATOM 310 CB PHE A 22 8.175 -1.630 -6.073 1.00 10.00 C ATOM 311 CG PHE A 22 6.902 -1.678 -5.271 1.00 10.00 C ATOM 312 CD1 PHE A 22 5.786 -2.341 -5.760 1.00 10.00 C ATOM 313 CD2 PHE A 22 6.823 -1.068 -4.029 1.00 10.00 C ATOM 314 CE1 PHE A 22 4.614 -2.390 -5.025 1.00 10.00 C ATOM 315 CE2 PHE A 22 5.654 -1.115 -3.292 1.00 10.00 C ATOM 316 CZ PHE A 22 4.549 -1.778 -3.791 1.00 10.00 C ATOM 0 H PHE A 22 9.959 -1.500 -8.057 1.00 10.00 H new ATOM 0 HA PHE A 22 7.008 -1.449 -7.857 1.00 10.00 H new ATOM 0 HB2 PHE A 22 8.605 -2.631 -6.118 1.00 10.00 H new ATOM 0 HB3 PHE A 22 8.896 -0.996 -5.558 1.00 10.00 H new ATOM 0 HD1 PHE A 22 5.832 -2.824 -6.725 1.00 10.00 H new ATOM 0 HD2 PHE A 22 7.684 -0.550 -3.632 1.00 10.00 H new ATOM 0 HE1 PHE A 22 3.751 -2.907 -5.418 1.00 10.00 H new ATOM 0 HE2 PHE A 22 5.605 -0.634 -2.326 1.00 10.00 H new ATOM 0 HZ PHE A 22 3.636 -1.817 -3.215 1.00 10.00 H new ATOM 326 N SER A 23 6.850 0.999 -7.829 1.00 10.00 N ATOM 327 CA SER A 23 6.718 2.444 -7.874 1.00 10.00 C ATOM 328 C SER A 23 5.320 2.858 -7.430 1.00 10.00 C ATOM 329 O SER A 23 4.433 2.013 -7.277 1.00 10.00 O ATOM 330 CB SER A 23 7.006 2.957 -9.286 1.00 10.00 C ATOM 331 OG SER A 23 6.747 1.957 -10.257 1.00 10.00 O ATOM 0 H SER A 23 5.997 0.491 -8.064 1.00 10.00 H new ATOM 0 HA SER A 23 7.444 2.886 -7.191 1.00 10.00 H new ATOM 0 HB2 SER A 23 6.391 3.834 -9.490 1.00 10.00 H new ATOM 0 HB3 SER A 23 8.046 3.274 -9.355 1.00 10.00 H new ATOM 0 HG SER A 23 6.937 2.312 -11.151 1.00 10.00 H new ATOM 337 N ASP A 24 5.125 4.150 -7.214 1.00 10.00 N ATOM 338 CA ASP A 24 3.834 4.659 -6.784 1.00 10.00 C ATOM 339 C ASP A 24 3.285 5.671 -7.783 1.00 10.00 C ATOM 340 O ASP A 24 4.033 6.277 -8.553 1.00 10.00 O ATOM 341 CB ASP A 24 3.917 5.281 -5.381 1.00 10.00 C ATOM 342 CG ASP A 24 5.026 6.311 -5.215 1.00 10.00 C ATOM 343 OD1 ASP A 24 5.565 6.798 -6.226 1.00 10.00 O ATOM 344 OD2 ASP A 24 5.350 6.639 -4.058 1.00 10.00 O ATOM 0 H ASP A 24 5.844 4.864 -7.330 1.00 10.00 H new ATOM 0 HA ASP A 24 3.148 3.813 -6.739 1.00 10.00 H new ATOM 0 HB2 ASP A 24 2.962 5.752 -5.149 1.00 10.00 H new ATOM 0 HB3 ASP A 24 4.065 4.485 -4.652 1.00 10.00 H new ATOM 349 N GLU A 25 1.970 5.828 -7.775 1.00 10.00 N ATOM 350 CA GLU A 25 1.293 6.761 -8.663 1.00 10.00 C ATOM 351 C GLU A 25 0.911 8.017 -7.889 1.00 10.00 C ATOM 352 O GLU A 25 1.187 9.141 -8.315 1.00 10.00 O ATOM 353 CB GLU A 25 0.038 6.125 -9.281 1.00 10.00 C ATOM 354 CG GLU A 25 -0.250 4.701 -8.813 1.00 10.00 C ATOM 355 CD GLU A 25 -0.878 4.641 -7.430 1.00 10.00 C ATOM 356 OE1 GLU A 25 -0.228 5.094 -6.466 1.00 10.00 O ATOM 357 OE2 GLU A 25 -2.012 4.126 -7.305 1.00 10.00 O ATOM 0 H GLU A 25 1.344 5.314 -7.155 1.00 10.00 H new ATOM 0 HA GLU A 25 1.974 7.022 -9.473 1.00 10.00 H new ATOM 0 HB2 GLU A 25 -0.823 6.751 -9.047 1.00 10.00 H new ATOM 0 HB3 GLU A 25 0.145 6.122 -10.366 1.00 10.00 H new ATOM 0 HG2 GLU A 25 -0.915 4.218 -9.528 1.00 10.00 H new ATOM 0 HG3 GLU A 25 0.680 4.132 -8.808 1.00 10.00 H new ATOM 364 N GLY A 26 0.280 7.811 -6.738 1.00 10.00 N ATOM 365 CA GLY A 26 -0.125 8.923 -5.901 1.00 10.00 C ATOM 366 C GLY A 26 0.964 9.322 -4.924 1.00 10.00 C ATOM 367 O GLY A 26 0.776 10.213 -4.095 1.00 10.00 O ATOM 0 H GLY A 26 0.042 6.890 -6.370 1.00 10.00 H new ATOM 0 HA2 GLY A 26 -0.379 9.777 -6.529 1.00 10.00 H new ATOM 0 HA3 GLY A 26 -1.026 8.653 -5.350 1.00 10.00 H new ATOM 371 N GLY A 27 2.108 8.657 -5.027 1.00 10.00 N ATOM 372 CA GLY A 27 3.225 8.946 -4.148 1.00 10.00 C ATOM 373 C GLY A 27 3.033 8.377 -2.759 1.00 10.00 C ATOM 374 O GLY A 27 3.242 9.075 -1.764 1.00 10.00 O ATOM 0 H GLY A 27 2.283 7.918 -5.708 1.00 10.00 H new ATOM 0 HA2 GLY A 27 4.138 8.538 -4.581 1.00 10.00 H new ATOM 0 HA3 GLY A 27 3.359 10.026 -4.079 1.00 10.00 H new ATOM 378 N TRP A 28 2.628 7.116 -2.686 1.00 10.00 N ATOM 379 CA TRP A 28 2.406 6.471 -1.402 1.00 10.00 C ATOM 380 C TRP A 28 3.618 5.652 -0.956 1.00 10.00 C ATOM 381 O TRP A 28 3.825 5.455 0.240 1.00 10.00 O ATOM 382 CB TRP A 28 1.150 5.596 -1.435 1.00 10.00 C ATOM 383 CG TRP A 28 1.206 4.419 -2.363 1.00 10.00 C ATOM 384 CD1 TRP A 28 1.098 4.429 -3.722 1.00 10.00 C ATOM 385 CD2 TRP A 28 1.346 3.045 -1.984 1.00 10.00 C ATOM 386 NE1 TRP A 28 1.178 3.148 -4.212 1.00 10.00 N ATOM 387 CE2 TRP A 28 1.328 2.281 -3.162 1.00 10.00 C ATOM 388 CE3 TRP A 28 1.489 2.392 -0.757 1.00 10.00 C ATOM 389 CZ2 TRP A 28 1.451 0.890 -3.152 1.00 10.00 C ATOM 390 CZ3 TRP A 28 1.609 1.017 -0.746 1.00 10.00 C ATOM 391 CH2 TRP A 28 1.586 0.277 -1.934 1.00 10.00 C ATOM 0 H TRP A 28 2.448 6.524 -3.497 1.00 10.00 H new ATOM 0 HA TRP A 28 2.257 7.264 -0.669 1.00 10.00 H new ATOM 0 HB2 TRP A 28 0.956 5.232 -0.426 1.00 10.00 H new ATOM 0 HB3 TRP A 28 0.302 6.219 -1.718 1.00 10.00 H new ATOM 0 HD1 TRP A 28 0.968 5.315 -4.326 1.00 10.00 H new ATOM 0 HE1 TRP A 28 1.133 2.885 -5.197 1.00 10.00 H new ATOM 0 HE3 TRP A 28 1.505 2.953 0.166 1.00 10.00 H new ATOM 0 HZ2 TRP A 28 1.440 0.319 -4.069 1.00 10.00 H new ATOM 0 HZ3 TRP A 28 1.723 0.502 0.197 1.00 10.00 H new ATOM 0 HH2 TRP A 28 1.676 -0.798 -1.890 1.00 10.00 H new ATOM 402 N LEU A 29 4.433 5.205 -1.905 1.00 10.00 N ATOM 403 CA LEU A 29 5.611 4.408 -1.577 1.00 10.00 C ATOM 404 C LEU A 29 6.641 5.273 -0.858 1.00 10.00 C ATOM 405 O LEU A 29 7.269 4.839 0.107 1.00 10.00 O ATOM 406 CB LEU A 29 6.218 3.795 -2.843 1.00 10.00 C ATOM 407 CG LEU A 29 7.522 3.016 -2.639 1.00 10.00 C ATOM 408 CD1 LEU A 29 7.314 1.846 -1.685 1.00 10.00 C ATOM 409 CD2 LEU A 29 8.067 2.523 -3.971 1.00 10.00 C ATOM 0 H LEU A 29 4.302 5.379 -2.901 1.00 10.00 H new ATOM 0 HA LEU A 29 5.310 3.595 -0.916 1.00 10.00 H new ATOM 0 HB2 LEU A 29 5.482 3.127 -3.291 1.00 10.00 H new ATOM 0 HB3 LEU A 29 6.401 4.594 -3.561 1.00 10.00 H new ATOM 0 HG LEU A 29 8.252 3.693 -2.195 1.00 10.00 H new ATOM 0 HD11 LEU A 29 8.254 1.309 -1.557 1.00 10.00 H new ATOM 0 HD12 LEU A 29 6.975 2.220 -0.719 1.00 10.00 H new ATOM 0 HD13 LEU A 29 6.564 1.170 -2.096 1.00 10.00 H new ATOM 0 HD21 LEU A 29 8.993 1.973 -3.804 1.00 10.00 H new ATOM 0 HD22 LEU A 29 7.335 1.868 -4.443 1.00 10.00 H new ATOM 0 HD23 LEU A 29 8.264 3.375 -4.621 1.00 10.00 H new ATOM 421 N THR A 30 6.783 6.510 -1.322 1.00 10.00 N ATOM 422 CA THR A 30 7.723 7.450 -0.725 1.00 10.00 C ATOM 423 C THR A 30 7.323 7.792 0.715 1.00 10.00 C ATOM 424 O THR A 30 8.156 8.201 1.519 1.00 10.00 O ATOM 425 CB THR A 30 7.839 8.741 -1.572 1.00 10.00 C ATOM 426 OG1 THR A 30 8.801 9.640 -0.999 1.00 10.00 O ATOM 427 CG2 THR A 30 6.497 9.448 -1.690 1.00 10.00 C ATOM 0 H THR A 30 6.257 6.885 -2.112 1.00 10.00 H new ATOM 0 HA THR A 30 8.699 6.966 -0.704 1.00 10.00 H new ATOM 0 HB THR A 30 8.168 8.446 -2.568 1.00 10.00 H new ATOM 0 HG1 THR A 30 8.861 10.449 -1.549 1.00 10.00 H new ATOM 0 HG21 THR A 30 6.613 10.350 -2.290 1.00 10.00 H new ATOM 0 HG22 THR A 30 5.777 8.784 -2.168 1.00 10.00 H new ATOM 0 HG23 THR A 30 6.139 9.717 -0.696 1.00 10.00 H new ATOM 435 N ARG A 31 6.043 7.605 1.038 1.00 10.00 N ATOM 436 CA ARG A 31 5.541 7.880 2.381 1.00 10.00 C ATOM 437 C ARG A 31 5.543 6.609 3.225 1.00 10.00 C ATOM 438 O ARG A 31 5.738 6.661 4.438 1.00 10.00 O ATOM 439 CB ARG A 31 4.126 8.464 2.323 1.00 10.00 C ATOM 440 CG ARG A 31 4.066 9.877 1.762 1.00 10.00 C ATOM 441 CD ARG A 31 4.742 10.889 2.681 1.00 10.00 C ATOM 442 NE ARG A 31 4.055 11.026 3.963 1.00 10.00 N ATOM 443 CZ ARG A 31 3.084 11.911 4.201 1.00 10.00 C ATOM 444 NH1 ARG A 31 2.650 12.710 3.232 1.00 10.00 N ATOM 445 NH2 ARG A 31 2.543 11.991 5.410 1.00 10.00 N ATOM 0 H ARG A 31 5.336 7.264 0.386 1.00 10.00 H new ATOM 0 HA ARG A 31 6.203 8.612 2.844 1.00 10.00 H new ATOM 0 HB2 ARG A 31 3.500 7.814 1.712 1.00 10.00 H new ATOM 0 HB3 ARG A 31 3.702 8.464 3.327 1.00 10.00 H new ATOM 0 HG2 ARG A 31 4.547 9.899 0.784 1.00 10.00 H new ATOM 0 HG3 ARG A 31 3.025 10.163 1.612 1.00 10.00 H new ATOM 0 HD2 ARG A 31 5.774 10.584 2.856 1.00 10.00 H new ATOM 0 HD3 ARG A 31 4.776 11.859 2.185 1.00 10.00 H new ATOM 0 HE ARG A 31 4.335 10.407 4.724 1.00 10.00 H new ATOM 0 HH11 ARG A 31 3.059 12.649 2.300 1.00 10.00 H new ATOM 0 HH12 ARG A 31 1.908 13.384 3.421 1.00 10.00 H new ATOM 0 HH21 ARG A 31 2.869 11.377 6.156 1.00 10.00 H new ATOM 0 HH22 ARG A 31 1.801 12.667 5.593 1.00 10.00 H new ATOM 459 N LEU A 32 5.333 5.473 2.571 1.00 10.00 N ATOM 460 CA LEU A 32 5.305 4.180 3.246 1.00 10.00 C ATOM 461 C LEU A 32 6.636 3.905 3.940 1.00 10.00 C ATOM 462 O LEU A 32 6.673 3.420 5.072 1.00 10.00 O ATOM 463 CB LEU A 32 5.003 3.070 2.238 1.00 10.00 C ATOM 464 CG LEU A 32 4.348 1.817 2.821 1.00 10.00 C ATOM 465 CD1 LEU A 32 2.864 2.053 3.062 1.00 10.00 C ATOM 466 CD2 LEU A 32 4.562 0.630 1.895 1.00 10.00 C ATOM 0 H LEU A 32 5.178 5.421 1.564 1.00 10.00 H new ATOM 0 HA LEU A 32 4.519 4.202 4.001 1.00 10.00 H new ATOM 0 HB2 LEU A 32 4.351 3.473 1.463 1.00 10.00 H new ATOM 0 HB3 LEU A 32 5.935 2.780 1.752 1.00 10.00 H new ATOM 0 HG LEU A 32 4.816 1.594 3.780 1.00 10.00 H new ATOM 0 HD11 LEU A 32 2.415 1.151 3.477 1.00 10.00 H new ATOM 0 HD12 LEU A 32 2.736 2.878 3.763 1.00 10.00 H new ATOM 0 HD13 LEU A 32 2.377 2.300 2.119 1.00 10.00 H new ATOM 0 HD21 LEU A 32 4.090 -0.255 2.323 1.00 10.00 H new ATOM 0 HD22 LEU A 32 4.119 0.843 0.922 1.00 10.00 H new ATOM 0 HD23 LEU A 32 5.630 0.450 1.775 1.00 10.00 H new ATOM 478 N LEU A 33 7.721 4.257 3.268 1.00 10.00 N ATOM 479 CA LEU A 33 9.063 4.047 3.801 1.00 10.00 C ATOM 480 C LEU A 33 9.380 5.020 4.938 1.00 10.00 C ATOM 481 O LEU A 33 10.416 4.911 5.585 1.00 10.00 O ATOM 482 CB LEU A 33 10.098 4.189 2.690 1.00 10.00 C ATOM 483 CG LEU A 33 9.922 3.228 1.509 1.00 10.00 C ATOM 484 CD1 LEU A 33 10.903 3.565 0.398 1.00 10.00 C ATOM 485 CD2 LEU A 33 10.105 1.784 1.957 1.00 10.00 C ATOM 0 H LEU A 33 7.700 4.693 2.346 1.00 10.00 H new ATOM 0 HA LEU A 33 9.102 3.036 4.207 1.00 10.00 H new ATOM 0 HB2 LEU A 33 10.066 5.212 2.314 1.00 10.00 H new ATOM 0 HB3 LEU A 33 11.089 4.037 3.117 1.00 10.00 H new ATOM 0 HG LEU A 33 8.908 3.343 1.125 1.00 10.00 H new ATOM 0 HD11 LEU A 33 10.764 2.873 -0.432 1.00 10.00 H new ATOM 0 HD12 LEU A 33 10.727 4.584 0.054 1.00 10.00 H new ATOM 0 HD13 LEU A 33 11.922 3.480 0.775 1.00 10.00 H new ATOM 0 HD21 LEU A 33 9.976 1.119 1.103 1.00 10.00 H new ATOM 0 HD22 LEU A 33 11.106 1.655 2.369 1.00 10.00 H new ATOM 0 HD23 LEU A 33 9.365 1.543 2.720 1.00 10.00 H new ATOM 497 N GLN A 34 8.499 5.980 5.165 1.00 10.00 N ATOM 498 CA GLN A 34 8.706 6.952 6.231 1.00 10.00 C ATOM 499 C GLN A 34 8.115 6.438 7.542 1.00 10.00 C ATOM 500 O GLN A 34 8.656 6.694 8.619 1.00 10.00 O ATOM 501 CB GLN A 34 8.081 8.304 5.867 1.00 10.00 C ATOM 502 CG GLN A 34 8.576 8.871 4.544 1.00 10.00 C ATOM 503 CD GLN A 34 10.080 9.061 4.506 1.00 10.00 C ATOM 504 OE1 GLN A 34 10.710 9.349 5.526 1.00 10.00 O ATOM 505 NE2 GLN A 34 10.666 8.901 3.329 1.00 10.00 N ATOM 0 H GLN A 34 7.639 6.109 4.631 1.00 10.00 H new ATOM 0 HA GLN A 34 9.780 7.092 6.358 1.00 10.00 H new ATOM 0 HB2 GLN A 34 6.998 8.193 5.822 1.00 10.00 H new ATOM 0 HB3 GLN A 34 8.295 9.019 6.661 1.00 10.00 H new ATOM 0 HG2 GLN A 34 8.279 8.203 3.735 1.00 10.00 H new ATOM 0 HG3 GLN A 34 8.090 9.829 4.361 1.00 10.00 H new ATOM 0 HE21 GLN A 34 10.108 8.663 2.509 1.00 10.00 H new ATOM 0 HE22 GLN A 34 11.676 9.016 3.242 1.00 10.00 H new ATOM 514 N THR A 35 7.008 5.701 7.452 1.00 10.00 N ATOM 515 CA THR A 35 6.353 5.175 8.641 1.00 10.00 C ATOM 516 C THR A 35 6.720 3.713 8.903 1.00 10.00 C ATOM 517 O THR A 35 6.383 3.163 9.950 1.00 10.00 O ATOM 518 CB THR A 35 4.820 5.311 8.546 1.00 10.00 C ATOM 519 OG1 THR A 35 4.349 4.819 7.282 1.00 10.00 O ATOM 520 CG2 THR A 35 4.404 6.764 8.713 1.00 10.00 C ATOM 0 H THR A 35 6.551 5.458 6.573 1.00 10.00 H new ATOM 0 HA THR A 35 6.713 5.774 9.478 1.00 10.00 H new ATOM 0 HB THR A 35 4.377 4.719 9.346 1.00 10.00 H new ATOM 0 HG1 THR A 35 3.398 5.035 7.181 1.00 10.00 H new ATOM 0 HG21 THR A 35 3.319 6.842 8.643 1.00 10.00 H new ATOM 0 HG22 THR A 35 4.732 7.127 9.687 1.00 10.00 H new ATOM 0 HG23 THR A 35 4.862 7.366 7.928 1.00 10.00 H new ATOM 528 N LYS A 36 7.387 3.078 7.948 1.00 10.00 N ATOM 529 CA LYS A 36 7.797 1.683 8.104 1.00 10.00 C ATOM 530 C LYS A 36 9.292 1.531 7.857 1.00 10.00 C ATOM 531 O LYS A 36 9.808 0.413 7.795 1.00 10.00 O ATOM 532 CB LYS A 36 7.011 0.784 7.147 1.00 10.00 C ATOM 533 CG LYS A 36 5.575 0.549 7.586 1.00 10.00 C ATOM 534 CD LYS A 36 4.589 0.940 6.498 1.00 10.00 C ATOM 535 CE LYS A 36 3.208 1.209 7.071 1.00 10.00 C ATOM 536 NZ LYS A 36 3.216 2.368 8.001 1.00 10.00 N ATOM 0 H LYS A 36 7.656 3.502 7.060 1.00 10.00 H new ATOM 0 HA LYS A 36 7.582 1.378 9.128 1.00 10.00 H new ATOM 0 HB2 LYS A 36 7.011 1.234 6.154 1.00 10.00 H new ATOM 0 HB3 LYS A 36 7.519 -0.176 7.062 1.00 10.00 H new ATOM 0 HG2 LYS A 36 5.439 -0.502 7.841 1.00 10.00 H new ATOM 0 HG3 LYS A 36 5.370 1.125 8.488 1.00 10.00 H new ATOM 0 HD2 LYS A 36 4.949 1.829 5.981 1.00 10.00 H new ATOM 0 HD3 LYS A 36 4.528 0.143 5.757 1.00 10.00 H new ATOM 0 HE2 LYS A 36 2.507 1.399 6.258 1.00 10.00 H new ATOM 0 HE3 LYS A 36 2.853 0.323 7.597 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 2.238 2.628 8.240 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 3.728 2.113 8.869 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 3.687 3.175 7.545 1.00 10.00 H new ATOM 550 N ASN A 37 9.971 2.670 7.737 1.00 10.00 N ATOM 551 CA ASN A 37 11.412 2.724 7.488 1.00 10.00 C ATOM 552 C ASN A 37 11.740 2.229 6.078 1.00 10.00 C ATOM 553 O ASN A 37 10.891 1.660 5.389 1.00 10.00 O ATOM 554 CB ASN A 37 12.195 1.920 8.541 1.00 10.00 C ATOM 555 CG ASN A 37 13.678 2.249 8.545 1.00 10.00 C ATOM 556 OD1 ASN A 37 14.094 3.327 8.110 1.00 10.00 O ATOM 557 ND2 ASN A 37 14.487 1.325 9.031 1.00 10.00 N ATOM 0 H ASN A 37 9.534 3.589 7.810 1.00 10.00 H new ATOM 0 HA ASN A 37 11.721 3.766 7.567 1.00 10.00 H new ATOM 0 HB2 ASN A 37 11.780 2.121 9.529 1.00 10.00 H new ATOM 0 HB3 ASN A 37 12.064 0.855 8.351 1.00 10.00 H new ATOM 0 HD21 ASN A 37 15.493 1.490 9.056 1.00 10.00 H new ATOM 0 HD22 ASN A 37 14.106 0.446 9.381 1.00 10.00 H new ATOM 564 N TYR A 38 12.971 2.456 5.648 1.00 10.00 N ATOM 565 CA TYR A 38 13.416 2.050 4.320 1.00 10.00 C ATOM 566 C TYR A 38 13.813 0.573 4.305 1.00 10.00 C ATOM 567 O TYR A 38 14.757 0.181 3.618 1.00 10.00 O ATOM 568 CB TYR A 38 14.608 2.905 3.879 1.00 10.00 C ATOM 569 CG TYR A 38 14.292 4.375 3.706 1.00 10.00 C ATOM 570 CD1 TYR A 38 14.429 5.260 4.766 1.00 10.00 C ATOM 571 CD2 TYR A 38 13.876 4.883 2.480 1.00 10.00 C ATOM 572 CE1 TYR A 38 14.153 6.607 4.614 1.00 10.00 C ATOM 573 CE2 TYR A 38 13.602 6.230 2.319 1.00 10.00 C ATOM 574 CZ TYR A 38 13.744 7.087 3.390 1.00 10.00 C ATOM 575 OH TYR A 38 13.475 8.429 3.236 1.00 10.00 O ATOM 0 H TYR A 38 13.687 2.924 6.204 1.00 10.00 H new ATOM 0 HA TYR A 38 12.588 2.196 3.627 1.00 10.00 H new ATOM 0 HB2 TYR A 38 15.406 2.801 4.614 1.00 10.00 H new ATOM 0 HB3 TYR A 38 14.991 2.515 2.936 1.00 10.00 H new ATOM 0 HD1 TYR A 38 14.757 4.891 5.726 1.00 10.00 H new ATOM 0 HD2 TYR A 38 13.765 4.215 1.639 1.00 10.00 H new ATOM 0 HE1 TYR A 38 14.258 7.280 5.452 1.00 10.00 H new ATOM 0 HE2 TYR A 38 13.279 6.608 1.360 1.00 10.00 H new ATOM 0 HH TYR A 38 13.433 8.647 2.281 1.00 10.00 H new ATOM 585 N ASP A 39 13.086 -0.242 5.058 1.00 10.00 N ATOM 586 CA ASP A 39 13.372 -1.666 5.131 1.00 10.00 C ATOM 587 C ASP A 39 12.753 -2.387 3.944 1.00 10.00 C ATOM 588 O ASP A 39 11.536 -2.566 3.876 1.00 10.00 O ATOM 589 CB ASP A 39 12.849 -2.263 6.437 1.00 10.00 C ATOM 590 CG ASP A 39 13.427 -3.640 6.704 1.00 10.00 C ATOM 591 OD1 ASP A 39 12.857 -4.636 6.217 1.00 10.00 O ATOM 592 OD2 ASP A 39 14.464 -3.728 7.393 1.00 10.00 O ATOM 0 H ASP A 39 12.294 0.060 5.626 1.00 10.00 H new ATOM 0 HA ASP A 39 14.454 -1.797 5.104 1.00 10.00 H new ATOM 0 HB2 ASP A 39 13.098 -1.599 7.265 1.00 10.00 H new ATOM 0 HB3 ASP A 39 11.762 -2.328 6.396 1.00 10.00 H new ATOM 597 N ILE A 40 13.604 -2.790 3.014 1.00 10.00 N ATOM 598 CA ILE A 40 13.170 -3.481 1.804 1.00 10.00 C ATOM 599 C ILE A 40 12.430 -4.778 2.133 1.00 10.00 C ATOM 600 O ILE A 40 11.422 -5.106 1.503 1.00 10.00 O ATOM 601 CB ILE A 40 14.374 -3.795 0.890 1.00 10.00 C ATOM 602 CG1 ILE A 40 15.190 -2.523 0.648 1.00 10.00 C ATOM 603 CG2 ILE A 40 13.905 -4.394 -0.429 1.00 10.00 C ATOM 604 CD1 ILE A 40 16.535 -2.770 0.003 1.00 10.00 C ATOM 0 H ILE A 40 14.613 -2.649 3.073 1.00 10.00 H new ATOM 0 HA ILE A 40 12.485 -2.813 1.282 1.00 10.00 H new ATOM 0 HB ILE A 40 15.009 -4.529 1.385 1.00 10.00 H new ATOM 0 HG12 ILE A 40 14.613 -1.848 0.015 1.00 10.00 H new ATOM 0 HG13 ILE A 40 15.343 -2.015 1.600 1.00 10.00 H new ATOM 0 HG21 ILE A 40 14.768 -4.608 -1.059 1.00 10.00 H new ATOM 0 HG22 ILE A 40 13.359 -5.317 -0.236 1.00 10.00 H new ATOM 0 HG23 ILE A 40 13.251 -3.686 -0.938 1.00 10.00 H new ATOM 0 HD11 ILE A 40 17.052 -1.820 -0.135 1.00 10.00 H new ATOM 0 HD12 ILE A 40 17.132 -3.418 0.644 1.00 10.00 H new ATOM 0 HD13 ILE A 40 16.392 -3.249 -0.965 1.00 10.00 H new ATOM 616 N GLY A 41 12.923 -5.499 3.134 1.00 10.00 N ATOM 617 CA GLY A 41 12.310 -6.752 3.530 1.00 10.00 C ATOM 618 C GLY A 41 10.892 -6.572 4.029 1.00 10.00 C ATOM 619 O GLY A 41 9.964 -7.188 3.505 1.00 10.00 O ATOM 0 H GLY A 41 13.742 -5.235 3.681 1.00 10.00 H new ATOM 0 HA2 GLY A 41 12.309 -7.436 2.682 1.00 10.00 H new ATOM 0 HA3 GLY A 41 12.911 -7.215 4.312 1.00 10.00 H new ATOM 623 N ALA A 42 10.726 -5.714 5.032 1.00 10.00 N ATOM 624 CA ALA A 42 9.416 -5.450 5.611 1.00 10.00 C ATOM 625 C ALA A 42 8.456 -4.900 4.562 1.00 10.00 C ATOM 626 O ALA A 42 7.273 -5.238 4.564 1.00 10.00 O ATOM 627 CB ALA A 42 9.532 -4.480 6.779 1.00 10.00 C ATOM 0 H ALA A 42 11.488 -5.188 5.461 1.00 10.00 H new ATOM 0 HA ALA A 42 9.016 -6.395 5.979 1.00 10.00 H new ATOM 0 HB1 ALA A 42 8.543 -4.295 7.198 1.00 10.00 H new ATOM 0 HB2 ALA A 42 10.177 -4.909 7.546 1.00 10.00 H new ATOM 0 HB3 ALA A 42 9.960 -3.540 6.430 1.00 10.00 H new ATOM 633 N ALA A 43 8.971 -4.063 3.665 1.00 10.00 N ATOM 634 CA ALA A 43 8.154 -3.470 2.609 1.00 10.00 C ATOM 635 C ALA A 43 7.534 -4.553 1.727 1.00 10.00 C ATOM 636 O ALA A 43 6.325 -4.557 1.491 1.00 10.00 O ATOM 637 CB ALA A 43 8.986 -2.513 1.772 1.00 10.00 C ATOM 0 H ALA A 43 9.951 -3.780 3.648 1.00 10.00 H new ATOM 0 HA ALA A 43 7.344 -2.910 3.077 1.00 10.00 H new ATOM 0 HB1 ALA A 43 8.364 -2.079 0.989 1.00 10.00 H new ATOM 0 HB2 ALA A 43 9.376 -1.718 2.408 1.00 10.00 H new ATOM 0 HB3 ALA A 43 9.816 -3.054 1.317 1.00 10.00 H new ATOM 643 N LEU A 44 8.366 -5.480 1.258 1.00 10.00 N ATOM 644 CA LEU A 44 7.900 -6.572 0.402 1.00 10.00 C ATOM 645 C LEU A 44 6.998 -7.525 1.180 1.00 10.00 C ATOM 646 O LEU A 44 6.058 -8.098 0.630 1.00 10.00 O ATOM 647 CB LEU A 44 9.094 -7.349 -0.166 1.00 10.00 C ATOM 648 CG LEU A 44 9.495 -6.989 -1.599 1.00 10.00 C ATOM 649 CD1 LEU A 44 9.881 -5.525 -1.700 1.00 10.00 C ATOM 650 CD2 LEU A 44 10.647 -7.872 -2.061 1.00 10.00 C ATOM 0 H LEU A 44 9.367 -5.498 1.455 1.00 10.00 H new ATOM 0 HA LEU A 44 7.328 -6.136 -0.417 1.00 10.00 H new ATOM 0 HB2 LEU A 44 9.953 -7.186 0.485 1.00 10.00 H new ATOM 0 HB3 LEU A 44 8.863 -8.414 -0.129 1.00 10.00 H new ATOM 0 HG LEU A 44 8.636 -7.161 -2.248 1.00 10.00 H new ATOM 0 HD11 LEU A 44 10.162 -5.293 -2.727 1.00 10.00 H new ATOM 0 HD12 LEU A 44 9.034 -4.904 -1.406 1.00 10.00 H new ATOM 0 HD13 LEU A 44 10.724 -5.325 -1.039 1.00 10.00 H new ATOM 0 HD21 LEU A 44 10.923 -7.606 -3.081 1.00 10.00 H new ATOM 0 HD22 LEU A 44 11.504 -7.725 -1.404 1.00 10.00 H new ATOM 0 HD23 LEU A 44 10.340 -8.917 -2.029 1.00 10.00 H new ATOM 662 N ASP A 45 7.296 -7.681 2.461 1.00 10.00 N ATOM 663 CA ASP A 45 6.536 -8.570 3.337 1.00 10.00 C ATOM 664 C ASP A 45 5.149 -8.014 3.641 1.00 10.00 C ATOM 665 O ASP A 45 4.192 -8.769 3.813 1.00 10.00 O ATOM 666 CB ASP A 45 7.306 -8.792 4.637 1.00 10.00 C ATOM 667 CG ASP A 45 6.896 -10.063 5.342 1.00 10.00 C ATOM 668 OD1 ASP A 45 7.164 -11.160 4.804 1.00 10.00 O ATOM 669 OD2 ASP A 45 6.334 -9.978 6.451 1.00 10.00 O ATOM 0 H ASP A 45 8.067 -7.199 2.924 1.00 10.00 H new ATOM 0 HA ASP A 45 6.404 -9.520 2.819 1.00 10.00 H new ATOM 0 HB2 ASP A 45 8.374 -8.828 4.421 1.00 10.00 H new ATOM 0 HB3 ASP A 45 7.144 -7.943 5.301 1.00 10.00 H new ATOM 674 N THR A 46 5.043 -6.691 3.682 1.00 10.00 N ATOM 675 CA THR A 46 3.776 -6.025 3.972 1.00 10.00 C ATOM 676 C THR A 46 2.708 -6.361 2.926 1.00 10.00 C ATOM 677 O THR A 46 1.525 -6.452 3.249 1.00 10.00 O ATOM 678 CB THR A 46 3.956 -4.491 4.060 1.00 10.00 C ATOM 679 OG1 THR A 46 4.927 -4.171 5.067 1.00 10.00 O ATOM 680 CG2 THR A 46 2.642 -3.789 4.389 1.00 10.00 C ATOM 0 H THR A 46 5.823 -6.054 3.517 1.00 10.00 H new ATOM 0 HA THR A 46 3.439 -6.396 4.940 1.00 10.00 H new ATOM 0 HB THR A 46 4.297 -4.142 3.085 1.00 10.00 H new ATOM 0 HG1 THR A 46 5.779 -4.603 4.849 1.00 10.00 H new ATOM 0 HG21 THR A 46 2.808 -2.713 4.443 1.00 10.00 H new ATOM 0 HG22 THR A 46 1.909 -4.005 3.611 1.00 10.00 H new ATOM 0 HG23 THR A 46 2.269 -4.147 5.349 1.00 10.00 H new ATOM 688 N ILE A 47 3.118 -6.561 1.677 1.00 10.00 N ATOM 689 CA ILE A 47 2.164 -6.885 0.621 1.00 10.00 C ATOM 690 C ILE A 47 2.260 -8.355 0.207 1.00 10.00 C ATOM 691 O ILE A 47 1.619 -8.774 -0.758 1.00 10.00 O ATOM 692 CB ILE A 47 2.353 -5.982 -0.618 1.00 10.00 C ATOM 693 CG1 ILE A 47 3.755 -6.163 -1.205 1.00 10.00 C ATOM 694 CG2 ILE A 47 2.108 -4.520 -0.254 1.00 10.00 C ATOM 695 CD1 ILE A 47 3.906 -5.606 -2.603 1.00 10.00 C ATOM 0 H ILE A 47 4.090 -6.506 1.374 1.00 10.00 H new ATOM 0 HA ILE A 47 1.172 -6.703 1.034 1.00 10.00 H new ATOM 0 HB ILE A 47 1.625 -6.275 -1.374 1.00 10.00 H new ATOM 0 HG12 ILE A 47 4.479 -5.678 -0.550 1.00 10.00 H new ATOM 0 HG13 ILE A 47 3.999 -7.225 -1.218 1.00 10.00 H new ATOM 0 HG21 ILE A 47 2.245 -3.897 -1.138 1.00 10.00 H new ATOM 0 HG22 ILE A 47 1.090 -4.403 0.118 1.00 10.00 H new ATOM 0 HG23 ILE A 47 2.814 -4.214 0.518 1.00 10.00 H new ATOM 0 HD11 ILE A 47 4.925 -5.771 -2.952 1.00 10.00 H new ATOM 0 HD12 ILE A 47 3.207 -6.108 -3.272 1.00 10.00 H new ATOM 0 HD13 ILE A 47 3.694 -4.537 -2.593 1.00 10.00 H new ATOM 707 N GLN A 48 3.071 -9.118 0.942 1.00 10.00 N ATOM 708 CA GLN A 48 3.280 -10.557 0.703 1.00 10.00 C ATOM 709 C GLN A 48 4.052 -10.853 -0.587 1.00 10.00 C ATOM 710 O GLN A 48 4.871 -11.772 -0.619 1.00 10.00 O ATOM 711 CB GLN A 48 1.952 -11.325 0.696 1.00 10.00 C ATOM 712 CG GLN A 48 1.500 -11.811 2.066 1.00 10.00 C ATOM 713 CD GLN A 48 2.487 -12.757 2.729 1.00 10.00 C ATOM 714 OE1 GLN A 48 3.704 -12.593 2.634 1.00 10.00 O ATOM 715 NE2 GLN A 48 1.965 -13.772 3.394 1.00 10.00 N ATOM 0 H GLN A 48 3.609 -8.756 1.729 1.00 10.00 H new ATOM 0 HA GLN A 48 3.893 -10.901 1.536 1.00 10.00 H new ATOM 0 HB2 GLN A 48 1.177 -10.683 0.278 1.00 10.00 H new ATOM 0 HB3 GLN A 48 2.047 -12.184 0.032 1.00 10.00 H new ATOM 0 HG2 GLN A 48 1.343 -10.949 2.715 1.00 10.00 H new ATOM 0 HG3 GLN A 48 0.538 -12.314 1.965 1.00 10.00 H new ATOM 0 HE21 GLN A 48 0.952 -13.877 3.452 1.00 10.00 H new ATOM 0 HE22 GLN A 48 2.575 -14.451 3.849 1.00 10.00 H new ATOM 724 N TYR A 49 3.785 -10.097 -1.648 1.00 10.00 N ATOM 725 CA TYR A 49 4.461 -10.293 -2.932 1.00 10.00 C ATOM 726 C TYR A 49 5.951 -9.958 -2.827 1.00 10.00 C ATOM 727 O TYR A 49 6.388 -8.876 -3.220 1.00 10.00 O ATOM 728 CB TYR A 49 3.809 -9.442 -4.028 1.00 10.00 C ATOM 729 CG TYR A 49 2.350 -9.758 -4.276 1.00 10.00 C ATOM 730 CD1 TYR A 49 1.968 -10.919 -4.936 1.00 10.00 C ATOM 731 CD2 TYR A 49 1.352 -8.885 -3.855 1.00 10.00 C ATOM 732 CE1 TYR A 49 0.634 -11.202 -5.169 1.00 10.00 C ATOM 733 CE2 TYR A 49 0.017 -9.162 -4.081 1.00 10.00 C ATOM 734 CZ TYR A 49 -0.340 -10.320 -4.740 1.00 10.00 C ATOM 735 OH TYR A 49 -1.672 -10.596 -4.968 1.00 10.00 O ATOM 0 H TYR A 49 3.102 -9.339 -1.646 1.00 10.00 H new ATOM 0 HA TYR A 49 4.361 -11.345 -3.199 1.00 10.00 H new ATOM 0 HB2 TYR A 49 3.900 -8.390 -3.757 1.00 10.00 H new ATOM 0 HB3 TYR A 49 4.362 -9.581 -4.957 1.00 10.00 H new ATOM 0 HD1 TYR A 49 2.725 -11.612 -5.273 1.00 10.00 H new ATOM 0 HD2 TYR A 49 1.625 -7.975 -3.342 1.00 10.00 H new ATOM 0 HE1 TYR A 49 0.355 -12.109 -5.684 1.00 10.00 H new ATOM 0 HE2 TYR A 49 -0.744 -8.474 -3.743 1.00 10.00 H new ATOM 0 HH TYR A 49 -2.223 -9.874 -4.601 1.00 10.00 H new ATOM 745 N SER A 50 6.718 -10.892 -2.281 1.00 10.00 N ATOM 746 CA SER A 50 8.154 -10.711 -2.119 1.00 10.00 C ATOM 747 C SER A 50 8.929 -11.435 -3.216 1.00 10.00 C ATOM 748 O SER A 50 10.091 -11.126 -3.478 1.00 10.00 O ATOM 749 CB SER A 50 8.591 -11.224 -0.742 1.00 10.00 C ATOM 750 OG SER A 50 7.611 -10.926 0.245 1.00 10.00 O ATOM 0 H SER A 50 6.367 -11.787 -1.941 1.00 10.00 H new ATOM 0 HA SER A 50 8.374 -9.646 -2.197 1.00 10.00 H new ATOM 0 HB2 SER A 50 8.753 -12.301 -0.785 1.00 10.00 H new ATOM 0 HB3 SER A 50 9.542 -10.769 -0.465 1.00 10.00 H new ATOM 0 HG SER A 50 7.331 -9.991 0.156 1.00 10.00 H new ATOM 756 N LYS A 51 8.284 -12.393 -3.862 1.00 10.00 N ATOM 757 CA LYS A 51 8.933 -13.152 -4.920 1.00 10.00 C ATOM 758 C LYS A 51 8.271 -12.870 -6.259 1.00 10.00 C ATOM 759 O LYS A 51 8.872 -12.262 -7.145 1.00 10.00 O ATOM 760 CB LYS A 51 8.882 -14.647 -4.615 1.00 10.00 C ATOM 761 CG LYS A 51 9.521 -15.020 -3.286 1.00 10.00 C ATOM 762 CD LYS A 51 9.899 -16.490 -3.239 1.00 10.00 C ATOM 763 CE LYS A 51 11.146 -16.773 -4.065 1.00 10.00 C ATOM 764 NZ LYS A 51 11.648 -18.156 -3.861 1.00 10.00 N ATOM 0 H LYS A 51 7.318 -12.663 -3.675 1.00 10.00 H new ATOM 0 HA LYS A 51 9.977 -12.842 -4.973 1.00 10.00 H new ATOM 0 HB2 LYS A 51 7.842 -14.973 -4.613 1.00 10.00 H new ATOM 0 HB3 LYS A 51 9.385 -15.190 -5.415 1.00 10.00 H new ATOM 0 HG2 LYS A 51 10.410 -14.410 -3.125 1.00 10.00 H new ATOM 0 HG3 LYS A 51 8.830 -14.796 -2.474 1.00 10.00 H new ATOM 0 HD2 LYS A 51 10.071 -16.790 -2.205 1.00 10.00 H new ATOM 0 HD3 LYS A 51 9.070 -17.092 -3.612 1.00 10.00 H new ATOM 0 HE2 LYS A 51 10.923 -16.620 -5.121 1.00 10.00 H new ATOM 0 HE3 LYS A 51 11.927 -16.061 -3.798 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 12.498 -18.306 -4.442 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 11.885 -18.295 -2.858 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 10.913 -18.837 -4.140 1.00 10.00 H new ATOM 778 N HIS A 52 7.028 -13.313 -6.392 1.00 10.00 N ATOM 779 CA HIS A 52 6.256 -13.115 -7.607 1.00 10.00 C ATOM 780 C HIS A 52 4.843 -13.603 -7.369 1.00 10.00 C ATOM 781 O HIS A 52 4.015 -13.527 -8.296 1.00 10.00 O ATOM 782 CB HIS A 52 6.875 -13.873 -8.788 1.00 10.00 C ATOM 783 CG HIS A 52 6.631 -13.220 -10.108 1.00 10.00 C ATOM 784 ND1 HIS A 52 5.544 -13.506 -10.903 1.00 10.00 N ATOM 785 CD2 HIS A 52 7.347 -12.288 -10.774 1.00 10.00 C ATOM 786 CE1 HIS A 52 5.601 -12.777 -12.001 1.00 10.00 C ATOM 787 NE2 HIS A 52 6.686 -12.027 -11.947 1.00 10.00 N ATOM 788 OXT HIS A 52 4.579 -14.085 -6.247 1.00 10.00 O ATOM 0 H HIS A 52 6.529 -13.819 -5.660 1.00 10.00 H new ATOM 0 HA HIS A 52 6.254 -12.054 -7.856 1.00 10.00 H new ATOM 0 HB2 HIS A 52 7.950 -13.963 -8.629 1.00 10.00 H new ATOM 0 HB3 HIS A 52 6.471 -14.885 -8.812 1.00 10.00 H new ATOM 0 HD2 HIS A 52 8.269 -11.833 -10.444 1.00 10.00 H new ATOM 0 HE1 HIS A 52 4.882 -12.791 -12.807 1.00 10.00 H new ATOM 0 HE2 HIS A 52 6.984 -11.362 -12.661 1.00 10.00 H new TER 797 HIS A 52 ATOM 798 N GLY B 1 -18.523 19.050 2.325 1.00 10.00 N ATOM 799 CA GLY B 1 -19.291 17.985 3.013 1.00 10.00 C ATOM 800 C GLY B 1 -19.825 16.964 2.032 1.00 10.00 C ATOM 801 O GLY B 1 -19.387 16.922 0.881 1.00 10.00 O ATOM 0 H1 GLY B 1 -17.584 19.140 2.764 1.00 10.00 H new ATOM 0 H2 GLY B 1 -18.414 18.805 1.320 1.00 10.00 H new ATOM 0 H3 GLY B 1 -19.032 19.953 2.408 1.00 10.00 H new ATOM 0 HA2 GLY B 1 -18.653 17.489 3.744 1.00 10.00 H new ATOM 0 HA3 GLY B 1 -20.120 18.430 3.563 1.00 10.00 H new ATOM 807 N SER B 2 -20.763 16.141 2.478 1.00 10.00 N ATOM 808 CA SER B 2 -21.354 15.126 1.618 1.00 10.00 C ATOM 809 C SER B 2 -22.787 15.509 1.233 1.00 10.00 C ATOM 810 O SER B 2 -23.724 15.302 2.005 1.00 10.00 O ATOM 811 CB SER B 2 -21.339 13.771 2.323 1.00 10.00 C ATOM 812 OG SER B 2 -20.076 13.529 2.920 1.00 10.00 O ATOM 0 H SER B 2 -21.131 16.156 3.429 1.00 10.00 H new ATOM 0 HA SER B 2 -20.762 15.058 0.705 1.00 10.00 H new ATOM 0 HB2 SER B 2 -22.118 13.744 3.085 1.00 10.00 H new ATOM 0 HB3 SER B 2 -21.566 12.981 1.607 1.00 10.00 H new ATOM 0 HG SER B 2 -20.087 12.657 3.368 1.00 10.00 H new ATOM 818 N PRO B 3 -22.967 16.085 0.035 1.00 10.00 N ATOM 819 CA PRO B 3 -24.282 16.499 -0.456 1.00 10.00 C ATOM 820 C PRO B 3 -25.072 15.325 -1.041 1.00 10.00 C ATOM 821 O PRO B 3 -24.518 14.243 -1.240 1.00 10.00 O ATOM 822 CB PRO B 3 -23.924 17.503 -1.551 1.00 10.00 C ATOM 823 CG PRO B 3 -22.633 17.006 -2.101 1.00 10.00 C ATOM 824 CD PRO B 3 -21.901 16.375 -0.945 1.00 10.00 C ATOM 0 HA PRO B 3 -24.918 16.904 0.331 1.00 10.00 H new ATOM 0 HB2 PRO B 3 -24.695 17.543 -2.321 1.00 10.00 H new ATOM 0 HB3 PRO B 3 -23.823 18.511 -1.148 1.00 10.00 H new ATOM 0 HG2 PRO B 3 -22.802 16.281 -2.897 1.00 10.00 H new ATOM 0 HG3 PRO B 3 -22.053 17.822 -2.531 1.00 10.00 H new ATOM 0 HD2 PRO B 3 -21.381 15.467 -1.250 1.00 10.00 H new ATOM 0 HD3 PRO B 3 -21.151 17.049 -0.531 1.00 10.00 H new ATOM 832 N PRO B 4 -26.374 15.525 -1.338 1.00 10.00 N ATOM 833 CA PRO B 4 -27.232 14.477 -1.916 1.00 10.00 C ATOM 834 C PRO B 4 -26.725 14.002 -3.276 1.00 10.00 C ATOM 835 O PRO B 4 -27.190 12.994 -3.808 1.00 10.00 O ATOM 836 CB PRO B 4 -28.594 15.164 -2.070 1.00 10.00 C ATOM 837 CG PRO B 4 -28.549 16.321 -1.134 1.00 10.00 C ATOM 838 CD PRO B 4 -27.120 16.774 -1.113 1.00 10.00 C ATOM 0 HA PRO B 4 -27.260 13.586 -1.288 1.00 10.00 H new ATOM 0 HB2 PRO B 4 -28.757 15.493 -3.096 1.00 10.00 H new ATOM 0 HB3 PRO B 4 -29.409 14.485 -1.820 1.00 10.00 H new ATOM 0 HG2 PRO B 4 -29.208 17.122 -1.470 1.00 10.00 H new ATOM 0 HG3 PRO B 4 -28.882 16.031 -0.137 1.00 10.00 H new ATOM 0 HD2 PRO B 4 -26.918 17.510 -1.891 1.00 10.00 H new ATOM 0 HD3 PRO B 4 -26.857 17.236 -0.161 1.00 10.00 H new ATOM 846 N GLU B 5 -25.777 14.744 -3.835 1.00 10.00 N ATOM 847 CA GLU B 5 -25.182 14.408 -5.120 1.00 10.00 C ATOM 848 C GLU B 5 -24.306 13.164 -4.991 1.00 10.00 C ATOM 849 O GLU B 5 -24.076 12.447 -5.964 1.00 10.00 O ATOM 850 CB GLU B 5 -24.338 15.580 -5.620 1.00 10.00 C ATOM 851 CG GLU B 5 -25.114 16.878 -5.751 1.00 10.00 C ATOM 852 CD GLU B 5 -25.987 16.903 -6.984 1.00 10.00 C ATOM 853 OE1 GLU B 5 -25.448 17.084 -8.095 1.00 10.00 O ATOM 854 OE2 GLU B 5 -27.218 16.743 -6.854 1.00 10.00 O ATOM 0 H GLU B 5 -25.401 15.592 -3.411 1.00 10.00 H new ATOM 0 HA GLU B 5 -25.981 14.204 -5.833 1.00 10.00 H new ATOM 0 HB2 GLU B 5 -23.503 15.733 -4.936 1.00 10.00 H new ATOM 0 HB3 GLU B 5 -23.912 15.322 -6.590 1.00 10.00 H new ATOM 0 HG2 GLU B 5 -25.735 17.018 -4.866 1.00 10.00 H new ATOM 0 HG3 GLU B 5 -24.416 17.714 -5.786 1.00 10.00 H new ATOM 861 N ALA B 6 -23.817 12.925 -3.781 1.00 10.00 N ATOM 862 CA ALA B 6 -22.963 11.778 -3.514 1.00 10.00 C ATOM 863 C ALA B 6 -23.795 10.569 -3.110 1.00 10.00 C ATOM 864 O ALA B 6 -24.708 10.677 -2.289 1.00 10.00 O ATOM 865 CB ALA B 6 -21.948 12.114 -2.429 1.00 10.00 C ATOM 0 H ALA B 6 -23.999 13.513 -2.968 1.00 10.00 H new ATOM 0 HA ALA B 6 -22.425 11.531 -4.429 1.00 10.00 H new ATOM 0 HB1 ALA B 6 -21.316 11.246 -2.240 1.00 10.00 H new ATOM 0 HB2 ALA B 6 -21.329 12.949 -2.756 1.00 10.00 H new ATOM 0 HB3 ALA B 6 -22.472 12.388 -1.513 1.00 10.00 H new ATOM 871 N ASP B 7 -23.480 9.426 -3.698 1.00 10.00 N ATOM 872 CA ASP B 7 -24.194 8.192 -3.406 1.00 10.00 C ATOM 873 C ASP B 7 -23.854 7.694 -2.003 1.00 10.00 C ATOM 874 O ASP B 7 -22.678 7.574 -1.648 1.00 10.00 O ATOM 875 CB ASP B 7 -23.840 7.122 -4.440 1.00 10.00 C ATOM 876 CG ASP B 7 -24.799 5.949 -4.427 1.00 10.00 C ATOM 877 OD1 ASP B 7 -24.798 5.178 -3.448 1.00 10.00 O ATOM 878 OD2 ASP B 7 -25.549 5.787 -5.410 1.00 10.00 O ATOM 0 H ASP B 7 -22.731 9.327 -4.383 1.00 10.00 H new ATOM 0 HA ASP B 7 -25.264 8.393 -3.454 1.00 10.00 H new ATOM 0 HB2 ASP B 7 -23.837 7.571 -5.433 1.00 10.00 H new ATOM 0 HB3 ASP B 7 -22.829 6.761 -4.250 1.00 10.00 H new ATOM 883 N PRO B 8 -24.878 7.393 -1.188 1.00 10.00 N ATOM 884 CA PRO B 8 -24.684 6.912 0.184 1.00 10.00 C ATOM 885 C PRO B 8 -23.955 5.572 0.242 1.00 10.00 C ATOM 886 O PRO B 8 -23.294 5.256 1.228 1.00 10.00 O ATOM 887 CB PRO B 8 -26.110 6.771 0.727 1.00 10.00 C ATOM 888 CG PRO B 8 -26.982 6.679 -0.479 1.00 10.00 C ATOM 889 CD PRO B 8 -26.306 7.499 -1.542 1.00 10.00 C ATOM 0 HA PRO B 8 -24.061 7.595 0.762 1.00 10.00 H new ATOM 0 HB2 PRO B 8 -26.207 5.883 1.352 1.00 10.00 H new ATOM 0 HB3 PRO B 8 -26.382 7.627 1.345 1.00 10.00 H new ATOM 0 HG2 PRO B 8 -27.097 5.643 -0.799 1.00 10.00 H new ATOM 0 HG3 PRO B 8 -27.981 7.060 -0.268 1.00 10.00 H new ATOM 0 HD2 PRO B 8 -26.504 7.108 -2.540 1.00 10.00 H new ATOM 0 HD3 PRO B 8 -26.648 8.534 -1.532 1.00 10.00 H new ATOM 897 N ARG B 9 -24.055 4.800 -0.828 1.00 10.00 N ATOM 898 CA ARG B 9 -23.411 3.498 -0.890 1.00 10.00 C ATOM 899 C ARG B 9 -21.981 3.641 -1.391 1.00 10.00 C ATOM 900 O ARG B 9 -21.122 2.810 -1.103 1.00 10.00 O ATOM 901 CB ARG B 9 -24.204 2.563 -1.803 1.00 10.00 C ATOM 902 CG ARG B 9 -25.652 2.411 -1.381 1.00 10.00 C ATOM 903 CD ARG B 9 -26.533 2.012 -2.547 1.00 10.00 C ATOM 904 NE ARG B 9 -26.603 3.054 -3.570 1.00 10.00 N ATOM 905 CZ ARG B 9 -27.556 3.116 -4.503 1.00 10.00 C ATOM 906 NH1 ARG B 9 -28.520 2.205 -4.529 1.00 10.00 N ATOM 907 NH2 ARG B 9 -27.539 4.088 -5.405 1.00 10.00 N ATOM 0 H ARG B 9 -24.577 5.053 -1.667 1.00 10.00 H new ATOM 0 HA ARG B 9 -23.386 3.070 0.112 1.00 10.00 H new ATOM 0 HB2 ARG B 9 -24.167 2.943 -2.824 1.00 10.00 H new ATOM 0 HB3 ARG B 9 -23.729 1.582 -1.811 1.00 10.00 H new ATOM 0 HG2 ARG B 9 -25.726 1.660 -0.595 1.00 10.00 H new ATOM 0 HG3 ARG B 9 -26.009 3.350 -0.959 1.00 10.00 H new ATOM 0 HD2 ARG B 9 -26.149 1.094 -2.992 1.00 10.00 H new ATOM 0 HD3 ARG B 9 -27.537 1.795 -2.183 1.00 10.00 H new ATOM 0 HE ARG B 9 -25.882 3.775 -3.571 1.00 10.00 H new ATOM 0 HH11 ARG B 9 -28.533 1.457 -3.836 1.00 10.00 H new ATOM 0 HH12 ARG B 9 -29.248 2.253 -5.242 1.00 10.00 H new ATOM 0 HH21 ARG B 9 -26.798 4.788 -5.386 1.00 10.00 H new ATOM 0 HH22 ARG B 9 -28.267 4.135 -6.118 1.00 10.00 H new ATOM 921 N LEU B 10 -21.729 4.715 -2.131 1.00 10.00 N ATOM 922 CA LEU B 10 -20.402 4.979 -2.668 1.00 10.00 C ATOM 923 C LEU B 10 -19.473 5.454 -1.557 1.00 10.00 C ATOM 924 O LEU B 10 -18.323 5.030 -1.465 1.00 10.00 O ATOM 925 CB LEU B 10 -20.476 6.032 -3.779 1.00 10.00 C ATOM 926 CG LEU B 10 -19.130 6.443 -4.379 1.00 10.00 C ATOM 927 CD1 LEU B 10 -18.584 5.350 -5.288 1.00 10.00 C ATOM 928 CD2 LEU B 10 -19.274 7.753 -5.139 1.00 10.00 C ATOM 0 H LEU B 10 -22.428 5.417 -2.372 1.00 10.00 H new ATOM 0 HA LEU B 10 -20.006 4.055 -3.089 1.00 10.00 H new ATOM 0 HB2 LEU B 10 -21.110 5.649 -4.579 1.00 10.00 H new ATOM 0 HB3 LEU B 10 -20.965 6.921 -3.382 1.00 10.00 H new ATOM 0 HG LEU B 10 -18.419 6.588 -3.566 1.00 10.00 H new ATOM 0 HD11 LEU B 10 -17.627 5.666 -5.702 1.00 10.00 H new ATOM 0 HD12 LEU B 10 -18.446 4.434 -4.713 1.00 10.00 H new ATOM 0 HD13 LEU B 10 -19.288 5.167 -6.100 1.00 10.00 H new ATOM 0 HD21 LEU B 10 -18.310 8.036 -5.562 1.00 10.00 H new ATOM 0 HD22 LEU B 10 -20.000 7.630 -5.942 1.00 10.00 H new ATOM 0 HD23 LEU B 10 -19.615 8.533 -4.458 1.00 10.00 H new ATOM 940 N ILE B 11 -19.988 6.326 -0.700 1.00 10.00 N ATOM 941 CA ILE B 11 -19.205 6.853 0.411 1.00 10.00 C ATOM 942 C ILE B 11 -18.985 5.771 1.470 1.00 10.00 C ATOM 943 O ILE B 11 -18.005 5.802 2.217 1.00 10.00 O ATOM 944 CB ILE B 11 -19.882 8.092 1.046 1.00 10.00 C ATOM 945 CG1 ILE B 11 -18.920 8.787 2.009 1.00 10.00 C ATOM 946 CG2 ILE B 11 -21.171 7.710 1.765 1.00 10.00 C ATOM 947 CD1 ILE B 11 -19.410 10.131 2.497 1.00 10.00 C ATOM 0 H ILE B 11 -20.942 6.683 -0.752 1.00 10.00 H new ATOM 0 HA ILE B 11 -18.239 7.165 0.015 1.00 10.00 H new ATOM 0 HB ILE B 11 -20.139 8.784 0.244 1.00 10.00 H new ATOM 0 HG12 ILE B 11 -18.750 8.139 2.869 1.00 10.00 H new ATOM 0 HG13 ILE B 11 -17.958 8.919 1.514 1.00 10.00 H new ATOM 0 HG21 ILE B 11 -21.623 8.601 2.200 1.00 10.00 H new ATOM 0 HG22 ILE B 11 -21.865 7.262 1.054 1.00 10.00 H new ATOM 0 HG23 ILE B 11 -20.948 6.993 2.555 1.00 10.00 H new ATOM 0 HD11 ILE B 11 -18.674 10.562 3.176 1.00 10.00 H new ATOM 0 HD12 ILE B 11 -19.553 10.797 1.646 1.00 10.00 H new ATOM 0 HD13 ILE B 11 -20.357 10.004 3.022 1.00 10.00 H new ATOM 959 N GLU B 12 -19.884 4.788 1.491 1.00 10.00 N ATOM 960 CA GLU B 12 -19.806 3.688 2.444 1.00 10.00 C ATOM 961 C GLU B 12 -18.626 2.772 2.136 1.00 10.00 C ATOM 962 O GLU B 12 -18.229 1.961 2.972 1.00 10.00 O ATOM 963 CB GLU B 12 -21.107 2.882 2.453 1.00 10.00 C ATOM 964 CG GLU B 12 -22.108 3.361 3.491 1.00 10.00 C ATOM 965 CD GLU B 12 -21.537 3.337 4.892 1.00 10.00 C ATOM 966 OE1 GLU B 12 -20.888 4.321 5.294 1.00 10.00 O ATOM 967 OE2 GLU B 12 -21.727 2.326 5.599 1.00 10.00 O ATOM 0 H GLU B 12 -20.678 4.734 0.854 1.00 10.00 H new ATOM 0 HA GLU B 12 -19.655 4.121 3.433 1.00 10.00 H new ATOM 0 HB2 GLU B 12 -21.565 2.936 1.466 1.00 10.00 H new ATOM 0 HB3 GLU B 12 -20.875 1.834 2.640 1.00 10.00 H new ATOM 0 HG2 GLU B 12 -22.424 4.375 3.247 1.00 10.00 H new ATOM 0 HG3 GLU B 12 -22.997 2.732 3.452 1.00 10.00 H new ATOM 974 N SER B 13 -18.069 2.898 0.939 1.00 10.00 N ATOM 975 CA SER B 13 -16.927 2.086 0.550 1.00 10.00 C ATOM 976 C SER B 13 -15.698 2.484 1.371 1.00 10.00 C ATOM 977 O SER B 13 -14.817 1.665 1.640 1.00 10.00 O ATOM 978 CB SER B 13 -16.657 2.242 -0.948 1.00 10.00 C ATOM 979 OG SER B 13 -17.837 2.008 -1.705 1.00 10.00 O ATOM 0 H SER B 13 -18.388 3.552 0.224 1.00 10.00 H new ATOM 0 HA SER B 13 -17.148 1.037 0.750 1.00 10.00 H new ATOM 0 HB2 SER B 13 -16.283 3.246 -1.151 1.00 10.00 H new ATOM 0 HB3 SER B 13 -15.879 1.544 -1.256 1.00 10.00 H new ATOM 0 HG SER B 13 -18.312 2.855 -1.841 1.00 10.00 H new ATOM 985 N LEU B 14 -15.666 3.743 1.799 1.00 10.00 N ATOM 986 CA LEU B 14 -14.566 4.254 2.599 1.00 10.00 C ATOM 987 C LEU B 14 -14.691 3.735 4.027 1.00 10.00 C ATOM 988 O LEU B 14 -13.735 3.211 4.604 1.00 10.00 O ATOM 989 CB LEU B 14 -14.578 5.790 2.605 1.00 10.00 C ATOM 990 CG LEU B 14 -14.703 6.454 1.230 1.00 10.00 C ATOM 991 CD1 LEU B 14 -15.180 7.893 1.368 1.00 10.00 C ATOM 992 CD2 LEU B 14 -13.378 6.403 0.490 1.00 10.00 C ATOM 0 H LEU B 14 -16.395 4.428 1.602 1.00 10.00 H new ATOM 0 HA LEU B 14 -13.626 3.912 2.166 1.00 10.00 H new ATOM 0 HB2 LEU B 14 -15.406 6.127 3.228 1.00 10.00 H new ATOM 0 HB3 LEU B 14 -13.660 6.141 3.077 1.00 10.00 H new ATOM 0 HG LEU B 14 -15.443 5.901 0.651 1.00 10.00 H new ATOM 0 HD11 LEU B 14 -15.262 8.346 0.380 1.00 10.00 H new ATOM 0 HD12 LEU B 14 -16.155 7.908 1.856 1.00 10.00 H new ATOM 0 HD13 LEU B 14 -14.466 8.457 1.967 1.00 10.00 H new ATOM 0 HD21 LEU B 14 -13.487 6.879 -0.484 1.00 10.00 H new ATOM 0 HD22 LEU B 14 -12.618 6.929 1.068 1.00 10.00 H new ATOM 0 HD23 LEU B 14 -13.077 5.364 0.354 1.00 10.00 H new ATOM 1004 N SER B 15 -15.892 3.862 4.576 1.00 10.00 N ATOM 1005 CA SER B 15 -16.181 3.419 5.929 1.00 10.00 C ATOM 1006 C SER B 15 -16.061 1.901 6.045 1.00 10.00 C ATOM 1007 O SER B 15 -15.733 1.373 7.110 1.00 10.00 O ATOM 1008 CB SER B 15 -17.587 3.873 6.314 1.00 10.00 C ATOM 1009 OG SER B 15 -18.234 4.482 5.205 1.00 10.00 O ATOM 0 H SER B 15 -16.691 4.275 4.095 1.00 10.00 H new ATOM 0 HA SER B 15 -15.454 3.861 6.610 1.00 10.00 H new ATOM 0 HB2 SER B 15 -18.170 3.019 6.659 1.00 10.00 H new ATOM 0 HB3 SER B 15 -17.534 4.578 7.144 1.00 10.00 H new ATOM 0 HG SER B 15 -19.167 4.674 5.435 1.00 10.00 H new ATOM 1015 N GLN B 16 -16.323 1.207 4.936 1.00 10.00 N ATOM 1016 CA GLN B 16 -16.236 -0.247 4.896 1.00 10.00 C ATOM 1017 C GLN B 16 -14.823 -0.702 5.251 1.00 10.00 C ATOM 1018 O GLN B 16 -14.637 -1.625 6.045 1.00 10.00 O ATOM 1019 CB GLN B 16 -16.614 -0.766 3.506 1.00 10.00 C ATOM 1020 CG GLN B 16 -16.585 -2.282 3.386 1.00 10.00 C ATOM 1021 CD GLN B 16 -17.555 -2.959 4.332 1.00 10.00 C ATOM 1022 OE1 GLN B 16 -18.621 -2.425 4.635 1.00 10.00 O ATOM 1023 NE2 GLN B 16 -17.192 -4.138 4.802 1.00 10.00 N ATOM 0 H GLN B 16 -16.598 1.634 4.052 1.00 10.00 H new ATOM 0 HA GLN B 16 -16.935 -0.654 5.627 1.00 10.00 H new ATOM 0 HB2 GLN B 16 -17.613 -0.410 3.255 1.00 10.00 H new ATOM 0 HB3 GLN B 16 -15.931 -0.340 2.771 1.00 10.00 H new ATOM 0 HG2 GLN B 16 -16.824 -2.566 2.361 1.00 10.00 H new ATOM 0 HG3 GLN B 16 -15.576 -2.640 3.589 1.00 10.00 H new ATOM 0 HE21 GLN B 16 -16.299 -4.545 4.525 1.00 10.00 H new ATOM 0 HE22 GLN B 16 -17.805 -4.642 5.443 1.00 10.00 H new ATOM 1032 N MET B 17 -13.832 -0.033 4.669 1.00 10.00 N ATOM 1033 CA MET B 17 -12.435 -0.356 4.927 1.00 10.00 C ATOM 1034 C MET B 17 -12.111 -0.124 6.400 1.00 10.00 C ATOM 1035 O MET B 17 -11.452 -0.941 7.042 1.00 10.00 O ATOM 1036 CB MET B 17 -11.515 0.492 4.040 1.00 10.00 C ATOM 1037 CG MET B 17 -11.727 0.264 2.551 1.00 10.00 C ATOM 1038 SD MET B 17 -11.350 -1.424 2.044 1.00 10.00 S ATOM 1039 CE MET B 17 -9.561 -1.374 1.987 1.00 10.00 C ATOM 0 H MET B 17 -13.972 0.737 4.015 1.00 10.00 H new ATOM 0 HA MET B 17 -12.269 -1.407 4.689 1.00 10.00 H new ATOM 0 HB2 MET B 17 -11.678 1.546 4.265 1.00 10.00 H new ATOM 0 HB3 MET B 17 -10.477 0.270 4.289 1.00 10.00 H new ATOM 0 HG2 MET B 17 -12.762 0.493 2.297 1.00 10.00 H new ATOM 0 HG3 MET B 17 -11.100 0.956 1.989 1.00 10.00 H new ATOM 0 HE1 MET B 17 -9.180 -2.339 1.653 1.00 10.00 H new ATOM 0 HE2 MET B 17 -9.241 -0.598 1.292 1.00 10.00 H new ATOM 0 HE3 MET B 17 -9.171 -1.155 2.981 1.00 10.00 H new ATOM 1049 N LEU B 18 -12.616 0.982 6.932 1.00 10.00 N ATOM 1050 CA LEU B 18 -12.396 1.335 8.330 1.00 10.00 C ATOM 1051 C LEU B 18 -13.038 0.300 9.257 1.00 10.00 C ATOM 1052 O LEU B 18 -12.458 -0.068 10.278 1.00 10.00 O ATOM 1053 CB LEU B 18 -12.964 2.733 8.612 1.00 10.00 C ATOM 1054 CG LEU B 18 -12.540 3.359 9.942 1.00 10.00 C ATOM 1055 CD1 LEU B 18 -11.045 3.639 9.957 1.00 10.00 C ATOM 1056 CD2 LEU B 18 -13.320 4.641 10.201 1.00 10.00 C ATOM 0 H LEU B 18 -13.183 1.653 6.414 1.00 10.00 H new ATOM 0 HA LEU B 18 -11.323 1.344 8.523 1.00 10.00 H new ATOM 0 HB2 LEU B 18 -12.662 3.399 7.804 1.00 10.00 H new ATOM 0 HB3 LEU B 18 -14.052 2.676 8.588 1.00 10.00 H new ATOM 0 HG LEU B 18 -12.763 2.648 10.737 1.00 10.00 H new ATOM 0 HD11 LEU B 18 -10.768 4.084 10.913 1.00 10.00 H new ATOM 0 HD12 LEU B 18 -10.499 2.706 9.819 1.00 10.00 H new ATOM 0 HD13 LEU B 18 -10.796 4.328 9.150 1.00 10.00 H new ATOM 0 HD21 LEU B 18 -13.005 5.073 11.151 1.00 10.00 H new ATOM 0 HD22 LEU B 18 -13.128 5.352 9.398 1.00 10.00 H new ATOM 0 HD23 LEU B 18 -14.386 4.417 10.240 1.00 10.00 H new ATOM 1068 N SER B 19 -14.221 -0.182 8.883 1.00 10.00 N ATOM 1069 CA SER B 19 -14.940 -1.179 9.677 1.00 10.00 C ATOM 1070 C SER B 19 -14.225 -2.530 9.654 1.00 10.00 C ATOM 1071 O SER B 19 -14.393 -3.347 10.558 1.00 10.00 O ATOM 1072 CB SER B 19 -16.377 -1.336 9.166 1.00 10.00 C ATOM 1073 OG SER B 19 -17.242 -0.390 9.770 1.00 10.00 O ATOM 0 H SER B 19 -14.705 0.103 8.031 1.00 10.00 H new ATOM 0 HA SER B 19 -14.965 -0.826 10.708 1.00 10.00 H new ATOM 0 HB2 SER B 19 -16.396 -1.211 8.083 1.00 10.00 H new ATOM 0 HB3 SER B 19 -16.733 -2.345 9.377 1.00 10.00 H new ATOM 0 HG SER B 19 -18.151 -0.511 9.425 1.00 10.00 H new ATOM 1079 N MET B 20 -13.431 -2.762 8.616 1.00 10.00 N ATOM 1080 CA MET B 20 -12.683 -4.008 8.496 1.00 10.00 C ATOM 1081 C MET B 20 -11.384 -3.927 9.295 1.00 10.00 C ATOM 1082 O MET B 20 -10.695 -4.930 9.489 1.00 10.00 O ATOM 1083 CB MET B 20 -12.374 -4.316 7.028 1.00 10.00 C ATOM 1084 CG MET B 20 -13.553 -4.899 6.261 1.00 10.00 C ATOM 1085 SD MET B 20 -14.126 -6.473 6.938 1.00 10.00 S ATOM 1086 CE MET B 20 -12.655 -7.480 6.758 1.00 10.00 C ATOM 0 H MET B 20 -13.288 -2.107 7.848 1.00 10.00 H new ATOM 0 HA MET B 20 -13.298 -4.813 8.898 1.00 10.00 H new ATOM 0 HB2 MET B 20 -12.049 -3.400 6.535 1.00 10.00 H new ATOM 0 HB3 MET B 20 -11.540 -5.016 6.981 1.00 10.00 H new ATOM 0 HG2 MET B 20 -14.376 -4.184 6.272 1.00 10.00 H new ATOM 0 HG3 MET B 20 -13.267 -5.040 5.219 1.00 10.00 H new ATOM 0 HE1 MET B 20 -12.928 -8.534 6.807 1.00 10.00 H new ATOM 0 HE2 MET B 20 -12.186 -7.271 5.797 1.00 10.00 H new ATOM 0 HE3 MET B 20 -11.955 -7.249 7.561 1.00 10.00 H new ATOM 1096 N GLY B 21 -11.062 -2.725 9.762 1.00 10.00 N ATOM 1097 CA GLY B 21 -9.852 -2.524 10.531 1.00 10.00 C ATOM 1098 C GLY B 21 -8.711 -2.011 9.678 1.00 10.00 C ATOM 1099 O GLY B 21 -7.539 -2.217 10.004 1.00 10.00 O ATOM 0 H GLY B 21 -11.622 -1.884 9.620 1.00 10.00 H new ATOM 0 HA2 GLY B 21 -10.049 -1.816 11.336 1.00 10.00 H new ATOM 0 HA3 GLY B 21 -9.560 -3.465 10.998 1.00 10.00 H new ATOM 1103 N PHE B 22 -9.043 -1.344 8.583 1.00 10.00 N ATOM 1104 CA PHE B 22 -8.031 -0.809 7.686 1.00 10.00 C ATOM 1105 C PHE B 22 -7.944 0.707 7.813 1.00 10.00 C ATOM 1106 O PHE B 22 -8.937 1.413 7.648 1.00 10.00 O ATOM 1107 CB PHE B 22 -8.355 -1.193 6.241 1.00 10.00 C ATOM 1108 CG PHE B 22 -7.147 -1.541 5.416 1.00 10.00 C ATOM 1109 CD1 PHE B 22 -6.136 -0.616 5.210 1.00 10.00 C ATOM 1110 CD2 PHE B 22 -7.029 -2.796 4.838 1.00 10.00 C ATOM 1111 CE1 PHE B 22 -5.028 -0.934 4.451 1.00 10.00 C ATOM 1112 CE2 PHE B 22 -5.923 -3.121 4.077 1.00 10.00 C ATOM 1113 CZ PHE B 22 -4.922 -2.189 3.883 1.00 10.00 C ATOM 0 H PHE B 22 -10.004 -1.161 8.295 1.00 10.00 H new ATOM 0 HA PHE B 22 -7.067 -1.235 7.963 1.00 10.00 H new ATOM 0 HB2 PHE B 22 -9.036 -2.044 6.246 1.00 10.00 H new ATOM 0 HB3 PHE B 22 -8.881 -0.366 5.765 1.00 10.00 H new ATOM 0 HD1 PHE B 22 -6.216 0.367 5.649 1.00 10.00 H new ATOM 0 HD2 PHE B 22 -7.810 -3.527 4.984 1.00 10.00 H new ATOM 0 HE1 PHE B 22 -4.246 -0.204 4.302 1.00 10.00 H new ATOM 0 HE2 PHE B 22 -5.841 -4.103 3.634 1.00 10.00 H new ATOM 0 HZ PHE B 22 -4.057 -2.441 3.288 1.00 10.00 H new ATOM 1123 N SER B 23 -6.749 1.193 8.119 1.00 10.00 N ATOM 1124 CA SER B 23 -6.493 2.622 8.257 1.00 10.00 C ATOM 1125 C SER B 23 -5.000 2.880 8.064 1.00 10.00 C ATOM 1126 O SER B 23 -4.178 2.047 8.448 1.00 10.00 O ATOM 1127 CB SER B 23 -6.953 3.132 9.628 1.00 10.00 C ATOM 1128 OG SER B 23 -7.215 2.060 10.520 1.00 10.00 O ATOM 0 H SER B 23 -5.929 0.608 8.279 1.00 10.00 H new ATOM 0 HA SER B 23 -7.059 3.162 7.498 1.00 10.00 H new ATOM 0 HB2 SER B 23 -6.187 3.781 10.052 1.00 10.00 H new ATOM 0 HB3 SER B 23 -7.852 3.736 9.510 1.00 10.00 H new ATOM 0 HG SER B 23 -7.504 2.418 11.385 1.00 10.00 H new ATOM 1134 N ASP B 24 -4.645 4.007 7.465 1.00 10.00 N ATOM 1135 CA ASP B 24 -3.240 4.315 7.226 1.00 10.00 C ATOM 1136 C ASP B 24 -2.829 5.626 7.909 1.00 10.00 C ATOM 1137 O ASP B 24 -3.654 6.287 8.541 1.00 10.00 O ATOM 1138 CB ASP B 24 -2.958 4.331 5.720 1.00 10.00 C ATOM 1139 CG ASP B 24 -3.030 5.706 5.099 1.00 10.00 C ATOM 1140 OD1 ASP B 24 -4.128 6.125 4.676 1.00 10.00 O ATOM 1141 OD2 ASP B 24 -1.978 6.356 4.995 1.00 10.00 O ATOM 0 H ASP B 24 -5.300 4.717 7.138 1.00 10.00 H new ATOM 0 HA ASP B 24 -2.627 3.532 7.674 1.00 10.00 H new ATOM 0 HB2 ASP B 24 -1.967 3.914 5.541 1.00 10.00 H new ATOM 0 HB3 ASP B 24 -3.674 3.679 5.219 1.00 10.00 H new ATOM 1146 N GLU B 25 -1.552 5.989 7.789 1.00 10.00 N ATOM 1147 CA GLU B 25 -1.033 7.190 8.442 1.00 10.00 C ATOM 1148 C GLU B 25 -0.805 8.356 7.473 1.00 10.00 C ATOM 1149 O GLU B 25 -1.414 9.418 7.616 1.00 10.00 O ATOM 1150 CB GLU B 25 0.285 6.873 9.168 1.00 10.00 C ATOM 1151 CG GLU B 25 0.379 5.447 9.697 1.00 10.00 C ATOM 1152 CD GLU B 25 1.043 4.493 8.718 1.00 10.00 C ATOM 1153 OE1 GLU B 25 1.701 4.960 7.769 1.00 10.00 O ATOM 1154 OE2 GLU B 25 0.921 3.261 8.904 1.00 10.00 O ATOM 0 H GLU B 25 -0.860 5.471 7.248 1.00 10.00 H new ATOM 0 HA GLU B 25 -1.797 7.503 9.154 1.00 10.00 H new ATOM 0 HB2 GLU B 25 1.115 7.051 8.484 1.00 10.00 H new ATOM 0 HB3 GLU B 25 0.404 7.566 10.001 1.00 10.00 H new ATOM 0 HG2 GLU B 25 0.940 5.448 10.632 1.00 10.00 H new ATOM 0 HG3 GLU B 25 -0.623 5.084 9.927 1.00 10.00 H new ATOM 1161 N GLY B 26 0.065 8.149 6.493 1.00 10.00 N ATOM 1162 CA GLY B 26 0.405 9.207 5.542 1.00 10.00 C ATOM 1163 C GLY B 26 -0.739 9.650 4.644 1.00 10.00 C ATOM 1164 O GLY B 26 -0.656 10.700 4.003 1.00 10.00 O ATOM 0 H GLY B 26 0.547 7.265 6.334 1.00 10.00 H new ATOM 0 HA2 GLY B 26 0.768 10.072 6.097 1.00 10.00 H new ATOM 0 HA3 GLY B 26 1.227 8.862 4.915 1.00 10.00 H new ATOM 1168 N GLY B 27 -1.791 8.860 4.584 1.00 10.00 N ATOM 1169 CA GLY B 27 -2.925 9.197 3.756 1.00 10.00 C ATOM 1170 C GLY B 27 -2.836 8.526 2.404 1.00 10.00 C ATOM 1171 O GLY B 27 -3.170 9.124 1.375 1.00 10.00 O ATOM 0 H GLY B 27 -1.882 7.984 5.098 1.00 10.00 H new ATOM 0 HA2 GLY B 27 -3.845 8.894 4.255 1.00 10.00 H new ATOM 0 HA3 GLY B 27 -2.974 10.278 3.625 1.00 10.00 H new ATOM 1175 N TRP B 28 -2.363 7.285 2.397 1.00 10.00 N ATOM 1176 CA TRP B 28 -2.223 6.544 1.154 1.00 10.00 C ATOM 1177 C TRP B 28 -3.433 5.656 0.888 1.00 10.00 C ATOM 1178 O TRP B 28 -3.723 5.334 -0.259 1.00 10.00 O ATOM 1179 CB TRP B 28 -0.925 5.722 1.122 1.00 10.00 C ATOM 1180 CG TRP B 28 -0.906 4.484 1.977 1.00 10.00 C ATOM 1181 CD1 TRP B 28 -0.503 4.388 3.276 1.00 10.00 C ATOM 1182 CD2 TRP B 28 -1.269 3.154 1.574 1.00 10.00 C ATOM 1183 NE1 TRP B 28 -0.620 3.092 3.716 1.00 10.00 N ATOM 1184 CE2 TRP B 28 -1.087 2.314 2.691 1.00 10.00 C ATOM 1185 CE3 TRP B 28 -1.746 2.594 0.386 1.00 10.00 C ATOM 1186 CZ2 TRP B 28 -1.356 0.946 2.650 1.00 10.00 C ATOM 1187 CZ3 TRP B 28 -2.008 1.235 0.345 1.00 10.00 C ATOM 1188 CH2 TRP B 28 -1.817 0.428 1.471 1.00 10.00 C ATOM 0 H TRP B 28 -2.073 6.776 3.232 1.00 10.00 H new ATOM 0 HA TRP B 28 -2.168 7.282 0.353 1.00 10.00 H new ATOM 0 HB2 TRP B 28 -0.729 5.430 0.090 1.00 10.00 H new ATOM 0 HB3 TRP B 28 -0.103 6.366 1.433 1.00 10.00 H new ATOM 0 HD1 TRP B 28 -0.143 5.213 3.873 1.00 10.00 H new ATOM 0 HE1 TRP B 28 -0.395 2.763 4.655 1.00 10.00 H new ATOM 0 HE3 TRP B 28 -1.908 3.211 -0.486 1.00 10.00 H new ATOM 0 HZ2 TRP B 28 -1.206 0.319 3.517 1.00 10.00 H new ATOM 0 HZ3 TRP B 28 -2.366 0.791 -0.572 1.00 10.00 H new ATOM 0 HH2 TRP B 28 -2.038 -0.627 1.408 1.00 10.00 H new ATOM 1199 N LEU B 29 -4.164 5.287 1.935 1.00 10.00 N ATOM 1200 CA LEU B 29 -5.343 4.446 1.765 1.00 10.00 C ATOM 1201 C LEU B 29 -6.432 5.233 1.049 1.00 10.00 C ATOM 1202 O LEU B 29 -7.057 4.745 0.107 1.00 10.00 O ATOM 1203 CB LEU B 29 -5.863 3.952 3.118 1.00 10.00 C ATOM 1204 CG LEU B 29 -7.101 3.054 3.055 1.00 10.00 C ATOM 1205 CD1 LEU B 29 -6.776 1.730 2.377 1.00 10.00 C ATOM 1206 CD2 LEU B 29 -7.660 2.814 4.449 1.00 10.00 C ATOM 0 H LEU B 29 -3.964 5.553 2.899 1.00 10.00 H new ATOM 0 HA LEU B 29 -5.066 3.577 1.168 1.00 10.00 H new ATOM 0 HB2 LEU B 29 -5.063 3.406 3.618 1.00 10.00 H new ATOM 0 HB3 LEU B 29 -6.094 4.818 3.738 1.00 10.00 H new ATOM 0 HG LEU B 29 -7.859 3.565 2.461 1.00 10.00 H new ATOM 0 HD11 LEU B 29 -7.671 1.109 2.344 1.00 10.00 H new ATOM 0 HD12 LEU B 29 -6.427 1.917 1.362 1.00 10.00 H new ATOM 0 HD13 LEU B 29 -5.997 1.215 2.939 1.00 10.00 H new ATOM 0 HD21 LEU B 29 -8.540 2.174 4.383 1.00 10.00 H new ATOM 0 HD22 LEU B 29 -6.903 2.329 5.066 1.00 10.00 H new ATOM 0 HD23 LEU B 29 -7.938 3.767 4.899 1.00 10.00 H new ATOM 1218 N THR B 30 -6.624 6.471 1.483 1.00 10.00 N ATOM 1219 CA THR B 30 -7.621 7.348 0.883 1.00 10.00 C ATOM 1220 C THR B 30 -7.180 7.772 -0.519 1.00 10.00 C ATOM 1221 O THR B 30 -7.986 8.230 -1.323 1.00 10.00 O ATOM 1222 CB THR B 30 -7.874 8.603 1.758 1.00 10.00 C ATOM 1223 OG1 THR B 30 -8.933 9.400 1.208 1.00 10.00 O ATOM 1224 CG2 THR B 30 -6.617 9.451 1.877 1.00 10.00 C ATOM 0 H THR B 30 -6.101 6.892 2.251 1.00 10.00 H new ATOM 0 HA THR B 30 -8.554 6.789 0.814 1.00 10.00 H new ATOM 0 HB THR B 30 -8.161 8.256 2.751 1.00 10.00 H new ATOM 0 HG1 THR B 30 -9.079 10.186 1.775 1.00 10.00 H new ATOM 0 HG21 THR B 30 -6.824 10.324 2.496 1.00 10.00 H new ATOM 0 HG22 THR B 30 -5.823 8.862 2.335 1.00 10.00 H new ATOM 0 HG23 THR B 30 -6.302 9.776 0.885 1.00 10.00 H new ATOM 1232 N ARG B 31 -5.899 7.583 -0.812 1.00 10.00 N ATOM 1233 CA ARG B 31 -5.338 7.944 -2.107 1.00 10.00 C ATOM 1234 C ARG B 31 -5.427 6.763 -3.067 1.00 10.00 C ATOM 1235 O ARG B 31 -5.754 6.924 -4.239 1.00 10.00 O ATOM 1236 CB ARG B 31 -3.880 8.377 -1.939 1.00 10.00 C ATOM 1237 CG ARG B 31 -3.485 9.560 -2.808 1.00 10.00 C ATOM 1238 CD ARG B 31 -2.039 9.966 -2.570 1.00 10.00 C ATOM 1239 NE ARG B 31 -1.775 10.295 -1.166 1.00 10.00 N ATOM 1240 CZ ARG B 31 -0.704 10.978 -0.756 1.00 10.00 C ATOM 1241 NH1 ARG B 31 0.221 11.356 -1.627 1.00 10.00 N ATOM 1242 NH2 ARG B 31 -0.543 11.265 0.526 1.00 10.00 N ATOM 0 H ARG B 31 -5.224 7.178 -0.163 1.00 10.00 H new ATOM 0 HA ARG B 31 -5.910 8.774 -2.521 1.00 10.00 H new ATOM 0 HB2 ARG B 31 -3.705 8.632 -0.894 1.00 10.00 H new ATOM 0 HB3 ARG B 31 -3.231 7.533 -2.174 1.00 10.00 H new ATOM 0 HG2 ARG B 31 -3.624 9.304 -3.858 1.00 10.00 H new ATOM 0 HG3 ARG B 31 -4.141 10.404 -2.596 1.00 10.00 H new ATOM 0 HD2 ARG B 31 -1.381 9.154 -2.880 1.00 10.00 H new ATOM 0 HD3 ARG B 31 -1.799 10.827 -3.194 1.00 10.00 H new ATOM 0 HE ARG B 31 -2.447 9.985 -0.464 1.00 10.00 H new ATOM 0 HH11 ARG B 31 0.116 11.125 -2.615 1.00 10.00 H new ATOM 0 HH12 ARG B 31 1.038 11.878 -1.309 1.00 10.00 H new ATOM 0 HH21 ARG B 31 -1.240 10.964 1.207 1.00 10.00 H new ATOM 0 HH22 ARG B 31 0.278 11.787 0.833 1.00 10.00 H new ATOM 1256 N LEU B 32 -5.145 5.577 -2.549 1.00 10.00 N ATOM 1257 CA LEU B 32 -5.186 4.349 -3.334 1.00 10.00 C ATOM 1258 C LEU B 32 -6.576 4.118 -3.912 1.00 10.00 C ATOM 1259 O LEU B 32 -6.723 3.626 -5.033 1.00 10.00 O ATOM 1260 CB LEU B 32 -4.792 3.159 -2.455 1.00 10.00 C ATOM 1261 CG LEU B 32 -4.435 1.880 -3.211 1.00 10.00 C ATOM 1262 CD1 LEU B 32 -2.953 1.868 -3.566 1.00 10.00 C ATOM 1263 CD2 LEU B 32 -4.806 0.652 -2.391 1.00 10.00 C ATOM 0 H LEU B 32 -4.881 5.437 -1.574 1.00 10.00 H new ATOM 0 HA LEU B 32 -4.480 4.447 -4.159 1.00 10.00 H new ATOM 0 HB2 LEU B 32 -3.939 3.449 -1.841 1.00 10.00 H new ATOM 0 HB3 LEU B 32 -5.616 2.942 -1.775 1.00 10.00 H new ATOM 0 HG LEU B 32 -5.008 1.854 -4.138 1.00 10.00 H new ATOM 0 HD11 LEU B 32 -2.715 0.950 -4.104 1.00 10.00 H new ATOM 0 HD12 LEU B 32 -2.723 2.728 -4.195 1.00 10.00 H new ATOM 0 HD13 LEU B 32 -2.360 1.917 -2.653 1.00 10.00 H new ATOM 0 HD21 LEU B 32 -4.544 -0.249 -2.946 1.00 10.00 H new ATOM 0 HD22 LEU B 32 -4.262 0.667 -1.447 1.00 10.00 H new ATOM 0 HD23 LEU B 32 -5.878 0.657 -2.193 1.00 10.00 H new ATOM 1275 N LEU B 33 -7.592 4.502 -3.148 1.00 10.00 N ATOM 1276 CA LEU B 33 -8.977 4.331 -3.567 1.00 10.00 C ATOM 1277 C LEU B 33 -9.353 5.308 -4.683 1.00 10.00 C ATOM 1278 O LEU B 33 -10.439 5.222 -5.252 1.00 10.00 O ATOM 1279 CB LEU B 33 -9.911 4.514 -2.373 1.00 10.00 C ATOM 1280 CG LEU B 33 -9.706 3.519 -1.229 1.00 10.00 C ATOM 1281 CD1 LEU B 33 -10.596 3.883 -0.053 1.00 10.00 C ATOM 1282 CD2 LEU B 33 -9.991 2.099 -1.691 1.00 10.00 C ATOM 0 H LEU B 33 -7.481 4.936 -2.231 1.00 10.00 H new ATOM 0 HA LEU B 33 -9.085 3.320 -3.960 1.00 10.00 H new ATOM 0 HB2 LEU B 33 -9.783 5.524 -1.983 1.00 10.00 H new ATOM 0 HB3 LEU B 33 -10.941 4.435 -2.722 1.00 10.00 H new ATOM 0 HG LEU B 33 -8.665 3.570 -0.911 1.00 10.00 H new ATOM 0 HD11 LEU B 33 -10.442 3.168 0.755 1.00 10.00 H new ATOM 0 HD12 LEU B 33 -10.346 4.885 0.296 1.00 10.00 H new ATOM 0 HD13 LEU B 33 -11.640 3.858 -0.365 1.00 10.00 H new ATOM 0 HD21 LEU B 33 -9.839 1.409 -0.861 1.00 10.00 H new ATOM 0 HD22 LEU B 33 -11.022 2.029 -2.037 1.00 10.00 H new ATOM 0 HD23 LEU B 33 -9.316 1.840 -2.507 1.00 10.00 H new ATOM 1294 N GLN B 34 -8.472 6.253 -4.980 1.00 10.00 N ATOM 1295 CA GLN B 34 -8.737 7.217 -6.040 1.00 10.00 C ATOM 1296 C GLN B 34 -8.120 6.744 -7.354 1.00 10.00 C ATOM 1297 O GLN B 34 -8.719 6.883 -8.423 1.00 10.00 O ATOM 1298 CB GLN B 34 -8.190 8.603 -5.678 1.00 10.00 C ATOM 1299 CG GLN B 34 -8.522 9.061 -4.263 1.00 10.00 C ATOM 1300 CD GLN B 34 -10.013 9.092 -3.962 1.00 10.00 C ATOM 1301 OE1 GLN B 34 -10.844 9.344 -4.839 1.00 10.00 O ATOM 1302 NE2 GLN B 34 -10.360 8.847 -2.710 1.00 10.00 N ATOM 0 H GLN B 34 -7.576 6.373 -4.508 1.00 10.00 H new ATOM 0 HA GLN B 34 -9.818 7.294 -6.158 1.00 10.00 H new ATOM 0 HB2 GLN B 34 -7.107 8.596 -5.800 1.00 10.00 H new ATOM 0 HB3 GLN B 34 -8.585 9.332 -6.385 1.00 10.00 H new ATOM 0 HG2 GLN B 34 -8.031 8.397 -3.552 1.00 10.00 H new ATOM 0 HG3 GLN B 34 -8.108 10.057 -4.107 1.00 10.00 H new ATOM 0 HE21 GLN B 34 -9.644 8.643 -2.013 1.00 10.00 H new ATOM 0 HE22 GLN B 34 -11.344 8.862 -2.441 1.00 10.00 H new ATOM 1311 N THR B 35 -6.930 6.167 -7.267 1.00 10.00 N ATOM 1312 CA THR B 35 -6.223 5.690 -8.447 1.00 10.00 C ATOM 1313 C THR B 35 -6.638 4.274 -8.832 1.00 10.00 C ATOM 1314 O THR B 35 -6.629 3.918 -10.012 1.00 10.00 O ATOM 1315 CB THR B 35 -4.700 5.726 -8.232 1.00 10.00 C ATOM 1316 OG1 THR B 35 -4.392 5.394 -6.872 1.00 10.00 O ATOM 1317 CG2 THR B 35 -4.138 7.096 -8.567 1.00 10.00 C ATOM 0 H THR B 35 -6.433 6.018 -6.389 1.00 10.00 H new ATOM 0 HA THR B 35 -6.494 6.363 -9.260 1.00 10.00 H new ATOM 0 HB THR B 35 -4.242 4.994 -8.897 1.00 10.00 H new ATOM 0 HG1 THR B 35 -3.598 4.820 -6.847 1.00 10.00 H new ATOM 0 HG21 THR B 35 -3.060 7.096 -8.407 1.00 10.00 H new ATOM 0 HG22 THR B 35 -4.350 7.331 -9.610 1.00 10.00 H new ATOM 0 HG23 THR B 35 -4.600 7.846 -7.925 1.00 10.00 H new ATOM 1325 N LYS B 36 -7.000 3.467 -7.843 1.00 10.00 N ATOM 1326 CA LYS B 36 -7.400 2.088 -8.094 1.00 10.00 C ATOM 1327 C LYS B 36 -8.892 1.880 -7.827 1.00 10.00 C ATOM 1328 O LYS B 36 -9.364 0.743 -7.782 1.00 10.00 O ATOM 1329 CB LYS B 36 -6.554 1.135 -7.241 1.00 10.00 C ATOM 1330 CG LYS B 36 -5.070 1.191 -7.582 1.00 10.00 C ATOM 1331 CD LYS B 36 -4.256 0.240 -6.725 1.00 10.00 C ATOM 1332 CE LYS B 36 -2.810 0.163 -7.204 1.00 10.00 C ATOM 1333 NZ LYS B 36 -2.106 1.467 -7.076 1.00 10.00 N ATOM 0 H LYS B 36 -7.025 3.743 -6.861 1.00 10.00 H new ATOM 0 HA LYS B 36 -7.226 1.868 -9.147 1.00 10.00 H new ATOM 0 HB2 LYS B 36 -6.689 1.382 -6.188 1.00 10.00 H new ATOM 0 HB3 LYS B 36 -6.915 0.116 -7.378 1.00 10.00 H new ATOM 0 HG2 LYS B 36 -4.930 0.942 -8.634 1.00 10.00 H new ATOM 0 HG3 LYS B 36 -4.704 2.208 -7.443 1.00 10.00 H new ATOM 0 HD2 LYS B 36 -4.280 0.571 -5.687 1.00 10.00 H new ATOM 0 HD3 LYS B 36 -4.704 -0.753 -6.754 1.00 10.00 H new ATOM 0 HE2 LYS B 36 -2.278 -0.594 -6.627 1.00 10.00 H new ATOM 0 HE3 LYS B 36 -2.791 -0.158 -8.246 1.00 10.00 H new ATOM 0 HZ1 LYS B 36 -1.132 1.372 -7.429 1.00 10.00 H new ATOM 0 HZ2 LYS B 36 -2.607 2.188 -7.633 1.00 10.00 H new ATOM 0 HZ3 LYS B 36 -2.086 1.754 -6.077 1.00 10.00 H new ATOM 1347 N ASN B 37 -9.615 2.992 -7.657 1.00 10.00 N ATOM 1348 CA ASN B 37 -11.065 2.969 -7.418 1.00 10.00 C ATOM 1349 C ASN B 37 -11.398 2.421 -6.026 1.00 10.00 C ATOM 1350 O ASN B 37 -10.542 1.876 -5.333 1.00 10.00 O ATOM 1351 CB ASN B 37 -11.771 2.150 -8.511 1.00 10.00 C ATOM 1352 CG ASN B 37 -13.287 2.232 -8.453 1.00 10.00 C ATOM 1353 OD1 ASN B 37 -13.858 3.235 -8.020 1.00 10.00 O ATOM 1354 ND2 ASN B 37 -13.948 1.171 -8.885 1.00 10.00 N ATOM 0 H ASN B 37 -9.215 3.930 -7.681 1.00 10.00 H new ATOM 0 HA ASN B 37 -11.429 3.996 -7.459 1.00 10.00 H new ATOM 0 HB2 ASN B 37 -11.434 2.498 -9.488 1.00 10.00 H new ATOM 0 HB3 ASN B 37 -11.469 1.106 -8.423 1.00 10.00 H new ATOM 0 HD21 ASN B 37 -14.968 1.163 -8.867 1.00 10.00 H new ATOM 0 HD22 ASN B 37 -13.438 0.360 -9.236 1.00 10.00 H new ATOM 1361 N TYR B 38 -12.654 2.574 -5.625 1.00 10.00 N ATOM 1362 CA TYR B 38 -13.121 2.117 -4.321 1.00 10.00 C ATOM 1363 C TYR B 38 -13.568 0.657 -4.384 1.00 10.00 C ATOM 1364 O TYR B 38 -14.522 0.260 -3.714 1.00 10.00 O ATOM 1365 CB TYR B 38 -14.283 2.993 -3.834 1.00 10.00 C ATOM 1366 CG TYR B 38 -14.084 4.473 -4.072 1.00 10.00 C ATOM 1367 CD1 TYR B 38 -13.360 5.251 -3.179 1.00 10.00 C ATOM 1368 CD2 TYR B 38 -14.627 5.091 -5.189 1.00 10.00 C ATOM 1369 CE1 TYR B 38 -13.181 6.604 -3.396 1.00 10.00 C ATOM 1370 CE2 TYR B 38 -14.452 6.441 -5.413 1.00 10.00 C ATOM 1371 CZ TYR B 38 -13.729 7.194 -4.515 1.00 10.00 C ATOM 1372 OH TYR B 38 -13.555 8.541 -4.738 1.00 10.00 O ATOM 0 H TYR B 38 -13.376 3.017 -6.193 1.00 10.00 H new ATOM 0 HA TYR B 38 -12.292 2.198 -3.618 1.00 10.00 H new ATOM 0 HB2 TYR B 38 -15.198 2.675 -4.335 1.00 10.00 H new ATOM 0 HB3 TYR B 38 -14.429 2.824 -2.767 1.00 10.00 H new ATOM 0 HD1 TYR B 38 -12.930 4.792 -2.301 1.00 10.00 H new ATOM 0 HD2 TYR B 38 -15.197 4.505 -5.895 1.00 10.00 H new ATOM 0 HE1 TYR B 38 -12.615 7.196 -2.692 1.00 10.00 H new ATOM 0 HE2 TYR B 38 -14.880 6.905 -6.289 1.00 10.00 H new ATOM 0 HH TYR B 38 -12.597 8.745 -4.776 1.00 10.00 H new ATOM 1382 N ASP B 39 -12.877 -0.139 -5.192 1.00 10.00 N ATOM 1383 CA ASP B 39 -13.201 -1.553 -5.339 1.00 10.00 C ATOM 1384 C ASP B 39 -12.559 -2.340 -4.208 1.00 10.00 C ATOM 1385 O ASP B 39 -11.335 -2.500 -4.164 1.00 10.00 O ATOM 1386 CB ASP B 39 -12.719 -2.079 -6.697 1.00 10.00 C ATOM 1387 CG ASP B 39 -13.241 -3.472 -7.008 1.00 10.00 C ATOM 1388 OD1 ASP B 39 -12.654 -4.457 -6.517 1.00 10.00 O ATOM 1389 OD2 ASP B 39 -14.237 -3.589 -7.752 1.00 10.00 O ATOM 0 H ASP B 39 -12.087 0.172 -5.757 1.00 10.00 H new ATOM 0 HA ASP B 39 -14.283 -1.676 -5.293 1.00 10.00 H new ATOM 0 HB2 ASP B 39 -13.038 -1.393 -7.481 1.00 10.00 H new ATOM 0 HB3 ASP B 39 -11.629 -2.093 -6.710 1.00 10.00 H new ATOM 1394 N ILE B 40 -13.389 -2.818 -3.292 1.00 10.00 N ATOM 1395 CA ILE B 40 -12.921 -3.574 -2.129 1.00 10.00 C ATOM 1396 C ILE B 40 -12.211 -4.857 -2.556 1.00 10.00 C ATOM 1397 O ILE B 40 -11.249 -5.297 -1.919 1.00 10.00 O ATOM 1398 CB ILE B 40 -14.094 -3.928 -1.186 1.00 10.00 C ATOM 1399 CG1 ILE B 40 -14.978 -2.698 -0.957 1.00 10.00 C ATOM 1400 CG2 ILE B 40 -13.574 -4.463 0.144 1.00 10.00 C ATOM 1401 CD1 ILE B 40 -16.348 -3.030 -0.408 1.00 10.00 C ATOM 0 H ILE B 40 -14.401 -2.696 -3.329 1.00 10.00 H new ATOM 0 HA ILE B 40 -12.215 -2.938 -1.595 1.00 10.00 H new ATOM 0 HB ILE B 40 -14.692 -4.708 -1.657 1.00 10.00 H new ATOM 0 HG12 ILE B 40 -14.473 -2.022 -0.267 1.00 10.00 H new ATOM 0 HG13 ILE B 40 -15.093 -2.163 -1.900 1.00 10.00 H new ATOM 0 HG21 ILE B 40 -14.416 -4.706 0.793 1.00 10.00 H new ATOM 0 HG22 ILE B 40 -12.981 -5.360 -0.032 1.00 10.00 H new ATOM 0 HG23 ILE B 40 -12.953 -3.706 0.623 1.00 10.00 H new ATOM 0 HD11 ILE B 40 -16.918 -2.111 -0.271 1.00 10.00 H new ATOM 0 HD12 ILE B 40 -16.872 -3.681 -1.107 1.00 10.00 H new ATOM 0 HD13 ILE B 40 -16.243 -3.537 0.551 1.00 10.00 H new ATOM 1413 N GLY B 41 -12.688 -5.451 -3.642 1.00 10.00 N ATOM 1414 CA GLY B 41 -12.093 -6.674 -4.144 1.00 10.00 C ATOM 1415 C GLY B 41 -10.654 -6.470 -4.571 1.00 10.00 C ATOM 1416 O GLY B 41 -9.760 -7.214 -4.157 1.00 10.00 O ATOM 0 H GLY B 41 -13.479 -5.106 -4.186 1.00 10.00 H new ATOM 0 HA2 GLY B 41 -12.137 -7.442 -3.372 1.00 10.00 H new ATOM 0 HA3 GLY B 41 -12.674 -7.039 -4.991 1.00 10.00 H new ATOM 1420 N ALA B 42 -10.425 -5.454 -5.388 1.00 10.00 N ATOM 1421 CA ALA B 42 -9.090 -5.140 -5.871 1.00 10.00 C ATOM 1422 C ALA B 42 -8.201 -4.638 -4.737 1.00 10.00 C ATOM 1423 O ALA B 42 -7.004 -4.924 -4.705 1.00 10.00 O ATOM 1424 CB ALA B 42 -9.161 -4.107 -6.988 1.00 10.00 C ATOM 0 H ALA B 42 -11.153 -4.828 -5.733 1.00 10.00 H new ATOM 0 HA ALA B 42 -8.648 -6.055 -6.266 1.00 10.00 H new ATOM 0 HB1 ALA B 42 -8.154 -3.882 -7.340 1.00 10.00 H new ATOM 0 HB2 ALA B 42 -9.753 -4.503 -7.813 1.00 10.00 H new ATOM 0 HB3 ALA B 42 -9.626 -3.196 -6.612 1.00 10.00 H new ATOM 1430 N ALA B 43 -8.796 -3.905 -3.805 1.00 10.00 N ATOM 1431 CA ALA B 43 -8.062 -3.355 -2.670 1.00 10.00 C ATOM 1432 C ALA B 43 -7.385 -4.451 -1.848 1.00 10.00 C ATOM 1433 O ALA B 43 -6.177 -4.401 -1.613 1.00 10.00 O ATOM 1434 CB ALA B 43 -8.992 -2.537 -1.786 1.00 10.00 C ATOM 0 H ALA B 43 -9.790 -3.676 -3.812 1.00 10.00 H new ATOM 0 HA ALA B 43 -7.281 -2.707 -3.067 1.00 10.00 H new ATOM 0 HB1 ALA B 43 -8.431 -2.133 -0.943 1.00 10.00 H new ATOM 0 HB2 ALA B 43 -9.417 -1.717 -2.365 1.00 10.00 H new ATOM 0 HB3 ALA B 43 -9.795 -3.174 -1.415 1.00 10.00 H new ATOM 1440 N LEU B 44 -8.165 -5.440 -1.430 1.00 10.00 N ATOM 1441 CA LEU B 44 -7.640 -6.544 -0.628 1.00 10.00 C ATOM 1442 C LEU B 44 -6.705 -7.430 -1.452 1.00 10.00 C ATOM 1443 O LEU B 44 -5.722 -7.965 -0.939 1.00 10.00 O ATOM 1444 CB LEU B 44 -8.793 -7.380 -0.063 1.00 10.00 C ATOM 1445 CG LEU B 44 -9.233 -7.021 1.360 1.00 10.00 C ATOM 1446 CD1 LEU B 44 -9.824 -5.618 1.410 1.00 10.00 C ATOM 1447 CD2 LEU B 44 -10.232 -8.041 1.885 1.00 10.00 C ATOM 0 H LEU B 44 -9.163 -5.503 -1.632 1.00 10.00 H new ATOM 0 HA LEU B 44 -7.066 -6.120 0.196 1.00 10.00 H new ATOM 0 HB2 LEU B 44 -9.652 -7.278 -0.727 1.00 10.00 H new ATOM 0 HB3 LEU B 44 -8.500 -8.430 -0.080 1.00 10.00 H new ATOM 0 HG LEU B 44 -8.352 -7.040 2.001 1.00 10.00 H new ATOM 0 HD11 LEU B 44 -10.128 -5.388 2.431 1.00 10.00 H new ATOM 0 HD12 LEU B 44 -9.076 -4.896 1.083 1.00 10.00 H new ATOM 0 HD13 LEU B 44 -10.691 -5.565 0.752 1.00 10.00 H new ATOM 0 HD21 LEU B 44 -10.532 -7.769 2.897 1.00 10.00 H new ATOM 0 HD22 LEU B 44 -11.109 -8.058 1.238 1.00 10.00 H new ATOM 0 HD23 LEU B 44 -9.771 -9.029 1.897 1.00 10.00 H new ATOM 1459 N ASP B 45 -7.013 -7.565 -2.737 1.00 10.00 N ATOM 1460 CA ASP B 45 -6.217 -8.388 -3.646 1.00 10.00 C ATOM 1461 C ASP B 45 -4.822 -7.796 -3.852 1.00 10.00 C ATOM 1462 O ASP B 45 -3.830 -8.522 -3.923 1.00 10.00 O ATOM 1463 CB ASP B 45 -6.934 -8.506 -4.994 1.00 10.00 C ATOM 1464 CG ASP B 45 -6.214 -9.414 -5.973 1.00 10.00 C ATOM 1465 OD1 ASP B 45 -5.272 -8.948 -6.642 1.00 10.00 O ATOM 1466 OD2 ASP B 45 -6.608 -10.592 -6.095 1.00 10.00 O ATOM 0 H ASP B 45 -7.814 -7.112 -3.177 1.00 10.00 H new ATOM 0 HA ASP B 45 -6.103 -9.376 -3.201 1.00 10.00 H new ATOM 0 HB2 ASP B 45 -7.943 -8.885 -4.830 1.00 10.00 H new ATOM 0 HB3 ASP B 45 -7.034 -7.514 -5.434 1.00 10.00 H new ATOM 1471 N THR B 46 -4.760 -6.471 -3.925 1.00 10.00 N ATOM 1472 CA THR B 46 -3.509 -5.747 -4.149 1.00 10.00 C ATOM 1473 C THR B 46 -2.415 -6.114 -3.136 1.00 10.00 C ATOM 1474 O THR B 46 -1.247 -6.253 -3.505 1.00 10.00 O ATOM 1475 CB THR B 46 -3.756 -4.221 -4.108 1.00 10.00 C ATOM 1476 OG1 THR B 46 -4.620 -3.837 -5.187 1.00 10.00 O ATOM 1477 CG2 THR B 46 -2.453 -3.439 -4.208 1.00 10.00 C ATOM 0 H THR B 46 -5.576 -5.866 -3.831 1.00 10.00 H new ATOM 0 HA THR B 46 -3.153 -6.044 -5.136 1.00 10.00 H new ATOM 0 HB THR B 46 -4.224 -3.988 -3.152 1.00 10.00 H new ATOM 0 HG1 THR B 46 -5.436 -4.379 -5.161 1.00 10.00 H new ATOM 0 HG21 THR B 46 -2.666 -2.371 -4.176 1.00 10.00 H new ATOM 0 HG22 THR B 46 -1.804 -3.705 -3.373 1.00 10.00 H new ATOM 0 HG23 THR B 46 -1.954 -3.681 -5.146 1.00 10.00 H new ATOM 1485 N ILE B 47 -2.787 -6.284 -1.874 1.00 10.00 N ATOM 1486 CA ILE B 47 -1.804 -6.605 -0.842 1.00 10.00 C ATOM 1487 C ILE B 47 -1.803 -8.090 -0.483 1.00 10.00 C ATOM 1488 O ILE B 47 -1.169 -8.490 0.490 1.00 10.00 O ATOM 1489 CB ILE B 47 -2.029 -5.771 0.435 1.00 10.00 C ATOM 1490 CG1 ILE B 47 -3.412 -6.053 1.029 1.00 10.00 C ATOM 1491 CG2 ILE B 47 -1.866 -4.286 0.130 1.00 10.00 C ATOM 1492 CD1 ILE B 47 -3.563 -5.579 2.459 1.00 10.00 C ATOM 0 H ILE B 47 -3.748 -6.207 -1.541 1.00 10.00 H new ATOM 0 HA ILE B 47 -0.832 -6.354 -1.266 1.00 10.00 H new ATOM 0 HB ILE B 47 -1.280 -6.058 1.173 1.00 10.00 H new ATOM 0 HG12 ILE B 47 -4.169 -5.569 0.412 1.00 10.00 H new ATOM 0 HG13 ILE B 47 -3.605 -7.125 0.988 1.00 10.00 H new ATOM 0 HG21 ILE B 47 -2.027 -3.708 1.040 1.00 10.00 H new ATOM 0 HG22 ILE B 47 -0.859 -4.100 -0.245 1.00 10.00 H new ATOM 0 HG23 ILE B 47 -2.595 -3.987 -0.624 1.00 10.00 H new ATOM 0 HD11 ILE B 47 -4.567 -5.811 2.815 1.00 10.00 H new ATOM 0 HD12 ILE B 47 -2.829 -6.082 3.088 1.00 10.00 H new ATOM 0 HD13 ILE B 47 -3.402 -4.502 2.504 1.00 10.00 H new ATOM 1504 N GLN B 48 -2.529 -8.888 -1.270 1.00 10.00 N ATOM 1505 CA GLN B 48 -2.626 -10.346 -1.080 1.00 10.00 C ATOM 1506 C GLN B 48 -3.451 -10.730 0.156 1.00 10.00 C ATOM 1507 O GLN B 48 -4.213 -11.698 0.116 1.00 10.00 O ATOM 1508 CB GLN B 48 -1.238 -10.984 -0.995 1.00 10.00 C ATOM 1509 CG GLN B 48 -1.114 -12.278 -1.782 1.00 10.00 C ATOM 1510 CD GLN B 48 -0.650 -13.436 -0.926 1.00 10.00 C ATOM 1511 OE1 GLN B 48 -0.936 -13.501 0.271 1.00 10.00 O ATOM 1512 NE2 GLN B 48 0.075 -14.362 -1.532 1.00 10.00 N ATOM 0 H GLN B 48 -3.071 -8.543 -2.063 1.00 10.00 H new ATOM 0 HA GLN B 48 -3.147 -10.732 -1.956 1.00 10.00 H new ATOM 0 HB2 GLN B 48 -0.498 -10.273 -1.362 1.00 10.00 H new ATOM 0 HB3 GLN B 48 -1.001 -11.180 0.051 1.00 10.00 H new ATOM 0 HG2 GLN B 48 -2.079 -12.523 -2.226 1.00 10.00 H new ATOM 0 HG3 GLN B 48 -0.412 -12.134 -2.603 1.00 10.00 H new ATOM 0 HE21 GLN B 48 0.290 -14.272 -2.525 1.00 10.00 H new ATOM 0 HE22 GLN B 48 0.418 -15.166 -1.006 1.00 10.00 H new ATOM 1521 N TYR B 49 -3.285 -9.997 1.252 1.00 10.00 N ATOM 1522 CA TYR B 49 -4.016 -10.274 2.486 1.00 10.00 C ATOM 1523 C TYR B 49 -5.521 -10.165 2.267 1.00 10.00 C ATOM 1524 O TYR B 49 -6.079 -9.070 2.230 1.00 10.00 O ATOM 1525 CB TYR B 49 -3.571 -9.321 3.599 1.00 10.00 C ATOM 1526 CG TYR B 49 -2.167 -9.587 4.094 1.00 10.00 C ATOM 1527 CD1 TYR B 49 -1.930 -10.515 5.102 1.00 10.00 C ATOM 1528 CD2 TYR B 49 -1.080 -8.914 3.551 1.00 10.00 C ATOM 1529 CE1 TYR B 49 -0.646 -10.765 5.552 1.00 10.00 C ATOM 1530 CE2 TYR B 49 0.205 -9.158 3.996 1.00 10.00 C ATOM 1531 CZ TYR B 49 0.419 -10.081 4.997 1.00 10.00 C ATOM 1532 OH TYR B 49 1.702 -10.324 5.440 1.00 10.00 O ATOM 0 H TYR B 49 -2.648 -9.203 1.312 1.00 10.00 H new ATOM 0 HA TYR B 49 -3.789 -11.296 2.789 1.00 10.00 H new ATOM 0 HB2 TYR B 49 -3.631 -8.296 3.234 1.00 10.00 H new ATOM 0 HB3 TYR B 49 -4.265 -9.403 4.436 1.00 10.00 H new ATOM 0 HD1 TYR B 49 -2.761 -11.048 5.540 1.00 10.00 H new ATOM 0 HD2 TYR B 49 -1.242 -8.188 2.768 1.00 10.00 H new ATOM 0 HE1 TYR B 49 -0.477 -11.491 6.333 1.00 10.00 H new ATOM 0 HE2 TYR B 49 1.039 -8.627 3.561 1.00 10.00 H new ATOM 0 HH TYR B 49 2.340 -9.833 4.881 1.00 10.00 H new ATOM 1542 N SER B 50 -6.167 -11.309 2.097 1.00 10.00 N ATOM 1543 CA SER B 50 -7.604 -11.349 1.875 1.00 10.00 C ATOM 1544 C SER B 50 -8.303 -12.150 2.971 1.00 10.00 C ATOM 1545 O SER B 50 -9.353 -11.744 3.474 1.00 10.00 O ATOM 1546 CB SER B 50 -7.902 -11.955 0.501 1.00 10.00 C ATOM 1547 OG SER B 50 -7.056 -11.396 -0.493 1.00 10.00 O ATOM 0 H SER B 50 -5.717 -12.224 2.109 1.00 10.00 H new ATOM 0 HA SER B 50 -7.987 -10.329 1.906 1.00 10.00 H new ATOM 0 HB2 SER B 50 -7.762 -13.035 0.537 1.00 10.00 H new ATOM 0 HB3 SER B 50 -8.945 -11.777 0.239 1.00 10.00 H new ATOM 0 HG SER B 50 -6.129 -11.662 -0.320 1.00 10.00 H new ATOM 1553 N LYS B 51 -7.714 -13.286 3.341 1.00 10.00 N ATOM 1554 CA LYS B 51 -8.288 -14.133 4.381 1.00 10.00 C ATOM 1555 C LYS B 51 -7.979 -13.564 5.758 1.00 10.00 C ATOM 1556 O LYS B 51 -8.869 -13.068 6.448 1.00 10.00 O ATOM 1557 CB LYS B 51 -7.749 -15.561 4.278 1.00 10.00 C ATOM 1558 CG LYS B 51 -8.399 -16.387 3.179 1.00 10.00 C ATOM 1559 CD LYS B 51 -7.776 -17.772 3.086 1.00 10.00 C ATOM 1560 CE LYS B 51 -8.059 -18.608 4.324 1.00 10.00 C ATOM 1561 NZ LYS B 51 -7.377 -19.927 4.272 1.00 10.00 N ATOM 0 H LYS B 51 -6.845 -13.638 2.938 1.00 10.00 H new ATOM 0 HA LYS B 51 -9.368 -14.157 4.239 1.00 10.00 H new ATOM 0 HB2 LYS B 51 -6.674 -15.521 4.102 1.00 10.00 H new ATOM 0 HB3 LYS B 51 -7.897 -16.065 5.233 1.00 10.00 H new ATOM 0 HG2 LYS B 51 -9.467 -16.479 3.374 1.00 10.00 H new ATOM 0 HG3 LYS B 51 -8.292 -15.873 2.224 1.00 10.00 H new ATOM 0 HD2 LYS B 51 -8.163 -18.285 2.206 1.00 10.00 H new ATOM 0 HD3 LYS B 51 -6.699 -17.677 2.951 1.00 10.00 H new ATOM 0 HE2 LYS B 51 -7.732 -18.065 5.211 1.00 10.00 H new ATOM 0 HE3 LYS B 51 -9.134 -18.759 4.422 1.00 10.00 H new ATOM 0 HZ1 LYS B 51 -7.596 -20.465 5.134 1.00 10.00 H new ATOM 0 HZ2 LYS B 51 -7.708 -20.456 3.440 1.00 10.00 H new ATOM 0 HZ3 LYS B 51 -6.349 -19.784 4.205 1.00 10.00 H new ATOM 1575 N HIS B 52 -6.713 -13.633 6.144 1.00 10.00 N ATOM 1576 CA HIS B 52 -6.273 -13.126 7.434 1.00 10.00 C ATOM 1577 C HIS B 52 -4.759 -12.997 7.442 1.00 10.00 C ATOM 1578 O HIS B 52 -4.240 -12.091 8.117 1.00 10.00 O ATOM 1579 CB HIS B 52 -6.717 -14.060 8.562 1.00 10.00 C ATOM 1580 CG HIS B 52 -6.738 -13.407 9.911 1.00 10.00 C ATOM 1581 ND1 HIS B 52 -5.673 -13.452 10.788 1.00 10.00 N ATOM 1582 CD2 HIS B 52 -7.704 -12.693 10.534 1.00 10.00 C ATOM 1583 CE1 HIS B 52 -5.985 -12.794 11.891 1.00 10.00 C ATOM 1584 NE2 HIS B 52 -7.210 -12.326 11.761 1.00 10.00 N ATOM 1585 OXT HIS B 52 -4.098 -13.803 6.753 1.00 10.00 O ATOM 0 H HIS B 52 -5.968 -14.038 5.577 1.00 10.00 H new ATOM 0 HA HIS B 52 -6.725 -12.147 7.596 1.00 10.00 H new ATOM 0 HB2 HIS B 52 -7.713 -14.440 8.336 1.00 10.00 H new ATOM 0 HB3 HIS B 52 -6.048 -14.920 8.595 1.00 10.00 H new ATOM 0 HD2 HIS B 52 -8.681 -12.456 10.140 1.00 10.00 H new ATOM 0 HE1 HIS B 52 -5.346 -12.662 12.751 1.00 10.00 H new ATOM 0 HE2 HIS B 52 -7.711 -11.778 12.461 1.00 10.00 H new TER 1594 HIS B 52