USER MOD reduce.3.24.130724 H: found=0, std=0, add=1349, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1349 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 143 THR OG1 : rot 180:sc= -0.177 USER MOD Set 1.2: A 144 THR OG1 : rot 180:sc= 0.042 USER MOD Set 2.1: A 23 SER OG : rot 180:sc= -0.0333 USER MOD Set 2.2: A 130 LYS NZ :NH3+ -121:sc= -1.27 (180deg=-3.97!) USER MOD Set 3.1: A 109 SER OG : rot -173:sc= -2.6! USER MOD Set 3.2: A 112 GLN : amide:sc= -6.66! C(o=-9.3!,f=-16!) USER MOD Set 4.1: A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 87 LYS NZ :NH3+ -151:sc= -0.161 (180deg=-1.03) USER MOD Single : A 21 THR OG1 : rot -90:sc= -0.417 USER MOD Single : A 22 SER OG : rot 180:sc= 0.00427 USER MOD Single : A 28 LYS NZ :NH3+ 178:sc= -0.0019 (180deg=-0.00963) USER MOD Single : A 29 GLN : amide:sc= -0.854 K(o=-0.85,f=-4.7!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0671) USER MOD Single : A 44 THR OG1 : rot -56:sc= 0.219 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.289) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.178 X(o=-0.18,f=-0.071) USER MOD Single : A 50 MET CE :methyl 144:sc= -0.611 (180deg=-4.16!) USER MOD Single : A 53 SER OG : rot 44:sc= 1.1 USER MOD Single : A 54 SER OG : rot 66:sc= 1.22 USER MOD Single : A 55 LYS NZ :NH3+ -151:sc= -0.0706 (180deg=-0.681) USER MOD Single : A 61 ASN : amide:sc= -0.872 K(o=-0.87,f=-1.5) USER MOD Single : A 62 ASN : amide:sc= -6.02! C(o=-6!,f=-5.7!) USER MOD Single : A 64 ASN : amide:sc= -0.019 X(o=-0.019,f=-0.33) USER MOD Single : A 68 MET CE :methyl -122:sc= -0.315 (180deg=-1.59!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.199 K(o=-0.2,f=-0.88) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot -78:sc= -2 USER MOD Single : A 101 TYR OH : rot 166:sc= -2.65 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -0.198 K(o=-0.2,f=-2.5!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 153:sc= 0.167 USER MOD Single : A 120 THR OG1 : rot -84:sc= -2.02! USER MOD Single : A 121 LYS NZ :NH3+ -152:sc= 0.00112 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= -0.0495 X(o=-0.049,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.709 X(o=-0.71,f=-0.71) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -0.243 K(o=-0.24,f=-3!) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.0587 USER MOD Single : A 139 THR OG1 : rot -149:sc= -5.2! USER MOD Single : A 145 ASN : amide:sc= -6.12! C(o=-6.1!,f=-7!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 113:sc= 0.964 USER MOD Single : A 151 LYS NZ :NH3+ 155:sc= -0.0115 (180deg=-0.221) USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 156 ASN : amide:sc= -0.0828 X(o=-0.083,f=-0.48) USER MOD Single : A 157 GLN : amide:sc= -0.206 K(o=-0.21,f=-2.7!) USER MOD Single : A 160 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 162 MET CE :methyl -139:sc= -13.4! (180deg=-25.1!) USER MOD Single : A 163 THR OG1 : rot 67:sc= 0.403 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 HIS : no HD1:sc= -2.8! K(o=-2.8!,f=-1.9) USER MOD Single : A 170 SER OG : rot 180:sc= -1.13 USER MOD Single : A 172 LYS NZ :NH3+ -132:sc= -2.63! (180deg=-4.18!) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 178 SER OG : rot -36:sc= -1.75! USER MOD Single : A 184 GLN : amide:sc= -2.06! C(o=-2.1!,f=-5.6!) USER MOD Single : A 185 MET CE :methyl -167:sc= -2.82 (180deg=-3.12) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 20 20.633 14.507 2.118 1.00 0.85 N ATOM 2 CA LEU A 20 19.432 13.870 1.509 1.00 0.79 C ATOM 3 C LEU A 20 19.867 12.706 0.615 1.00 0.66 C ATOM 4 O LEU A 20 19.866 12.808 -0.596 1.00 1.44 O ATOM 5 CB LEU A 20 18.676 14.902 0.668 1.00 0.94 C ATOM 6 CG LEU A 20 17.170 14.708 0.854 1.00 0.91 C ATOM 7 CD1 LEU A 20 16.707 15.469 2.097 1.00 0.60 C ATOM 8 CD2 LEU A 20 16.433 15.245 -0.375 1.00 1.34 C ATOM 0 HA LEU A 20 18.781 13.497 2.300 1.00 0.79 H new ATOM 0 HB2 LEU A 20 18.963 15.910 0.966 1.00 0.94 H new ATOM 0 HB3 LEU A 20 18.940 14.793 -0.384 1.00 0.94 H new ATOM 0 HG LEU A 20 16.952 13.647 0.976 1.00 0.91 H new ATOM 0 HD11 LEU A 20 15.634 15.331 2.230 1.00 0.60 H new ATOM 0 HD12 LEU A 20 17.233 15.089 2.973 1.00 0.60 H new ATOM 0 HD13 LEU A 20 16.924 16.530 1.976 1.00 0.60 H new ATOM 0 HD21 LEU A 20 15.360 15.108 -0.244 1.00 1.34 H new ATOM 0 HD22 LEU A 20 16.651 16.306 -0.495 1.00 1.34 H new ATOM 0 HD23 LEU A 20 16.763 14.704 -1.262 1.00 1.34 H new ATOM 20 N THR A 21 20.238 11.602 1.200 1.00 0.31 N ATOM 21 CA THR A 21 20.672 10.436 0.377 1.00 0.49 C ATOM 22 C THR A 21 19.457 9.815 -0.314 1.00 0.56 C ATOM 23 O THR A 21 18.327 10.180 -0.054 1.00 0.51 O ATOM 24 CB THR A 21 21.339 9.392 1.278 1.00 0.62 C ATOM 25 OG1 THR A 21 21.489 8.176 0.560 1.00 0.74 O ATOM 26 CG2 THR A 21 20.476 9.150 2.517 1.00 0.67 C ATOM 0 H THR A 21 20.260 11.455 2.209 1.00 0.31 H new ATOM 0 HA THR A 21 21.384 10.771 -0.377 1.00 0.49 H new ATOM 0 HB THR A 21 22.318 9.757 1.588 1.00 0.62 H new ATOM 0 HG1 THR A 21 20.694 7.619 0.691 1.00 0.74 H new ATOM 0 HG21 THR A 21 20.955 8.407 3.154 1.00 0.67 H new ATOM 0 HG22 THR A 21 20.363 10.083 3.069 1.00 0.67 H new ATOM 0 HG23 THR A 21 19.494 8.788 2.212 1.00 0.67 H new ATOM 34 N SER A 22 19.679 8.880 -1.197 1.00 0.68 N ATOM 35 CA SER A 22 18.541 8.235 -1.912 1.00 0.76 C ATOM 36 C SER A 22 17.529 7.697 -0.896 1.00 0.71 C ATOM 37 O SER A 22 16.343 7.939 -1.001 1.00 0.67 O ATOM 38 CB SER A 22 19.068 7.082 -2.766 1.00 0.94 C ATOM 39 OG SER A 22 20.164 7.541 -3.545 1.00 1.50 O ATOM 0 H SER A 22 20.603 8.534 -1.455 1.00 0.68 H new ATOM 0 HA SER A 22 18.052 8.971 -2.551 1.00 0.76 H new ATOM 0 HB2 SER A 22 19.380 6.255 -2.129 1.00 0.94 H new ATOM 0 HB3 SER A 22 18.278 6.704 -3.415 1.00 0.94 H new ATOM 0 HG SER A 22 20.507 6.805 -4.093 1.00 1.50 H new ATOM 45 N SER A 23 17.985 6.970 0.087 1.00 0.73 N ATOM 46 CA SER A 23 17.044 6.422 1.103 1.00 0.68 C ATOM 47 C SER A 23 16.244 7.567 1.725 1.00 0.56 C ATOM 48 O SER A 23 15.069 7.436 2.003 1.00 0.60 O ATOM 49 CB SER A 23 17.835 5.698 2.194 1.00 0.70 C ATOM 50 OG SER A 23 17.074 4.598 2.675 1.00 0.95 O ATOM 0 H SER A 23 18.967 6.732 0.230 1.00 0.73 H new ATOM 0 HA SER A 23 16.361 5.720 0.625 1.00 0.68 H new ATOM 0 HB2 SER A 23 18.789 5.349 1.797 1.00 0.70 H new ATOM 0 HB3 SER A 23 18.061 6.383 3.011 1.00 0.70 H new ATOM 0 HG SER A 23 17.579 4.131 3.373 1.00 0.95 H new ATOM 56 N GLU A 24 16.868 8.693 1.940 1.00 0.42 N ATOM 57 CA GLU A 24 16.134 9.845 2.534 1.00 0.33 C ATOM 58 C GLU A 24 14.993 10.243 1.600 1.00 0.38 C ATOM 59 O GLU A 24 13.919 10.609 2.034 1.00 0.37 O ATOM 60 CB GLU A 24 17.086 11.029 2.708 1.00 0.28 C ATOM 61 CG GLU A 24 16.464 12.040 3.671 1.00 0.77 C ATOM 62 CD GLU A 24 17.101 11.889 5.053 1.00 0.49 C ATOM 63 OE1 GLU A 24 17.515 10.788 5.377 1.00 1.75 O ATOM 64 OE2 GLU A 24 17.165 12.878 5.765 1.00 1.14 O ATOM 0 H GLU A 24 17.851 8.864 1.731 1.00 0.42 H new ATOM 0 HA GLU A 24 15.734 9.561 3.507 1.00 0.33 H new ATOM 0 HB2 GLU A 24 18.046 10.685 3.094 1.00 0.28 H new ATOM 0 HB3 GLU A 24 17.280 11.499 1.744 1.00 0.28 H new ATOM 0 HG2 GLU A 24 16.615 13.053 3.298 1.00 0.77 H new ATOM 0 HG3 GLU A 24 15.388 11.881 3.736 1.00 0.77 H new ATOM 71 N ARG A 25 15.218 10.168 0.317 1.00 0.44 N ATOM 72 CA ARG A 25 14.147 10.535 -0.649 1.00 0.51 C ATOM 73 C ARG A 25 13.062 9.457 -0.629 1.00 0.55 C ATOM 74 O ARG A 25 11.911 9.720 -0.906 1.00 0.58 O ATOM 75 CB ARG A 25 14.739 10.635 -2.056 1.00 0.60 C ATOM 76 CG ARG A 25 15.380 12.012 -2.244 1.00 0.67 C ATOM 77 CD ARG A 25 16.568 11.897 -3.200 1.00 1.68 C ATOM 78 NE ARG A 25 16.488 12.978 -4.221 1.00 1.11 N ATOM 79 CZ ARG A 25 17.573 13.595 -4.603 1.00 1.98 C ATOM 80 NH1 ARG A 25 18.235 14.332 -3.754 1.00 2.89 N ATOM 81 NH2 ARG A 25 17.996 13.474 -5.830 1.00 2.41 N ATOM 0 H ARG A 25 16.098 9.868 -0.103 1.00 0.44 H new ATOM 0 HA ARG A 25 13.716 11.496 -0.369 1.00 0.51 H new ATOM 0 HB2 ARG A 25 15.483 9.852 -2.205 1.00 0.60 H new ATOM 0 HB3 ARG A 25 13.959 10.480 -2.802 1.00 0.60 H new ATOM 0 HG2 ARG A 25 14.647 12.715 -2.641 1.00 0.67 H new ATOM 0 HG3 ARG A 25 15.710 12.405 -1.283 1.00 0.67 H new ATOM 0 HD2 ARG A 25 17.504 11.974 -2.646 1.00 1.68 H new ATOM 0 HD3 ARG A 25 16.564 10.921 -3.686 1.00 1.68 H new ATOM 0 HE ARG A 25 15.586 13.236 -4.622 1.00 1.11 H new ATOM 0 HH11 ARG A 25 17.905 14.425 -2.794 1.00 2.89 H new ATOM 0 HH12 ARG A 25 19.083 14.815 -4.051 1.00 2.89 H new ATOM 0 HH21 ARG A 25 17.479 12.897 -6.493 1.00 2.41 H new ATOM 0 HH22 ARG A 25 18.844 13.957 -6.127 1.00 2.41 H new ATOM 95 N ILE A 26 13.420 8.245 -0.297 1.00 0.58 N ATOM 96 CA ILE A 26 12.405 7.153 -0.250 1.00 0.64 C ATOM 97 C ILE A 26 11.423 7.439 0.892 1.00 0.51 C ATOM 98 O ILE A 26 10.225 7.487 0.700 1.00 0.32 O ATOM 99 CB ILE A 26 13.113 5.812 -0.002 1.00 0.75 C ATOM 100 CG1 ILE A 26 13.997 5.460 -1.220 1.00 1.05 C ATOM 101 CG2 ILE A 26 12.078 4.704 0.250 1.00 0.60 C ATOM 102 CD1 ILE A 26 13.168 4.826 -2.352 1.00 0.23 C ATOM 0 H ILE A 26 14.371 7.964 -0.057 1.00 0.58 H new ATOM 0 HA ILE A 26 11.864 7.103 -1.195 1.00 0.64 H new ATOM 0 HB ILE A 26 13.745 5.897 0.882 1.00 0.75 H new ATOM 0 HG12 ILE A 26 14.488 6.361 -1.587 1.00 1.05 H new ATOM 0 HG13 ILE A 26 14.784 4.771 -0.913 1.00 1.05 H new ATOM 0 HG21 ILE A 26 12.592 3.759 0.424 1.00 0.60 H new ATOM 0 HG22 ILE A 26 11.479 4.958 1.124 1.00 0.60 H new ATOM 0 HG23 ILE A 26 11.428 4.609 -0.620 1.00 0.60 H new ATOM 0 HD11 ILE A 26 13.820 4.591 -3.193 1.00 0.23 H new ATOM 0 HD12 ILE A 26 12.698 3.911 -1.990 1.00 0.23 H new ATOM 0 HD13 ILE A 26 12.398 5.526 -2.675 1.00 0.23 H new ATOM 114 N ASP A 27 11.928 7.625 2.082 1.00 0.64 N ATOM 115 CA ASP A 27 11.040 7.904 3.249 1.00 0.54 C ATOM 116 C ASP A 27 10.162 9.127 2.962 1.00 0.50 C ATOM 117 O ASP A 27 8.990 9.147 3.280 1.00 0.45 O ATOM 118 CB ASP A 27 11.908 8.179 4.483 1.00 0.57 C ATOM 119 CG ASP A 27 11.015 8.523 5.676 1.00 0.57 C ATOM 120 OD1 ASP A 27 10.646 9.679 5.802 1.00 0.50 O ATOM 121 OD2 ASP A 27 10.715 7.625 6.446 1.00 1.41 O ATOM 0 H ASP A 27 12.924 7.596 2.298 1.00 0.64 H new ATOM 0 HA ASP A 27 10.398 7.041 3.428 1.00 0.54 H new ATOM 0 HB2 ASP A 27 12.517 7.305 4.713 1.00 0.57 H new ATOM 0 HB3 ASP A 27 12.594 9.002 4.281 1.00 0.57 H new ATOM 126 N LYS A 28 10.720 10.152 2.380 1.00 0.57 N ATOM 127 CA LYS A 28 9.920 11.379 2.095 1.00 0.57 C ATOM 128 C LYS A 28 8.812 11.077 1.084 1.00 0.50 C ATOM 129 O LYS A 28 7.719 11.598 1.179 1.00 0.54 O ATOM 130 CB LYS A 28 10.841 12.462 1.526 1.00 0.68 C ATOM 131 CG LYS A 28 10.116 13.811 1.532 1.00 0.18 C ATOM 132 CD LYS A 28 9.656 14.137 2.954 1.00 1.81 C ATOM 133 CE LYS A 28 9.362 15.634 3.069 1.00 2.07 C ATOM 134 NZ LYS A 28 8.075 15.837 3.793 1.00 3.33 N ATOM 0 H LYS A 28 11.697 10.194 2.089 1.00 0.57 H new ATOM 0 HA LYS A 28 9.464 11.724 3.023 1.00 0.57 H new ATOM 0 HB2 LYS A 28 11.753 12.526 2.119 1.00 0.68 H new ATOM 0 HB3 LYS A 28 11.139 12.203 0.510 1.00 0.68 H new ATOM 0 HG2 LYS A 28 10.779 14.594 1.165 1.00 0.18 H new ATOM 0 HG3 LYS A 28 9.259 13.778 0.860 1.00 0.18 H new ATOM 0 HD2 LYS A 28 8.764 13.561 3.199 1.00 1.81 H new ATOM 0 HD3 LYS A 28 10.426 13.852 3.670 1.00 1.81 H new ATOM 0 HE2 LYS A 28 10.172 16.134 3.600 1.00 2.07 H new ATOM 0 HE3 LYS A 28 9.307 16.081 2.077 1.00 2.07 H new ATOM 0 HZ1 LYS A 28 7.894 16.855 3.900 1.00 3.33 H new ATOM 0 HZ2 LYS A 28 7.300 15.402 3.252 1.00 3.33 H new ATOM 0 HZ3 LYS A 28 8.132 15.395 4.733 1.00 3.33 H new ATOM 148 N GLN A 29 9.083 10.252 0.114 1.00 0.40 N ATOM 149 CA GLN A 29 8.038 9.940 -0.902 1.00 0.33 C ATOM 150 C GLN A 29 6.916 9.121 -0.258 1.00 0.36 C ATOM 151 O GLN A 29 5.776 9.195 -0.672 1.00 0.40 O ATOM 152 CB GLN A 29 8.664 9.150 -2.054 1.00 0.24 C ATOM 153 CG GLN A 29 9.866 9.918 -2.606 1.00 1.12 C ATOM 154 CD GLN A 29 9.482 10.602 -3.920 1.00 0.62 C ATOM 155 OE1 GLN A 29 8.348 10.528 -4.349 1.00 0.50 O ATOM 156 NE2 GLN A 29 10.386 11.272 -4.580 1.00 1.32 N ATOM 0 H GLN A 29 9.978 9.781 -0.021 1.00 0.40 H new ATOM 0 HA GLN A 29 7.621 10.870 -1.288 1.00 0.33 H new ATOM 0 HB2 GLN A 29 8.977 8.165 -1.706 1.00 0.24 H new ATOM 0 HB3 GLN A 29 7.928 8.991 -2.842 1.00 0.24 H new ATOM 0 HG2 GLN A 29 10.199 10.661 -1.882 1.00 1.12 H new ATOM 0 HG3 GLN A 29 10.701 9.237 -2.770 1.00 1.12 H new ATOM 0 HE21 GLN A 29 11.338 11.334 -4.220 1.00 1.32 H new ATOM 0 HE22 GLN A 29 10.140 11.733 -5.456 1.00 1.32 H new ATOM 165 N ILE A 30 7.212 8.350 0.759 1.00 0.37 N ATOM 166 CA ILE A 30 6.127 7.558 1.409 1.00 0.41 C ATOM 167 C ILE A 30 5.236 8.517 2.189 1.00 0.40 C ATOM 168 O ILE A 30 4.030 8.394 2.193 1.00 0.35 O ATOM 169 CB ILE A 30 6.700 6.522 2.376 1.00 0.44 C ATOM 170 CG1 ILE A 30 7.843 5.734 1.697 1.00 0.60 C ATOM 171 CG2 ILE A 30 5.577 5.585 2.824 1.00 0.43 C ATOM 172 CD1 ILE A 30 7.304 4.531 0.908 1.00 0.25 C ATOM 0 H ILE A 30 8.143 8.236 1.161 1.00 0.37 H new ATOM 0 HA ILE A 30 5.564 7.033 0.637 1.00 0.41 H new ATOM 0 HB ILE A 30 7.115 7.022 3.251 1.00 0.44 H new ATOM 0 HG12 ILE A 30 8.393 6.394 1.026 1.00 0.60 H new ATOM 0 HG13 ILE A 30 8.548 5.389 2.453 1.00 0.60 H new ATOM 0 HG21 ILE A 30 5.977 4.842 3.514 1.00 0.43 H new ATOM 0 HG22 ILE A 30 4.799 6.162 3.323 1.00 0.43 H new ATOM 0 HG23 ILE A 30 5.154 5.082 1.954 1.00 0.43 H new ATOM 0 HD11 ILE A 30 8.134 3.999 0.443 1.00 0.25 H new ATOM 0 HD12 ILE A 30 6.776 3.859 1.585 1.00 0.25 H new ATOM 0 HD13 ILE A 30 6.619 4.880 0.135 1.00 0.25 H new ATOM 184 N ARG A 31 5.823 9.486 2.844 1.00 0.45 N ATOM 185 CA ARG A 31 5.006 10.468 3.610 1.00 0.44 C ATOM 186 C ARG A 31 3.983 11.088 2.658 1.00 0.43 C ATOM 187 O ARG A 31 2.909 11.498 3.056 1.00 0.42 O ATOM 188 CB ARG A 31 5.915 11.562 4.177 1.00 0.50 C ATOM 189 CG ARG A 31 5.181 12.311 5.295 1.00 0.54 C ATOM 190 CD ARG A 31 5.801 13.698 5.476 1.00 0.74 C ATOM 191 NE ARG A 31 4.792 14.619 6.071 1.00 0.54 N ATOM 192 CZ ARG A 31 4.138 15.452 5.308 1.00 1.51 C ATOM 193 NH1 ARG A 31 3.751 15.080 4.117 1.00 2.86 N ATOM 194 NH2 ARG A 31 3.870 16.656 5.736 1.00 2.03 N ATOM 0 H ARG A 31 6.831 9.637 2.880 1.00 0.45 H new ATOM 0 HA ARG A 31 4.496 9.972 4.436 1.00 0.44 H new ATOM 0 HB2 ARG A 31 6.834 11.121 4.563 1.00 0.50 H new ATOM 0 HB3 ARG A 31 6.202 12.256 3.387 1.00 0.50 H new ATOM 0 HG2 ARG A 31 4.123 12.404 5.051 1.00 0.54 H new ATOM 0 HG3 ARG A 31 5.245 11.748 6.226 1.00 0.54 H new ATOM 0 HD2 ARG A 31 6.677 13.635 6.121 1.00 0.74 H new ATOM 0 HD3 ARG A 31 6.140 14.085 4.515 1.00 0.74 H new ATOM 0 HE ARG A 31 4.612 14.599 7.075 1.00 0.54 H new ATOM 0 HH11 ARG A 31 3.960 14.139 3.784 1.00 2.86 H new ATOM 0 HH12 ARG A 31 3.240 15.731 3.520 1.00 2.86 H new ATOM 0 HH21 ARG A 31 4.172 16.945 6.666 1.00 2.03 H new ATOM 0 HH22 ARG A 31 3.359 17.307 5.140 1.00 2.03 H new ATOM 208 N TYR A 32 4.305 11.132 1.393 1.00 0.46 N ATOM 209 CA TYR A 32 3.361 11.693 0.398 1.00 0.47 C ATOM 210 C TYR A 32 2.284 10.647 0.132 1.00 0.41 C ATOM 211 O TYR A 32 1.118 10.956 -0.013 1.00 0.42 O ATOM 212 CB TYR A 32 4.115 11.994 -0.899 1.00 0.51 C ATOM 213 CG TYR A 32 3.401 13.082 -1.660 1.00 0.37 C ATOM 214 CD1 TYR A 32 2.168 12.818 -2.266 1.00 1.16 C ATOM 215 CD2 TYR A 32 3.975 14.354 -1.765 1.00 0.89 C ATOM 216 CE1 TYR A 32 1.508 13.826 -2.977 1.00 1.41 C ATOM 217 CE2 TYR A 32 3.317 15.362 -2.475 1.00 0.63 C ATOM 218 CZ TYR A 32 2.082 15.100 -3.082 1.00 0.60 C ATOM 219 OH TYR A 32 1.432 16.095 -3.783 1.00 0.83 O ATOM 0 H TYR A 32 5.189 10.800 1.009 1.00 0.46 H new ATOM 0 HA TYR A 32 2.912 12.614 0.770 1.00 0.47 H new ATOM 0 HB2 TYR A 32 5.136 12.304 -0.674 1.00 0.51 H new ATOM 0 HB3 TYR A 32 4.182 11.094 -1.510 1.00 0.51 H new ATOM 0 HD1 TYR A 32 1.726 11.836 -2.185 1.00 1.16 H new ATOM 0 HD2 TYR A 32 4.927 14.557 -1.297 1.00 0.89 H new ATOM 0 HE1 TYR A 32 0.556 13.622 -3.445 1.00 1.41 H new ATOM 0 HE2 TYR A 32 3.761 16.343 -2.556 1.00 0.63 H new ATOM 0 HH TYR A 32 1.966 16.916 -3.757 1.00 0.83 H new ATOM 229 N ILE A 33 2.672 9.401 0.081 1.00 0.35 N ATOM 230 CA ILE A 33 1.678 8.324 -0.162 1.00 0.30 C ATOM 231 C ILE A 33 0.575 8.413 0.893 1.00 0.33 C ATOM 232 O ILE A 33 -0.592 8.288 0.594 1.00 0.34 O ATOM 233 CB ILE A 33 2.357 6.955 -0.068 1.00 0.25 C ATOM 234 CG1 ILE A 33 3.521 6.891 -1.058 1.00 0.32 C ATOM 235 CG2 ILE A 33 1.343 5.864 -0.413 1.00 0.14 C ATOM 236 CD1 ILE A 33 4.211 5.531 -0.946 1.00 0.45 C ATOM 0 H ILE A 33 3.635 9.086 0.197 1.00 0.35 H new ATOM 0 HA ILE A 33 1.252 8.445 -1.158 1.00 0.30 H new ATOM 0 HB ILE A 33 2.732 6.805 0.945 1.00 0.25 H new ATOM 0 HG12 ILE A 33 3.157 7.044 -2.074 1.00 0.32 H new ATOM 0 HG13 ILE A 33 4.233 7.690 -0.851 1.00 0.32 H new ATOM 0 HG21 ILE A 33 1.823 4.887 -0.347 1.00 0.14 H new ATOM 0 HG22 ILE A 33 0.510 5.907 0.288 1.00 0.14 H new ATOM 0 HG23 ILE A 33 0.973 6.019 -1.426 1.00 0.14 H new ATOM 0 HD11 ILE A 33 5.041 5.485 -1.651 1.00 0.45 H new ATOM 0 HD12 ILE A 33 4.589 5.397 0.068 1.00 0.45 H new ATOM 0 HD13 ILE A 33 3.496 4.740 -1.174 1.00 0.45 H new ATOM 248 N LEU A 34 0.945 8.635 2.127 1.00 0.34 N ATOM 249 CA LEU A 34 -0.072 8.738 3.214 1.00 0.38 C ATOM 250 C LEU A 34 -0.939 9.977 2.989 1.00 0.34 C ATOM 251 O LEU A 34 -2.150 9.918 3.064 1.00 0.30 O ATOM 252 CB LEU A 34 0.641 8.861 4.562 1.00 0.42 C ATOM 253 CG LEU A 34 0.481 7.561 5.348 1.00 0.51 C ATOM 254 CD1 LEU A 34 1.554 6.565 4.911 1.00 0.40 C ATOM 255 CD2 LEU A 34 0.634 7.849 6.844 1.00 0.67 C ATOM 0 H LEU A 34 1.912 8.750 2.430 1.00 0.34 H new ATOM 0 HA LEU A 34 -0.701 7.848 3.208 1.00 0.38 H new ATOM 0 HB2 LEU A 34 1.698 9.076 4.407 1.00 0.42 H new ATOM 0 HB3 LEU A 34 0.226 9.694 5.129 1.00 0.42 H new ATOM 0 HG LEU A 34 -0.506 7.140 5.156 1.00 0.51 H new ATOM 0 HD11 LEU A 34 1.440 5.637 5.472 1.00 0.40 H new ATOM 0 HD12 LEU A 34 1.448 6.360 3.846 1.00 0.40 H new ATOM 0 HD13 LEU A 34 2.541 6.986 5.103 1.00 0.40 H new ATOM 0 HD21 LEU A 34 0.520 6.922 7.406 1.00 0.67 H new ATOM 0 HD22 LEU A 34 1.621 8.270 7.034 1.00 0.67 H new ATOM 0 HD23 LEU A 34 -0.130 8.560 7.158 1.00 0.67 H new ATOM 267 N ASP A 35 -0.331 11.100 2.705 1.00 0.35 N ATOM 268 CA ASP A 35 -1.125 12.340 2.467 1.00 0.32 C ATOM 269 C ASP A 35 -2.192 12.044 1.417 1.00 0.32 C ATOM 270 O ASP A 35 -3.242 12.654 1.387 1.00 0.33 O ATOM 271 CB ASP A 35 -0.201 13.451 1.963 1.00 0.33 C ATOM 272 CG ASP A 35 -0.869 14.809 2.183 1.00 0.63 C ATOM 273 OD1 ASP A 35 -1.636 15.216 1.327 1.00 1.99 O ATOM 274 OD2 ASP A 35 -0.601 15.419 3.206 1.00 0.74 O ATOM 0 H ASP A 35 0.680 11.211 2.628 1.00 0.35 H new ATOM 0 HA ASP A 35 -1.597 12.664 3.394 1.00 0.32 H new ATOM 0 HB2 ASP A 35 0.752 13.413 2.490 1.00 0.33 H new ATOM 0 HB3 ASP A 35 0.014 13.307 0.904 1.00 0.33 H new ATOM 279 N GLY A 36 -1.929 11.093 0.566 1.00 0.35 N ATOM 280 CA GLY A 36 -2.921 10.729 -0.472 1.00 0.36 C ATOM 281 C GLY A 36 -4.001 9.854 0.164 1.00 0.32 C ATOM 282 O GLY A 36 -5.173 10.058 -0.045 1.00 0.29 O ATOM 0 H GLY A 36 -1.065 10.552 0.548 1.00 0.35 H new ATOM 0 HA2 GLY A 36 -3.366 11.627 -0.900 1.00 0.36 H new ATOM 0 HA3 GLY A 36 -2.435 10.195 -1.288 1.00 0.36 H new ATOM 286 N ILE A 37 -3.603 8.880 0.939 1.00 0.34 N ATOM 287 CA ILE A 37 -4.592 7.974 1.596 1.00 0.30 C ATOM 288 C ILE A 37 -5.596 8.777 2.419 1.00 0.22 C ATOM 289 O ILE A 37 -6.714 8.348 2.619 1.00 0.16 O ATOM 290 CB ILE A 37 -3.872 7.001 2.528 1.00 0.33 C ATOM 291 CG1 ILE A 37 -2.809 6.227 1.750 1.00 0.45 C ATOM 292 CG2 ILE A 37 -4.892 6.017 3.106 1.00 0.26 C ATOM 293 CD1 ILE A 37 -3.458 5.496 0.573 1.00 0.44 C ATOM 0 H ILE A 37 -2.627 8.671 1.147 1.00 0.34 H new ATOM 0 HA ILE A 37 -5.117 7.427 0.813 1.00 0.30 H new ATOM 0 HB ILE A 37 -3.392 7.557 3.333 1.00 0.33 H new ATOM 0 HG12 ILE A 37 -2.041 6.910 1.387 1.00 0.45 H new ATOM 0 HG13 ILE A 37 -2.314 5.511 2.406 1.00 0.45 H new ATOM 0 HG21 ILE A 37 -4.386 5.318 3.773 1.00 0.26 H new ATOM 0 HG22 ILE A 37 -5.651 6.566 3.663 1.00 0.26 H new ATOM 0 HG23 ILE A 37 -5.366 5.465 2.294 1.00 0.26 H new ATOM 0 HD11 ILE A 37 -2.696 4.946 0.022 1.00 0.44 H new ATOM 0 HD12 ILE A 37 -4.209 4.800 0.946 1.00 0.44 H new ATOM 0 HD13 ILE A 37 -3.932 6.221 -0.089 1.00 0.44 H new ATOM 305 N SER A 38 -5.229 9.937 2.891 1.00 0.26 N ATOM 306 CA SER A 38 -6.201 10.734 3.680 1.00 0.19 C ATOM 307 C SER A 38 -7.328 11.108 2.736 1.00 0.20 C ATOM 308 O SER A 38 -8.495 11.050 3.070 1.00 0.21 O ATOM 309 CB SER A 38 -5.527 11.997 4.219 1.00 0.21 C ATOM 310 OG SER A 38 -6.238 12.458 5.360 1.00 0.89 O ATOM 0 H SER A 38 -4.310 10.360 2.765 1.00 0.26 H new ATOM 0 HA SER A 38 -6.576 10.166 4.531 1.00 0.19 H new ATOM 0 HB2 SER A 38 -4.491 11.786 4.483 1.00 0.21 H new ATOM 0 HB3 SER A 38 -5.509 12.770 3.451 1.00 0.21 H new ATOM 0 HG SER A 38 -5.808 13.266 5.709 1.00 0.89 H new ATOM 316 N ALA A 39 -6.974 11.464 1.536 1.00 0.28 N ATOM 317 CA ALA A 39 -8.002 11.818 0.538 1.00 0.35 C ATOM 318 C ALA A 39 -8.590 10.533 -0.056 1.00 0.36 C ATOM 319 O ALA A 39 -9.635 10.552 -0.675 1.00 0.41 O ATOM 320 CB ALA A 39 -7.372 12.661 -0.572 1.00 0.45 C ATOM 0 H ALA A 39 -6.010 11.524 1.207 1.00 0.28 H new ATOM 0 HA ALA A 39 -8.794 12.394 1.016 1.00 0.35 H new ATOM 0 HB1 ALA A 39 -8.133 12.921 -1.308 1.00 0.45 H new ATOM 0 HB2 ALA A 39 -6.954 13.572 -0.144 1.00 0.45 H new ATOM 0 HB3 ALA A 39 -6.579 12.091 -1.056 1.00 0.45 H new ATOM 326 N LEU A 40 -7.935 9.413 0.131 1.00 0.32 N ATOM 327 CA LEU A 40 -8.476 8.142 -0.421 1.00 0.33 C ATOM 328 C LEU A 40 -9.219 7.371 0.672 1.00 0.26 C ATOM 329 O LEU A 40 -9.777 6.323 0.424 1.00 0.28 O ATOM 330 CB LEU A 40 -7.346 7.252 -0.962 1.00 0.34 C ATOM 331 CG LEU A 40 -6.502 7.998 -2.004 1.00 0.40 C ATOM 332 CD1 LEU A 40 -5.599 6.999 -2.730 1.00 0.49 C ATOM 333 CD2 LEU A 40 -7.407 8.688 -3.025 1.00 0.40 C ATOM 0 H LEU A 40 -7.055 9.329 0.639 1.00 0.32 H new ATOM 0 HA LEU A 40 -9.156 8.395 -1.234 1.00 0.33 H new ATOM 0 HB2 LEU A 40 -6.709 6.928 -0.139 1.00 0.34 H new ATOM 0 HB3 LEU A 40 -7.770 6.353 -1.410 1.00 0.34 H new ATOM 0 HG LEU A 40 -5.898 8.751 -1.497 1.00 0.40 H new ATOM 0 HD11 LEU A 40 -4.997 7.525 -3.472 1.00 0.49 H new ATOM 0 HD12 LEU A 40 -4.942 6.512 -2.009 1.00 0.49 H new ATOM 0 HD13 LEU A 40 -6.213 6.248 -3.227 1.00 0.49 H new ATOM 0 HD21 LEU A 40 -6.794 9.213 -3.758 1.00 0.40 H new ATOM 0 HD22 LEU A 40 -8.019 7.942 -3.532 1.00 0.40 H new ATOM 0 HD23 LEU A 40 -8.054 9.402 -2.514 1.00 0.40 H new ATOM 345 N ARG A 41 -9.235 7.869 1.879 1.00 0.18 N ATOM 346 CA ARG A 41 -9.950 7.143 2.964 1.00 0.14 C ATOM 347 C ARG A 41 -10.815 8.117 3.769 1.00 0.20 C ATOM 348 O ARG A 41 -11.452 7.737 4.729 1.00 0.20 O ATOM 349 CB ARG A 41 -8.938 6.476 3.894 1.00 0.11 C ATOM 350 CG ARG A 41 -9.662 5.435 4.748 1.00 0.12 C ATOM 351 CD ARG A 41 -8.636 4.590 5.506 1.00 0.36 C ATOM 352 NE ARG A 41 -8.788 4.820 6.970 1.00 0.18 N ATOM 353 CZ ARG A 41 -8.048 5.712 7.571 1.00 1.01 C ATOM 354 NH1 ARG A 41 -8.366 6.976 7.499 1.00 2.11 N ATOM 355 NH2 ARG A 41 -6.994 5.340 8.245 1.00 1.66 N ATOM 0 H ARG A 41 -8.787 8.742 2.158 1.00 0.18 H new ATOM 0 HA ARG A 41 -10.589 6.383 2.515 1.00 0.14 H new ATOM 0 HB2 ARG A 41 -8.147 6.003 3.313 1.00 0.11 H new ATOM 0 HB3 ARG A 41 -8.463 7.222 4.531 1.00 0.11 H new ATOM 0 HG2 ARG A 41 -10.332 5.929 5.451 1.00 0.12 H new ATOM 0 HG3 ARG A 41 -10.278 4.796 4.116 1.00 0.12 H new ATOM 0 HD2 ARG A 41 -8.778 3.534 5.276 1.00 0.36 H new ATOM 0 HD3 ARG A 41 -7.627 4.853 5.189 1.00 0.36 H new ATOM 0 HE ARG A 41 -9.470 4.281 7.503 1.00 0.18 H new ATOM 0 HH11 ARG A 41 -9.191 7.265 6.974 1.00 2.11 H new ATOM 0 HH12 ARG A 41 -7.789 7.675 7.968 1.00 2.11 H new ATOM 0 HH21 ARG A 41 -6.748 4.352 8.302 1.00 1.66 H new ATOM 0 HH22 ARG A 41 -6.416 6.038 8.714 1.00 1.66 H new ATOM 369 N LYS A 42 -10.857 9.365 3.389 1.00 0.25 N ATOM 370 CA LYS A 42 -11.692 10.334 4.135 1.00 0.33 C ATOM 371 C LYS A 42 -13.131 10.199 3.651 1.00 0.33 C ATOM 372 O LYS A 42 -14.066 10.192 4.426 1.00 0.36 O ATOM 373 CB LYS A 42 -11.191 11.752 3.852 1.00 0.38 C ATOM 374 CG LYS A 42 -12.077 12.766 4.579 1.00 0.52 C ATOM 375 CD LYS A 42 -11.200 13.835 5.234 1.00 0.77 C ATOM 376 CE LYS A 42 -11.742 15.224 4.892 1.00 1.42 C ATOM 377 NZ LYS A 42 -13.096 15.390 5.495 1.00 1.55 N ATOM 0 H LYS A 42 -10.348 9.750 2.594 1.00 0.25 H new ATOM 0 HA LYS A 42 -11.636 10.139 5.206 1.00 0.33 H new ATOM 0 HB2 LYS A 42 -10.157 11.855 4.182 1.00 0.38 H new ATOM 0 HB3 LYS A 42 -11.204 11.946 2.779 1.00 0.38 H new ATOM 0 HG2 LYS A 42 -12.769 13.229 3.876 1.00 0.52 H new ATOM 0 HG3 LYS A 42 -12.680 12.262 5.335 1.00 0.52 H new ATOM 0 HD2 LYS A 42 -11.185 13.695 6.315 1.00 0.77 H new ATOM 0 HD3 LYS A 42 -10.171 13.739 4.886 1.00 0.77 H new ATOM 0 HE2 LYS A 42 -11.067 15.993 5.269 1.00 1.42 H new ATOM 0 HE3 LYS A 42 -11.796 15.349 3.811 1.00 1.42 H new ATOM 0 HZ1 LYS A 42 -13.387 16.386 5.426 1.00 1.55 H new ATOM 0 HZ2 LYS A 42 -13.779 14.794 4.985 1.00 1.55 H new ATOM 0 HZ3 LYS A 42 -13.068 15.106 6.495 1.00 1.55 H new ATOM 391 N GLU A 43 -13.309 10.082 2.367 1.00 0.31 N ATOM 392 CA GLU A 43 -14.676 9.949 1.813 1.00 0.34 C ATOM 393 C GLU A 43 -15.075 8.476 1.780 1.00 0.34 C ATOM 394 O GLU A 43 -16.146 8.103 2.237 1.00 0.32 O ATOM 395 CB GLU A 43 -14.699 10.513 0.392 1.00 0.43 C ATOM 396 CG GLU A 43 -15.990 11.303 0.176 1.00 0.53 C ATOM 397 CD GLU A 43 -17.110 10.351 -0.253 1.00 1.23 C ATOM 398 OE1 GLU A 43 -16.944 9.154 -0.080 1.00 2.25 O ATOM 399 OE2 GLU A 43 -18.115 10.835 -0.749 1.00 1.47 O ATOM 0 H GLU A 43 -12.559 10.073 1.675 1.00 0.31 H new ATOM 0 HA GLU A 43 -15.378 10.499 2.440 1.00 0.34 H new ATOM 0 HB2 GLU A 43 -13.835 11.158 0.232 1.00 0.43 H new ATOM 0 HB3 GLU A 43 -14.631 9.702 -0.333 1.00 0.43 H new ATOM 0 HG2 GLU A 43 -16.270 11.819 1.094 1.00 0.53 H new ATOM 0 HG3 GLU A 43 -15.837 12.067 -0.586 1.00 0.53 H new ATOM 406 N THR A 44 -14.223 7.639 1.233 1.00 0.41 N ATOM 407 CA THR A 44 -14.542 6.185 1.140 1.00 0.49 C ATOM 408 C THR A 44 -14.202 5.454 2.448 1.00 0.48 C ATOM 409 O THR A 44 -13.697 4.349 2.445 1.00 0.55 O ATOM 410 CB THR A 44 -13.770 5.567 -0.037 1.00 0.66 C ATOM 411 OG1 THR A 44 -14.289 4.276 -0.327 1.00 0.91 O ATOM 412 CG2 THR A 44 -12.283 5.455 0.306 1.00 0.41 C ATOM 0 H THR A 44 -13.318 7.906 0.847 1.00 0.41 H new ATOM 0 HA THR A 44 -15.613 6.074 0.971 1.00 0.49 H new ATOM 0 HB THR A 44 -13.886 6.210 -0.909 1.00 0.66 H new ATOM 0 HG1 THR A 44 -14.251 3.720 0.479 1.00 0.91 H new ATOM 0 HG21 THR A 44 -11.748 5.016 -0.536 1.00 0.41 H new ATOM 0 HG22 THR A 44 -11.882 6.447 0.514 1.00 0.41 H new ATOM 0 HG23 THR A 44 -12.159 4.822 1.185 1.00 0.41 H new ATOM 420 N CYS A 45 -14.509 6.049 3.560 1.00 0.44 N ATOM 421 CA CYS A 45 -14.257 5.402 4.865 1.00 0.49 C ATOM 422 C CYS A 45 -15.032 6.184 5.909 1.00 0.48 C ATOM 423 O CYS A 45 -15.764 5.624 6.699 1.00 0.43 O ATOM 424 CB CYS A 45 -12.768 5.400 5.212 1.00 0.65 C ATOM 425 SG CYS A 45 -12.362 3.851 6.065 1.00 0.94 S ATOM 0 H CYS A 45 -14.932 6.975 3.618 1.00 0.44 H new ATOM 0 HA CYS A 45 -14.577 4.361 4.830 1.00 0.49 H new ATOM 0 HB2 CYS A 45 -12.170 5.499 4.306 1.00 0.65 H new ATOM 0 HB3 CYS A 45 -12.528 6.253 5.847 1.00 0.65 H new ATOM 430 N ASN A 46 -14.916 7.488 5.894 1.00 0.63 N ATOM 431 CA ASN A 46 -15.692 8.292 6.864 1.00 0.80 C ATOM 432 C ASN A 46 -17.167 8.076 6.552 1.00 0.77 C ATOM 433 O ASN A 46 -17.964 7.811 7.429 1.00 0.88 O ATOM 434 CB ASN A 46 -15.342 9.775 6.721 1.00 0.86 C ATOM 435 CG ASN A 46 -15.898 10.546 7.919 1.00 0.57 C ATOM 436 OD1 ASN A 46 -15.276 10.603 8.962 1.00 1.46 O ATOM 437 ND2 ASN A 46 -17.052 11.145 7.816 1.00 0.84 N ATOM 0 H ASN A 46 -14.322 8.019 5.257 1.00 0.63 H new ATOM 0 HA ASN A 46 -15.461 7.988 7.885 1.00 0.80 H new ATOM 0 HB2 ASN A 46 -14.261 9.901 6.664 1.00 0.86 H new ATOM 0 HB3 ASN A 46 -15.759 10.171 5.795 1.00 0.86 H new ATOM 0 HD21 ASN A 46 -17.432 11.661 8.610 1.00 0.84 H new ATOM 0 HD22 ASN A 46 -17.575 11.098 6.941 1.00 0.84 H new ATOM 444 N LYS A 47 -17.538 8.165 5.298 1.00 0.65 N ATOM 445 CA LYS A 47 -18.962 7.938 4.950 1.00 0.69 C ATOM 446 C LYS A 47 -19.170 6.470 4.582 1.00 0.63 C ATOM 447 O LYS A 47 -20.251 5.931 4.707 1.00 1.30 O ATOM 448 CB LYS A 47 -19.364 8.832 3.775 1.00 0.63 C ATOM 449 CG LYS A 47 -19.801 10.201 4.298 1.00 1.32 C ATOM 450 CD LYS A 47 -21.289 10.163 4.655 1.00 1.55 C ATOM 451 CE LYS A 47 -21.592 11.237 5.699 1.00 2.80 C ATOM 452 NZ LYS A 47 -21.133 12.562 5.198 1.00 3.10 N ATOM 0 H LYS A 47 -16.921 8.382 4.515 1.00 0.65 H new ATOM 0 HA LYS A 47 -19.585 8.186 5.809 1.00 0.69 H new ATOM 0 HB2 LYS A 47 -18.526 8.945 3.087 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -20.176 8.369 3.214 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -19.213 10.471 5.175 1.00 1.32 H new ATOM 0 HG3 LYS A 47 -19.617 10.966 3.543 1.00 1.32 H new ATOM 0 HD2 LYS A 47 -21.892 10.329 3.762 1.00 1.55 H new ATOM 0 HD3 LYS A 47 -21.556 9.180 5.042 1.00 1.55 H new ATOM 0 HE2 LYS A 47 -22.662 11.266 5.906 1.00 2.80 H new ATOM 0 HE3 LYS A 47 -21.092 10.998 6.637 1.00 2.80 H new ATOM 0 HZ1 LYS A 47 -21.596 13.318 5.742 1.00 3.10 H new ATOM 0 HZ2 LYS A 47 -20.102 12.637 5.309 1.00 3.10 H new ATOM 0 HZ3 LYS A 47 -21.381 12.658 4.193 1.00 3.10 H new ATOM 466 N SER A 48 -18.138 5.828 4.123 1.00 0.55 N ATOM 467 CA SER A 48 -18.258 4.394 3.735 1.00 0.40 C ATOM 468 C SER A 48 -18.466 3.540 4.986 1.00 0.64 C ATOM 469 O SER A 48 -17.538 3.226 5.699 1.00 1.74 O ATOM 470 CB SER A 48 -16.980 3.952 3.022 1.00 0.76 C ATOM 471 OG SER A 48 -17.219 2.721 2.352 1.00 1.11 O ATOM 0 H SER A 48 -17.211 6.234 3.998 1.00 0.55 H new ATOM 0 HA SER A 48 -19.110 4.269 3.067 1.00 0.40 H new ATOM 0 HB2 SER A 48 -16.666 4.713 2.308 1.00 0.76 H new ATOM 0 HB3 SER A 48 -16.169 3.837 3.742 1.00 0.76 H new ATOM 0 HG SER A 48 -16.402 2.435 1.892 1.00 1.11 H new ATOM 477 N ASN A 49 -19.683 3.152 5.253 1.00 0.39 N ATOM 478 CA ASN A 49 -19.968 2.315 6.455 1.00 0.26 C ATOM 479 C ASN A 49 -18.980 1.140 6.560 1.00 0.41 C ATOM 480 O ASN A 49 -18.825 0.555 7.613 1.00 0.81 O ATOM 481 CB ASN A 49 -21.393 1.770 6.362 1.00 0.38 C ATOM 482 CG ASN A 49 -22.385 2.934 6.351 1.00 0.54 C ATOM 483 OD1 ASN A 49 -23.229 3.021 5.483 1.00 1.54 O ATOM 484 ND2 ASN A 49 -22.315 3.843 7.287 1.00 1.60 N ATOM 0 H ASN A 49 -20.499 3.381 4.686 1.00 0.39 H new ATOM 0 HA ASN A 49 -19.858 2.937 7.343 1.00 0.26 H new ATOM 0 HB2 ASN A 49 -21.507 1.173 5.457 1.00 0.38 H new ATOM 0 HB3 ASN A 49 -21.598 1.112 7.206 1.00 0.38 H new ATOM 0 HD21 ASN A 49 -22.969 4.625 7.288 1.00 1.60 H new ATOM 0 HD22 ASN A 49 -21.606 3.770 8.017 1.00 1.60 H new ATOM 491 N MET A 50 -18.321 0.783 5.484 1.00 0.93 N ATOM 492 CA MET A 50 -17.355 -0.357 5.529 1.00 1.11 C ATOM 493 C MET A 50 -16.443 -0.235 6.755 1.00 0.74 C ATOM 494 O MET A 50 -16.182 -1.201 7.443 1.00 1.50 O ATOM 495 CB MET A 50 -16.498 -0.346 4.262 1.00 1.56 C ATOM 496 CG MET A 50 -17.273 -0.994 3.113 1.00 2.61 C ATOM 497 SD MET A 50 -17.423 -2.773 3.413 1.00 1.56 S ATOM 498 CE MET A 50 -19.114 -2.961 2.799 1.00 1.10 C ATOM 0 H MET A 50 -18.412 1.234 4.574 1.00 0.93 H new ATOM 0 HA MET A 50 -17.914 -1.290 5.593 1.00 1.11 H new ATOM 0 HB2 MET A 50 -16.230 0.678 4.001 1.00 1.56 H new ATOM 0 HB3 MET A 50 -15.567 -0.885 4.436 1.00 1.56 H new ATOM 0 HG2 MET A 50 -18.262 -0.544 3.028 1.00 2.61 H new ATOM 0 HG3 MET A 50 -16.760 -0.816 2.168 1.00 2.61 H new ATOM 0 HE1 MET A 50 -19.213 -3.923 2.296 1.00 1.10 H new ATOM 0 HE2 MET A 50 -19.812 -2.915 3.635 1.00 1.10 H new ATOM 0 HE3 MET A 50 -19.337 -2.159 2.096 1.00 1.10 H new ATOM 508 N CYS A 51 -15.959 0.944 7.036 1.00 0.80 N ATOM 509 CA CYS A 51 -15.073 1.117 8.218 1.00 1.08 C ATOM 510 C CYS A 51 -15.767 2.023 9.239 1.00 1.01 C ATOM 511 O CYS A 51 -16.741 2.683 8.930 1.00 1.13 O ATOM 512 CB CYS A 51 -13.739 1.740 7.770 1.00 1.53 C ATOM 513 SG CYS A 51 -13.997 3.437 7.187 1.00 0.74 S ATOM 0 H CYS A 51 -16.139 1.792 6.499 1.00 0.80 H new ATOM 0 HA CYS A 51 -14.873 0.150 8.679 1.00 1.08 H new ATOM 0 HB2 CYS A 51 -13.032 1.738 8.600 1.00 1.53 H new ATOM 0 HB3 CYS A 51 -13.299 1.139 6.975 1.00 1.53 H new ATOM 518 N GLU A 52 -15.275 2.071 10.449 1.00 2.34 N ATOM 519 CA GLU A 52 -15.904 2.944 11.482 1.00 2.43 C ATOM 520 C GLU A 52 -16.084 4.352 10.909 1.00 2.56 C ATOM 521 O GLU A 52 -17.121 4.968 11.056 1.00 1.95 O ATOM 522 CB GLU A 52 -14.994 3.009 12.711 1.00 3.60 C ATOM 523 CG GLU A 52 -15.846 3.016 13.981 1.00 4.04 C ATOM 524 CD GLU A 52 -15.136 2.216 15.074 1.00 5.27 C ATOM 525 OE1 GLU A 52 -14.269 2.778 15.724 1.00 5.89 O ATOM 526 OE2 GLU A 52 -15.469 1.054 15.243 1.00 5.86 O ATOM 0 H GLU A 52 -14.463 1.542 10.767 1.00 2.34 H new ATOM 0 HA GLU A 52 -16.874 2.537 11.767 1.00 2.43 H new ATOM 0 HB2 GLU A 52 -14.317 2.155 12.720 1.00 3.60 H new ATOM 0 HB3 GLU A 52 -14.376 3.906 12.671 1.00 3.60 H new ATOM 0 HG2 GLU A 52 -16.012 4.040 14.315 1.00 4.04 H new ATOM 0 HG3 GLU A 52 -16.826 2.584 13.777 1.00 4.04 H new ATOM 533 N SER A 53 -15.080 4.855 10.241 1.00 3.89 N ATOM 534 CA SER A 53 -15.182 6.215 9.637 1.00 4.87 C ATOM 535 C SER A 53 -13.793 6.665 9.176 1.00 6.64 C ATOM 536 O SER A 53 -13.568 6.928 8.013 1.00 7.21 O ATOM 537 CB SER A 53 -15.714 7.209 10.674 1.00 6.02 C ATOM 538 OG SER A 53 -17.118 7.353 10.510 1.00 5.38 O ATOM 0 H SER A 53 -14.190 4.380 10.087 1.00 3.89 H new ATOM 0 HA SER A 53 -15.865 6.181 8.788 1.00 4.87 H new ATOM 0 HB2 SER A 53 -15.488 6.857 11.681 1.00 6.02 H new ATOM 0 HB3 SER A 53 -15.222 8.174 10.555 1.00 6.02 H new ATOM 0 HG SER A 53 -17.524 6.471 10.379 1.00 5.38 H new ATOM 544 N SER A 54 -12.859 6.757 10.083 1.00 7.84 N ATOM 545 CA SER A 54 -11.487 7.192 9.698 1.00 9.76 C ATOM 546 C SER A 54 -10.594 7.219 10.939 1.00 10.67 C ATOM 547 O SER A 54 -10.466 8.230 11.602 1.00 11.33 O ATOM 548 CB SER A 54 -11.551 8.589 9.083 1.00 10.95 C ATOM 549 OG SER A 54 -11.571 8.477 7.665 1.00 11.35 O ATOM 0 H SER A 54 -12.987 6.550 11.073 1.00 7.84 H new ATOM 0 HA SER A 54 -11.074 6.494 8.970 1.00 9.76 H new ATOM 0 HB2 SER A 54 -12.442 9.112 9.431 1.00 10.95 H new ATOM 0 HB3 SER A 54 -10.691 9.179 9.401 1.00 10.95 H new ATOM 0 HG SER A 54 -12.404 8.045 7.383 1.00 11.35 H new ATOM 555 N LYS A 55 -9.979 6.115 11.260 1.00 10.78 N ATOM 556 CA LYS A 55 -9.096 6.073 12.460 1.00 11.71 C ATOM 557 C LYS A 55 -8.629 4.634 12.689 1.00 11.24 C ATOM 558 O LYS A 55 -7.455 4.329 12.603 1.00 12.01 O ATOM 559 CB LYS A 55 -9.875 6.556 13.687 1.00 11.97 C ATOM 560 CG LYS A 55 -9.148 7.742 14.327 1.00 13.54 C ATOM 561 CD LYS A 55 -10.031 8.992 14.254 1.00 13.69 C ATOM 562 CE LYS A 55 -9.286 10.101 13.509 1.00 15.46 C ATOM 563 NZ LYS A 55 -8.012 10.405 14.219 1.00 16.95 N ATOM 0 H LYS A 55 -10.050 5.239 10.743 1.00 10.78 H new ATOM 0 HA LYS A 55 -8.233 6.720 12.302 1.00 11.71 H new ATOM 0 HB2 LYS A 55 -10.884 6.849 13.397 1.00 11.97 H new ATOM 0 HB3 LYS A 55 -9.974 5.745 14.409 1.00 11.97 H new ATOM 0 HG2 LYS A 55 -8.908 7.515 15.366 1.00 13.54 H new ATOM 0 HG3 LYS A 55 -8.204 7.922 13.813 1.00 13.54 H new ATOM 0 HD2 LYS A 55 -10.966 8.761 13.743 1.00 13.69 H new ATOM 0 HD3 LYS A 55 -10.291 9.326 15.259 1.00 13.69 H new ATOM 0 HE2 LYS A 55 -9.079 9.791 12.485 1.00 15.46 H new ATOM 0 HE3 LYS A 55 -9.906 10.996 13.452 1.00 15.46 H new ATOM 0 HZ1 LYS A 55 -7.755 11.400 14.060 1.00 16.95 H new ATOM 0 HZ2 LYS A 55 -8.134 10.237 15.238 1.00 16.95 H new ATOM 0 HZ3 LYS A 55 -7.256 9.790 13.855 1.00 16.95 H new ATOM 577 N GLU A 56 -9.541 3.748 12.976 1.00 10.00 N ATOM 578 CA GLU A 56 -9.159 2.322 13.211 1.00 9.50 C ATOM 579 C GLU A 56 -10.067 1.420 12.390 1.00 8.20 C ATOM 580 O GLU A 56 -9.663 0.843 11.400 1.00 8.31 O ATOM 581 CB GLU A 56 -9.320 1.930 14.693 1.00 9.71 C ATOM 582 CG GLU A 56 -10.158 2.970 15.451 1.00 10.18 C ATOM 583 CD GLU A 56 -10.049 2.719 16.955 1.00 10.95 C ATOM 584 OE1 GLU A 56 -10.411 1.636 17.383 1.00 10.12 O ATOM 585 OE2 GLU A 56 -9.606 3.616 17.655 1.00 12.41 O ATOM 0 H GLU A 56 -10.538 3.948 13.059 1.00 10.00 H new ATOM 0 HA GLU A 56 -8.114 2.206 12.922 1.00 9.50 H new ATOM 0 HB2 GLU A 56 -9.797 0.952 14.764 1.00 9.71 H new ATOM 0 HB3 GLU A 56 -8.338 1.841 15.158 1.00 9.71 H new ATOM 0 HG2 GLU A 56 -9.810 3.975 15.214 1.00 10.18 H new ATOM 0 HG3 GLU A 56 -11.200 2.911 15.137 1.00 10.18 H new ATOM 592 N ALA A 57 -11.291 1.277 12.817 1.00 7.20 N ATOM 593 CA ALA A 57 -12.238 0.396 12.097 1.00 5.88 C ATOM 594 C ALA A 57 -11.815 -1.049 12.345 1.00 5.39 C ATOM 595 O ALA A 57 -10.888 -1.554 11.744 1.00 5.31 O ATOM 596 CB ALA A 57 -12.223 0.718 10.599 1.00 5.63 C ATOM 0 H ALA A 57 -11.674 1.739 13.642 1.00 7.20 H new ATOM 0 HA ALA A 57 -13.255 0.551 12.458 1.00 5.88 H new ATOM 0 HB1 ALA A 57 -12.923 0.064 10.079 1.00 5.63 H new ATOM 0 HB2 ALA A 57 -12.516 1.757 10.447 1.00 5.63 H new ATOM 0 HB3 ALA A 57 -11.219 0.562 10.203 1.00 5.63 H new ATOM 602 N LEU A 58 -12.476 -1.704 13.258 1.00 5.27 N ATOM 603 CA LEU A 58 -12.112 -3.107 13.597 1.00 4.85 C ATOM 604 C LEU A 58 -12.216 -3.996 12.358 1.00 3.91 C ATOM 605 O LEU A 58 -13.265 -4.518 12.039 1.00 3.28 O ATOM 606 CB LEU A 58 -13.069 -3.616 14.675 1.00 5.05 C ATOM 607 CG LEU A 58 -12.505 -3.285 16.057 1.00 6.53 C ATOM 608 CD1 LEU A 58 -13.574 -3.546 17.120 1.00 7.03 C ATOM 609 CD2 LEU A 58 -11.285 -4.166 16.333 1.00 7.18 C ATOM 0 H LEU A 58 -13.260 -1.323 13.788 1.00 5.27 H new ATOM 0 HA LEU A 58 -11.085 -3.138 13.961 1.00 4.85 H new ATOM 0 HB2 LEU A 58 -14.050 -3.157 14.552 1.00 5.05 H new ATOM 0 HB3 LEU A 58 -13.206 -4.693 14.575 1.00 5.05 H new ATOM 0 HG LEU A 58 -12.211 -2.236 16.088 1.00 6.53 H new ATOM 0 HD11 LEU A 58 -13.172 -3.310 18.105 1.00 7.03 H new ATOM 0 HD12 LEU A 58 -14.444 -2.919 16.923 1.00 7.03 H new ATOM 0 HD13 LEU A 58 -13.869 -4.595 17.090 1.00 7.03 H new ATOM 0 HD21 LEU A 58 -10.882 -3.931 17.318 1.00 7.18 H new ATOM 0 HD22 LEU A 58 -11.579 -5.215 16.302 1.00 7.18 H new ATOM 0 HD23 LEU A 58 -10.523 -3.980 15.576 1.00 7.18 H new ATOM 621 N ALA A 59 -11.125 -4.180 11.665 1.00 4.04 N ATOM 622 CA ALA A 59 -11.148 -5.045 10.450 1.00 3.14 C ATOM 623 C ALA A 59 -10.129 -6.174 10.617 1.00 3.54 C ATOM 624 O ALA A 59 -8.991 -6.060 10.206 1.00 3.79 O ATOM 625 CB ALA A 59 -10.787 -4.212 9.220 1.00 2.61 C ATOM 0 H ALA A 59 -10.218 -3.769 11.887 1.00 4.04 H new ATOM 0 HA ALA A 59 -12.145 -5.465 10.321 1.00 3.14 H new ATOM 0 HB1 ALA A 59 -10.804 -4.846 8.333 1.00 2.61 H new ATOM 0 HB2 ALA A 59 -11.509 -3.404 9.103 1.00 2.61 H new ATOM 0 HB3 ALA A 59 -9.789 -3.791 9.346 1.00 2.61 H new ATOM 631 N GLU A 60 -10.522 -7.259 11.225 1.00 3.84 N ATOM 632 CA GLU A 60 -9.570 -8.386 11.426 1.00 4.24 C ATOM 633 C GLU A 60 -9.996 -9.588 10.575 1.00 3.68 C ATOM 634 O GLU A 60 -9.689 -10.720 10.889 1.00 3.89 O ATOM 635 CB GLU A 60 -9.571 -8.781 12.902 1.00 5.22 C ATOM 636 CG GLU A 60 -8.180 -9.277 13.297 1.00 5.88 C ATOM 637 CD GLU A 60 -8.312 -10.389 14.339 1.00 6.39 C ATOM 638 OE1 GLU A 60 -9.305 -11.096 14.300 1.00 6.02 O ATOM 639 OE2 GLU A 60 -7.417 -10.514 15.158 1.00 7.25 O ATOM 0 H GLU A 60 -11.461 -7.413 11.591 1.00 3.84 H new ATOM 0 HA GLU A 60 -8.570 -8.075 11.125 1.00 4.24 H new ATOM 0 HB2 GLU A 60 -9.853 -7.927 13.518 1.00 5.22 H new ATOM 0 HB3 GLU A 60 -10.311 -9.561 13.080 1.00 5.22 H new ATOM 0 HG2 GLU A 60 -7.652 -9.648 12.419 1.00 5.88 H new ATOM 0 HG3 GLU A 60 -7.590 -8.454 13.700 1.00 5.88 H new ATOM 646 N ASN A 61 -10.694 -9.351 9.499 1.00 3.09 N ATOM 647 CA ASN A 61 -11.134 -10.481 8.628 1.00 2.88 C ATOM 648 C ASN A 61 -11.436 -9.948 7.228 1.00 1.42 C ATOM 649 O ASN A 61 -12.569 -9.665 6.893 1.00 2.17 O ATOM 650 CB ASN A 61 -12.397 -11.118 9.213 1.00 4.61 C ATOM 651 CG ASN A 61 -13.376 -10.021 9.636 1.00 4.96 C ATOM 652 OD1 ASN A 61 -13.198 -9.394 10.662 1.00 6.16 O ATOM 653 ND2 ASN A 61 -14.408 -9.759 8.882 1.00 4.47 N ATOM 0 H ASN A 61 -10.980 -8.424 9.184 1.00 3.09 H new ATOM 0 HA ASN A 61 -10.344 -11.230 8.574 1.00 2.88 H new ATOM 0 HB2 ASN A 61 -12.863 -11.770 8.475 1.00 4.61 H new ATOM 0 HB3 ASN A 61 -12.139 -11.740 10.070 1.00 4.61 H new ATOM 0 HD21 ASN A 61 -15.065 -9.028 9.153 1.00 4.47 H new ATOM 0 HD22 ASN A 61 -14.557 -10.285 8.021 1.00 4.47 H new ATOM 660 N ASN A 62 -10.430 -9.794 6.411 1.00 1.14 N ATOM 661 CA ASN A 62 -10.654 -9.262 5.043 1.00 1.78 C ATOM 662 C ASN A 62 -9.550 -9.787 4.124 1.00 1.16 C ATOM 663 O ASN A 62 -9.074 -10.892 4.289 1.00 1.22 O ATOM 664 CB ASN A 62 -10.595 -7.736 5.104 1.00 3.11 C ATOM 665 CG ASN A 62 -11.532 -7.228 6.201 1.00 3.61 C ATOM 666 OD1 ASN A 62 -12.716 -7.073 5.981 1.00 4.35 O ATOM 667 ND2 ASN A 62 -11.048 -6.963 7.384 1.00 3.35 N ATOM 0 H ASN A 62 -9.460 -10.015 6.636 1.00 1.14 H new ATOM 0 HA ASN A 62 -11.624 -9.578 4.659 1.00 1.78 H new ATOM 0 HB2 ASN A 62 -9.574 -7.409 5.304 1.00 3.11 H new ATOM 0 HB3 ASN A 62 -10.882 -7.312 4.142 1.00 3.11 H new ATOM 0 HD21 ASN A 62 -11.664 -6.626 8.123 1.00 3.35 H new ATOM 0 HD22 ASN A 62 -10.053 -7.093 7.569 1.00 3.35 H new ATOM 674 N LEU A 63 -9.129 -9.004 3.167 1.00 0.83 N ATOM 675 CA LEU A 63 -8.047 -9.451 2.260 1.00 0.40 C ATOM 676 C LEU A 63 -6.821 -9.800 3.095 1.00 1.04 C ATOM 677 O LEU A 63 -6.895 -9.897 4.305 1.00 1.52 O ATOM 678 CB LEU A 63 -7.700 -8.308 1.321 1.00 0.37 C ATOM 679 CG LEU A 63 -8.433 -8.495 0.002 1.00 1.32 C ATOM 680 CD1 LEU A 63 -8.101 -7.324 -0.919 1.00 1.70 C ATOM 681 CD2 LEU A 63 -7.982 -9.807 -0.645 1.00 2.06 C ATOM 0 H LEU A 63 -9.494 -8.070 2.978 1.00 0.83 H new ATOM 0 HA LEU A 63 -8.366 -10.322 1.687 1.00 0.40 H new ATOM 0 HB2 LEU A 63 -7.978 -7.356 1.772 1.00 0.37 H new ATOM 0 HB3 LEU A 63 -6.624 -8.278 1.150 1.00 0.37 H new ATOM 0 HG LEU A 63 -9.509 -8.531 0.174 1.00 1.32 H new ATOM 0 HD11 LEU A 63 -8.622 -7.449 -1.868 1.00 1.70 H new ATOM 0 HD12 LEU A 63 -8.418 -6.392 -0.451 1.00 1.70 H new ATOM 0 HD13 LEU A 63 -7.026 -7.294 -1.096 1.00 1.70 H new ATOM 0 HD21 LEU A 63 -8.505 -9.945 -1.591 1.00 2.06 H new ATOM 0 HD22 LEU A 63 -6.908 -9.773 -0.826 1.00 2.06 H new ATOM 0 HD23 LEU A 63 -8.211 -10.639 0.021 1.00 2.06 H new ATOM 693 N ASN A 64 -5.688 -9.982 2.478 1.00 1.40 N ATOM 694 CA ASN A 64 -4.488 -10.314 3.285 1.00 2.22 C ATOM 695 C ASN A 64 -3.241 -9.705 2.653 1.00 2.01 C ATOM 696 O ASN A 64 -2.221 -10.350 2.513 1.00 2.50 O ATOM 697 CB ASN A 64 -4.336 -11.831 3.369 1.00 3.13 C ATOM 698 CG ASN A 64 -4.488 -12.434 1.971 1.00 2.00 C ATOM 699 OD1 ASN A 64 -5.590 -12.651 1.507 1.00 1.30 O ATOM 700 ND2 ASN A 64 -3.421 -12.713 1.276 1.00 2.72 N ATOM 0 H ASN A 64 -5.544 -9.917 1.470 1.00 1.40 H new ATOM 0 HA ASN A 64 -4.608 -9.903 4.287 1.00 2.22 H new ATOM 0 HB2 ASN A 64 -3.361 -12.088 3.784 1.00 3.13 H new ATOM 0 HB3 ASN A 64 -5.088 -12.246 4.040 1.00 3.13 H new ATOM 0 HD21 ASN A 64 -3.511 -13.114 0.342 1.00 2.72 H new ATOM 0 HD22 ASN A 64 -2.496 -12.531 1.666 1.00 2.72 H new ATOM 707 N LEU A 65 -3.313 -8.464 2.280 1.00 1.35 N ATOM 708 CA LEU A 65 -2.134 -7.803 1.667 1.00 1.10 C ATOM 709 C LEU A 65 -1.202 -7.146 2.723 1.00 1.36 C ATOM 710 O LEU A 65 -0.031 -6.982 2.443 1.00 1.11 O ATOM 711 CB LEU A 65 -2.603 -6.748 0.656 1.00 0.43 C ATOM 712 CG LEU A 65 -3.299 -5.591 1.374 1.00 0.54 C ATOM 713 CD1 LEU A 65 -3.049 -4.295 0.603 1.00 0.99 C ATOM 714 CD2 LEU A 65 -4.806 -5.854 1.434 1.00 0.33 C ATOM 0 H LEU A 65 -4.141 -7.875 2.373 1.00 1.35 H new ATOM 0 HA LEU A 65 -1.553 -8.575 1.163 1.00 1.10 H new ATOM 0 HB2 LEU A 65 -1.750 -6.373 0.091 1.00 0.43 H new ATOM 0 HB3 LEU A 65 -3.286 -7.202 -0.062 1.00 0.43 H new ATOM 0 HG LEU A 65 -2.903 -5.504 2.386 1.00 0.54 H new ATOM 0 HD11 LEU A 65 -3.544 -3.468 1.112 1.00 0.99 H new ATOM 0 HD12 LEU A 65 -1.977 -4.102 0.554 1.00 0.99 H new ATOM 0 HD13 LEU A 65 -3.447 -4.390 -0.407 1.00 0.99 H new ATOM 0 HD21 LEU A 65 -5.299 -5.028 1.946 1.00 0.33 H new ATOM 0 HD22 LEU A 65 -5.201 -5.941 0.422 1.00 0.33 H new ATOM 0 HD23 LEU A 65 -4.992 -6.781 1.977 1.00 0.33 H new ATOM 726 N PRO A 66 -1.702 -6.770 3.900 1.00 2.42 N ATOM 727 CA PRO A 66 -0.845 -6.132 4.920 1.00 2.85 C ATOM 728 C PRO A 66 -0.042 -7.188 5.684 1.00 2.58 C ATOM 729 O PRO A 66 -0.498 -7.735 6.668 1.00 3.89 O ATOM 730 CB PRO A 66 -1.840 -5.437 5.852 1.00 4.31 C ATOM 731 CG PRO A 66 -3.189 -6.168 5.674 1.00 4.69 C ATOM 732 CD PRO A 66 -3.111 -6.930 4.340 1.00 3.47 C ATOM 0 HA PRO A 66 -0.117 -5.444 4.490 1.00 2.85 H new ATOM 0 HB2 PRO A 66 -1.504 -5.489 6.888 1.00 4.31 H new ATOM 0 HB3 PRO A 66 -1.935 -4.381 5.601 1.00 4.31 H new ATOM 0 HG2 PRO A 66 -3.368 -6.855 6.501 1.00 4.69 H new ATOM 0 HG3 PRO A 66 -4.015 -5.457 5.665 1.00 4.69 H new ATOM 0 HD2 PRO A 66 -3.370 -7.981 4.468 1.00 3.47 H new ATOM 0 HD3 PRO A 66 -3.805 -6.518 3.607 1.00 3.47 H new ATOM 740 N LYS A 67 1.150 -7.478 5.242 1.00 1.25 N ATOM 741 CA LYS A 67 1.974 -8.496 5.950 1.00 1.47 C ATOM 742 C LYS A 67 3.116 -7.799 6.692 1.00 1.26 C ATOM 743 O LYS A 67 4.096 -7.389 6.103 1.00 1.03 O ATOM 744 CB LYS A 67 2.552 -9.486 4.939 1.00 1.62 C ATOM 745 CG LYS A 67 2.799 -10.828 5.627 1.00 2.70 C ATOM 746 CD LYS A 67 3.494 -11.781 4.654 1.00 3.02 C ATOM 747 CE LYS A 67 4.612 -12.527 5.383 1.00 3.92 C ATOM 748 NZ LYS A 67 5.467 -13.235 4.390 1.00 4.54 N ATOM 0 H LYS A 67 1.588 -7.055 4.423 1.00 1.25 H new ATOM 0 HA LYS A 67 1.349 -9.034 6.663 1.00 1.47 H new ATOM 0 HB2 LYS A 67 1.863 -9.614 4.104 1.00 1.62 H new ATOM 0 HB3 LYS A 67 3.484 -9.099 4.527 1.00 1.62 H new ATOM 0 HG2 LYS A 67 3.415 -10.685 6.515 1.00 2.70 H new ATOM 0 HG3 LYS A 67 1.854 -11.257 5.960 1.00 2.70 H new ATOM 0 HD2 LYS A 67 2.774 -12.491 4.247 1.00 3.02 H new ATOM 0 HD3 LYS A 67 3.903 -11.223 3.812 1.00 3.02 H new ATOM 0 HE2 LYS A 67 5.213 -11.826 5.962 1.00 3.92 H new ATOM 0 HE3 LYS A 67 4.187 -13.242 6.088 1.00 3.92 H new ATOM 0 HZ1 LYS A 67 6.227 -13.742 4.886 1.00 4.54 H new ATOM 0 HZ2 LYS A 67 4.889 -13.914 3.856 1.00 4.54 H new ATOM 0 HZ3 LYS A 67 5.883 -12.543 3.734 1.00 4.54 H new ATOM 762 N MET A 68 2.994 -7.664 7.982 1.00 1.45 N ATOM 763 CA MET A 68 4.067 -6.996 8.771 1.00 1.28 C ATOM 764 C MET A 68 4.060 -7.543 10.198 1.00 1.33 C ATOM 765 O MET A 68 3.018 -7.810 10.764 1.00 1.68 O ATOM 766 CB MET A 68 3.813 -5.486 8.800 1.00 1.37 C ATOM 767 CG MET A 68 4.947 -4.764 8.072 1.00 0.93 C ATOM 768 SD MET A 68 5.071 -3.065 8.682 1.00 1.77 S ATOM 769 CE MET A 68 6.427 -2.540 7.606 1.00 0.64 C ATOM 0 H MET A 68 2.195 -7.988 8.527 1.00 1.45 H new ATOM 0 HA MET A 68 5.036 -7.191 8.311 1.00 1.28 H new ATOM 0 HB2 MET A 68 2.859 -5.258 8.325 1.00 1.37 H new ATOM 0 HB3 MET A 68 3.748 -5.137 9.831 1.00 1.37 H new ATOM 0 HG2 MET A 68 5.889 -5.289 8.233 1.00 0.93 H new ATOM 0 HG3 MET A 68 4.762 -4.763 6.998 1.00 0.93 H new ATOM 0 HE1 MET A 68 7.263 -2.197 8.215 1.00 0.64 H new ATOM 0 HE2 MET A 68 6.748 -3.380 6.989 1.00 0.64 H new ATOM 0 HE3 MET A 68 6.088 -1.727 6.964 1.00 0.64 H new ATOM 779 N ALA A 69 5.212 -7.718 10.785 1.00 1.03 N ATOM 780 CA ALA A 69 5.261 -8.252 12.174 1.00 1.19 C ATOM 781 C ALA A 69 6.720 -8.420 12.611 1.00 1.01 C ATOM 782 O ALA A 69 7.604 -7.741 12.126 1.00 0.97 O ATOM 783 CB ALA A 69 4.549 -9.607 12.215 1.00 1.33 C ATOM 0 H ALA A 69 6.119 -7.515 10.364 1.00 1.03 H new ATOM 0 HA ALA A 69 4.765 -7.558 12.852 1.00 1.19 H new ATOM 0 HB1 ALA A 69 4.581 -10.004 13.230 1.00 1.33 H new ATOM 0 HB2 ALA A 69 3.511 -9.482 11.907 1.00 1.33 H new ATOM 0 HB3 ALA A 69 5.048 -10.301 11.538 1.00 1.33 H new ATOM 789 N GLU A 70 6.980 -9.313 13.527 1.00 1.26 N ATOM 790 CA GLU A 70 8.380 -9.516 13.998 1.00 1.52 C ATOM 791 C GLU A 70 9.199 -10.219 12.913 1.00 1.29 C ATOM 792 O GLU A 70 10.413 -10.157 12.903 1.00 1.60 O ATOM 793 CB GLU A 70 8.365 -10.381 15.261 1.00 2.11 C ATOM 794 CG GLU A 70 7.693 -11.720 14.953 1.00 3.07 C ATOM 795 CD GLU A 70 6.827 -12.141 16.141 1.00 3.27 C ATOM 796 OE1 GLU A 70 7.360 -12.233 17.235 1.00 3.26 O ATOM 797 OE2 GLU A 70 5.644 -12.364 15.937 1.00 3.73 O ATOM 0 H GLU A 70 6.283 -9.911 13.970 1.00 1.26 H new ATOM 0 HA GLU A 70 8.831 -8.548 14.216 1.00 1.52 H new ATOM 0 HB2 GLU A 70 9.383 -10.545 15.614 1.00 2.11 H new ATOM 0 HB3 GLU A 70 7.829 -9.868 16.060 1.00 2.11 H new ATOM 0 HG2 GLU A 70 7.081 -11.634 14.055 1.00 3.07 H new ATOM 0 HG3 GLU A 70 8.448 -12.480 14.752 1.00 3.07 H new ATOM 804 N LYS A 71 8.550 -10.894 12.004 1.00 1.02 N ATOM 805 CA LYS A 71 9.300 -11.606 10.930 1.00 1.44 C ATOM 806 C LYS A 71 9.588 -10.656 9.762 1.00 1.44 C ATOM 807 O LYS A 71 10.407 -10.941 8.912 1.00 2.11 O ATOM 808 CB LYS A 71 8.467 -12.786 10.430 1.00 1.58 C ATOM 809 CG LYS A 71 9.367 -13.745 9.650 1.00 2.46 C ATOM 810 CD LYS A 71 8.643 -15.078 9.451 1.00 2.53 C ATOM 811 CE LYS A 71 7.505 -14.897 8.446 1.00 3.25 C ATOM 812 NZ LYS A 71 7.526 -16.020 7.467 1.00 4.17 N ATOM 0 H LYS A 71 7.535 -10.983 11.958 1.00 1.02 H new ATOM 0 HA LYS A 71 10.246 -11.964 11.336 1.00 1.44 H new ATOM 0 HB2 LYS A 71 8.007 -13.304 11.272 1.00 1.58 H new ATOM 0 HB3 LYS A 71 7.657 -12.430 9.793 1.00 1.58 H new ATOM 0 HG2 LYS A 71 9.626 -13.312 8.684 1.00 2.46 H new ATOM 0 HG3 LYS A 71 10.301 -13.903 10.189 1.00 2.46 H new ATOM 0 HD2 LYS A 71 9.342 -15.833 9.092 1.00 2.53 H new ATOM 0 HD3 LYS A 71 8.249 -15.435 10.402 1.00 2.53 H new ATOM 0 HE2 LYS A 71 6.547 -14.871 8.965 1.00 3.25 H new ATOM 0 HE3 LYS A 71 7.612 -13.945 7.926 1.00 3.25 H new ATOM 0 HZ1 LYS A 71 6.752 -15.898 6.783 1.00 4.17 H new ATOM 0 HZ2 LYS A 71 8.436 -16.025 6.964 1.00 4.17 H new ATOM 0 HZ3 LYS A 71 7.404 -16.922 7.970 1.00 4.17 H new ATOM 826 N ASP A 72 8.922 -9.534 9.706 1.00 0.87 N ATOM 827 CA ASP A 72 9.167 -8.582 8.585 1.00 1.24 C ATOM 828 C ASP A 72 10.602 -8.050 8.655 1.00 1.05 C ATOM 829 O ASP A 72 11.128 -7.538 7.688 1.00 1.64 O ATOM 830 CB ASP A 72 8.180 -7.414 8.683 1.00 1.56 C ATOM 831 CG ASP A 72 8.316 -6.523 7.447 1.00 2.58 C ATOM 832 OD1 ASP A 72 9.167 -5.649 7.460 1.00 3.78 O ATOM 833 OD2 ASP A 72 7.565 -6.728 6.507 1.00 2.46 O ATOM 0 H ASP A 72 8.222 -9.236 10.385 1.00 0.87 H new ATOM 0 HA ASP A 72 9.026 -9.100 7.637 1.00 1.24 H new ATOM 0 HB2 ASP A 72 7.161 -7.792 8.761 1.00 1.56 H new ATOM 0 HB3 ASP A 72 8.375 -6.834 9.585 1.00 1.56 H new ATOM 838 N GLY A 73 11.242 -8.171 9.787 1.00 1.04 N ATOM 839 CA GLY A 73 12.643 -7.673 9.898 1.00 1.65 C ATOM 840 C GLY A 73 12.662 -6.344 10.657 1.00 1.44 C ATOM 841 O GLY A 73 13.525 -6.099 11.474 1.00 1.91 O ATOM 0 H GLY A 73 10.858 -8.590 10.634 1.00 1.04 H new ATOM 0 HA2 GLY A 73 13.260 -8.407 10.416 1.00 1.65 H new ATOM 0 HA3 GLY A 73 13.072 -7.541 8.905 1.00 1.65 H new ATOM 845 N CYS A 74 11.718 -5.484 10.394 1.00 1.28 N ATOM 846 CA CYS A 74 11.685 -4.172 11.104 1.00 1.28 C ATOM 847 C CYS A 74 11.649 -4.413 12.617 1.00 2.00 C ATOM 848 O CYS A 74 12.172 -3.636 13.390 1.00 3.09 O ATOM 849 CB CYS A 74 10.444 -3.391 10.670 1.00 1.22 C ATOM 850 SG CYS A 74 10.921 -2.141 9.450 1.00 1.60 S ATOM 0 H CYS A 74 10.968 -5.631 9.719 1.00 1.28 H new ATOM 0 HA CYS A 74 12.576 -3.596 10.855 1.00 1.28 H new ATOM 0 HB2 CYS A 74 9.704 -4.069 10.243 1.00 1.22 H new ATOM 0 HB3 CYS A 74 9.979 -2.915 11.533 1.00 1.22 H new ATOM 855 N PHE A 75 11.044 -5.490 13.044 1.00 1.94 N ATOM 856 CA PHE A 75 10.985 -5.784 14.507 1.00 2.74 C ATOM 857 C PHE A 75 11.521 -7.193 14.761 1.00 3.91 C ATOM 858 O PHE A 75 11.024 -7.915 15.601 1.00 4.34 O ATOM 859 CB PHE A 75 9.540 -5.707 14.998 1.00 1.90 C ATOM 860 CG PHE A 75 8.890 -4.451 14.471 1.00 1.25 C ATOM 861 CD1 PHE A 75 8.398 -4.413 13.161 1.00 1.89 C ATOM 862 CD2 PHE A 75 8.776 -3.325 15.294 1.00 2.06 C ATOM 863 CE1 PHE A 75 7.793 -3.248 12.674 1.00 1.51 C ATOM 864 CE2 PHE A 75 8.172 -2.160 14.808 1.00 2.89 C ATOM 865 CZ PHE A 75 7.680 -2.121 13.498 1.00 2.10 C ATOM 0 H PHE A 75 10.589 -6.178 12.444 1.00 1.94 H new ATOM 0 HA PHE A 75 11.589 -5.051 15.042 1.00 2.74 H new ATOM 0 HB2 PHE A 75 8.985 -6.583 14.663 1.00 1.90 H new ATOM 0 HB3 PHE A 75 9.515 -5.711 16.088 1.00 1.90 H new ATOM 0 HD1 PHE A 75 8.485 -5.282 12.526 1.00 1.89 H new ATOM 0 HD2 PHE A 75 9.154 -3.355 16.305 1.00 2.06 H new ATOM 0 HE1 PHE A 75 7.414 -3.218 11.663 1.00 1.51 H new ATOM 0 HE2 PHE A 75 8.085 -1.291 15.443 1.00 2.89 H new ATOM 0 HZ PHE A 75 7.213 -1.222 13.123 1.00 2.10 H new ATOM 875 N GLN A 76 12.528 -7.589 14.038 1.00 5.17 N ATOM 876 CA GLN A 76 13.095 -8.951 14.230 1.00 6.47 C ATOM 877 C GLN A 76 14.029 -8.975 15.446 1.00 5.02 C ATOM 878 O GLN A 76 14.613 -9.996 15.745 1.00 5.45 O ATOM 879 CB GLN A 76 13.894 -9.337 12.983 1.00 8.76 C ATOM 880 CG GLN A 76 13.312 -10.608 12.363 1.00 10.61 C ATOM 881 CD GLN A 76 14.377 -11.706 12.360 1.00 12.48 C ATOM 882 OE1 GLN A 76 15.198 -11.773 13.253 1.00 12.40 O ATOM 883 NE2 GLN A 76 14.400 -12.574 11.387 1.00 14.29 N ATOM 0 H GLN A 76 12.985 -7.027 13.320 1.00 5.17 H new ATOM 0 HA GLN A 76 12.279 -9.655 14.394 1.00 6.47 H new ATOM 0 HB2 GLN A 76 13.868 -8.524 12.258 1.00 8.76 H new ATOM 0 HB3 GLN A 76 14.940 -9.496 13.246 1.00 8.76 H new ATOM 0 HG2 GLN A 76 12.439 -10.935 12.928 1.00 10.61 H new ATOM 0 HG3 GLN A 76 12.977 -10.409 11.345 1.00 10.61 H new ATOM 0 HE21 GLN A 76 13.711 -12.518 10.637 1.00 14.29 H new ATOM 0 HE22 GLN A 76 15.107 -13.309 11.376 1.00 14.29 H new ATOM 892 N SER A 77 14.184 -7.855 16.128 1.00 3.70 N ATOM 893 CA SER A 77 15.100 -7.774 17.317 1.00 3.12 C ATOM 894 C SER A 77 16.517 -7.495 16.810 1.00 3.45 C ATOM 895 O SER A 77 17.115 -6.488 17.134 1.00 4.52 O ATOM 896 CB SER A 77 15.073 -9.070 18.136 1.00 4.39 C ATOM 897 OG SER A 77 15.607 -8.819 19.428 1.00 4.86 O ATOM 0 H SER A 77 13.706 -6.982 15.905 1.00 3.70 H new ATOM 0 HA SER A 77 14.766 -6.972 17.975 1.00 3.12 H new ATOM 0 HB2 SER A 77 14.051 -9.441 18.218 1.00 4.39 H new ATOM 0 HB3 SER A 77 15.654 -9.844 17.634 1.00 4.39 H new ATOM 0 HG SER A 77 15.590 -9.645 19.955 1.00 4.86 H new ATOM 903 N GLY A 78 17.040 -8.354 15.977 1.00 3.32 N ATOM 904 CA GLY A 78 18.392 -8.113 15.403 1.00 3.61 C ATOM 905 C GLY A 78 18.198 -7.544 13.994 1.00 3.45 C ATOM 906 O GLY A 78 18.985 -7.776 13.098 1.00 4.35 O ATOM 0 H GLY A 78 16.587 -9.214 15.669 1.00 3.32 H new ATOM 0 HA2 GLY A 78 18.954 -7.416 16.024 1.00 3.61 H new ATOM 0 HA3 GLY A 78 18.964 -9.040 15.367 1.00 3.61 H new ATOM 910 N PHE A 79 17.127 -6.813 13.809 1.00 2.50 N ATOM 911 CA PHE A 79 16.795 -6.209 12.485 1.00 2.46 C ATOM 912 C PHE A 79 18.050 -5.668 11.789 1.00 2.08 C ATOM 913 O PHE A 79 18.769 -4.847 12.322 1.00 1.68 O ATOM 914 CB PHE A 79 15.794 -5.066 12.718 1.00 2.15 C ATOM 915 CG PHE A 79 15.538 -4.289 11.440 1.00 2.38 C ATOM 916 CD1 PHE A 79 15.666 -4.908 10.189 1.00 3.59 C ATOM 917 CD2 PHE A 79 15.173 -2.940 11.516 1.00 1.87 C ATOM 918 CE1 PHE A 79 15.432 -4.178 9.020 1.00 3.75 C ATOM 919 CE2 PHE A 79 14.937 -2.210 10.344 1.00 2.15 C ATOM 920 CZ PHE A 79 15.066 -2.829 9.097 1.00 2.82 C ATOM 0 H PHE A 79 16.451 -6.605 14.544 1.00 2.50 H new ATOM 0 HA PHE A 79 16.364 -6.974 11.839 1.00 2.46 H new ATOM 0 HB2 PHE A 79 14.855 -5.473 13.093 1.00 2.15 H new ATOM 0 HB3 PHE A 79 16.179 -4.393 13.484 1.00 2.15 H new ATOM 0 HD1 PHE A 79 15.946 -5.949 10.128 1.00 3.59 H new ATOM 0 HD2 PHE A 79 15.073 -2.461 12.479 1.00 1.87 H new ATOM 0 HE1 PHE A 79 15.534 -4.655 8.057 1.00 3.75 H new ATOM 0 HE2 PHE A 79 14.655 -1.169 10.404 1.00 2.15 H new ATOM 0 HZ PHE A 79 14.883 -2.267 8.193 1.00 2.82 H new ATOM 930 N ASN A 80 18.297 -6.115 10.586 1.00 2.59 N ATOM 931 CA ASN A 80 19.480 -5.624 9.833 1.00 2.59 C ATOM 932 C ASN A 80 19.123 -4.290 9.179 1.00 2.00 C ATOM 933 O ASN A 80 19.522 -3.242 9.641 1.00 2.40 O ATOM 934 CB ASN A 80 19.861 -6.644 8.757 1.00 3.51 C ATOM 935 CG ASN A 80 20.808 -7.687 9.355 1.00 3.80 C ATOM 936 OD1 ASN A 80 20.406 -8.492 10.171 1.00 2.95 O ATOM 937 ND2 ASN A 80 22.058 -7.707 8.981 1.00 5.16 N ATOM 0 H ASN A 80 17.726 -6.802 10.094 1.00 2.59 H new ATOM 0 HA ASN A 80 20.325 -5.490 10.508 1.00 2.59 H new ATOM 0 HB2 ASN A 80 18.966 -7.130 8.368 1.00 3.51 H new ATOM 0 HB3 ASN A 80 20.340 -6.141 7.917 1.00 3.51 H new ATOM 0 HD21 ASN A 80 22.697 -8.398 9.374 1.00 5.16 H new ATOM 0 HD22 ASN A 80 22.396 -7.031 8.296 1.00 5.16 H new ATOM 944 N GLU A 81 18.367 -4.327 8.110 1.00 1.20 N ATOM 945 CA GLU A 81 17.965 -3.068 7.412 1.00 0.58 C ATOM 946 C GLU A 81 17.409 -3.421 6.032 1.00 0.47 C ATOM 947 O GLU A 81 16.373 -2.932 5.612 1.00 0.48 O ATOM 948 CB GLU A 81 19.185 -2.158 7.232 1.00 0.82 C ATOM 949 CG GLU A 81 19.128 -1.020 8.251 1.00 1.26 C ATOM 950 CD GLU A 81 20.548 -0.645 8.690 1.00 1.15 C ATOM 951 OE1 GLU A 81 21.487 -1.156 8.101 1.00 0.81 O ATOM 952 OE2 GLU A 81 20.670 0.146 9.611 1.00 1.63 O ATOM 0 H GLU A 81 18.008 -5.183 7.688 1.00 1.20 H new ATOM 0 HA GLU A 81 17.211 -2.552 8.007 1.00 0.58 H new ATOM 0 HB2 GLU A 81 20.102 -2.732 7.363 1.00 0.82 H new ATOM 0 HB3 GLU A 81 19.204 -1.753 6.220 1.00 0.82 H new ATOM 0 HG2 GLU A 81 18.632 -0.153 7.815 1.00 1.26 H new ATOM 0 HG3 GLU A 81 18.538 -1.323 9.116 1.00 1.26 H new ATOM 959 N GLU A 82 18.105 -4.259 5.322 1.00 0.58 N ATOM 960 CA GLU A 82 17.663 -4.644 3.966 1.00 0.68 C ATOM 961 C GLU A 82 16.520 -5.662 4.031 1.00 0.49 C ATOM 962 O GLU A 82 15.933 -5.997 3.024 1.00 0.35 O ATOM 963 CB GLU A 82 18.850 -5.259 3.236 1.00 1.04 C ATOM 964 CG GLU A 82 19.459 -6.377 4.085 1.00 1.49 C ATOM 965 CD GLU A 82 19.874 -7.536 3.178 1.00 0.86 C ATOM 966 OE1 GLU A 82 20.552 -7.281 2.196 1.00 1.57 O ATOM 967 OE2 GLU A 82 19.507 -8.659 3.480 1.00 1.87 O ATOM 0 H GLU A 82 18.973 -4.697 5.632 1.00 0.58 H new ATOM 0 HA GLU A 82 17.300 -3.761 3.440 1.00 0.68 H new ATOM 0 HB2 GLU A 82 18.530 -5.655 2.272 1.00 1.04 H new ATOM 0 HB3 GLU A 82 19.600 -4.494 3.033 1.00 1.04 H new ATOM 0 HG2 GLU A 82 20.323 -6.002 4.633 1.00 1.49 H new ATOM 0 HG3 GLU A 82 18.737 -6.721 4.825 1.00 1.49 H new ATOM 974 N THR A 83 16.185 -6.156 5.193 1.00 0.51 N ATOM 975 CA THR A 83 15.072 -7.142 5.270 1.00 0.41 C ATOM 976 C THR A 83 13.749 -6.391 5.286 1.00 0.25 C ATOM 977 O THR A 83 12.802 -6.764 4.623 1.00 0.23 O ATOM 978 CB THR A 83 15.193 -7.979 6.543 1.00 0.52 C ATOM 979 OG1 THR A 83 16.429 -8.681 6.531 1.00 0.59 O ATOM 980 CG2 THR A 83 14.033 -8.975 6.598 1.00 0.51 C ATOM 0 H THR A 83 16.628 -5.922 6.081 1.00 0.51 H new ATOM 0 HA THR A 83 15.119 -7.805 4.406 1.00 0.41 H new ATOM 0 HB THR A 83 15.158 -7.330 7.418 1.00 0.52 H new ATOM 0 HG1 THR A 83 16.509 -9.217 7.348 1.00 0.59 H new ATOM 0 HG21 THR A 83 14.112 -9.576 7.504 1.00 0.51 H new ATOM 0 HG22 THR A 83 13.088 -8.432 6.604 1.00 0.51 H new ATOM 0 HG23 THR A 83 14.072 -9.627 5.725 1.00 0.51 H new ATOM 988 N CYS A 84 13.678 -5.328 6.034 1.00 0.17 N ATOM 989 CA CYS A 84 12.417 -4.554 6.079 1.00 0.11 C ATOM 990 C CYS A 84 12.262 -3.813 4.756 1.00 0.17 C ATOM 991 O CYS A 84 11.221 -3.844 4.135 1.00 0.12 O ATOM 992 CB CYS A 84 12.448 -3.554 7.239 1.00 0.28 C ATOM 993 SG CYS A 84 10.752 -3.086 7.672 1.00 0.78 S ATOM 0 H CYS A 84 14.436 -4.966 6.612 1.00 0.17 H new ATOM 0 HA CYS A 84 11.574 -5.228 6.233 1.00 0.11 H new ATOM 0 HB2 CYS A 84 12.947 -3.996 8.102 1.00 0.28 H new ATOM 0 HB3 CYS A 84 13.021 -2.670 6.957 1.00 0.28 H new ATOM 998 N LEU A 85 13.300 -3.157 4.308 1.00 0.30 N ATOM 999 CA LEU A 85 13.203 -2.427 3.014 1.00 0.38 C ATOM 1000 C LEU A 85 12.807 -3.409 1.908 1.00 0.34 C ATOM 1001 O LEU A 85 12.023 -3.088 1.035 1.00 0.34 O ATOM 1002 CB LEU A 85 14.556 -1.797 2.679 1.00 0.50 C ATOM 1003 CG LEU A 85 14.406 -0.898 1.451 1.00 0.45 C ATOM 1004 CD1 LEU A 85 13.442 0.244 1.773 1.00 0.62 C ATOM 1005 CD2 LEU A 85 15.771 -0.322 1.070 1.00 0.67 C ATOM 0 H LEU A 85 14.203 -3.096 4.779 1.00 0.30 H new ATOM 0 HA LEU A 85 12.450 -1.643 3.093 1.00 0.38 H new ATOM 0 HB2 LEU A 85 14.919 -1.216 3.527 1.00 0.50 H new ATOM 0 HB3 LEU A 85 15.294 -2.575 2.486 1.00 0.50 H new ATOM 0 HG LEU A 85 14.014 -1.482 0.618 1.00 0.45 H new ATOM 0 HD11 LEU A 85 13.334 0.886 0.899 1.00 0.62 H new ATOM 0 HD12 LEU A 85 12.469 -0.166 2.045 1.00 0.62 H new ATOM 0 HD13 LEU A 85 13.835 0.828 2.606 1.00 0.62 H new ATOM 0 HD21 LEU A 85 15.664 0.319 0.195 1.00 0.67 H new ATOM 0 HD22 LEU A 85 16.164 0.263 1.902 1.00 0.67 H new ATOM 0 HD23 LEU A 85 16.459 -1.136 0.842 1.00 0.67 H new ATOM 1017 N VAL A 86 13.334 -4.605 1.937 1.00 0.33 N ATOM 1018 CA VAL A 86 12.969 -5.596 0.887 1.00 0.33 C ATOM 1019 C VAL A 86 11.453 -5.840 0.957 1.00 0.26 C ATOM 1020 O VAL A 86 10.770 -5.856 -0.048 1.00 0.21 O ATOM 1021 CB VAL A 86 13.762 -6.903 1.116 1.00 0.37 C ATOM 1022 CG1 VAL A 86 13.113 -8.077 0.368 1.00 0.31 C ATOM 1023 CG2 VAL A 86 15.188 -6.718 0.582 1.00 0.47 C ATOM 0 H VAL A 86 13.997 -4.935 2.638 1.00 0.33 H new ATOM 0 HA VAL A 86 13.221 -5.222 -0.105 1.00 0.33 H new ATOM 0 HB VAL A 86 13.768 -7.122 2.184 1.00 0.37 H new ATOM 0 HG11 VAL A 86 13.690 -8.985 0.545 1.00 0.31 H new ATOM 0 HG12 VAL A 86 12.094 -8.219 0.728 1.00 0.31 H new ATOM 0 HG13 VAL A 86 13.094 -7.862 -0.700 1.00 0.31 H new ATOM 0 HG21 VAL A 86 15.757 -7.635 0.738 1.00 0.47 H new ATOM 0 HG22 VAL A 86 15.151 -6.491 -0.484 1.00 0.47 H new ATOM 0 HG23 VAL A 86 15.671 -5.896 1.111 1.00 0.47 H new ATOM 1033 N LYS A 87 10.919 -6.013 2.135 1.00 0.27 N ATOM 1034 CA LYS A 87 9.450 -6.239 2.257 1.00 0.22 C ATOM 1035 C LYS A 87 8.704 -5.032 1.683 1.00 0.18 C ATOM 1036 O LYS A 87 7.571 -5.134 1.257 1.00 0.14 O ATOM 1037 CB LYS A 87 9.079 -6.413 3.732 1.00 0.27 C ATOM 1038 CG LYS A 87 9.255 -7.877 4.139 1.00 0.62 C ATOM 1039 CD LYS A 87 8.222 -8.738 3.410 1.00 0.34 C ATOM 1040 CE LYS A 87 7.605 -9.738 4.391 1.00 0.65 C ATOM 1041 NZ LYS A 87 6.117 -9.662 4.318 1.00 2.37 N ATOM 0 H LYS A 87 11.434 -6.008 3.016 1.00 0.27 H new ATOM 0 HA LYS A 87 9.172 -7.138 1.706 1.00 0.22 H new ATOM 0 HB2 LYS A 87 9.708 -5.775 4.353 1.00 0.27 H new ATOM 0 HB3 LYS A 87 8.048 -6.101 3.897 1.00 0.27 H new ATOM 0 HG2 LYS A 87 10.262 -8.215 3.895 1.00 0.62 H new ATOM 0 HG3 LYS A 87 9.136 -7.982 5.217 1.00 0.62 H new ATOM 0 HD2 LYS A 87 7.444 -8.106 2.981 1.00 0.34 H new ATOM 0 HD3 LYS A 87 8.694 -9.268 2.583 1.00 0.34 H new ATOM 0 HE2 LYS A 87 7.939 -10.748 4.154 1.00 0.65 H new ATOM 0 HE3 LYS A 87 7.940 -9.521 5.405 1.00 0.65 H new ATOM 0 HZ1 LYS A 87 5.710 -9.922 5.239 1.00 2.37 H new ATOM 0 HZ2 LYS A 87 5.830 -8.692 4.075 1.00 2.37 H new ATOM 0 HZ3 LYS A 87 5.771 -10.318 3.589 1.00 2.37 H new ATOM 1055 N ILE A 88 9.330 -3.884 1.677 1.00 0.22 N ATOM 1056 CA ILE A 88 8.658 -2.664 1.141 1.00 0.23 C ATOM 1057 C ILE A 88 8.658 -2.686 -0.391 1.00 0.22 C ATOM 1058 O ILE A 88 7.763 -2.162 -1.023 1.00 0.23 O ATOM 1059 CB ILE A 88 9.407 -1.417 1.619 1.00 0.30 C ATOM 1060 CG1 ILE A 88 9.421 -1.380 3.150 1.00 0.14 C ATOM 1061 CG2 ILE A 88 8.714 -0.162 1.080 1.00 0.49 C ATOM 1062 CD1 ILE A 88 7.992 -1.252 3.676 1.00 0.43 C ATOM 0 H ILE A 88 10.279 -3.739 2.021 1.00 0.22 H new ATOM 0 HA ILE A 88 7.629 -2.645 1.501 1.00 0.23 H new ATOM 0 HB ILE A 88 10.432 -1.449 1.250 1.00 0.30 H new ATOM 0 HG12 ILE A 88 9.883 -2.287 3.541 1.00 0.14 H new ATOM 0 HG13 ILE A 88 10.023 -0.540 3.497 1.00 0.14 H new ATOM 0 HG21 ILE A 88 9.249 0.724 1.422 1.00 0.49 H new ATOM 0 HG22 ILE A 88 8.712 -0.187 -0.010 1.00 0.49 H new ATOM 0 HG23 ILE A 88 7.687 -0.129 1.444 1.00 0.49 H new ATOM 0 HD11 ILE A 88 8.006 -1.226 4.766 1.00 0.43 H new ATOM 0 HD12 ILE A 88 7.546 -0.333 3.297 1.00 0.43 H new ATOM 0 HD13 ILE A 88 7.403 -2.106 3.341 1.00 0.43 H new ATOM 1074 N ILE A 89 9.654 -3.272 -0.998 1.00 0.22 N ATOM 1075 CA ILE A 89 9.694 -3.303 -2.490 1.00 0.25 C ATOM 1076 C ILE A 89 8.630 -4.269 -3.013 1.00 0.26 C ATOM 1077 O ILE A 89 7.826 -3.918 -3.857 1.00 0.35 O ATOM 1078 CB ILE A 89 11.081 -3.743 -2.959 1.00 0.33 C ATOM 1079 CG1 ILE A 89 12.127 -2.811 -2.332 1.00 0.30 C ATOM 1080 CG2 ILE A 89 11.156 -3.659 -4.490 1.00 0.51 C ATOM 1081 CD1 ILE A 89 13.521 -3.133 -2.877 1.00 0.47 C ATOM 0 H ILE A 89 10.437 -3.728 -0.530 1.00 0.22 H new ATOM 0 HA ILE A 89 9.489 -2.306 -2.879 1.00 0.25 H new ATOM 0 HB ILE A 89 11.273 -4.772 -2.654 1.00 0.33 H new ATOM 0 HG12 ILE A 89 11.875 -1.773 -2.549 1.00 0.30 H new ATOM 0 HG13 ILE A 89 12.119 -2.921 -1.248 1.00 0.30 H new ATOM 0 HG21 ILE A 89 12.145 -3.973 -4.824 1.00 0.51 H new ATOM 0 HG22 ILE A 89 10.401 -4.312 -4.928 1.00 0.51 H new ATOM 0 HG23 ILE A 89 10.975 -2.632 -4.807 1.00 0.51 H new ATOM 0 HD11 ILE A 89 14.252 -2.464 -2.423 1.00 0.47 H new ATOM 0 HD12 ILE A 89 13.776 -4.165 -2.637 1.00 0.47 H new ATOM 0 HD13 ILE A 89 13.529 -2.999 -3.959 1.00 0.47 H new ATOM 1093 N THR A 90 8.595 -5.478 -2.515 1.00 0.27 N ATOM 1094 CA THR A 90 7.556 -6.433 -2.995 1.00 0.34 C ATOM 1095 C THR A 90 6.206 -6.017 -2.411 1.00 0.31 C ATOM 1096 O THR A 90 5.163 -6.305 -2.964 1.00 0.42 O ATOM 1097 CB THR A 90 7.894 -7.859 -2.551 1.00 0.42 C ATOM 1098 OG1 THR A 90 6.770 -8.699 -2.775 1.00 1.54 O ATOM 1099 CG2 THR A 90 8.249 -7.870 -1.065 1.00 1.06 C ATOM 0 H THR A 90 9.232 -5.841 -1.806 1.00 0.27 H new ATOM 0 HA THR A 90 7.518 -6.413 -4.084 1.00 0.34 H new ATOM 0 HB THR A 90 8.746 -8.223 -3.125 1.00 0.42 H new ATOM 0 HG1 THR A 90 6.983 -9.613 -2.493 1.00 1.54 H new ATOM 0 HG21 THR A 90 8.488 -8.887 -0.756 1.00 1.06 H new ATOM 0 HG22 THR A 90 9.111 -7.226 -0.892 1.00 1.06 H new ATOM 0 HG23 THR A 90 7.401 -7.505 -0.486 1.00 1.06 H new ATOM 1107 N GLY A 91 6.221 -5.325 -1.304 1.00 0.20 N ATOM 1108 CA GLY A 91 4.945 -4.870 -0.693 1.00 0.19 C ATOM 1109 C GLY A 91 4.381 -3.723 -1.530 1.00 0.18 C ATOM 1110 O GLY A 91 3.186 -3.505 -1.588 1.00 0.22 O ATOM 0 H GLY A 91 7.065 -5.056 -0.798 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.232 -5.693 -0.651 1.00 0.19 H new ATOM 0 HA3 GLY A 91 5.113 -4.542 0.333 1.00 0.19 H new ATOM 1114 N LEU A 92 5.239 -2.990 -2.185 1.00 0.14 N ATOM 1115 CA LEU A 92 4.767 -1.855 -3.024 1.00 0.14 C ATOM 1116 C LEU A 92 4.283 -2.386 -4.374 1.00 0.15 C ATOM 1117 O LEU A 92 3.405 -1.819 -4.986 1.00 0.15 O ATOM 1118 CB LEU A 92 5.916 -0.872 -3.245 1.00 0.09 C ATOM 1119 CG LEU A 92 5.673 0.386 -2.415 1.00 0.67 C ATOM 1120 CD1 LEU A 92 7.013 0.985 -1.989 1.00 0.40 C ATOM 1121 CD2 LEU A 92 4.902 1.406 -3.256 1.00 1.27 C ATOM 0 H LEU A 92 6.249 -3.130 -2.175 1.00 0.14 H new ATOM 0 HA LEU A 92 3.946 -1.346 -2.518 1.00 0.14 H new ATOM 0 HB2 LEU A 92 6.862 -1.332 -2.960 1.00 0.09 H new ATOM 0 HB3 LEU A 92 5.991 -0.615 -4.302 1.00 0.09 H new ATOM 0 HG LEU A 92 5.093 0.131 -1.528 1.00 0.67 H new ATOM 0 HD11 LEU A 92 6.838 1.883 -1.397 1.00 0.40 H new ATOM 0 HD12 LEU A 92 7.563 0.258 -1.392 1.00 0.40 H new ATOM 0 HD13 LEU A 92 7.595 1.242 -2.874 1.00 0.40 H new ATOM 0 HD21 LEU A 92 4.727 2.306 -2.666 1.00 1.27 H new ATOM 0 HD22 LEU A 92 5.483 1.661 -4.142 1.00 1.27 H new ATOM 0 HD23 LEU A 92 3.946 0.979 -3.559 1.00 1.27 H new ATOM 1133 N LEU A 93 4.842 -3.473 -4.842 1.00 0.15 N ATOM 1134 CA LEU A 93 4.388 -4.036 -6.149 1.00 0.16 C ATOM 1135 C LEU A 93 2.982 -4.611 -5.959 1.00 0.10 C ATOM 1136 O LEU A 93 2.074 -4.362 -6.738 1.00 0.08 O ATOM 1137 CB LEU A 93 5.344 -5.144 -6.596 1.00 0.21 C ATOM 1138 CG LEU A 93 6.760 -4.578 -6.721 1.00 0.20 C ATOM 1139 CD1 LEU A 93 7.776 -5.688 -6.445 1.00 0.14 C ATOM 1140 CD2 LEU A 93 6.970 -4.038 -8.137 1.00 0.38 C ATOM 0 H LEU A 93 5.588 -3.992 -4.379 1.00 0.15 H new ATOM 0 HA LEU A 93 4.377 -3.257 -6.911 1.00 0.16 H new ATOM 0 HB2 LEU A 93 5.331 -5.963 -5.876 1.00 0.21 H new ATOM 0 HB3 LEU A 93 5.020 -5.555 -7.552 1.00 0.21 H new ATOM 0 HG LEU A 93 6.895 -3.771 -6.000 1.00 0.20 H new ATOM 0 HD11 LEU A 93 8.786 -5.287 -6.533 1.00 0.14 H new ATOM 0 HD12 LEU A 93 7.626 -6.076 -5.437 1.00 0.14 H new ATOM 0 HD13 LEU A 93 7.641 -6.493 -7.167 1.00 0.14 H new ATOM 0 HD21 LEU A 93 7.979 -3.635 -8.227 1.00 0.38 H new ATOM 0 HD22 LEU A 93 6.836 -4.845 -8.858 1.00 0.38 H new ATOM 0 HD23 LEU A 93 6.245 -3.249 -8.337 1.00 0.38 H new ATOM 1152 N GLU A 94 2.786 -5.356 -4.903 1.00 0.17 N ATOM 1153 CA GLU A 94 1.435 -5.910 -4.633 1.00 0.15 C ATOM 1154 C GLU A 94 0.506 -4.721 -4.409 1.00 0.12 C ATOM 1155 O GLU A 94 -0.654 -4.734 -4.768 1.00 0.15 O ATOM 1156 CB GLU A 94 1.478 -6.786 -3.379 1.00 0.26 C ATOM 1157 CG GLU A 94 2.263 -8.064 -3.677 1.00 0.66 C ATOM 1158 CD GLU A 94 2.582 -8.786 -2.366 1.00 1.93 C ATOM 1159 OE1 GLU A 94 1.647 -9.164 -1.678 1.00 1.78 O ATOM 1160 OE2 GLU A 94 3.754 -8.950 -2.073 1.00 3.32 O ATOM 0 H GLU A 94 3.503 -5.602 -4.220 1.00 0.17 H new ATOM 0 HA GLU A 94 1.087 -6.524 -5.463 1.00 0.15 H new ATOM 0 HB2 GLU A 94 1.946 -6.242 -2.558 1.00 0.26 H new ATOM 0 HB3 GLU A 94 0.465 -7.034 -3.061 1.00 0.26 H new ATOM 0 HG2 GLU A 94 1.683 -8.715 -4.331 1.00 0.66 H new ATOM 0 HG3 GLU A 94 3.185 -7.822 -4.205 1.00 0.66 H new ATOM 1167 N PHE A 95 1.036 -3.675 -3.838 1.00 0.30 N ATOM 1168 CA PHE A 95 0.225 -2.457 -3.609 1.00 0.36 C ATOM 1169 C PHE A 95 -0.111 -1.848 -4.968 1.00 0.36 C ATOM 1170 O PHE A 95 -1.129 -1.220 -5.142 1.00 0.41 O ATOM 1171 CB PHE A 95 1.046 -1.449 -2.800 1.00 0.43 C ATOM 1172 CG PHE A 95 0.716 -1.569 -1.332 1.00 0.54 C ATOM 1173 CD1 PHE A 95 -0.616 -1.657 -0.914 1.00 1.48 C ATOM 1174 CD2 PHE A 95 1.749 -1.588 -0.389 1.00 0.53 C ATOM 1175 CE1 PHE A 95 -0.916 -1.764 0.447 1.00 1.62 C ATOM 1176 CE2 PHE A 95 1.450 -1.696 0.972 1.00 0.41 C ATOM 1177 CZ PHE A 95 0.117 -1.785 1.392 1.00 0.78 C ATOM 0 H PHE A 95 2.003 -3.616 -3.520 1.00 0.30 H new ATOM 0 HA PHE A 95 -0.686 -2.705 -3.064 1.00 0.36 H new ATOM 0 HB2 PHE A 95 2.110 -1.626 -2.957 1.00 0.43 H new ATOM 0 HB3 PHE A 95 0.837 -0.437 -3.146 1.00 0.43 H new ATOM 0 HD1 PHE A 95 -1.413 -1.642 -1.643 1.00 1.48 H new ATOM 0 HD2 PHE A 95 2.777 -1.519 -0.712 1.00 0.53 H new ATOM 0 HE1 PHE A 95 -1.945 -1.830 0.770 1.00 1.62 H new ATOM 0 HE2 PHE A 95 2.247 -1.711 1.700 1.00 0.41 H new ATOM 0 HZ PHE A 95 -0.114 -1.870 2.444 1.00 0.78 H new ATOM 1187 N GLU A 96 0.753 -2.039 -5.929 1.00 0.31 N ATOM 1188 CA GLU A 96 0.512 -1.484 -7.289 1.00 0.35 C ATOM 1189 C GLU A 96 -0.768 -2.086 -7.860 1.00 0.32 C ATOM 1190 O GLU A 96 -1.599 -1.387 -8.402 1.00 0.36 O ATOM 1191 CB GLU A 96 1.690 -1.827 -8.199 1.00 0.33 C ATOM 1192 CG GLU A 96 2.334 -0.537 -8.714 1.00 0.55 C ATOM 1193 CD GLU A 96 3.505 -0.881 -9.641 1.00 1.92 C ATOM 1194 OE1 GLU A 96 3.888 -2.039 -9.680 1.00 2.74 O ATOM 1195 OE2 GLU A 96 4.001 0.021 -10.296 1.00 2.49 O ATOM 0 H GLU A 96 1.623 -2.561 -5.827 1.00 0.31 H new ATOM 0 HA GLU A 96 0.409 -0.401 -7.227 1.00 0.35 H new ATOM 0 HB2 GLU A 96 2.424 -2.419 -7.653 1.00 0.33 H new ATOM 0 HB3 GLU A 96 1.350 -2.435 -9.037 1.00 0.33 H new ATOM 0 HG2 GLU A 96 1.597 0.061 -9.250 1.00 0.55 H new ATOM 0 HG3 GLU A 96 2.685 0.066 -7.876 1.00 0.55 H new ATOM 1202 N VAL A 97 -0.950 -3.376 -7.740 1.00 0.24 N ATOM 1203 CA VAL A 97 -2.209 -3.972 -8.276 1.00 0.20 C ATOM 1204 C VAL A 97 -3.372 -3.429 -7.438 1.00 0.17 C ATOM 1205 O VAL A 97 -4.458 -3.186 -7.934 1.00 0.13 O ATOM 1206 CB VAL A 97 -2.157 -5.505 -8.210 1.00 0.18 C ATOM 1207 CG1 VAL A 97 -1.924 -5.973 -6.774 1.00 0.43 C ATOM 1208 CG2 VAL A 97 -3.480 -6.081 -8.720 1.00 0.25 C ATOM 0 H VAL A 97 -0.298 -4.029 -7.305 1.00 0.24 H new ATOM 0 HA VAL A 97 -2.340 -3.702 -9.324 1.00 0.20 H new ATOM 0 HB VAL A 97 -1.333 -5.854 -8.832 1.00 0.18 H new ATOM 0 HG11 VAL A 97 -1.890 -7.062 -6.747 1.00 0.43 H new ATOM 0 HG12 VAL A 97 -0.979 -5.572 -6.409 1.00 0.43 H new ATOM 0 HG13 VAL A 97 -2.737 -5.620 -6.140 1.00 0.43 H new ATOM 0 HG21 VAL A 97 -3.445 -7.169 -8.674 1.00 0.25 H new ATOM 0 HG22 VAL A 97 -4.299 -5.718 -8.099 1.00 0.25 H new ATOM 0 HG23 VAL A 97 -3.640 -5.767 -9.751 1.00 0.25 H new ATOM 1218 N TYR A 98 -3.139 -3.198 -6.172 1.00 0.23 N ATOM 1219 CA TYR A 98 -4.211 -2.632 -5.311 1.00 0.24 C ATOM 1220 C TYR A 98 -4.493 -1.202 -5.776 1.00 0.26 C ATOM 1221 O TYR A 98 -5.574 -0.677 -5.594 1.00 0.21 O ATOM 1222 CB TYR A 98 -3.753 -2.626 -3.852 1.00 0.42 C ATOM 1223 CG TYR A 98 -3.992 -3.992 -3.256 1.00 0.34 C ATOM 1224 CD1 TYR A 98 -5.283 -4.532 -3.246 1.00 0.50 C ATOM 1225 CD2 TYR A 98 -2.923 -4.721 -2.722 1.00 0.42 C ATOM 1226 CE1 TYR A 98 -5.505 -5.801 -2.702 1.00 0.71 C ATOM 1227 CE2 TYR A 98 -3.146 -5.991 -2.176 1.00 0.72 C ATOM 1228 CZ TYR A 98 -4.438 -6.531 -2.166 1.00 0.84 C ATOM 1229 OH TYR A 98 -4.659 -7.784 -1.632 1.00 1.15 O ATOM 0 H TYR A 98 -2.252 -3.378 -5.701 1.00 0.23 H new ATOM 0 HA TYR A 98 -5.115 -3.236 -5.388 1.00 0.24 H new ATOM 0 HB2 TYR A 98 -2.696 -2.368 -3.790 1.00 0.42 H new ATOM 0 HB3 TYR A 98 -4.299 -1.869 -3.289 1.00 0.42 H new ATOM 0 HD1 TYR A 98 -6.107 -3.969 -3.658 1.00 0.50 H new ATOM 0 HD2 TYR A 98 -1.927 -4.304 -2.731 1.00 0.42 H new ATOM 0 HE1 TYR A 98 -6.501 -6.218 -2.695 1.00 0.71 H new ATOM 0 HE2 TYR A 98 -2.322 -6.554 -1.763 1.00 0.72 H new ATOM 0 HH TYR A 98 -5.049 -7.694 -0.738 1.00 1.15 H new ATOM 1239 N LEU A 99 -3.534 -0.583 -6.416 1.00 0.39 N ATOM 1240 CA LEU A 99 -3.754 0.789 -6.934 1.00 0.51 C ATOM 1241 C LEU A 99 -4.678 0.657 -8.126 1.00 0.50 C ATOM 1242 O LEU A 99 -5.529 1.483 -8.365 1.00 0.58 O ATOM 1243 CB LEU A 99 -2.433 1.405 -7.391 1.00 0.75 C ATOM 1244 CG LEU A 99 -1.558 1.708 -6.182 1.00 0.86 C ATOM 1245 CD1 LEU A 99 -0.127 1.987 -6.647 1.00 1.12 C ATOM 1246 CD2 LEU A 99 -2.113 2.936 -5.462 1.00 0.85 C ATOM 0 H LEU A 99 -2.610 -0.974 -6.599 1.00 0.39 H new ATOM 0 HA LEU A 99 -4.177 1.429 -6.160 1.00 0.51 H new ATOM 0 HB2 LEU A 99 -1.916 0.720 -8.063 1.00 0.75 H new ATOM 0 HB3 LEU A 99 -2.623 2.320 -7.952 1.00 0.75 H new ATOM 0 HG LEU A 99 -1.555 0.855 -5.503 1.00 0.86 H new ATOM 0 HD11 LEU A 99 0.501 2.204 -5.783 1.00 1.12 H new ATOM 0 HD12 LEU A 99 0.263 1.113 -7.168 1.00 1.12 H new ATOM 0 HD13 LEU A 99 -0.124 2.843 -7.322 1.00 1.12 H new ATOM 0 HD21 LEU A 99 -1.492 3.161 -4.594 1.00 0.85 H new ATOM 0 HD22 LEU A 99 -2.109 3.789 -6.141 1.00 0.85 H new ATOM 0 HD23 LEU A 99 -3.134 2.736 -5.136 1.00 0.85 H new ATOM 1258 N GLU A 100 -4.539 -0.423 -8.848 1.00 0.46 N ATOM 1259 CA GLU A 100 -5.426 -0.670 -10.002 1.00 0.53 C ATOM 1260 C GLU A 100 -6.844 -0.703 -9.453 1.00 0.50 C ATOM 1261 O GLU A 100 -7.790 -0.271 -10.081 1.00 0.63 O ATOM 1262 CB GLU A 100 -5.069 -2.022 -10.621 1.00 0.50 C ATOM 1263 CG GLU A 100 -5.198 -1.947 -12.142 1.00 0.59 C ATOM 1264 CD GLU A 100 -6.661 -1.713 -12.522 1.00 1.26 C ATOM 1265 OE1 GLU A 100 -7.418 -2.669 -12.510 1.00 2.03 O ATOM 1266 OE2 GLU A 100 -7.000 -0.579 -12.819 1.00 1.20 O ATOM 0 H GLU A 100 -3.840 -1.146 -8.679 1.00 0.46 H new ATOM 0 HA GLU A 100 -5.324 0.098 -10.769 1.00 0.53 H new ATOM 0 HB2 GLU A 100 -4.051 -2.300 -10.347 1.00 0.50 H new ATOM 0 HB3 GLU A 100 -5.728 -2.797 -10.229 1.00 0.50 H new ATOM 0 HG2 GLU A 100 -4.577 -1.140 -12.530 1.00 0.59 H new ATOM 0 HG3 GLU A 100 -4.838 -2.871 -12.594 1.00 0.59 H new ATOM 1273 N TYR A 101 -6.973 -1.195 -8.250 1.00 0.34 N ATOM 1274 CA TYR A 101 -8.300 -1.243 -7.601 1.00 0.34 C ATOM 1275 C TYR A 101 -8.818 0.182 -7.439 1.00 0.37 C ATOM 1276 O TYR A 101 -9.938 0.499 -7.784 1.00 0.45 O ATOM 1277 CB TYR A 101 -8.166 -1.893 -6.219 1.00 0.25 C ATOM 1278 CG TYR A 101 -9.235 -2.942 -6.055 1.00 0.36 C ATOM 1279 CD1 TYR A 101 -9.396 -3.923 -7.037 1.00 0.41 C ATOM 1280 CD2 TYR A 101 -10.069 -2.931 -4.931 1.00 0.41 C ATOM 1281 CE1 TYR A 101 -10.394 -4.893 -6.903 1.00 0.52 C ATOM 1282 CE2 TYR A 101 -11.067 -3.904 -4.795 1.00 0.52 C ATOM 1283 CZ TYR A 101 -11.230 -4.885 -5.783 1.00 0.58 C ATOM 1284 OH TYR A 101 -12.216 -5.845 -5.653 1.00 0.70 O ATOM 0 H TYR A 101 -6.205 -1.567 -7.691 1.00 0.34 H new ATOM 0 HA TYR A 101 -8.992 -1.825 -8.210 1.00 0.34 H new ATOM 0 HB2 TYR A 101 -7.179 -2.343 -6.111 1.00 0.25 H new ATOM 0 HB3 TYR A 101 -8.259 -1.138 -5.439 1.00 0.25 H new ATOM 0 HD1 TYR A 101 -8.748 -3.932 -7.901 1.00 0.41 H new ATOM 0 HD2 TYR A 101 -9.943 -2.174 -4.171 1.00 0.41 H new ATOM 0 HE1 TYR A 101 -10.519 -5.648 -7.665 1.00 0.52 H new ATOM 0 HE2 TYR A 101 -11.711 -3.899 -3.928 1.00 0.52 H new ATOM 0 HH TYR A 101 -12.556 -5.842 -4.734 1.00 0.70 H new ATOM 1294 N LEU A 102 -8.005 1.033 -6.891 1.00 0.34 N ATOM 1295 CA LEU A 102 -8.424 2.443 -6.665 1.00 0.39 C ATOM 1296 C LEU A 102 -8.011 3.322 -7.851 1.00 0.50 C ATOM 1297 O LEU A 102 -8.043 4.534 -7.769 1.00 0.51 O ATOM 1298 CB LEU A 102 -7.763 2.964 -5.383 1.00 0.35 C ATOM 1299 CG LEU A 102 -7.781 1.873 -4.301 1.00 0.26 C ATOM 1300 CD1 LEU A 102 -6.391 1.749 -3.677 1.00 0.34 C ATOM 1301 CD2 LEU A 102 -8.801 2.243 -3.229 1.00 0.22 C ATOM 0 H LEU A 102 -7.057 0.812 -6.586 1.00 0.34 H new ATOM 0 HA LEU A 102 -9.509 2.481 -6.566 1.00 0.39 H new ATOM 0 HB2 LEU A 102 -6.736 3.265 -5.590 1.00 0.35 H new ATOM 0 HB3 LEU A 102 -8.289 3.850 -5.027 1.00 0.35 H new ATOM 0 HG LEU A 102 -8.058 0.918 -4.747 1.00 0.26 H new ATOM 0 HD11 LEU A 102 -6.404 0.975 -2.910 1.00 0.34 H new ATOM 0 HD12 LEU A 102 -5.668 1.483 -4.448 1.00 0.34 H new ATOM 0 HD13 LEU A 102 -6.108 2.701 -3.227 1.00 0.34 H new ATOM 0 HD21 LEU A 102 -8.816 1.471 -2.460 1.00 0.22 H new ATOM 0 HD22 LEU A 102 -8.527 3.198 -2.780 1.00 0.22 H new ATOM 0 HD23 LEU A 102 -9.790 2.325 -3.680 1.00 0.22 H new ATOM 1313 N GLN A 103 -7.622 2.734 -8.950 1.00 0.58 N ATOM 1314 CA GLN A 103 -7.210 3.560 -10.121 1.00 0.69 C ATOM 1315 C GLN A 103 -8.400 3.719 -11.067 1.00 0.83 C ATOM 1316 O GLN A 103 -8.258 3.700 -12.274 1.00 1.66 O ATOM 1317 CB GLN A 103 -6.057 2.875 -10.863 1.00 0.59 C ATOM 1318 CG GLN A 103 -5.513 3.812 -11.943 1.00 0.72 C ATOM 1319 CD GLN A 103 -5.168 3.006 -13.196 1.00 0.88 C ATOM 1320 OE1 GLN A 103 -5.875 3.062 -14.183 1.00 1.85 O ATOM 1321 NE2 GLN A 103 -4.102 2.251 -13.199 1.00 1.12 N ATOM 0 H GLN A 103 -7.572 1.725 -9.087 1.00 0.58 H new ATOM 0 HA GLN A 103 -6.880 4.539 -9.774 1.00 0.69 H new ATOM 0 HB2 GLN A 103 -5.265 2.613 -10.162 1.00 0.59 H new ATOM 0 HB3 GLN A 103 -6.403 1.945 -11.315 1.00 0.59 H new ATOM 0 HG2 GLN A 103 -6.253 4.576 -12.182 1.00 0.72 H new ATOM 0 HG3 GLN A 103 -4.627 4.330 -11.576 1.00 0.72 H new ATOM 0 HE21 GLN A 103 -3.508 2.204 -12.371 1.00 1.12 H new ATOM 0 HE22 GLN A 103 -3.863 1.709 -14.029 1.00 1.12 H new ATOM 1330 N ASN A 104 -9.576 3.868 -10.526 1.00 0.70 N ATOM 1331 CA ASN A 104 -10.785 4.023 -11.382 1.00 0.73 C ATOM 1332 C ASN A 104 -12.028 3.998 -10.493 1.00 0.71 C ATOM 1333 O ASN A 104 -13.011 4.661 -10.760 1.00 0.76 O ATOM 1334 CB ASN A 104 -10.856 2.870 -12.385 1.00 0.77 C ATOM 1335 CG ASN A 104 -11.053 3.431 -13.794 1.00 0.62 C ATOM 1336 OD1 ASN A 104 -11.937 4.234 -14.024 1.00 1.44 O ATOM 1337 ND2 ASN A 104 -10.261 3.039 -14.755 1.00 0.50 N ATOM 0 H ASN A 104 -9.753 3.889 -9.522 1.00 0.70 H new ATOM 0 HA ASN A 104 -10.733 4.968 -11.923 1.00 0.73 H new ATOM 0 HB2 ASN A 104 -9.941 2.280 -12.342 1.00 0.77 H new ATOM 0 HB3 ASN A 104 -11.679 2.202 -12.130 1.00 0.77 H new ATOM 0 HD21 ASN A 104 -10.384 3.406 -15.699 1.00 0.50 H new ATOM 0 HD22 ASN A 104 -9.520 2.366 -14.562 1.00 0.50 H new ATOM 1344 N ARG A 105 -11.986 3.238 -9.435 1.00 0.63 N ATOM 1345 CA ARG A 105 -13.155 3.166 -8.519 1.00 0.62 C ATOM 1346 C ARG A 105 -13.489 4.569 -8.013 1.00 0.60 C ATOM 1347 O ARG A 105 -14.634 4.897 -7.775 1.00 0.61 O ATOM 1348 CB ARG A 105 -12.812 2.260 -7.334 1.00 0.54 C ATOM 1349 CG ARG A 105 -14.027 1.404 -6.975 1.00 0.94 C ATOM 1350 CD ARG A 105 -14.976 2.213 -6.091 1.00 1.91 C ATOM 1351 NE ARG A 105 -14.219 2.774 -4.937 1.00 3.18 N ATOM 1352 CZ ARG A 105 -14.511 3.959 -4.477 1.00 4.29 C ATOM 1353 NH1 ARG A 105 -15.503 4.109 -3.642 1.00 4.58 N ATOM 1354 NH2 ARG A 105 -13.809 4.994 -4.850 1.00 5.42 N ATOM 0 H ARG A 105 -11.189 2.662 -9.165 1.00 0.63 H new ATOM 0 HA ARG A 105 -14.015 2.759 -9.051 1.00 0.62 H new ATOM 0 HB2 ARG A 105 -11.965 1.621 -7.585 1.00 0.54 H new ATOM 0 HB3 ARG A 105 -12.513 2.863 -6.477 1.00 0.54 H new ATOM 0 HG2 ARG A 105 -14.541 1.084 -7.882 1.00 0.94 H new ATOM 0 HG3 ARG A 105 -13.708 0.501 -6.454 1.00 0.94 H new ATOM 0 HD2 ARG A 105 -15.431 3.018 -6.668 1.00 1.91 H new ATOM 0 HD3 ARG A 105 -15.788 1.579 -5.734 1.00 1.91 H new ATOM 0 HE ARG A 105 -13.471 2.231 -4.506 1.00 3.18 H new ATOM 0 HH11 ARG A 105 -16.050 3.299 -3.349 1.00 4.58 H new ATOM 0 HH12 ARG A 105 -15.731 5.036 -3.282 1.00 4.58 H new ATOM 0 HH21 ARG A 105 -13.033 4.876 -5.501 1.00 5.42 H new ATOM 0 HH22 ARG A 105 -14.037 5.921 -4.491 1.00 5.42 H new ATOM 1368 N PHE A 106 -12.498 5.404 -7.850 1.00 0.58 N ATOM 1369 CA PHE A 106 -12.769 6.787 -7.364 1.00 0.56 C ATOM 1370 C PHE A 106 -13.374 7.612 -8.501 1.00 0.72 C ATOM 1371 O PHE A 106 -12.677 8.087 -9.375 1.00 0.69 O ATOM 1372 CB PHE A 106 -11.462 7.434 -6.896 1.00 0.42 C ATOM 1373 CG PHE A 106 -11.500 7.619 -5.398 1.00 0.73 C ATOM 1374 CD1 PHE A 106 -12.612 8.221 -4.795 1.00 1.33 C ATOM 1375 CD2 PHE A 106 -10.426 7.187 -4.610 1.00 0.68 C ATOM 1376 CE1 PHE A 106 -12.649 8.391 -3.406 1.00 1.66 C ATOM 1377 CE2 PHE A 106 -10.463 7.357 -3.221 1.00 1.05 C ATOM 1378 CZ PHE A 106 -11.575 7.959 -2.619 1.00 1.47 C ATOM 0 H PHE A 106 -11.517 5.190 -8.031 1.00 0.58 H new ATOM 0 HA PHE A 106 -13.468 6.750 -6.529 1.00 0.56 H new ATOM 0 HB2 PHE A 106 -10.614 6.808 -7.174 1.00 0.42 H new ATOM 0 HB3 PHE A 106 -11.323 8.396 -7.389 1.00 0.42 H new ATOM 0 HD1 PHE A 106 -13.441 8.554 -5.402 1.00 1.33 H new ATOM 0 HD2 PHE A 106 -9.569 6.722 -5.074 1.00 0.68 H new ATOM 0 HE1 PHE A 106 -13.506 8.856 -2.942 1.00 1.66 H new ATOM 0 HE2 PHE A 106 -9.634 7.024 -2.614 1.00 1.05 H new ATOM 0 HZ PHE A 106 -11.604 8.090 -1.547 1.00 1.47 H new ATOM 1388 N GLU A 107 -14.668 7.779 -8.496 1.00 1.03 N ATOM 1389 CA GLU A 107 -15.324 8.568 -9.579 1.00 1.19 C ATOM 1390 C GLU A 107 -15.415 10.037 -9.163 1.00 0.98 C ATOM 1391 O GLU A 107 -15.428 10.928 -9.989 1.00 0.90 O ATOM 1392 CB GLU A 107 -16.733 8.025 -9.821 1.00 1.59 C ATOM 1393 CG GLU A 107 -17.472 7.901 -8.487 1.00 2.40 C ATOM 1394 CD GLU A 107 -18.951 8.238 -8.690 1.00 3.14 C ATOM 1395 OE1 GLU A 107 -19.262 9.413 -8.798 1.00 4.13 O ATOM 1396 OE2 GLU A 107 -19.747 7.314 -8.733 1.00 3.17 O ATOM 0 H GLU A 107 -15.300 7.404 -7.789 1.00 1.03 H new ATOM 0 HA GLU A 107 -14.735 8.485 -10.493 1.00 1.19 H new ATOM 0 HB2 GLU A 107 -17.279 8.689 -10.491 1.00 1.59 H new ATOM 0 HB3 GLU A 107 -16.680 7.053 -10.310 1.00 1.59 H new ATOM 0 HG2 GLU A 107 -17.369 6.889 -8.095 1.00 2.40 H new ATOM 0 HG3 GLU A 107 -17.032 8.574 -7.751 1.00 2.40 H new ATOM 1403 N SER A 108 -15.469 10.296 -7.888 1.00 0.93 N ATOM 1404 CA SER A 108 -15.548 11.707 -7.415 1.00 0.82 C ATOM 1405 C SER A 108 -14.128 12.214 -7.190 1.00 0.56 C ATOM 1406 O SER A 108 -13.738 13.256 -7.676 1.00 0.34 O ATOM 1407 CB SER A 108 -16.332 11.771 -6.103 1.00 0.99 C ATOM 1408 OG SER A 108 -16.114 13.034 -5.488 1.00 2.65 O ATOM 0 H SER A 108 -15.462 9.591 -7.151 1.00 0.93 H new ATOM 0 HA SER A 108 -16.056 12.324 -8.156 1.00 0.82 H new ATOM 0 HB2 SER A 108 -17.395 11.625 -6.294 1.00 0.99 H new ATOM 0 HB3 SER A 108 -16.014 10.969 -5.436 1.00 0.99 H new ATOM 0 HG SER A 108 -16.616 13.080 -4.648 1.00 2.65 H new ATOM 1414 N SER A 109 -13.349 11.460 -6.470 1.00 0.64 N ATOM 1415 CA SER A 109 -11.941 11.859 -6.219 1.00 0.43 C ATOM 1416 C SER A 109 -11.053 11.063 -7.169 1.00 0.37 C ATOM 1417 O SER A 109 -10.025 10.541 -6.790 1.00 0.42 O ATOM 1418 CB SER A 109 -11.567 11.539 -4.773 1.00 0.41 C ATOM 1419 OG SER A 109 -10.803 12.611 -4.239 1.00 0.42 O ATOM 0 H SER A 109 -13.630 10.578 -6.042 1.00 0.64 H new ATOM 0 HA SER A 109 -11.812 12.929 -6.384 1.00 0.43 H new ATOM 0 HB2 SER A 109 -12.467 11.386 -4.177 1.00 0.41 H new ATOM 0 HB3 SER A 109 -10.995 10.612 -4.729 1.00 0.41 H new ATOM 0 HG SER A 109 -10.464 12.362 -3.354 1.00 0.42 H new ATOM 1425 N GLU A 110 -11.464 10.949 -8.402 1.00 0.50 N ATOM 1426 CA GLU A 110 -10.674 10.171 -9.388 1.00 0.62 C ATOM 1427 C GLU A 110 -9.220 10.653 -9.399 1.00 0.54 C ATOM 1428 O GLU A 110 -8.300 9.885 -9.207 1.00 0.64 O ATOM 1429 CB GLU A 110 -11.276 10.353 -10.782 1.00 0.79 C ATOM 1430 CG GLU A 110 -10.654 9.335 -11.741 1.00 0.92 C ATOM 1431 CD GLU A 110 -10.337 10.013 -13.075 1.00 0.86 C ATOM 1432 OE1 GLU A 110 -9.814 11.115 -13.048 1.00 1.68 O ATOM 1433 OE2 GLU A 110 -10.621 9.418 -14.101 1.00 1.11 O ATOM 0 H GLU A 110 -12.320 11.366 -8.768 1.00 0.50 H new ATOM 0 HA GLU A 110 -10.699 9.118 -9.109 1.00 0.62 H new ATOM 0 HB2 GLU A 110 -12.357 10.220 -10.744 1.00 0.79 H new ATOM 0 HB3 GLU A 110 -11.092 11.366 -11.140 1.00 0.79 H new ATOM 0 HG2 GLU A 110 -9.744 8.920 -11.307 1.00 0.92 H new ATOM 0 HG3 GLU A 110 -11.340 8.503 -11.899 1.00 0.92 H new ATOM 1440 N GLU A 111 -9.007 11.920 -9.639 1.00 0.46 N ATOM 1441 CA GLU A 111 -7.615 12.454 -9.683 1.00 0.55 C ATOM 1442 C GLU A 111 -6.901 12.192 -8.354 1.00 0.45 C ATOM 1443 O GLU A 111 -5.690 12.138 -8.294 1.00 0.37 O ATOM 1444 CB GLU A 111 -7.657 13.961 -9.944 1.00 0.69 C ATOM 1445 CG GLU A 111 -6.871 14.280 -11.216 1.00 1.35 C ATOM 1446 CD GLU A 111 -7.842 14.463 -12.385 1.00 2.69 C ATOM 1447 OE1 GLU A 111 -8.769 15.244 -12.243 1.00 2.72 O ATOM 1448 OE2 GLU A 111 -7.643 13.818 -13.402 1.00 3.90 O ATOM 0 H GLU A 111 -9.740 12.610 -9.807 1.00 0.46 H new ATOM 0 HA GLU A 111 -7.071 11.952 -10.483 1.00 0.55 H new ATOM 0 HB2 GLU A 111 -8.690 14.294 -10.049 1.00 0.69 H new ATOM 0 HB3 GLU A 111 -7.233 14.500 -9.097 1.00 0.69 H new ATOM 0 HG2 GLU A 111 -6.281 15.186 -11.074 1.00 1.35 H new ATOM 0 HG3 GLU A 111 -6.170 13.474 -11.435 1.00 1.35 H new ATOM 1455 N GLN A 112 -7.633 12.034 -7.288 1.00 0.53 N ATOM 1456 CA GLN A 112 -6.979 11.782 -5.972 1.00 0.44 C ATOM 1457 C GLN A 112 -6.445 10.347 -5.926 1.00 0.34 C ATOM 1458 O GLN A 112 -5.400 10.082 -5.367 1.00 0.32 O ATOM 1459 CB GLN A 112 -7.997 11.990 -4.849 1.00 0.44 C ATOM 1460 CG GLN A 112 -8.322 13.481 -4.728 1.00 0.39 C ATOM 1461 CD GLN A 112 -8.586 13.834 -3.263 1.00 1.03 C ATOM 1462 OE1 GLN A 112 -9.146 13.048 -2.527 1.00 1.98 O ATOM 1463 NE2 GLN A 112 -8.202 14.996 -2.807 1.00 0.96 N ATOM 0 H GLN A 112 -8.652 12.068 -7.269 1.00 0.53 H new ATOM 0 HA GLN A 112 -6.149 12.476 -5.842 1.00 0.44 H new ATOM 0 HB2 GLN A 112 -8.905 11.424 -5.057 1.00 0.44 H new ATOM 0 HB3 GLN A 112 -7.597 11.616 -3.907 1.00 0.44 H new ATOM 0 HG2 GLN A 112 -7.493 14.076 -5.112 1.00 0.39 H new ATOM 0 HG3 GLN A 112 -9.195 13.723 -5.334 1.00 0.39 H new ATOM 0 HE21 GLN A 112 -7.731 15.656 -3.426 1.00 0.96 H new ATOM 0 HE22 GLN A 112 -8.373 15.243 -1.832 1.00 0.96 H new ATOM 1472 N ALA A 113 -7.150 9.418 -6.513 1.00 0.33 N ATOM 1473 CA ALA A 113 -6.676 8.004 -6.503 1.00 0.28 C ATOM 1474 C ALA A 113 -5.491 7.853 -7.462 1.00 0.42 C ATOM 1475 O ALA A 113 -4.512 7.202 -7.158 1.00 0.26 O ATOM 1476 CB ALA A 113 -7.815 7.084 -6.952 1.00 0.49 C ATOM 0 H ALA A 113 -8.033 9.577 -6.999 1.00 0.33 H new ATOM 0 HA ALA A 113 -6.362 7.733 -5.495 1.00 0.28 H new ATOM 0 HB1 ALA A 113 -7.471 6.050 -6.946 1.00 0.49 H new ATOM 0 HB2 ALA A 113 -8.659 7.190 -6.270 1.00 0.49 H new ATOM 0 HB3 ALA A 113 -8.127 7.356 -7.960 1.00 0.49 H new ATOM 1482 N ARG A 114 -5.573 8.452 -8.618 1.00 0.76 N ATOM 1483 CA ARG A 114 -4.456 8.347 -9.600 1.00 0.95 C ATOM 1484 C ARG A 114 -3.204 9.015 -9.029 1.00 0.97 C ATOM 1485 O ARG A 114 -2.103 8.522 -9.176 1.00 1.06 O ATOM 1486 CB ARG A 114 -4.862 9.048 -10.898 1.00 1.14 C ATOM 1487 CG ARG A 114 -3.709 8.987 -11.903 1.00 0.50 C ATOM 1488 CD ARG A 114 -4.176 9.551 -13.246 1.00 0.53 C ATOM 1489 NE ARG A 114 -3.082 9.423 -14.249 1.00 0.51 N ATOM 1490 CZ ARG A 114 -3.309 9.713 -15.501 1.00 0.83 C ATOM 1491 NH1 ARG A 114 -4.062 10.733 -15.811 1.00 1.16 N ATOM 1492 NH2 ARG A 114 -2.782 8.981 -16.446 1.00 1.17 N ATOM 0 H ARG A 114 -6.368 9.012 -8.926 1.00 0.76 H new ATOM 0 HA ARG A 114 -4.243 7.297 -9.800 1.00 0.95 H new ATOM 0 HB2 ARG A 114 -5.748 8.571 -11.318 1.00 1.14 H new ATOM 0 HB3 ARG A 114 -5.125 10.086 -10.695 1.00 1.14 H new ATOM 0 HG2 ARG A 114 -2.858 9.558 -11.532 1.00 0.50 H new ATOM 0 HG3 ARG A 114 -3.373 7.957 -12.025 1.00 0.50 H new ATOM 0 HD2 ARG A 114 -5.062 9.016 -13.589 1.00 0.53 H new ATOM 0 HD3 ARG A 114 -4.460 10.597 -13.134 1.00 0.53 H new ATOM 0 HE ARG A 114 -2.156 9.109 -13.957 1.00 0.51 H new ATOM 0 HH11 ARG A 114 -4.474 11.305 -15.074 1.00 1.16 H new ATOM 0 HH12 ARG A 114 -4.238 10.958 -16.790 1.00 1.16 H new ATOM 0 HH21 ARG A 114 -2.194 8.183 -16.205 1.00 1.17 H new ATOM 0 HH22 ARG A 114 -2.959 9.207 -17.425 1.00 1.17 H new ATOM 1506 N ALA A 115 -3.363 10.134 -8.382 1.00 1.04 N ATOM 1507 CA ALA A 115 -2.183 10.836 -7.804 1.00 1.18 C ATOM 1508 C ALA A 115 -1.494 9.921 -6.791 1.00 1.09 C ATOM 1509 O ALA A 115 -0.285 9.798 -6.774 1.00 1.37 O ATOM 1510 CB ALA A 115 -2.643 12.118 -7.108 1.00 1.25 C ATOM 0 H ALA A 115 -4.260 10.594 -8.228 1.00 1.04 H new ATOM 0 HA ALA A 115 -1.482 11.089 -8.600 1.00 1.18 H new ATOM 0 HB1 ALA A 115 -1.780 12.632 -6.685 1.00 1.25 H new ATOM 0 HB2 ALA A 115 -3.134 12.769 -7.832 1.00 1.25 H new ATOM 0 HB3 ALA A 115 -3.343 11.868 -6.311 1.00 1.25 H new ATOM 1516 N VAL A 116 -2.251 9.277 -5.946 1.00 0.76 N ATOM 1517 CA VAL A 116 -1.632 8.371 -4.938 1.00 0.71 C ATOM 1518 C VAL A 116 -0.899 7.238 -5.659 1.00 0.63 C ATOM 1519 O VAL A 116 0.109 6.751 -5.197 1.00 0.59 O ATOM 1520 CB VAL A 116 -2.720 7.784 -4.034 1.00 0.65 C ATOM 1521 CG1 VAL A 116 -2.105 6.758 -3.077 1.00 1.40 C ATOM 1522 CG2 VAL A 116 -3.363 8.910 -3.225 1.00 2.27 C ATOM 0 H VAL A 116 -3.268 9.339 -5.910 1.00 0.76 H new ATOM 0 HA VAL A 116 -0.925 8.935 -4.329 1.00 0.71 H new ATOM 0 HB VAL A 116 -3.474 7.293 -4.649 1.00 0.65 H new ATOM 0 HG11 VAL A 116 -2.884 6.345 -2.437 1.00 1.40 H new ATOM 0 HG12 VAL A 116 -1.644 5.955 -3.652 1.00 1.40 H new ATOM 0 HG13 VAL A 116 -1.349 7.243 -2.460 1.00 1.40 H new ATOM 0 HG21 VAL A 116 -4.138 8.497 -2.580 1.00 2.27 H new ATOM 0 HG22 VAL A 116 -2.604 9.398 -2.614 1.00 2.27 H new ATOM 0 HG23 VAL A 116 -3.806 9.639 -3.904 1.00 2.27 H new ATOM 1532 N GLN A 117 -1.400 6.810 -6.784 1.00 0.60 N ATOM 1533 CA GLN A 117 -0.730 5.710 -7.521 1.00 0.52 C ATOM 1534 C GLN A 117 0.616 6.199 -8.059 1.00 0.43 C ATOM 1535 O GLN A 117 1.581 5.463 -8.109 1.00 0.51 O ATOM 1536 CB GLN A 117 -1.617 5.271 -8.684 1.00 0.58 C ATOM 1537 CG GLN A 117 -0.977 4.076 -9.383 1.00 0.60 C ATOM 1538 CD GLN A 117 -0.486 4.495 -10.770 1.00 1.10 C ATOM 1539 OE1 GLN A 117 -0.299 5.666 -11.032 1.00 1.87 O ATOM 1540 NE2 GLN A 117 -0.267 3.581 -11.676 1.00 1.09 N ATOM 0 H GLN A 117 -2.245 7.176 -7.223 1.00 0.60 H new ATOM 0 HA GLN A 117 -0.564 4.868 -6.849 1.00 0.52 H new ATOM 0 HB2 GLN A 117 -2.609 5.005 -8.319 1.00 0.58 H new ATOM 0 HB3 GLN A 117 -1.746 6.093 -9.388 1.00 0.58 H new ATOM 0 HG2 GLN A 117 -0.144 3.698 -8.790 1.00 0.60 H new ATOM 0 HG3 GLN A 117 -1.699 3.264 -9.472 1.00 0.60 H new ATOM 0 HE21 GLN A 117 -0.424 2.597 -11.456 1.00 1.09 H new ATOM 0 HE22 GLN A 117 0.061 3.851 -12.603 1.00 1.09 H new ATOM 1549 N MET A 118 0.685 7.437 -8.464 1.00 0.37 N ATOM 1550 CA MET A 118 1.966 7.974 -9.003 1.00 0.38 C ATOM 1551 C MET A 118 3.019 8.001 -7.891 1.00 0.30 C ATOM 1552 O MET A 118 4.176 7.701 -8.113 1.00 0.40 O ATOM 1553 CB MET A 118 1.743 9.393 -9.532 1.00 0.43 C ATOM 1554 CG MET A 118 0.470 9.428 -10.381 1.00 0.56 C ATOM 1555 SD MET A 118 0.766 10.410 -11.871 1.00 1.18 S ATOM 1556 CE MET A 118 -0.294 11.810 -11.433 1.00 2.08 C ATOM 0 H MET A 118 -0.090 8.100 -8.445 1.00 0.37 H new ATOM 0 HA MET A 118 2.314 7.335 -9.815 1.00 0.38 H new ATOM 0 HB2 MET A 118 1.658 10.093 -8.701 1.00 0.43 H new ATOM 0 HB3 MET A 118 2.599 9.709 -10.128 1.00 0.43 H new ATOM 0 HG2 MET A 118 0.174 8.415 -10.653 1.00 0.56 H new ATOM 0 HG3 MET A 118 -0.351 9.857 -9.807 1.00 0.56 H new ATOM 0 HE1 MET A 118 -0.262 12.554 -12.229 1.00 2.08 H new ATOM 0 HE2 MET A 118 -1.319 11.463 -11.301 1.00 2.08 H new ATOM 0 HE3 MET A 118 0.060 12.258 -10.504 1.00 2.08 H new ATOM 1566 N SER A 119 2.628 8.358 -6.698 1.00 0.18 N ATOM 1567 CA SER A 119 3.605 8.402 -5.573 1.00 0.26 C ATOM 1568 C SER A 119 4.072 6.982 -5.243 1.00 0.19 C ATOM 1569 O SER A 119 5.252 6.700 -5.198 1.00 0.17 O ATOM 1570 CB SER A 119 2.934 9.017 -4.345 1.00 0.34 C ATOM 1571 OG SER A 119 3.687 10.142 -3.912 1.00 0.50 O ATOM 0 H SER A 119 1.673 8.621 -6.454 1.00 0.18 H new ATOM 0 HA SER A 119 4.465 9.007 -5.861 1.00 0.26 H new ATOM 0 HB2 SER A 119 1.915 9.318 -4.586 1.00 0.34 H new ATOM 0 HB3 SER A 119 2.868 8.280 -3.545 1.00 0.34 H new ATOM 0 HG SER A 119 3.097 10.771 -3.447 1.00 0.50 H new ATOM 1577 N THR A 120 3.154 6.085 -5.012 1.00 0.17 N ATOM 1578 CA THR A 120 3.541 4.685 -4.686 1.00 0.15 C ATOM 1579 C THR A 120 4.321 4.080 -5.859 1.00 0.17 C ATOM 1580 O THR A 120 5.019 3.096 -5.709 1.00 0.23 O ATOM 1581 CB THR A 120 2.278 3.863 -4.416 1.00 0.16 C ATOM 1582 OG1 THR A 120 1.351 4.066 -5.473 1.00 0.95 O ATOM 1583 CG2 THR A 120 1.654 4.308 -3.092 1.00 0.91 C ATOM 0 H THR A 120 2.150 6.262 -5.035 1.00 0.17 H new ATOM 0 HA THR A 120 4.174 4.675 -3.799 1.00 0.15 H new ATOM 0 HB THR A 120 2.535 2.805 -4.356 1.00 0.16 H new ATOM 0 HG1 THR A 120 0.837 4.883 -5.305 1.00 0.95 H new ATOM 0 HG21 THR A 120 0.755 3.723 -2.899 1.00 0.91 H new ATOM 0 HG22 THR A 120 2.368 4.153 -2.283 1.00 0.91 H new ATOM 0 HG23 THR A 120 1.394 5.365 -3.149 1.00 0.91 H new ATOM 1591 N LYS A 121 4.229 4.671 -7.022 1.00 0.21 N ATOM 1592 CA LYS A 121 4.988 4.144 -8.189 1.00 0.27 C ATOM 1593 C LYS A 121 6.396 4.730 -8.124 1.00 0.21 C ATOM 1594 O LYS A 121 7.362 4.117 -8.528 1.00 0.21 O ATOM 1595 CB LYS A 121 4.293 4.579 -9.488 1.00 0.38 C ATOM 1596 CG LYS A 121 5.174 4.244 -10.696 1.00 1.58 C ATOM 1597 CD LYS A 121 5.287 2.726 -10.847 1.00 1.23 C ATOM 1598 CE LYS A 121 6.714 2.360 -11.260 1.00 2.76 C ATOM 1599 NZ LYS A 121 6.701 1.062 -11.990 1.00 3.11 N ATOM 0 H LYS A 121 3.660 5.496 -7.212 1.00 0.21 H new ATOM 0 HA LYS A 121 5.031 3.055 -8.169 1.00 0.27 H new ATOM 0 HB2 LYS A 121 3.330 4.076 -9.580 1.00 0.38 H new ATOM 0 HB3 LYS A 121 4.092 5.650 -9.461 1.00 0.38 H new ATOM 0 HG2 LYS A 121 4.748 4.678 -11.600 1.00 1.58 H new ATOM 0 HG3 LYS A 121 6.164 4.681 -10.568 1.00 1.58 H new ATOM 0 HD2 LYS A 121 5.032 2.236 -9.907 1.00 1.23 H new ATOM 0 HD3 LYS A 121 4.578 2.370 -11.595 1.00 1.23 H new ATOM 0 HE2 LYS A 121 7.133 3.142 -11.894 1.00 2.76 H new ATOM 0 HE3 LYS A 121 7.352 2.288 -10.379 1.00 2.76 H new ATOM 0 HZ1 LYS A 121 7.614 0.582 -11.860 1.00 3.11 H new ATOM 0 HZ2 LYS A 121 5.938 0.462 -11.617 1.00 3.11 H new ATOM 0 HZ3 LYS A 121 6.542 1.235 -13.003 1.00 3.11 H new ATOM 1613 N VAL A 122 6.508 5.918 -7.601 1.00 0.20 N ATOM 1614 CA VAL A 122 7.839 6.566 -7.483 1.00 0.20 C ATOM 1615 C VAL A 122 8.679 5.805 -6.453 1.00 0.14 C ATOM 1616 O VAL A 122 9.886 5.760 -6.545 1.00 0.15 O ATOM 1617 CB VAL A 122 7.648 8.016 -7.037 1.00 0.28 C ATOM 1618 CG1 VAL A 122 9.008 8.666 -6.791 1.00 0.35 C ATOM 1619 CG2 VAL A 122 6.911 8.783 -8.134 1.00 0.36 C ATOM 0 H VAL A 122 5.727 6.471 -7.248 1.00 0.20 H new ATOM 0 HA VAL A 122 8.353 6.550 -8.444 1.00 0.20 H new ATOM 0 HB VAL A 122 7.068 8.039 -6.114 1.00 0.28 H new ATOM 0 HG11 VAL A 122 8.865 9.699 -6.474 1.00 0.35 H new ATOM 0 HG12 VAL A 122 9.538 8.117 -6.013 1.00 0.35 H new ATOM 0 HG13 VAL A 122 9.592 8.647 -7.711 1.00 0.35 H new ATOM 0 HG21 VAL A 122 6.771 9.818 -7.823 1.00 0.36 H new ATOM 0 HG22 VAL A 122 7.497 8.756 -9.053 1.00 0.36 H new ATOM 0 HG23 VAL A 122 5.939 8.322 -8.310 1.00 0.36 H new ATOM 1629 N LEU A 123 8.051 5.202 -5.477 1.00 0.15 N ATOM 1630 CA LEU A 123 8.826 4.436 -4.454 1.00 0.18 C ATOM 1631 C LEU A 123 9.231 3.079 -5.039 1.00 0.18 C ATOM 1632 O LEU A 123 10.149 2.436 -4.569 1.00 0.36 O ATOM 1633 CB LEU A 123 7.966 4.206 -3.209 1.00 0.23 C ATOM 1634 CG LEU A 123 8.050 5.423 -2.288 1.00 0.28 C ATOM 1635 CD1 LEU A 123 9.501 5.658 -1.867 1.00 0.65 C ATOM 1636 CD2 LEU A 123 7.532 6.650 -3.032 1.00 0.16 C ATOM 0 H LEU A 123 7.040 5.206 -5.344 1.00 0.15 H new ATOM 0 HA LEU A 123 9.714 5.005 -4.179 1.00 0.18 H new ATOM 0 HB2 LEU A 123 6.930 4.029 -3.499 1.00 0.23 H new ATOM 0 HB3 LEU A 123 8.306 3.315 -2.681 1.00 0.23 H new ATOM 0 HG LEU A 123 7.445 5.246 -1.399 1.00 0.28 H new ATOM 0 HD11 LEU A 123 9.553 6.527 -1.211 1.00 0.65 H new ATOM 0 HD12 LEU A 123 9.873 4.781 -1.338 1.00 0.65 H new ATOM 0 HD13 LEU A 123 10.113 5.834 -2.752 1.00 0.65 H new ATOM 0 HD21 LEU A 123 7.589 7.522 -2.380 1.00 0.16 H new ATOM 0 HD22 LEU A 123 8.140 6.820 -3.920 1.00 0.16 H new ATOM 0 HD23 LEU A 123 6.496 6.486 -3.328 1.00 0.16 H new ATOM 1648 N ILE A 124 8.550 2.643 -6.063 1.00 0.25 N ATOM 1649 CA ILE A 124 8.882 1.334 -6.692 1.00 0.37 C ATOM 1650 C ILE A 124 10.094 1.517 -7.603 1.00 0.36 C ATOM 1651 O ILE A 124 11.060 0.779 -7.534 1.00 0.37 O ATOM 1652 CB ILE A 124 7.672 0.856 -7.509 1.00 0.46 C ATOM 1653 CG1 ILE A 124 6.524 0.516 -6.560 1.00 0.43 C ATOM 1654 CG2 ILE A 124 8.037 -0.391 -8.317 1.00 0.48 C ATOM 1655 CD1 ILE A 124 5.235 0.326 -7.362 1.00 0.59 C ATOM 0 H ILE A 124 7.772 3.142 -6.494 1.00 0.25 H new ATOM 0 HA ILE A 124 9.116 0.591 -5.929 1.00 0.37 H new ATOM 0 HB ILE A 124 7.372 1.650 -8.192 1.00 0.46 H new ATOM 0 HG12 ILE A 124 6.755 -0.392 -6.004 1.00 0.43 H new ATOM 0 HG13 ILE A 124 6.395 1.314 -5.828 1.00 0.43 H new ATOM 0 HG21 ILE A 124 7.171 -0.719 -8.891 1.00 0.48 H new ATOM 0 HG22 ILE A 124 8.856 -0.157 -8.997 1.00 0.48 H new ATOM 0 HG23 ILE A 124 8.345 -1.187 -7.639 1.00 0.48 H new ATOM 0 HD11 ILE A 124 4.417 0.083 -6.684 1.00 0.59 H new ATOM 0 HD12 ILE A 124 5.001 1.246 -7.898 1.00 0.59 H new ATOM 0 HD13 ILE A 124 5.367 -0.487 -8.076 1.00 0.59 H new ATOM 1667 N GLN A 125 10.054 2.501 -8.453 1.00 0.39 N ATOM 1668 CA GLN A 125 11.190 2.748 -9.365 1.00 0.41 C ATOM 1669 C GLN A 125 12.389 3.237 -8.556 1.00 0.27 C ATOM 1670 O GLN A 125 13.520 2.905 -8.840 1.00 0.36 O ATOM 1671 CB GLN A 125 10.772 3.810 -10.370 1.00 0.44 C ATOM 1672 CG GLN A 125 10.194 3.128 -11.609 1.00 0.63 C ATOM 1673 CD GLN A 125 10.266 4.085 -12.801 1.00 0.89 C ATOM 1674 OE1 GLN A 125 10.636 3.691 -13.890 1.00 1.10 O ATOM 1675 NE2 GLN A 125 9.925 5.334 -12.640 1.00 2.54 N ATOM 0 H GLN A 125 9.273 3.149 -8.552 1.00 0.39 H new ATOM 0 HA GLN A 125 11.468 1.833 -9.888 1.00 0.41 H new ATOM 0 HB2 GLN A 125 10.031 4.475 -9.927 1.00 0.44 H new ATOM 0 HB3 GLN A 125 11.629 4.425 -10.645 1.00 0.44 H new ATOM 0 HG2 GLN A 125 10.750 2.216 -11.827 1.00 0.63 H new ATOM 0 HG3 GLN A 125 9.160 2.835 -11.427 1.00 0.63 H new ATOM 0 HE21 GLN A 125 9.615 5.664 -11.726 1.00 2.54 H new ATOM 0 HE22 GLN A 125 9.969 5.980 -13.428 1.00 2.54 H new ATOM 1684 N PHE A 126 12.146 4.024 -7.545 1.00 0.11 N ATOM 1685 CA PHE A 126 13.268 4.533 -6.708 1.00 0.17 C ATOM 1686 C PHE A 126 13.829 3.394 -5.857 1.00 0.31 C ATOM 1687 O PHE A 126 15.008 3.335 -5.585 1.00 0.38 O ATOM 1688 CB PHE A 126 12.761 5.637 -5.776 1.00 0.18 C ATOM 1689 CG PHE A 126 12.838 6.972 -6.475 1.00 0.22 C ATOM 1690 CD1 PHE A 126 12.399 7.099 -7.798 1.00 0.25 C ATOM 1691 CD2 PHE A 126 13.353 8.085 -5.799 1.00 0.34 C ATOM 1692 CE1 PHE A 126 12.473 8.339 -8.444 1.00 0.39 C ATOM 1693 CE2 PHE A 126 13.427 9.324 -6.444 1.00 0.45 C ATOM 1694 CZ PHE A 126 12.988 9.452 -7.767 1.00 0.48 C ATOM 0 H PHE A 126 11.217 4.337 -7.262 1.00 0.11 H new ATOM 0 HA PHE A 126 14.045 4.929 -7.362 1.00 0.17 H new ATOM 0 HB2 PHE A 126 11.733 5.431 -5.479 1.00 0.18 H new ATOM 0 HB3 PHE A 126 13.358 5.659 -4.864 1.00 0.18 H new ATOM 0 HD1 PHE A 126 12.003 6.241 -8.320 1.00 0.25 H new ATOM 0 HD2 PHE A 126 13.693 7.987 -4.779 1.00 0.34 H new ATOM 0 HE1 PHE A 126 12.133 8.437 -9.464 1.00 0.39 H new ATOM 0 HE2 PHE A 126 13.823 10.182 -5.921 1.00 0.45 H new ATOM 0 HZ PHE A 126 13.046 10.408 -8.266 1.00 0.48 H new ATOM 1704 N LEU A 127 12.990 2.497 -5.419 1.00 0.39 N ATOM 1705 CA LEU A 127 13.476 1.373 -4.567 1.00 0.53 C ATOM 1706 C LEU A 127 14.237 0.349 -5.415 1.00 0.48 C ATOM 1707 O LEU A 127 15.029 -0.418 -4.908 1.00 0.89 O ATOM 1708 CB LEU A 127 12.279 0.687 -3.903 1.00 0.67 C ATOM 1709 CG LEU A 127 11.853 1.479 -2.667 1.00 0.92 C ATOM 1710 CD1 LEU A 127 10.526 0.930 -2.141 1.00 1.69 C ATOM 1711 CD2 LEU A 127 12.924 1.342 -1.582 1.00 0.71 C ATOM 0 H LEU A 127 11.989 2.493 -5.614 1.00 0.39 H new ATOM 0 HA LEU A 127 14.148 1.772 -3.807 1.00 0.53 H new ATOM 0 HB2 LEU A 127 11.450 0.619 -4.607 1.00 0.67 H new ATOM 0 HB3 LEU A 127 12.542 -0.332 -3.621 1.00 0.67 H new ATOM 0 HG LEU A 127 11.733 2.529 -2.932 1.00 0.92 H new ATOM 0 HD11 LEU A 127 10.222 1.495 -1.260 1.00 1.69 H new ATOM 0 HD12 LEU A 127 9.762 1.023 -2.913 1.00 1.69 H new ATOM 0 HD13 LEU A 127 10.647 -0.120 -1.875 1.00 1.69 H new ATOM 0 HD21 LEU A 127 12.622 1.906 -0.700 1.00 0.71 H new ATOM 0 HD22 LEU A 127 13.042 0.291 -1.318 1.00 0.71 H new ATOM 0 HD23 LEU A 127 13.871 1.731 -1.955 1.00 0.71 H new ATOM 1723 N GLN A 128 14.002 0.322 -6.698 1.00 0.34 N ATOM 1724 CA GLN A 128 14.717 -0.663 -7.560 1.00 0.36 C ATOM 1725 C GLN A 128 16.015 -0.046 -8.089 1.00 0.43 C ATOM 1726 O GLN A 128 17.000 -0.728 -8.289 1.00 0.55 O ATOM 1727 CB GLN A 128 13.821 -1.064 -8.736 1.00 0.33 C ATOM 1728 CG GLN A 128 13.430 0.180 -9.535 1.00 2.47 C ATOM 1729 CD GLN A 128 12.697 -0.244 -10.809 1.00 2.61 C ATOM 1730 OE1 GLN A 128 11.583 -0.728 -10.750 1.00 2.13 O ATOM 1731 NE2 GLN A 128 13.278 -0.084 -11.966 1.00 3.73 N ATOM 0 H GLN A 128 13.349 0.936 -7.186 1.00 0.34 H new ATOM 0 HA GLN A 128 14.956 -1.547 -6.969 1.00 0.36 H new ATOM 0 HB2 GLN A 128 14.344 -1.771 -9.379 1.00 0.33 H new ATOM 0 HB3 GLN A 128 12.927 -1.568 -8.369 1.00 0.33 H new ATOM 0 HG2 GLN A 128 12.792 0.827 -8.933 1.00 2.47 H new ATOM 0 HG3 GLN A 128 14.319 0.757 -9.789 1.00 2.47 H new ATOM 0 HE21 GLN A 128 14.212 0.322 -12.016 1.00 3.73 H new ATOM 0 HE22 GLN A 128 12.798 -0.365 -12.821 1.00 3.73 H new ATOM 1740 N LYS A 129 16.024 1.238 -8.318 1.00 0.37 N ATOM 1741 CA LYS A 129 17.259 1.896 -8.835 1.00 0.47 C ATOM 1742 C LYS A 129 18.242 2.101 -7.683 1.00 0.32 C ATOM 1743 O LYS A 129 19.378 1.672 -7.738 1.00 0.30 O ATOM 1744 CB LYS A 129 16.901 3.253 -9.446 1.00 0.56 C ATOM 1745 CG LYS A 129 16.102 3.041 -10.734 1.00 0.63 C ATOM 1746 CD LYS A 129 15.641 4.395 -11.278 1.00 0.98 C ATOM 1747 CE LYS A 129 15.803 4.418 -12.800 1.00 1.21 C ATOM 1748 NZ LYS A 129 16.042 5.818 -13.253 1.00 1.91 N ATOM 0 H LYS A 129 15.230 1.861 -8.170 1.00 0.37 H new ATOM 0 HA LYS A 129 17.715 1.265 -9.598 1.00 0.47 H new ATOM 0 HB2 LYS A 129 16.318 3.840 -8.737 1.00 0.56 H new ATOM 0 HB3 LYS A 129 17.808 3.819 -9.658 1.00 0.56 H new ATOM 0 HG2 LYS A 129 16.716 2.529 -11.475 1.00 0.63 H new ATOM 0 HG3 LYS A 129 15.240 2.403 -10.539 1.00 0.63 H new ATOM 0 HD2 LYS A 129 14.599 4.570 -11.010 1.00 0.98 H new ATOM 0 HD3 LYS A 129 16.225 5.197 -10.828 1.00 0.98 H new ATOM 0 HE2 LYS A 129 16.636 3.781 -13.097 1.00 1.21 H new ATOM 0 HE3 LYS A 129 14.909 4.017 -13.278 1.00 1.21 H new ATOM 0 HZ1 LYS A 129 16.152 5.834 -14.287 1.00 1.91 H new ATOM 0 HZ2 LYS A 129 15.234 6.413 -12.981 1.00 1.91 H new ATOM 0 HZ3 LYS A 129 16.907 6.184 -12.807 1.00 1.91 H new ATOM 1762 N LYS A 130 17.816 2.752 -6.635 1.00 0.29 N ATOM 1763 CA LYS A 130 18.726 2.980 -5.479 1.00 0.21 C ATOM 1764 C LYS A 130 18.595 1.830 -4.480 1.00 0.17 C ATOM 1765 O LYS A 130 18.701 2.029 -3.287 1.00 0.36 O ATOM 1766 CB LYS A 130 18.379 4.316 -4.799 1.00 0.44 C ATOM 1767 CG LYS A 130 17.060 4.196 -4.024 1.00 0.67 C ATOM 1768 CD LYS A 130 17.331 4.374 -2.528 1.00 0.47 C ATOM 1769 CE LYS A 130 16.595 3.285 -1.742 1.00 1.37 C ATOM 1770 NZ LYS A 130 16.842 3.464 -0.282 1.00 1.46 N ATOM 0 H LYS A 130 16.877 3.136 -6.530 1.00 0.29 H new ATOM 0 HA LYS A 130 19.755 3.021 -5.835 1.00 0.21 H new ATOM 0 HB2 LYS A 130 19.182 4.605 -4.121 1.00 0.44 H new ATOM 0 HB3 LYS A 130 18.297 5.103 -5.549 1.00 0.44 H new ATOM 0 HG2 LYS A 130 16.353 4.950 -4.369 1.00 0.67 H new ATOM 0 HG3 LYS A 130 16.604 3.223 -4.209 1.00 0.67 H new ATOM 0 HD2 LYS A 130 18.402 4.318 -2.332 1.00 0.47 H new ATOM 0 HD3 LYS A 130 16.999 5.360 -2.202 1.00 0.47 H new ATOM 0 HE2 LYS A 130 15.526 3.334 -1.948 1.00 1.37 H new ATOM 0 HE3 LYS A 130 16.936 2.300 -2.060 1.00 1.37 H new ATOM 0 HZ1 LYS A 130 17.288 2.607 0.102 1.00 1.46 H new ATOM 0 HZ2 LYS A 130 17.472 4.278 -0.134 1.00 1.46 H new ATOM 0 HZ3 LYS A 130 15.939 3.632 0.205 1.00 1.46 H new ATOM 1784 N ALA A 131 18.374 0.630 -4.947 1.00 0.28 N ATOM 1785 CA ALA A 131 18.256 -0.511 -4.002 1.00 0.38 C ATOM 1786 C ALA A 131 19.654 -1.055 -3.681 1.00 0.24 C ATOM 1787 O ALA A 131 19.885 -2.245 -3.704 1.00 0.32 O ATOM 1788 CB ALA A 131 17.402 -1.624 -4.621 1.00 0.62 C ATOM 0 H ALA A 131 18.271 0.395 -5.934 1.00 0.28 H new ATOM 0 HA ALA A 131 17.777 -0.166 -3.086 1.00 0.38 H new ATOM 0 HB1 ALA A 131 17.323 -2.455 -3.920 1.00 0.62 H new ATOM 0 HB2 ALA A 131 16.406 -1.239 -4.841 1.00 0.62 H new ATOM 0 HB3 ALA A 131 17.869 -1.971 -5.543 1.00 0.62 H new ATOM 1794 N LYS A 132 20.591 -0.198 -3.369 1.00 0.51 N ATOM 1795 CA LYS A 132 21.952 -0.695 -3.027 1.00 0.84 C ATOM 1796 C LYS A 132 21.822 -1.623 -1.819 1.00 1.13 C ATOM 1797 O LYS A 132 21.219 -1.273 -0.825 1.00 1.15 O ATOM 1798 CB LYS A 132 22.867 0.483 -2.679 1.00 0.91 C ATOM 1799 CG LYS A 132 22.115 1.471 -1.784 1.00 0.90 C ATOM 1800 CD LYS A 132 23.083 2.087 -0.773 1.00 1.26 C ATOM 1801 CE LYS A 132 22.368 2.278 0.566 1.00 1.56 C ATOM 1802 NZ LYS A 132 22.675 3.631 1.118 1.00 1.93 N ATOM 0 H LYS A 132 20.473 0.815 -3.337 1.00 0.51 H new ATOM 0 HA LYS A 132 22.384 -1.228 -3.874 1.00 0.84 H new ATOM 0 HB2 LYS A 132 23.761 0.124 -2.170 1.00 0.91 H new ATOM 0 HB3 LYS A 132 23.198 0.981 -3.590 1.00 0.91 H new ATOM 0 HG2 LYS A 132 21.661 2.254 -2.391 1.00 0.90 H new ATOM 0 HG3 LYS A 132 21.305 0.961 -1.263 1.00 0.90 H new ATOM 0 HD2 LYS A 132 23.952 1.441 -0.645 1.00 1.26 H new ATOM 0 HD3 LYS A 132 23.450 3.045 -1.142 1.00 1.26 H new ATOM 0 HE2 LYS A 132 21.292 2.166 0.433 1.00 1.56 H new ATOM 0 HE3 LYS A 132 22.684 1.508 1.270 1.00 1.56 H new ATOM 0 HZ1 LYS A 132 22.186 3.754 2.028 1.00 1.93 H new ATOM 0 HZ2 LYS A 132 23.701 3.723 1.261 1.00 1.93 H new ATOM 0 HZ3 LYS A 132 22.352 4.360 0.450 1.00 1.93 H new ATOM 1816 N ASN A 133 22.363 -2.808 -1.910 1.00 1.45 N ATOM 1817 CA ASN A 133 22.258 -3.788 -0.783 1.00 1.78 C ATOM 1818 C ASN A 133 20.865 -4.416 -0.796 1.00 1.60 C ATOM 1819 O ASN A 133 20.327 -4.808 0.220 1.00 1.80 O ATOM 1820 CB ASN A 133 22.517 -3.103 0.565 1.00 2.15 C ATOM 1821 CG ASN A 133 23.128 -4.109 1.541 1.00 2.93 C ATOM 1822 OD1 ASN A 133 23.425 -5.228 1.172 1.00 2.97 O ATOM 1823 ND2 ASN A 133 23.327 -3.758 2.782 1.00 3.80 N ATOM 0 H ASN A 133 22.878 -3.145 -2.723 1.00 1.45 H new ATOM 0 HA ASN A 133 23.013 -4.563 -0.915 1.00 1.78 H new ATOM 0 HB2 ASN A 133 23.190 -2.256 0.431 1.00 2.15 H new ATOM 0 HB3 ASN A 133 21.585 -2.709 0.969 1.00 2.15 H new ATOM 0 HD21 ASN A 133 23.732 -4.423 3.441 1.00 3.80 H new ATOM 0 HD22 ASN A 133 23.078 -2.819 3.093 1.00 3.80 H new ATOM 1830 N LEU A 134 20.300 -4.533 -1.963 1.00 1.25 N ATOM 1831 CA LEU A 134 18.954 -5.157 -2.118 1.00 1.14 C ATOM 1832 C LEU A 134 19.049 -6.153 -3.273 1.00 0.85 C ATOM 1833 O LEU A 134 20.123 -6.629 -3.587 1.00 1.21 O ATOM 1834 CB LEU A 134 17.885 -4.084 -2.404 1.00 1.31 C ATOM 1835 CG LEU A 134 17.590 -3.257 -1.141 1.00 1.55 C ATOM 1836 CD1 LEU A 134 17.286 -4.183 0.039 1.00 1.48 C ATOM 1837 CD2 LEU A 134 18.793 -2.377 -0.796 1.00 2.34 C ATOM 0 H LEU A 134 20.722 -4.216 -2.836 1.00 1.25 H new ATOM 0 HA LEU A 134 18.657 -5.664 -1.200 1.00 1.14 H new ATOM 0 HB2 LEU A 134 18.228 -3.426 -3.203 1.00 1.31 H new ATOM 0 HB3 LEU A 134 16.969 -4.561 -2.754 1.00 1.31 H new ATOM 0 HG LEU A 134 16.723 -2.626 -1.336 1.00 1.55 H new ATOM 0 HD11 LEU A 134 17.079 -3.585 0.927 1.00 1.48 H new ATOM 0 HD12 LEU A 134 16.417 -4.798 -0.195 1.00 1.48 H new ATOM 0 HD13 LEU A 134 18.145 -4.827 0.227 1.00 1.48 H new ATOM 0 HD21 LEU A 134 18.574 -1.796 0.100 1.00 2.34 H new ATOM 0 HD22 LEU A 134 19.664 -3.006 -0.616 1.00 2.34 H new ATOM 0 HD23 LEU A 134 18.999 -1.701 -1.626 1.00 2.34 H new ATOM 1849 N ASP A 135 17.961 -6.488 -3.904 1.00 0.82 N ATOM 1850 CA ASP A 135 18.059 -7.474 -5.024 1.00 1.14 C ATOM 1851 C ASP A 135 16.857 -7.385 -5.968 1.00 1.02 C ATOM 1852 O ASP A 135 16.552 -8.331 -6.666 1.00 1.99 O ATOM 1853 CB ASP A 135 18.138 -8.887 -4.444 1.00 1.97 C ATOM 1854 CG ASP A 135 18.943 -9.786 -5.387 1.00 2.34 C ATOM 1855 OD1 ASP A 135 19.622 -9.253 -6.248 1.00 2.12 O ATOM 1856 OD2 ASP A 135 18.864 -10.993 -5.230 1.00 3.15 O ATOM 0 H ASP A 135 17.026 -6.134 -3.703 1.00 0.82 H new ATOM 0 HA ASP A 135 18.956 -7.242 -5.598 1.00 1.14 H new ATOM 0 HB2 ASP A 135 18.608 -8.861 -3.461 1.00 1.97 H new ATOM 0 HB3 ASP A 135 17.135 -9.292 -4.308 1.00 1.97 H new ATOM 1861 N ALA A 136 16.160 -6.273 -5.973 1.00 0.39 N ATOM 1862 CA ALA A 136 14.949 -6.106 -6.848 1.00 0.85 C ATOM 1863 C ALA A 136 13.732 -6.654 -6.122 1.00 0.70 C ATOM 1864 O ALA A 136 12.611 -6.265 -6.381 1.00 1.31 O ATOM 1865 CB ALA A 136 15.115 -6.809 -8.201 1.00 1.29 C ATOM 0 H ALA A 136 16.381 -5.459 -5.399 1.00 0.39 H new ATOM 0 HA ALA A 136 14.820 -5.043 -7.051 1.00 0.85 H new ATOM 0 HB1 ALA A 136 14.216 -6.662 -8.800 1.00 1.29 H new ATOM 0 HB2 ALA A 136 15.974 -6.390 -8.726 1.00 1.29 H new ATOM 0 HB3 ALA A 136 15.273 -7.875 -8.040 1.00 1.29 H new ATOM 1871 N ILE A 137 13.950 -7.507 -5.173 1.00 0.28 N ATOM 1872 CA ILE A 137 12.834 -8.028 -4.380 1.00 0.54 C ATOM 1873 C ILE A 137 11.798 -8.703 -5.293 1.00 0.52 C ATOM 1874 O ILE A 137 10.655 -8.899 -4.931 1.00 1.01 O ATOM 1875 CB ILE A 137 12.252 -6.842 -3.603 1.00 0.76 C ATOM 1876 CG1 ILE A 137 13.244 -6.432 -2.499 1.00 0.86 C ATOM 1877 CG2 ILE A 137 10.925 -7.224 -2.959 1.00 0.99 C ATOM 1878 CD1 ILE A 137 14.564 -5.936 -3.108 1.00 0.46 C ATOM 0 H ILE A 137 14.869 -7.866 -4.915 1.00 0.28 H new ATOM 0 HA ILE A 137 13.159 -8.797 -3.680 1.00 0.54 H new ATOM 0 HB ILE A 137 12.085 -6.015 -4.293 1.00 0.76 H new ATOM 0 HG12 ILE A 137 12.805 -5.647 -1.883 1.00 0.86 H new ATOM 0 HG13 ILE A 137 13.437 -7.281 -1.844 1.00 0.86 H new ATOM 0 HG21 ILE A 137 10.527 -6.370 -2.412 1.00 0.99 H new ATOM 0 HG22 ILE A 137 10.217 -7.521 -3.733 1.00 0.99 H new ATOM 0 HG23 ILE A 137 11.080 -8.055 -2.271 1.00 0.99 H new ATOM 0 HD11 ILE A 137 15.249 -5.652 -2.309 1.00 0.46 H new ATOM 0 HD12 ILE A 137 15.011 -6.731 -3.704 1.00 0.46 H new ATOM 0 HD13 ILE A 137 14.370 -5.072 -3.744 1.00 0.46 H new ATOM 1890 N THR A 138 12.199 -9.091 -6.468 1.00 0.27 N ATOM 1891 CA THR A 138 11.246 -9.780 -7.384 1.00 0.22 C ATOM 1892 C THR A 138 9.973 -8.943 -7.539 1.00 0.31 C ATOM 1893 O THR A 138 9.953 -7.760 -7.260 1.00 0.59 O ATOM 1894 CB THR A 138 10.883 -11.143 -6.788 1.00 0.29 C ATOM 1895 OG1 THR A 138 11.932 -11.575 -5.931 1.00 0.52 O ATOM 1896 CG2 THR A 138 10.691 -12.161 -7.913 1.00 0.58 C ATOM 0 H THR A 138 13.142 -8.963 -6.835 1.00 0.27 H new ATOM 0 HA THR A 138 11.711 -9.909 -8.362 1.00 0.22 H new ATOM 0 HB THR A 138 9.957 -11.056 -6.219 1.00 0.29 H new ATOM 0 HG1 THR A 138 11.702 -12.447 -5.546 1.00 0.52 H new ATOM 0 HG21 THR A 138 10.433 -13.130 -7.486 1.00 0.58 H new ATOM 0 HG22 THR A 138 9.888 -11.829 -8.571 1.00 0.58 H new ATOM 0 HG23 THR A 138 11.615 -12.251 -8.484 1.00 0.58 H new ATOM 1904 N THR A 139 8.910 -9.554 -7.985 1.00 0.24 N ATOM 1905 CA THR A 139 7.637 -8.808 -8.163 1.00 0.47 C ATOM 1906 C THR A 139 6.525 -9.801 -8.544 1.00 0.50 C ATOM 1907 O THR A 139 6.792 -10.793 -9.192 1.00 0.32 O ATOM 1908 CB THR A 139 7.832 -7.755 -9.267 1.00 0.63 C ATOM 1909 OG1 THR A 139 6.793 -6.790 -9.192 1.00 0.85 O ATOM 1910 CG2 THR A 139 7.820 -8.415 -10.656 1.00 0.54 C ATOM 0 H THR A 139 8.870 -10.542 -8.234 1.00 0.24 H new ATOM 0 HA THR A 139 7.352 -8.303 -7.240 1.00 0.47 H new ATOM 0 HB THR A 139 8.797 -7.271 -9.119 1.00 0.63 H new ATOM 0 HG1 THR A 139 6.603 -6.444 -10.089 1.00 0.85 H new ATOM 0 HG21 THR A 139 7.959 -7.653 -11.422 1.00 0.54 H new ATOM 0 HG22 THR A 139 8.627 -9.145 -10.719 1.00 0.54 H new ATOM 0 HG23 THR A 139 6.865 -8.916 -10.812 1.00 0.54 H new ATOM 1918 N PRO A 140 5.309 -9.511 -8.142 1.00 0.91 N ATOM 1919 CA PRO A 140 4.164 -10.378 -8.453 1.00 1.10 C ATOM 1920 C PRO A 140 3.761 -10.209 -9.909 1.00 1.15 C ATOM 1921 O PRO A 140 3.114 -9.253 -10.288 1.00 1.50 O ATOM 1922 CB PRO A 140 3.067 -9.897 -7.500 1.00 1.66 C ATOM 1923 CG PRO A 140 3.442 -8.451 -7.101 1.00 1.79 C ATOM 1924 CD PRO A 140 4.955 -8.306 -7.356 1.00 1.29 C ATOM 0 HA PRO A 140 4.376 -11.439 -8.324 1.00 1.10 H new ATOM 0 HB2 PRO A 140 2.091 -9.926 -7.984 1.00 1.66 H new ATOM 0 HB3 PRO A 140 3.006 -10.539 -6.621 1.00 1.66 H new ATOM 0 HG2 PRO A 140 2.878 -7.727 -7.690 1.00 1.79 H new ATOM 0 HG3 PRO A 140 3.205 -8.264 -6.054 1.00 1.79 H new ATOM 0 HD2 PRO A 140 5.180 -7.392 -7.905 1.00 1.29 H new ATOM 0 HD3 PRO A 140 5.514 -8.262 -6.421 1.00 1.29 H new ATOM 1932 N ASP A 141 4.145 -11.152 -10.721 1.00 1.00 N ATOM 1933 CA ASP A 141 3.811 -11.115 -12.170 1.00 1.45 C ATOM 1934 C ASP A 141 2.332 -10.723 -12.351 1.00 1.05 C ATOM 1935 O ASP A 141 1.570 -10.798 -11.410 1.00 0.80 O ATOM 1936 CB ASP A 141 4.051 -12.515 -12.733 1.00 2.06 C ATOM 1937 CG ASP A 141 5.006 -12.445 -13.926 1.00 2.84 C ATOM 1938 OD1 ASP A 141 5.942 -11.667 -13.866 1.00 3.01 O ATOM 1939 OD2 ASP A 141 4.784 -13.174 -14.880 1.00 3.34 O ATOM 0 H ASP A 141 4.689 -11.966 -10.434 1.00 1.00 H new ATOM 0 HA ASP A 141 4.428 -10.383 -12.691 1.00 1.45 H new ATOM 0 HB2 ASP A 141 4.469 -13.160 -11.960 1.00 2.06 H new ATOM 0 HB3 ASP A 141 3.104 -12.959 -13.041 1.00 2.06 H new ATOM 1944 N PRO A 142 1.963 -10.311 -13.545 1.00 1.16 N ATOM 1945 CA PRO A 142 0.574 -9.906 -13.831 1.00 1.16 C ATOM 1946 C PRO A 142 -0.353 -11.126 -13.895 1.00 0.92 C ATOM 1947 O PRO A 142 -1.558 -10.993 -13.978 1.00 1.16 O ATOM 1948 CB PRO A 142 0.672 -9.201 -15.186 1.00 1.65 C ATOM 1949 CG PRO A 142 1.968 -9.715 -15.851 1.00 1.72 C ATOM 1950 CD PRO A 142 2.871 -10.217 -14.710 1.00 1.52 C ATOM 0 HA PRO A 142 0.151 -9.264 -13.059 1.00 1.16 H new ATOM 0 HB2 PRO A 142 -0.197 -9.425 -15.804 1.00 1.65 H new ATOM 0 HB3 PRO A 142 0.703 -8.119 -15.060 1.00 1.65 H new ATOM 0 HG2 PRO A 142 1.751 -10.517 -16.556 1.00 1.72 H new ATOM 0 HG3 PRO A 142 2.458 -8.920 -16.413 1.00 1.72 H new ATOM 0 HD2 PRO A 142 3.314 -11.184 -14.949 1.00 1.52 H new ATOM 0 HD3 PRO A 142 3.693 -9.527 -14.520 1.00 1.52 H new ATOM 1958 N THR A 143 0.190 -12.315 -13.840 1.00 0.71 N ATOM 1959 CA THR A 143 -0.676 -13.526 -13.878 1.00 1.05 C ATOM 1960 C THR A 143 -1.104 -13.862 -12.451 1.00 0.99 C ATOM 1961 O THR A 143 -2.264 -14.097 -12.178 1.00 1.23 O ATOM 1962 CB THR A 143 0.099 -14.700 -14.481 1.00 1.19 C ATOM 1963 OG1 THR A 143 1.225 -14.992 -13.665 1.00 1.26 O ATOM 1964 CG2 THR A 143 0.569 -14.333 -15.889 1.00 0.91 C ATOM 0 H THR A 143 1.191 -12.497 -13.771 1.00 0.71 H new ATOM 0 HA THR A 143 -1.555 -13.337 -14.494 1.00 1.05 H new ATOM 0 HB THR A 143 -0.549 -15.575 -14.533 1.00 1.19 H new ATOM 0 HG1 THR A 143 1.721 -15.745 -14.049 1.00 1.26 H new ATOM 0 HG21 THR A 143 1.121 -15.169 -16.318 1.00 0.91 H new ATOM 0 HG22 THR A 143 -0.295 -14.110 -16.514 1.00 0.91 H new ATOM 0 HG23 THR A 143 1.217 -13.458 -15.840 1.00 0.91 H new ATOM 1972 N THR A 144 -0.177 -13.863 -11.533 1.00 0.78 N ATOM 1973 CA THR A 144 -0.535 -14.153 -10.119 1.00 0.98 C ATOM 1974 C THR A 144 -1.337 -12.969 -9.583 1.00 0.85 C ATOM 1975 O THR A 144 -2.275 -13.122 -8.822 1.00 1.05 O ATOM 1976 CB THR A 144 0.744 -14.332 -9.298 1.00 1.03 C ATOM 1977 OG1 THR A 144 1.790 -14.775 -10.151 1.00 1.19 O ATOM 1978 CG2 THR A 144 0.509 -15.364 -8.195 1.00 1.41 C ATOM 0 H THR A 144 0.811 -13.676 -11.702 1.00 0.78 H new ATOM 0 HA THR A 144 -1.125 -15.067 -10.051 1.00 0.98 H new ATOM 0 HB THR A 144 1.021 -13.381 -8.844 1.00 1.03 H new ATOM 0 HG1 THR A 144 2.612 -14.889 -9.629 1.00 1.19 H new ATOM 0 HG21 THR A 144 1.422 -15.489 -7.613 1.00 1.41 H new ATOM 0 HG22 THR A 144 -0.294 -15.022 -7.542 1.00 1.41 H new ATOM 0 HG23 THR A 144 0.231 -16.318 -8.643 1.00 1.41 H new ATOM 1986 N ASN A 145 -0.984 -11.784 -10.003 1.00 0.53 N ATOM 1987 CA ASN A 145 -1.729 -10.578 -9.557 1.00 0.39 C ATOM 1988 C ASN A 145 -3.137 -10.617 -10.155 1.00 0.62 C ATOM 1989 O ASN A 145 -4.011 -9.878 -9.752 1.00 0.51 O ATOM 1990 CB ASN A 145 -1.006 -9.320 -10.042 1.00 0.26 C ATOM 1991 CG ASN A 145 -0.269 -8.668 -8.870 1.00 0.64 C ATOM 1992 OD1 ASN A 145 0.894 -8.333 -8.979 1.00 0.93 O ATOM 1993 ND2 ASN A 145 -0.902 -8.470 -7.746 1.00 0.85 N ATOM 0 H ASN A 145 -0.208 -11.602 -10.639 1.00 0.53 H new ATOM 0 HA ASN A 145 -1.787 -10.562 -8.469 1.00 0.39 H new ATOM 0 HB2 ASN A 145 -0.300 -9.576 -10.832 1.00 0.26 H new ATOM 0 HB3 ASN A 145 -1.722 -8.619 -10.470 1.00 0.26 H new ATOM 0 HD21 ASN A 145 -0.421 -8.034 -6.959 1.00 0.85 H new ATOM 0 HD22 ASN A 145 -1.878 -8.751 -7.654 1.00 0.85 H new ATOM 2000 N ALA A 146 -3.366 -11.481 -11.110 1.00 1.01 N ATOM 2001 CA ALA A 146 -4.717 -11.577 -11.721 1.00 1.33 C ATOM 2002 C ALA A 146 -5.591 -12.448 -10.836 1.00 1.52 C ATOM 2003 O ALA A 146 -6.792 -12.319 -10.829 1.00 1.70 O ATOM 2004 CB ALA A 146 -4.607 -12.198 -13.114 1.00 1.50 C ATOM 0 H ALA A 146 -2.672 -12.124 -11.491 1.00 1.01 H new ATOM 0 HA ALA A 146 -5.157 -10.584 -11.811 1.00 1.33 H new ATOM 0 HB1 ALA A 146 -5.599 -12.268 -13.561 1.00 1.50 H new ATOM 0 HB2 ALA A 146 -3.970 -11.575 -13.741 1.00 1.50 H new ATOM 0 HB3 ALA A 146 -4.174 -13.195 -13.035 1.00 1.50 H new ATOM 2010 N SER A 147 -5.002 -13.323 -10.075 1.00 1.54 N ATOM 2011 CA SER A 147 -5.820 -14.178 -9.178 1.00 1.78 C ATOM 2012 C SER A 147 -6.159 -13.371 -7.926 1.00 1.63 C ATOM 2013 O SER A 147 -7.262 -13.428 -7.421 1.00 1.73 O ATOM 2014 CB SER A 147 -5.036 -15.434 -8.796 1.00 1.93 C ATOM 2015 OG SER A 147 -5.878 -16.571 -8.929 1.00 2.09 O ATOM 0 H SER A 147 -3.995 -13.483 -10.035 1.00 1.54 H new ATOM 0 HA SER A 147 -6.735 -14.485 -9.684 1.00 1.78 H new ATOM 0 HB2 SER A 147 -4.160 -15.539 -9.436 1.00 1.93 H new ATOM 0 HB3 SER A 147 -4.674 -15.353 -7.771 1.00 1.93 H new ATOM 0 HG SER A 147 -5.378 -17.378 -8.687 1.00 2.09 H new ATOM 2021 N LEU A 148 -5.228 -12.599 -7.433 1.00 1.39 N ATOM 2022 CA LEU A 148 -5.523 -11.770 -6.231 1.00 1.26 C ATOM 2023 C LEU A 148 -6.535 -10.702 -6.629 1.00 1.15 C ATOM 2024 O LEU A 148 -7.544 -10.519 -5.990 1.00 1.11 O ATOM 2025 CB LEU A 148 -4.243 -11.082 -5.733 1.00 1.08 C ATOM 2026 CG LEU A 148 -4.602 -9.946 -4.752 1.00 0.95 C ATOM 2027 CD1 LEU A 148 -5.495 -10.476 -3.628 1.00 1.12 C ATOM 2028 CD2 LEU A 148 -3.332 -9.367 -4.146 1.00 0.95 C ATOM 0 H LEU A 148 -4.284 -12.507 -7.808 1.00 1.39 H new ATOM 0 HA LEU A 148 -5.916 -12.403 -5.435 1.00 1.26 H new ATOM 0 HB2 LEU A 148 -3.598 -11.809 -5.240 1.00 1.08 H new ATOM 0 HB3 LEU A 148 -3.684 -10.681 -6.578 1.00 1.08 H new ATOM 0 HG LEU A 148 -5.136 -9.171 -5.301 1.00 0.95 H new ATOM 0 HD11 LEU A 148 -5.740 -9.663 -2.944 1.00 1.12 H new ATOM 0 HD12 LEU A 148 -6.413 -10.881 -4.053 1.00 1.12 H new ATOM 0 HD13 LEU A 148 -4.969 -11.261 -3.085 1.00 1.12 H new ATOM 0 HD21 LEU A 148 -3.591 -8.566 -3.454 1.00 0.95 H new ATOM 0 HD22 LEU A 148 -2.795 -10.150 -3.610 1.00 0.95 H new ATOM 0 HD23 LEU A 148 -2.698 -8.971 -4.939 1.00 0.95 H new ATOM 2040 N LEU A 149 -6.249 -9.986 -7.673 1.00 1.12 N ATOM 2041 CA LEU A 149 -7.172 -8.917 -8.120 1.00 1.05 C ATOM 2042 C LEU A 149 -8.511 -9.542 -8.479 1.00 1.20 C ATOM 2043 O LEU A 149 -9.557 -8.986 -8.227 1.00 1.18 O ATOM 2044 CB LEU A 149 -6.585 -8.233 -9.354 1.00 1.01 C ATOM 2045 CG LEU A 149 -7.526 -7.122 -9.829 1.00 0.98 C ATOM 2046 CD1 LEU A 149 -7.836 -6.174 -8.670 1.00 0.80 C ATOM 2047 CD2 LEU A 149 -6.858 -6.335 -10.959 1.00 0.98 C ATOM 0 H LEU A 149 -5.408 -10.097 -8.240 1.00 1.12 H new ATOM 0 HA LEU A 149 -7.308 -8.183 -7.325 1.00 1.05 H new ATOM 0 HB2 LEU A 149 -5.606 -7.817 -9.119 1.00 1.01 H new ATOM 0 HB3 LEU A 149 -6.438 -8.963 -10.150 1.00 1.01 H new ATOM 0 HG LEU A 149 -8.453 -7.569 -10.189 1.00 0.98 H new ATOM 0 HD11 LEU A 149 -8.506 -5.386 -9.014 1.00 0.80 H new ATOM 0 HD12 LEU A 149 -8.314 -6.730 -7.863 1.00 0.80 H new ATOM 0 HD13 LEU A 149 -6.910 -5.730 -8.306 1.00 0.80 H new ATOM 0 HD21 LEU A 149 -7.528 -5.544 -11.297 1.00 0.98 H new ATOM 0 HD22 LEU A 149 -5.930 -5.894 -10.596 1.00 0.98 H new ATOM 0 HD23 LEU A 149 -6.640 -7.006 -11.790 1.00 0.98 H new ATOM 2059 N THR A 150 -8.479 -10.706 -9.056 1.00 1.37 N ATOM 2060 CA THR A 150 -9.740 -11.398 -9.425 1.00 1.53 C ATOM 2061 C THR A 150 -10.433 -11.858 -8.136 1.00 1.58 C ATOM 2062 O THR A 150 -11.627 -12.069 -8.103 1.00 1.67 O ATOM 2063 CB THR A 150 -9.394 -12.594 -10.327 1.00 1.71 C ATOM 2064 OG1 THR A 150 -9.039 -12.112 -11.616 1.00 1.92 O ATOM 2065 CG2 THR A 150 -10.586 -13.536 -10.461 1.00 1.17 C ATOM 0 H THR A 150 -7.625 -11.213 -9.290 1.00 1.37 H new ATOM 0 HA THR A 150 -10.414 -10.736 -9.968 1.00 1.53 H new ATOM 0 HB THR A 150 -8.564 -13.141 -9.880 1.00 1.71 H new ATOM 0 HG1 THR A 150 -8.089 -12.288 -11.781 1.00 1.92 H new ATOM 0 HG21 THR A 150 -10.317 -14.374 -11.104 1.00 1.17 H new ATOM 0 HG22 THR A 150 -10.867 -13.909 -9.476 1.00 1.17 H new ATOM 0 HG23 THR A 150 -11.427 -12.999 -10.899 1.00 1.17 H new ATOM 2073 N LYS A 151 -9.683 -12.006 -7.074 1.00 1.54 N ATOM 2074 CA LYS A 151 -10.275 -12.438 -5.776 1.00 1.60 C ATOM 2075 C LYS A 151 -11.039 -11.268 -5.140 1.00 1.34 C ATOM 2076 O LYS A 151 -12.195 -11.394 -4.789 1.00 1.14 O ATOM 2077 CB LYS A 151 -9.151 -12.882 -4.839 1.00 1.66 C ATOM 2078 CG LYS A 151 -9.741 -13.607 -3.629 1.00 1.78 C ATOM 2079 CD LYS A 151 -8.610 -14.248 -2.822 1.00 1.87 C ATOM 2080 CE LYS A 151 -8.682 -13.777 -1.368 1.00 2.26 C ATOM 2081 NZ LYS A 151 -9.959 -14.243 -0.758 1.00 1.65 N ATOM 0 H LYS A 151 -8.676 -11.844 -7.053 1.00 1.54 H new ATOM 0 HA LYS A 151 -10.964 -13.265 -5.946 1.00 1.60 H new ATOM 0 HB2 LYS A 151 -8.462 -13.540 -5.369 1.00 1.66 H new ATOM 0 HB3 LYS A 151 -8.576 -12.016 -4.511 1.00 1.66 H new ATOM 0 HG2 LYS A 151 -10.296 -12.906 -3.006 1.00 1.78 H new ATOM 0 HG3 LYS A 151 -10.447 -14.370 -3.957 1.00 1.78 H new ATOM 0 HD2 LYS A 151 -8.689 -15.334 -2.867 1.00 1.87 H new ATOM 0 HD3 LYS A 151 -7.646 -13.980 -3.254 1.00 1.87 H new ATOM 0 HE2 LYS A 151 -7.834 -14.168 -0.806 1.00 2.26 H new ATOM 0 HE3 LYS A 151 -8.621 -12.690 -1.323 1.00 2.26 H new ATOM 0 HZ1 LYS A 151 -9.846 -14.313 0.273 1.00 1.65 H new ATOM 0 HZ2 LYS A 151 -10.717 -13.565 -0.978 1.00 1.65 H new ATOM 0 HZ3 LYS A 151 -10.207 -15.177 -1.143 1.00 1.65 H new ATOM 2095 N LEU A 152 -10.413 -10.124 -4.997 1.00 1.35 N ATOM 2096 CA LEU A 152 -11.141 -8.965 -4.396 1.00 1.12 C ATOM 2097 C LEU A 152 -12.259 -8.573 -5.348 1.00 1.02 C ATOM 2098 O LEU A 152 -13.290 -8.073 -4.944 1.00 0.78 O ATOM 2099 CB LEU A 152 -10.225 -7.746 -4.142 1.00 1.22 C ATOM 2100 CG LEU A 152 -8.951 -7.789 -4.993 1.00 0.21 C ATOM 2101 CD1 LEU A 152 -8.466 -6.362 -5.256 1.00 0.65 C ATOM 2102 CD2 LEU A 152 -7.866 -8.551 -4.232 1.00 0.85 C ATOM 0 H LEU A 152 -9.445 -9.945 -5.266 1.00 1.35 H new ATOM 0 HA LEU A 152 -11.528 -9.270 -3.424 1.00 1.12 H new ATOM 0 HB2 LEU A 152 -10.774 -6.830 -4.360 1.00 1.22 H new ATOM 0 HB3 LEU A 152 -9.954 -7.712 -3.087 1.00 1.22 H new ATOM 0 HG LEU A 152 -9.161 -8.286 -5.940 1.00 0.21 H new ATOM 0 HD11 LEU A 152 -7.560 -6.391 -5.861 1.00 0.65 H new ATOM 0 HD12 LEU A 152 -9.239 -5.807 -5.787 1.00 0.65 H new ATOM 0 HD13 LEU A 152 -8.253 -5.870 -4.307 1.00 0.65 H new ATOM 0 HD21 LEU A 152 -6.957 -8.585 -4.832 1.00 0.85 H new ATOM 0 HD22 LEU A 152 -7.660 -8.045 -3.289 1.00 0.85 H new ATOM 0 HD23 LEU A 152 -8.207 -9.567 -4.032 1.00 0.85 H new ATOM 2114 N GLN A 153 -12.069 -8.813 -6.615 1.00 1.28 N ATOM 2115 CA GLN A 153 -13.130 -8.472 -7.593 1.00 1.34 C ATOM 2116 C GLN A 153 -14.143 -9.624 -7.667 1.00 1.44 C ATOM 2117 O GLN A 153 -15.241 -9.464 -8.160 1.00 1.48 O ATOM 2118 CB GLN A 153 -12.512 -8.247 -8.975 1.00 1.56 C ATOM 2119 CG GLN A 153 -12.328 -6.747 -9.217 1.00 1.27 C ATOM 2120 CD GLN A 153 -13.126 -6.328 -10.452 1.00 1.53 C ATOM 2121 OE1 GLN A 153 -14.195 -5.762 -10.335 1.00 1.22 O ATOM 2122 NE2 GLN A 153 -12.650 -6.584 -11.639 1.00 2.40 N ATOM 0 H GLN A 153 -11.226 -9.229 -7.012 1.00 1.28 H new ATOM 0 HA GLN A 153 -13.634 -7.560 -7.274 1.00 1.34 H new ATOM 0 HB2 GLN A 153 -11.551 -8.757 -9.042 1.00 1.56 H new ATOM 0 HB3 GLN A 153 -13.154 -8.674 -9.746 1.00 1.56 H new ATOM 0 HG2 GLN A 153 -12.663 -6.184 -8.346 1.00 1.27 H new ATOM 0 HG3 GLN A 153 -11.272 -6.517 -9.358 1.00 1.27 H new ATOM 0 HE21 GLN A 153 -11.753 -7.059 -11.737 1.00 2.40 H new ATOM 0 HE22 GLN A 153 -13.175 -6.309 -12.469 1.00 2.40 H new ATOM 2131 N ALA A 154 -13.779 -10.785 -7.184 1.00 1.55 N ATOM 2132 CA ALA A 154 -14.718 -11.945 -7.232 1.00 1.66 C ATOM 2133 C ALA A 154 -15.513 -12.025 -5.926 1.00 1.58 C ATOM 2134 O ALA A 154 -16.083 -13.047 -5.599 1.00 1.77 O ATOM 2135 CB ALA A 154 -13.919 -13.238 -7.414 1.00 1.78 C ATOM 0 H ALA A 154 -12.872 -10.979 -6.759 1.00 1.55 H new ATOM 0 HA ALA A 154 -15.406 -11.814 -8.067 1.00 1.66 H new ATOM 0 HB1 ALA A 154 -14.603 -14.086 -7.449 1.00 1.78 H new ATOM 0 HB2 ALA A 154 -13.354 -13.188 -8.345 1.00 1.78 H new ATOM 0 HB3 ALA A 154 -13.231 -13.361 -6.578 1.00 1.78 H new ATOM 2141 N GLN A 155 -15.561 -10.957 -5.178 1.00 1.30 N ATOM 2142 CA GLN A 155 -16.324 -10.982 -3.899 1.00 1.22 C ATOM 2143 C GLN A 155 -17.653 -10.251 -4.096 1.00 1.12 C ATOM 2144 O GLN A 155 -17.797 -9.437 -4.985 1.00 1.12 O ATOM 2145 CB GLN A 155 -15.513 -10.283 -2.807 1.00 1.21 C ATOM 2146 CG GLN A 155 -14.106 -10.884 -2.756 1.00 1.30 C ATOM 2147 CD GLN A 155 -13.899 -11.589 -1.414 1.00 1.43 C ATOM 2148 OE1 GLN A 155 -14.516 -12.599 -1.144 1.00 1.66 O ATOM 2149 NE2 GLN A 155 -13.048 -11.094 -0.557 1.00 1.42 N ATOM 0 H GLN A 155 -15.106 -10.071 -5.397 1.00 1.30 H new ATOM 0 HA GLN A 155 -16.512 -12.014 -3.603 1.00 1.22 H new ATOM 0 HB2 GLN A 155 -15.457 -9.213 -3.009 1.00 1.21 H new ATOM 0 HB3 GLN A 155 -16.006 -10.400 -1.842 1.00 1.21 H new ATOM 0 HG2 GLN A 155 -13.971 -11.591 -3.575 1.00 1.30 H new ATOM 0 HG3 GLN A 155 -13.360 -10.100 -2.886 1.00 1.30 H new ATOM 0 HE21 GLN A 155 -12.530 -10.245 -0.785 1.00 1.42 H new ATOM 0 HE22 GLN A 155 -12.901 -11.556 0.340 1.00 1.42 H new ATOM 2158 N ASN A 156 -18.626 -10.531 -3.272 1.00 1.07 N ATOM 2159 CA ASN A 156 -19.941 -9.844 -3.418 1.00 0.97 C ATOM 2160 C ASN A 156 -19.723 -8.332 -3.404 1.00 0.90 C ATOM 2161 O ASN A 156 -18.668 -7.857 -3.040 1.00 1.02 O ATOM 2162 CB ASN A 156 -20.856 -10.239 -2.257 1.00 0.85 C ATOM 2163 CG ASN A 156 -21.733 -11.419 -2.678 1.00 0.73 C ATOM 2164 OD1 ASN A 156 -22.344 -11.393 -3.728 1.00 0.81 O ATOM 2165 ND2 ASN A 156 -21.822 -12.462 -1.899 1.00 0.91 N ATOM 0 H ASN A 156 -18.568 -11.203 -2.507 1.00 1.07 H new ATOM 0 HA ASN A 156 -20.405 -10.138 -4.359 1.00 0.97 H new ATOM 0 HB2 ASN A 156 -20.260 -10.508 -1.385 1.00 0.85 H new ATOM 0 HB3 ASN A 156 -21.480 -9.393 -1.968 1.00 0.85 H new ATOM 0 HD21 ASN A 156 -22.404 -13.254 -2.172 1.00 0.91 H new ATOM 0 HD22 ASN A 156 -21.310 -12.485 -1.017 1.00 0.91 H new ATOM 2172 N GLN A 157 -20.704 -7.571 -3.800 1.00 0.79 N ATOM 2173 CA GLN A 157 -20.537 -6.092 -3.805 1.00 0.81 C ATOM 2174 C GLN A 157 -20.151 -5.623 -2.403 1.00 0.61 C ATOM 2175 O GLN A 157 -19.457 -4.641 -2.233 1.00 0.61 O ATOM 2176 CB GLN A 157 -21.851 -5.429 -4.220 1.00 0.88 C ATOM 2177 CG GLN A 157 -21.633 -3.924 -4.384 1.00 0.84 C ATOM 2178 CD GLN A 157 -22.533 -3.395 -5.501 1.00 0.83 C ATOM 2179 OE1 GLN A 157 -23.319 -4.132 -6.064 1.00 1.48 O ATOM 2180 NE2 GLN A 157 -22.450 -2.140 -5.848 1.00 0.86 N ATOM 0 H GLN A 157 -21.612 -7.908 -4.120 1.00 0.79 H new ATOM 0 HA GLN A 157 -19.755 -5.816 -4.512 1.00 0.81 H new ATOM 0 HB2 GLN A 157 -22.208 -5.860 -5.155 1.00 0.88 H new ATOM 0 HB3 GLN A 157 -22.618 -5.616 -3.469 1.00 0.88 H new ATOM 0 HG2 GLN A 157 -21.856 -3.410 -3.449 1.00 0.84 H new ATOM 0 HG3 GLN A 157 -20.588 -3.721 -4.618 1.00 0.84 H new ATOM 0 HE21 GLN A 157 -21.790 -1.523 -5.375 1.00 0.86 H new ATOM 0 HE22 GLN A 157 -23.045 -1.776 -6.592 1.00 0.86 H new ATOM 2189 N TRP A 158 -20.598 -6.320 -1.394 1.00 0.45 N ATOM 2190 CA TRP A 158 -20.259 -5.919 0.001 1.00 0.25 C ATOM 2191 C TRP A 158 -18.757 -6.093 0.235 1.00 0.21 C ATOM 2192 O TRP A 158 -18.043 -5.144 0.491 1.00 0.20 O ATOM 2193 CB TRP A 158 -21.027 -6.803 0.985 1.00 0.08 C ATOM 2194 CG TRP A 158 -20.766 -6.338 2.383 1.00 0.21 C ATOM 2195 CD1 TRP A 158 -19.672 -6.652 3.115 1.00 0.19 C ATOM 2196 CD2 TRP A 158 -21.593 -5.487 3.227 1.00 0.60 C ATOM 2197 NE1 TRP A 158 -19.775 -6.047 4.355 1.00 0.46 N ATOM 2198 CE2 TRP A 158 -20.942 -5.318 4.472 1.00 0.75 C ATOM 2199 CE3 TRP A 158 -22.834 -4.851 3.035 1.00 0.87 C ATOM 2200 CZ2 TRP A 158 -21.503 -4.546 5.491 1.00 1.13 C ATOM 2201 CZ3 TRP A 158 -23.400 -4.074 4.058 1.00 1.26 C ATOM 2202 CH2 TRP A 158 -22.735 -3.921 5.283 1.00 1.39 C ATOM 0 H TRP A 158 -21.184 -7.151 -1.476 1.00 0.45 H new ATOM 0 HA TRP A 158 -20.533 -4.875 0.153 1.00 0.25 H new ATOM 0 HB2 TRP A 158 -22.095 -6.762 0.770 1.00 0.08 H new ATOM 0 HB3 TRP A 158 -20.719 -7.843 0.873 1.00 0.08 H new ATOM 0 HD1 TRP A 158 -18.852 -7.273 2.785 1.00 0.19 H new ATOM 0 HE1 TRP A 158 -19.075 -6.129 5.092 1.00 0.46 H new ATOM 0 HE3 TRP A 158 -23.354 -4.961 2.095 1.00 0.87 H new ATOM 0 HZ2 TRP A 158 -20.988 -4.433 6.434 1.00 1.13 H new ATOM 0 HZ3 TRP A 158 -24.353 -3.591 3.901 1.00 1.26 H new ATOM 0 HH2 TRP A 158 -23.175 -3.320 6.065 1.00 1.39 H new ATOM 2213 N LEU A 159 -18.271 -7.303 0.152 1.00 0.33 N ATOM 2214 CA LEU A 159 -16.816 -7.543 0.374 1.00 0.40 C ATOM 2215 C LEU A 159 -15.992 -6.751 -0.648 1.00 0.44 C ATOM 2216 O LEU A 159 -14.806 -6.548 -0.475 1.00 0.49 O ATOM 2217 CB LEU A 159 -16.523 -9.038 0.226 1.00 0.61 C ATOM 2218 CG LEU A 159 -16.832 -9.749 1.546 1.00 0.82 C ATOM 2219 CD1 LEU A 159 -17.141 -11.223 1.280 1.00 1.05 C ATOM 2220 CD2 LEU A 159 -15.623 -9.641 2.477 1.00 1.01 C ATOM 0 H LEU A 159 -18.820 -8.136 -0.060 1.00 0.33 H new ATOM 0 HA LEU A 159 -16.545 -7.214 1.377 1.00 0.40 H new ATOM 0 HB2 LEU A 159 -17.126 -9.460 -0.577 1.00 0.61 H new ATOM 0 HB3 LEU A 159 -15.479 -9.190 -0.046 1.00 0.61 H new ATOM 0 HG LEU A 159 -17.697 -9.280 2.014 1.00 0.82 H new ATOM 0 HD11 LEU A 159 -17.360 -11.725 2.223 1.00 1.05 H new ATOM 0 HD12 LEU A 159 -18.004 -11.300 0.619 1.00 1.05 H new ATOM 0 HD13 LEU A 159 -16.279 -11.696 0.809 1.00 1.05 H new ATOM 0 HD21 LEU A 159 -15.842 -10.147 3.417 1.00 1.01 H new ATOM 0 HD22 LEU A 159 -14.758 -10.108 2.006 1.00 1.01 H new ATOM 0 HD23 LEU A 159 -15.406 -8.591 2.672 1.00 1.01 H new ATOM 2232 N GLN A 160 -16.605 -6.297 -1.709 1.00 0.46 N ATOM 2233 CA GLN A 160 -15.847 -5.519 -2.728 1.00 0.56 C ATOM 2234 C GLN A 160 -15.631 -4.094 -2.215 1.00 0.45 C ATOM 2235 O GLN A 160 -14.554 -3.542 -2.327 1.00 0.49 O ATOM 2236 CB GLN A 160 -16.637 -5.484 -4.038 1.00 0.74 C ATOM 2237 CG GLN A 160 -16.080 -6.542 -4.993 1.00 1.74 C ATOM 2238 CD GLN A 160 -16.897 -6.552 -6.285 1.00 2.21 C ATOM 2239 OE1 GLN A 160 -18.087 -6.798 -6.265 1.00 2.82 O ATOM 2240 NE2 GLN A 160 -16.304 -6.294 -7.418 1.00 2.49 N ATOM 0 H GLN A 160 -17.595 -6.432 -1.912 1.00 0.46 H new ATOM 0 HA GLN A 160 -14.881 -5.991 -2.907 1.00 0.56 H new ATOM 0 HB2 GLN A 160 -17.693 -5.672 -3.844 1.00 0.74 H new ATOM 0 HB3 GLN A 160 -16.567 -4.495 -4.492 1.00 0.74 H new ATOM 0 HG2 GLN A 160 -15.034 -6.331 -5.215 1.00 1.74 H new ATOM 0 HG3 GLN A 160 -16.114 -7.525 -4.522 1.00 1.74 H new ATOM 0 HE21 GLN A 160 -15.305 -6.087 -7.435 1.00 2.49 H new ATOM 0 HE22 GLN A 160 -16.839 -6.299 -8.286 1.00 2.49 H new ATOM 2249 N ASP A 161 -16.640 -3.498 -1.643 1.00 0.39 N ATOM 2250 CA ASP A 161 -16.482 -2.115 -1.114 1.00 0.46 C ATOM 2251 C ASP A 161 -15.524 -2.149 0.078 1.00 0.33 C ATOM 2252 O ASP A 161 -14.845 -1.185 0.370 1.00 0.36 O ATOM 2253 CB ASP A 161 -17.841 -1.577 -0.661 1.00 0.56 C ATOM 2254 CG ASP A 161 -17.769 -0.056 -0.516 1.00 0.88 C ATOM 2255 OD1 ASP A 161 -16.869 0.533 -1.093 1.00 1.41 O ATOM 2256 OD2 ASP A 161 -18.614 0.494 0.170 1.00 0.70 O ATOM 0 H ASP A 161 -17.566 -3.908 -1.519 1.00 0.39 H new ATOM 0 HA ASP A 161 -16.084 -1.466 -1.894 1.00 0.46 H new ATOM 0 HB2 ASP A 161 -18.610 -1.847 -1.385 1.00 0.56 H new ATOM 0 HB3 ASP A 161 -18.124 -2.030 0.289 1.00 0.56 H new ATOM 2261 N MET A 162 -15.464 -3.257 0.768 1.00 0.23 N ATOM 2262 CA MET A 162 -14.549 -3.356 1.938 1.00 0.20 C ATOM 2263 C MET A 162 -13.098 -3.405 1.434 1.00 0.15 C ATOM 2264 O MET A 162 -12.219 -2.789 1.998 1.00 0.33 O ATOM 2265 CB MET A 162 -14.931 -4.611 2.773 1.00 0.20 C ATOM 2266 CG MET A 162 -13.788 -5.641 2.855 1.00 0.20 C ATOM 2267 SD MET A 162 -12.509 -5.041 3.992 1.00 0.96 S ATOM 2268 CE MET A 162 -11.089 -5.259 2.890 1.00 0.26 C ATOM 0 H MET A 162 -16.009 -4.096 0.571 1.00 0.23 H new ATOM 0 HA MET A 162 -14.643 -2.486 2.588 1.00 0.20 H new ATOM 0 HB2 MET A 162 -15.208 -4.301 3.781 1.00 0.20 H new ATOM 0 HB3 MET A 162 -15.809 -5.083 2.331 1.00 0.20 H new ATOM 0 HG2 MET A 162 -14.174 -6.601 3.199 1.00 0.20 H new ATOM 0 HG3 MET A 162 -13.361 -5.805 1.866 1.00 0.20 H new ATOM 0 HE1 MET A 162 -10.247 -5.658 3.456 1.00 0.26 H new ATOM 0 HE2 MET A 162 -11.351 -5.953 2.092 1.00 0.26 H new ATOM 0 HE3 MET A 162 -10.813 -4.297 2.458 1.00 0.26 H new ATOM 2278 N THR A 163 -12.845 -4.137 0.380 1.00 0.15 N ATOM 2279 CA THR A 163 -11.454 -4.233 -0.155 1.00 0.24 C ATOM 2280 C THR A 163 -10.849 -2.830 -0.300 1.00 0.09 C ATOM 2281 O THR A 163 -9.694 -2.614 0.000 1.00 0.21 O ATOM 2282 CB THR A 163 -11.481 -4.934 -1.518 1.00 0.48 C ATOM 2283 OG1 THR A 163 -11.918 -6.276 -1.347 1.00 0.81 O ATOM 2284 CG2 THR A 163 -10.079 -4.928 -2.135 1.00 0.44 C ATOM 0 H THR A 163 -13.543 -4.674 -0.134 1.00 0.15 H new ATOM 0 HA THR A 163 -10.840 -4.810 0.537 1.00 0.24 H new ATOM 0 HB THR A 163 -12.165 -4.406 -2.182 1.00 0.48 H new ATOM 0 HG1 THR A 163 -12.856 -6.281 -1.064 1.00 0.81 H new ATOM 0 HG21 THR A 163 -10.105 -5.428 -3.103 1.00 0.44 H new ATOM 0 HG22 THR A 163 -9.744 -3.899 -2.267 1.00 0.44 H new ATOM 0 HG23 THR A 163 -9.389 -5.453 -1.475 1.00 0.44 H new ATOM 2292 N THR A 164 -11.616 -1.878 -0.750 1.00 0.09 N ATOM 2293 CA THR A 164 -11.069 -0.498 -0.899 1.00 0.23 C ATOM 2294 C THR A 164 -10.647 0.018 0.478 1.00 0.26 C ATOM 2295 O THR A 164 -9.614 0.639 0.634 1.00 0.34 O ATOM 2296 CB THR A 164 -12.148 0.420 -1.481 1.00 0.33 C ATOM 2297 OG1 THR A 164 -12.508 -0.038 -2.776 1.00 1.26 O ATOM 2298 CG2 THR A 164 -11.611 1.850 -1.575 1.00 0.76 C ATOM 0 H THR A 164 -12.593 -1.992 -1.020 1.00 0.09 H new ATOM 0 HA THR A 164 -10.209 -0.511 -1.569 1.00 0.23 H new ATOM 0 HB THR A 164 -13.024 0.406 -0.833 1.00 0.33 H new ATOM 0 HG1 THR A 164 -13.200 0.547 -3.149 1.00 1.26 H new ATOM 0 HG21 THR A 164 -12.381 2.501 -1.989 1.00 0.76 H new ATOM 0 HG22 THR A 164 -11.335 2.201 -0.581 1.00 0.76 H new ATOM 0 HG23 THR A 164 -10.734 1.868 -2.222 1.00 0.76 H new ATOM 2306 N HIS A 165 -11.446 -0.237 1.473 1.00 0.27 N ATOM 2307 CA HIS A 165 -11.117 0.227 2.848 1.00 0.38 C ATOM 2308 C HIS A 165 -9.792 -0.405 3.308 1.00 0.36 C ATOM 2309 O HIS A 165 -8.820 0.280 3.542 1.00 0.43 O ATOM 2310 CB HIS A 165 -12.270 -0.174 3.791 1.00 0.45 C ATOM 2311 CG HIS A 165 -11.814 -0.194 5.229 1.00 0.36 C ATOM 2312 ND1 HIS A 165 -12.033 -1.286 6.052 1.00 0.31 N ATOM 2313 CD2 HIS A 165 -11.135 0.723 5.994 1.00 0.77 C ATOM 2314 CE1 HIS A 165 -11.493 -1.006 7.250 1.00 0.26 C ATOM 2315 NE2 HIS A 165 -10.932 0.206 7.270 1.00 0.74 N ATOM 0 H HIS A 165 -12.322 -0.753 1.392 1.00 0.27 H new ATOM 0 HA HIS A 165 -10.999 1.310 2.863 1.00 0.38 H new ATOM 0 HB2 HIS A 165 -13.097 0.527 3.678 1.00 0.45 H new ATOM 0 HB3 HIS A 165 -12.647 -1.158 3.512 1.00 0.45 H new ATOM 0 HD2 HIS A 165 -10.809 1.696 5.657 1.00 0.77 H new ATOM 0 HE1 HIS A 165 -11.510 -1.679 8.094 1.00 0.26 H new ATOM 0 HE2 HIS A 165 -10.457 0.656 8.052 1.00 0.74 H new ATOM 2323 N LEU A 166 -9.760 -1.702 3.466 1.00 0.30 N ATOM 2324 CA LEU A 166 -8.511 -2.368 3.943 1.00 0.29 C ATOM 2325 C LEU A 166 -7.294 -1.888 3.147 1.00 0.26 C ATOM 2326 O LEU A 166 -6.223 -1.742 3.695 1.00 0.24 O ATOM 2327 CB LEU A 166 -8.649 -3.884 3.816 1.00 0.27 C ATOM 2328 CG LEU A 166 -7.397 -4.561 4.378 1.00 0.69 C ATOM 2329 CD1 LEU A 166 -7.401 -4.451 5.904 1.00 0.71 C ATOM 2330 CD2 LEU A 166 -7.391 -6.038 3.976 1.00 1.83 C ATOM 0 H LEU A 166 -10.544 -2.329 3.286 1.00 0.30 H new ATOM 0 HA LEU A 166 -8.361 -2.103 4.990 1.00 0.29 H new ATOM 0 HB2 LEU A 166 -9.533 -4.226 4.355 1.00 0.27 H new ATOM 0 HB3 LEU A 166 -8.787 -4.161 2.771 1.00 0.27 H new ATOM 0 HG LEU A 166 -6.509 -4.071 3.978 1.00 0.69 H new ATOM 0 HD11 LEU A 166 -6.510 -4.933 6.306 1.00 0.71 H new ATOM 0 HD12 LEU A 166 -7.407 -3.400 6.193 1.00 0.71 H new ATOM 0 HD13 LEU A 166 -8.289 -4.942 6.302 1.00 0.71 H new ATOM 0 HD21 LEU A 166 -6.499 -6.520 4.376 1.00 1.83 H new ATOM 0 HD22 LEU A 166 -8.279 -6.528 4.376 1.00 1.83 H new ATOM 0 HD23 LEU A 166 -7.391 -6.119 2.889 1.00 1.83 H new ATOM 2342 N ILE A 167 -7.433 -1.631 1.871 1.00 0.26 N ATOM 2343 CA ILE A 167 -6.249 -1.150 1.099 1.00 0.25 C ATOM 2344 C ILE A 167 -5.813 0.190 1.689 1.00 0.30 C ATOM 2345 O ILE A 167 -4.645 0.432 1.918 1.00 0.41 O ATOM 2346 CB ILE A 167 -6.606 -0.977 -0.385 1.00 0.19 C ATOM 2347 CG1 ILE A 167 -6.848 -2.356 -1.005 1.00 0.22 C ATOM 2348 CG2 ILE A 167 -5.445 -0.286 -1.121 1.00 0.28 C ATOM 2349 CD1 ILE A 167 -7.370 -2.194 -2.436 1.00 0.30 C ATOM 0 H ILE A 167 -8.298 -1.731 1.339 1.00 0.26 H new ATOM 0 HA ILE A 167 -5.441 -1.879 1.168 1.00 0.25 H new ATOM 0 HB ILE A 167 -7.504 -0.366 -0.475 1.00 0.19 H new ATOM 0 HG12 ILE A 167 -5.922 -2.932 -1.008 1.00 0.22 H new ATOM 0 HG13 ILE A 167 -7.568 -2.914 -0.406 1.00 0.22 H new ATOM 0 HG21 ILE A 167 -5.702 -0.165 -2.173 1.00 0.28 H new ATOM 0 HG22 ILE A 167 -5.264 0.693 -0.677 1.00 0.28 H new ATOM 0 HG23 ILE A 167 -4.545 -0.896 -1.035 1.00 0.28 H new ATOM 0 HD11 ILE A 167 -7.541 -3.177 -2.874 1.00 0.30 H new ATOM 0 HD12 ILE A 167 -8.306 -1.636 -2.421 1.00 0.30 H new ATOM 0 HD13 ILE A 167 -6.635 -1.654 -3.033 1.00 0.30 H new ATOM 2361 N LEU A 168 -6.750 1.059 1.945 1.00 0.26 N ATOM 2362 CA LEU A 168 -6.401 2.380 2.534 1.00 0.33 C ATOM 2363 C LEU A 168 -5.922 2.183 3.976 1.00 0.35 C ATOM 2364 O LEU A 168 -5.290 3.046 4.553 1.00 0.43 O ATOM 2365 CB LEU A 168 -7.636 3.284 2.531 1.00 0.33 C ATOM 2366 CG LEU A 168 -8.243 3.321 1.126 1.00 0.39 C ATOM 2367 CD1 LEU A 168 -9.716 3.725 1.218 1.00 0.73 C ATOM 2368 CD2 LEU A 168 -7.488 4.342 0.273 1.00 0.33 C ATOM 0 H LEU A 168 -7.744 0.911 1.771 1.00 0.26 H new ATOM 0 HA LEU A 168 -5.610 2.842 1.944 1.00 0.33 H new ATOM 0 HB2 LEU A 168 -8.371 2.914 3.246 1.00 0.33 H new ATOM 0 HB3 LEU A 168 -7.363 4.291 2.847 1.00 0.33 H new ATOM 0 HG LEU A 168 -8.164 2.335 0.669 1.00 0.39 H new ATOM 0 HD11 LEU A 168 -10.149 3.752 0.218 1.00 0.73 H new ATOM 0 HD12 LEU A 168 -10.255 3.000 1.828 1.00 0.73 H new ATOM 0 HD13 LEU A 168 -9.795 4.712 1.674 1.00 0.73 H new ATOM 0 HD21 LEU A 168 -7.919 4.370 -0.728 1.00 0.33 H new ATOM 0 HD22 LEU A 168 -7.568 5.328 0.730 1.00 0.33 H new ATOM 0 HD23 LEU A 168 -6.438 4.057 0.208 1.00 0.33 H new ATOM 2380 N ARG A 169 -6.215 1.051 4.562 1.00 0.28 N ATOM 2381 CA ARG A 169 -5.778 0.796 5.961 1.00 0.30 C ATOM 2382 C ARG A 169 -4.332 0.300 5.954 1.00 0.27 C ATOM 2383 O ARG A 169 -3.583 0.523 6.886 1.00 0.20 O ATOM 2384 CB ARG A 169 -6.680 -0.268 6.587 1.00 0.34 C ATOM 2385 CG ARG A 169 -6.968 0.097 8.043 1.00 0.57 C ATOM 2386 CD ARG A 169 -6.687 -1.114 8.933 1.00 0.23 C ATOM 2387 NE ARG A 169 -5.316 -1.002 9.504 1.00 1.53 N ATOM 2388 CZ ARG A 169 -5.071 -0.126 10.440 1.00 2.27 C ATOM 2389 NH1 ARG A 169 -5.244 -0.446 11.694 1.00 2.23 N ATOM 2390 NH2 ARG A 169 -4.652 1.068 10.123 1.00 3.64 N ATOM 0 H ARG A 169 -6.740 0.292 4.128 1.00 0.28 H new ATOM 0 HA ARG A 169 -5.845 1.716 6.541 1.00 0.30 H new ATOM 0 HB2 ARG A 169 -7.613 -0.343 6.029 1.00 0.34 H new ATOM 0 HB3 ARG A 169 -6.198 -1.244 6.535 1.00 0.34 H new ATOM 0 HG2 ARG A 169 -6.347 0.939 8.348 1.00 0.57 H new ATOM 0 HG3 ARG A 169 -8.006 0.410 8.153 1.00 0.57 H new ATOM 0 HD2 ARG A 169 -7.423 -1.168 9.735 1.00 0.23 H new ATOM 0 HD3 ARG A 169 -6.778 -2.033 8.354 1.00 0.23 H new ATOM 0 HE ARG A 169 -4.570 -1.609 9.164 1.00 1.53 H new ATOM 0 HH11 ARG A 169 -5.570 -1.380 11.942 1.00 2.23 H new ATOM 0 HH12 ARG A 169 -5.053 0.238 12.426 1.00 2.23 H new ATOM 0 HH21 ARG A 169 -4.516 1.317 9.143 1.00 3.64 H new ATOM 0 HH22 ARG A 169 -4.461 1.752 10.855 1.00 3.64 H new ATOM 2404 N SER A 170 -3.927 -0.358 4.902 1.00 0.33 N ATOM 2405 CA SER A 170 -2.535 -0.851 4.828 1.00 0.32 C ATOM 2406 C SER A 170 -1.642 0.329 4.481 1.00 0.27 C ATOM 2407 O SER A 170 -0.695 0.624 5.165 1.00 0.28 O ATOM 2408 CB SER A 170 -2.424 -1.921 3.742 1.00 0.40 C ATOM 2409 OG SER A 170 -1.394 -2.838 4.087 1.00 0.64 O ATOM 0 H SER A 170 -4.507 -0.573 4.091 1.00 0.33 H new ATOM 0 HA SER A 170 -2.234 -1.290 5.779 1.00 0.32 H new ATOM 0 HB2 SER A 170 -3.373 -2.446 3.635 1.00 0.40 H new ATOM 0 HB3 SER A 170 -2.206 -1.457 2.780 1.00 0.40 H new ATOM 0 HG SER A 170 -1.322 -3.526 3.393 1.00 0.64 H new ATOM 2415 N PHE A 171 -1.946 1.029 3.430 1.00 0.26 N ATOM 2416 CA PHE A 171 -1.108 2.201 3.064 1.00 0.23 C ATOM 2417 C PHE A 171 -0.944 3.112 4.284 1.00 0.23 C ATOM 2418 O PHE A 171 0.141 3.535 4.606 1.00 0.20 O ATOM 2419 CB PHE A 171 -1.775 2.972 1.929 1.00 0.27 C ATOM 2420 CG PHE A 171 -1.480 2.300 0.611 1.00 0.21 C ATOM 2421 CD1 PHE A 171 -0.183 1.855 0.318 1.00 1.60 C ATOM 2422 CD2 PHE A 171 -2.503 2.134 -0.325 1.00 1.40 C ATOM 2423 CE1 PHE A 171 0.085 1.246 -0.908 1.00 1.54 C ATOM 2424 CE2 PHE A 171 -2.234 1.525 -1.555 1.00 1.46 C ATOM 2425 CZ PHE A 171 -0.936 1.082 -1.847 1.00 0.17 C ATOM 0 H PHE A 171 -2.734 0.843 2.810 1.00 0.26 H new ATOM 0 HA PHE A 171 -0.127 1.859 2.736 1.00 0.23 H new ATOM 0 HB2 PHE A 171 -2.852 3.017 2.092 1.00 0.27 H new ATOM 0 HB3 PHE A 171 -1.412 4.000 1.913 1.00 0.27 H new ATOM 0 HD1 PHE A 171 0.608 1.984 1.041 1.00 1.60 H new ATOM 0 HD2 PHE A 171 -3.502 2.476 -0.099 1.00 1.40 H new ATOM 0 HE1 PHE A 171 1.084 0.901 -1.132 1.00 1.54 H new ATOM 0 HE2 PHE A 171 -3.025 1.396 -2.279 1.00 1.46 H new ATOM 0 HZ PHE A 171 -0.726 0.614 -2.797 1.00 0.17 H new ATOM 2435 N LYS A 172 -2.007 3.403 4.978 1.00 0.32 N ATOM 2436 CA LYS A 172 -1.884 4.272 6.180 1.00 0.34 C ATOM 2437 C LYS A 172 -0.861 3.668 7.151 1.00 0.36 C ATOM 2438 O LYS A 172 0.208 4.212 7.362 1.00 0.34 O ATOM 2439 CB LYS A 172 -3.246 4.379 6.871 1.00 0.39 C ATOM 2440 CG LYS A 172 -3.272 5.620 7.765 1.00 0.69 C ATOM 2441 CD LYS A 172 -3.823 6.807 6.971 1.00 0.52 C ATOM 2442 CE LYS A 172 -3.572 8.105 7.742 1.00 1.14 C ATOM 2443 NZ LYS A 172 -2.324 8.747 7.238 1.00 2.16 N ATOM 0 H LYS A 172 -2.951 3.079 4.767 1.00 0.32 H new ATOM 0 HA LYS A 172 -1.550 5.264 5.878 1.00 0.34 H new ATOM 0 HB2 LYS A 172 -4.039 4.439 6.126 1.00 0.39 H new ATOM 0 HB3 LYS A 172 -3.434 3.486 7.466 1.00 0.39 H new ATOM 0 HG2 LYS A 172 -3.892 5.436 8.643 1.00 0.69 H new ATOM 0 HG3 LYS A 172 -2.268 5.844 8.125 1.00 0.69 H new ATOM 0 HD2 LYS A 172 -3.345 6.856 5.993 1.00 0.52 H new ATOM 0 HD3 LYS A 172 -4.891 6.676 6.798 1.00 0.52 H new ATOM 0 HE2 LYS A 172 -4.417 8.782 7.620 1.00 1.14 H new ATOM 0 HE3 LYS A 172 -3.482 7.896 8.808 1.00 1.14 H new ATOM 0 HZ1 LYS A 172 -1.724 9.018 8.043 1.00 2.16 H new ATOM 0 HZ2 LYS A 172 -1.809 8.077 6.632 1.00 2.16 H new ATOM 0 HZ3 LYS A 172 -2.568 9.595 6.687 1.00 2.16 H new ATOM 2457 N GLU A 173 -1.179 2.549 7.747 1.00 0.40 N ATOM 2458 CA GLU A 173 -0.232 1.914 8.711 1.00 0.43 C ATOM 2459 C GLU A 173 0.993 1.362 7.973 1.00 0.39 C ATOM 2460 O GLU A 173 2.094 1.832 8.159 1.00 0.37 O ATOM 2461 CB GLU A 173 -0.943 0.771 9.438 1.00 0.50 C ATOM 2462 CG GLU A 173 -0.528 0.767 10.910 1.00 0.29 C ATOM 2463 CD GLU A 173 -0.804 -0.611 11.516 1.00 0.70 C ATOM 2464 OE1 GLU A 173 -1.592 -1.344 10.940 1.00 1.33 O ATOM 2465 OE2 GLU A 173 -0.225 -0.910 12.547 1.00 1.31 O ATOM 0 H GLU A 173 -2.055 2.046 7.608 1.00 0.40 H new ATOM 0 HA GLU A 173 0.098 2.665 9.429 1.00 0.43 H new ATOM 0 HB2 GLU A 173 -2.023 0.889 9.354 1.00 0.50 H new ATOM 0 HB3 GLU A 173 -0.689 -0.183 8.975 1.00 0.50 H new ATOM 0 HG2 GLU A 173 0.531 1.010 11.001 1.00 0.29 H new ATOM 0 HG3 GLU A 173 -1.079 1.533 11.456 1.00 0.29 H new ATOM 2472 N PHE A 174 0.802 0.355 7.156 1.00 0.38 N ATOM 2473 CA PHE A 174 1.936 -0.275 6.392 1.00 0.35 C ATOM 2474 C PHE A 174 2.979 0.770 5.954 1.00 0.31 C ATOM 2475 O PHE A 174 4.133 0.689 6.324 1.00 0.34 O ATOM 2476 CB PHE A 174 1.373 -0.968 5.149 1.00 0.30 C ATOM 2477 CG PHE A 174 2.233 -2.150 4.792 1.00 0.37 C ATOM 2478 CD1 PHE A 174 3.356 -1.972 3.980 1.00 0.51 C ATOM 2479 CD2 PHE A 174 1.906 -3.424 5.271 1.00 1.19 C ATOM 2480 CE1 PHE A 174 4.159 -3.068 3.646 1.00 0.35 C ATOM 2481 CE2 PHE A 174 2.708 -4.521 4.938 1.00 1.35 C ATOM 2482 CZ PHE A 174 3.835 -4.344 4.124 1.00 0.64 C ATOM 0 H PHE A 174 -0.109 -0.068 6.980 1.00 0.38 H new ATOM 0 HA PHE A 174 2.430 -0.992 7.048 1.00 0.35 H new ATOM 0 HB2 PHE A 174 0.350 -1.294 5.335 1.00 0.30 H new ATOM 0 HB3 PHE A 174 1.338 -0.267 4.315 1.00 0.30 H new ATOM 0 HD1 PHE A 174 3.604 -0.988 3.610 1.00 0.51 H new ATOM 0 HD2 PHE A 174 1.036 -3.560 5.897 1.00 1.19 H new ATOM 0 HE1 PHE A 174 5.028 -2.930 3.020 1.00 0.35 H new ATOM 0 HE2 PHE A 174 2.459 -5.504 5.308 1.00 1.35 H new ATOM 0 HZ PHE A 174 4.453 -5.191 3.865 1.00 0.64 H new ATOM 2492 N LEU A 175 2.592 1.743 5.172 1.00 0.27 N ATOM 2493 CA LEU A 175 3.582 2.770 4.728 1.00 0.25 C ATOM 2494 C LEU A 175 4.185 3.466 5.954 1.00 0.26 C ATOM 2495 O LEU A 175 5.370 3.728 6.007 1.00 0.26 O ATOM 2496 CB LEU A 175 2.892 3.820 3.854 1.00 0.23 C ATOM 2497 CG LEU A 175 2.359 3.181 2.570 1.00 0.31 C ATOM 2498 CD1 LEU A 175 1.326 4.111 1.938 1.00 0.32 C ATOM 2499 CD2 LEU A 175 3.508 2.973 1.580 1.00 0.29 C ATOM 0 H LEU A 175 1.642 1.872 4.824 1.00 0.27 H new ATOM 0 HA LEU A 175 4.367 2.277 4.155 1.00 0.25 H new ATOM 0 HB2 LEU A 175 2.072 4.280 4.406 1.00 0.23 H new ATOM 0 HB3 LEU A 175 3.595 4.615 3.607 1.00 0.23 H new ATOM 0 HG LEU A 175 1.903 2.220 2.809 1.00 0.31 H new ATOM 0 HD11 LEU A 175 0.943 3.661 1.022 1.00 0.32 H new ATOM 0 HD12 LEU A 175 0.504 4.270 2.636 1.00 0.32 H new ATOM 0 HD13 LEU A 175 1.793 5.068 1.704 1.00 0.32 H new ATOM 0 HD21 LEU A 175 3.124 2.518 0.667 1.00 0.29 H new ATOM 0 HD22 LEU A 175 3.962 3.935 1.342 1.00 0.29 H new ATOM 0 HD23 LEU A 175 4.257 2.318 2.025 1.00 0.29 H new ATOM 2511 N GLN A 176 3.378 3.777 6.938 1.00 0.28 N ATOM 2512 CA GLN A 176 3.912 4.466 8.153 1.00 0.29 C ATOM 2513 C GLN A 176 5.130 3.704 8.691 1.00 0.31 C ATOM 2514 O GLN A 176 6.178 4.278 8.917 1.00 0.23 O ATOM 2515 CB GLN A 176 2.825 4.525 9.231 1.00 0.31 C ATOM 2516 CG GLN A 176 2.250 5.943 9.297 1.00 0.32 C ATOM 2517 CD GLN A 176 1.278 6.044 10.476 1.00 0.82 C ATOM 2518 OE1 GLN A 176 1.692 6.182 11.609 1.00 0.68 O ATOM 2519 NE2 GLN A 176 -0.007 5.981 10.253 1.00 2.23 N ATOM 0 H GLN A 176 2.376 3.584 6.953 1.00 0.28 H new ATOM 0 HA GLN A 176 4.213 5.479 7.886 1.00 0.29 H new ATOM 0 HB2 GLN A 176 2.034 3.810 9.005 1.00 0.31 H new ATOM 0 HB3 GLN A 176 3.241 4.244 10.198 1.00 0.31 H new ATOM 0 HG2 GLN A 176 3.055 6.669 9.412 1.00 0.32 H new ATOM 0 HG3 GLN A 176 1.736 6.182 8.366 1.00 0.32 H new ATOM 0 HE21 GLN A 176 -0.354 5.865 9.301 1.00 2.23 H new ATOM 0 HE22 GLN A 176 -0.663 6.048 11.031 1.00 2.23 H new ATOM 2528 N SER A 177 5.006 2.421 8.895 1.00 0.42 N ATOM 2529 CA SER A 177 6.162 1.636 9.410 1.00 0.45 C ATOM 2530 C SER A 177 7.303 1.711 8.398 1.00 0.41 C ATOM 2531 O SER A 177 8.463 1.676 8.752 1.00 0.39 O ATOM 2532 CB SER A 177 5.751 0.176 9.605 1.00 0.51 C ATOM 2533 OG SER A 177 4.672 0.108 10.528 1.00 0.73 O ATOM 0 H SER A 177 4.155 1.884 8.727 1.00 0.42 H new ATOM 0 HA SER A 177 6.485 2.047 10.366 1.00 0.45 H new ATOM 0 HB2 SER A 177 5.456 -0.261 8.651 1.00 0.51 H new ATOM 0 HB3 SER A 177 6.596 -0.405 9.974 1.00 0.51 H new ATOM 0 HG SER A 177 4.406 -0.827 10.653 1.00 0.73 H new ATOM 2539 N SER A 178 6.983 1.819 7.137 1.00 0.41 N ATOM 2540 CA SER A 178 8.051 1.904 6.104 1.00 0.40 C ATOM 2541 C SER A 178 8.914 3.136 6.381 1.00 0.36 C ATOM 2542 O SER A 178 10.102 3.142 6.134 1.00 0.31 O ATOM 2543 CB SER A 178 7.417 2.023 4.718 1.00 0.42 C ATOM 2544 OG SER A 178 8.353 1.598 3.735 1.00 0.59 O ATOM 0 H SER A 178 6.028 1.852 6.779 1.00 0.41 H new ATOM 0 HA SER A 178 8.668 1.006 6.138 1.00 0.40 H new ATOM 0 HB2 SER A 178 6.515 1.414 4.665 1.00 0.42 H new ATOM 0 HB3 SER A 178 7.117 3.054 4.530 1.00 0.42 H new ATOM 0 HG SER A 178 9.256 1.863 4.007 1.00 0.59 H new ATOM 2550 N LEU A 179 8.322 4.182 6.896 1.00 0.41 N ATOM 2551 CA LEU A 179 9.108 5.413 7.195 1.00 0.43 C ATOM 2552 C LEU A 179 9.910 5.203 8.482 1.00 0.49 C ATOM 2553 O LEU A 179 11.078 5.528 8.557 1.00 0.57 O ATOM 2554 CB LEU A 179 8.155 6.595 7.380 1.00 0.39 C ATOM 2555 CG LEU A 179 7.707 7.108 6.011 1.00 0.20 C ATOM 2556 CD1 LEU A 179 6.336 6.524 5.672 1.00 0.33 C ATOM 2557 CD2 LEU A 179 7.616 8.637 6.044 1.00 0.30 C ATOM 0 H LEU A 179 7.329 4.236 7.122 1.00 0.41 H new ATOM 0 HA LEU A 179 9.788 5.619 6.369 1.00 0.43 H new ATOM 0 HB2 LEU A 179 7.289 6.289 7.967 1.00 0.39 H new ATOM 0 HB3 LEU A 179 8.650 7.392 7.935 1.00 0.39 H new ATOM 0 HG LEU A 179 8.430 6.803 5.254 1.00 0.20 H new ATOM 0 HD11 LEU A 179 6.016 6.889 4.696 1.00 0.33 H new ATOM 0 HD12 LEU A 179 6.399 5.436 5.649 1.00 0.33 H new ATOM 0 HD13 LEU A 179 5.613 6.829 6.429 1.00 0.33 H new ATOM 0 HD21 LEU A 179 7.297 9.004 5.068 1.00 0.30 H new ATOM 0 HD22 LEU A 179 6.893 8.942 6.801 1.00 0.30 H new ATOM 0 HD23 LEU A 179 8.593 9.055 6.286 1.00 0.30 H new ATOM 2569 N ARG A 180 9.290 4.661 9.496 1.00 0.48 N ATOM 2570 CA ARG A 180 10.015 4.427 10.779 1.00 0.56 C ATOM 2571 C ARG A 180 11.218 3.516 10.525 1.00 0.48 C ATOM 2572 O ARG A 180 12.199 3.546 11.244 1.00 0.50 O ATOM 2573 CB ARG A 180 9.073 3.757 11.780 1.00 0.58 C ATOM 2574 CG ARG A 180 8.630 4.776 12.830 1.00 0.72 C ATOM 2575 CD ARG A 180 8.990 4.262 14.227 1.00 1.30 C ATOM 2576 NE ARG A 180 7.976 4.739 15.209 1.00 1.36 N ATOM 2577 CZ ARG A 180 7.541 3.932 16.140 1.00 1.95 C ATOM 2578 NH1 ARG A 180 8.275 3.694 17.193 1.00 2.81 N ATOM 2579 NH2 ARG A 180 6.372 3.366 16.018 1.00 2.39 N ATOM 0 H ARG A 180 8.312 4.370 9.491 1.00 0.48 H new ATOM 0 HA ARG A 180 10.358 5.380 11.182 1.00 0.56 H new ATOM 0 HB2 ARG A 180 8.204 3.353 11.262 1.00 0.58 H new ATOM 0 HB3 ARG A 180 9.575 2.918 12.262 1.00 0.58 H new ATOM 0 HG2 ARG A 180 9.115 5.735 12.648 1.00 0.72 H new ATOM 0 HG3 ARG A 180 7.555 4.943 12.759 1.00 0.72 H new ATOM 0 HD2 ARG A 180 9.027 3.173 14.227 1.00 1.30 H new ATOM 0 HD3 ARG A 180 9.981 4.615 14.512 1.00 1.30 H new ATOM 0 HE ARG A 180 7.622 5.694 15.155 1.00 1.36 H new ATOM 0 HH11 ARG A 180 9.188 4.138 17.289 1.00 2.81 H new ATOM 0 HH12 ARG A 180 7.935 3.064 17.920 1.00 2.81 H new ATOM 0 HH21 ARG A 180 5.798 3.553 15.196 1.00 2.39 H new ATOM 0 HH22 ARG A 180 6.032 2.736 16.745 1.00 2.39 H new ATOM 2593 N ALA A 181 11.152 2.712 9.501 1.00 0.39 N ATOM 2594 CA ALA A 181 12.284 1.806 9.192 1.00 0.31 C ATOM 2595 C ALA A 181 13.347 2.607 8.448 1.00 0.42 C ATOM 2596 O ALA A 181 14.511 2.589 8.793 1.00 0.67 O ATOM 2597 CB ALA A 181 11.786 0.662 8.306 1.00 0.19 C ATOM 0 H ALA A 181 10.358 2.646 8.864 1.00 0.39 H new ATOM 0 HA ALA A 181 12.703 1.391 10.109 1.00 0.31 H new ATOM 0 HB1 ALA A 181 12.615 -0.007 8.076 1.00 0.19 H new ATOM 0 HB2 ALA A 181 11.007 0.108 8.830 1.00 0.19 H new ATOM 0 HB3 ALA A 181 11.381 1.069 7.380 1.00 0.19 H new ATOM 2603 N LEU A 182 12.943 3.315 7.431 1.00 0.28 N ATOM 2604 CA LEU A 182 13.912 4.126 6.649 1.00 0.36 C ATOM 2605 C LEU A 182 14.688 5.059 7.581 1.00 0.40 C ATOM 2606 O LEU A 182 15.808 5.440 7.300 1.00 0.39 O ATOM 2607 CB LEU A 182 13.156 4.965 5.615 1.00 0.52 C ATOM 2608 CG LEU A 182 12.788 4.094 4.412 1.00 0.85 C ATOM 2609 CD1 LEU A 182 11.316 4.306 4.056 1.00 1.78 C ATOM 2610 CD2 LEU A 182 13.660 4.483 3.217 1.00 0.26 C ATOM 0 H LEU A 182 11.977 3.366 7.107 1.00 0.28 H new ATOM 0 HA LEU A 182 14.610 3.457 6.146 1.00 0.36 H new ATOM 0 HB2 LEU A 182 12.254 5.384 6.062 1.00 0.52 H new ATOM 0 HB3 LEU A 182 13.772 5.805 5.293 1.00 0.52 H new ATOM 0 HG LEU A 182 12.954 3.046 4.660 1.00 0.85 H new ATOM 0 HD11 LEU A 182 11.056 3.685 3.199 1.00 1.78 H new ATOM 0 HD12 LEU A 182 10.693 4.030 4.907 1.00 1.78 H new ATOM 0 HD13 LEU A 182 11.149 5.354 3.808 1.00 1.78 H new ATOM 0 HD21 LEU A 182 13.399 3.863 2.359 1.00 0.26 H new ATOM 0 HD22 LEU A 182 13.493 5.532 2.971 1.00 0.26 H new ATOM 0 HD23 LEU A 182 14.710 4.332 3.468 1.00 0.26 H new ATOM 2622 N ARG A 183 14.102 5.442 8.683 1.00 0.53 N ATOM 2623 CA ARG A 183 14.808 6.361 9.620 1.00 0.60 C ATOM 2624 C ARG A 183 15.755 5.567 10.522 1.00 0.49 C ATOM 2625 O ARG A 183 16.858 5.993 10.802 1.00 0.41 O ATOM 2626 CB ARG A 183 13.784 7.097 10.485 1.00 0.80 C ATOM 2627 CG ARG A 183 14.491 8.196 11.280 1.00 1.54 C ATOM 2628 CD ARG A 183 13.723 8.465 12.574 1.00 2.55 C ATOM 2629 NE ARG A 183 13.815 9.913 12.915 1.00 2.52 N ATOM 2630 CZ ARG A 183 12.743 10.654 12.911 1.00 2.22 C ATOM 2631 NH1 ARG A 183 12.128 10.909 11.788 1.00 1.64 N ATOM 2632 NH2 ARG A 183 12.283 11.143 14.030 1.00 3.22 N ATOM 0 H ARG A 183 13.166 5.159 8.974 1.00 0.53 H new ATOM 0 HA ARG A 183 15.385 7.081 9.040 1.00 0.60 H new ATOM 0 HB2 ARG A 183 13.005 7.530 9.858 1.00 0.80 H new ATOM 0 HB3 ARG A 183 13.295 6.398 11.164 1.00 0.80 H new ATOM 0 HG2 ARG A 183 15.513 7.894 11.508 1.00 1.54 H new ATOM 0 HG3 ARG A 183 14.553 9.107 10.685 1.00 1.54 H new ATOM 0 HD2 ARG A 183 12.679 8.174 12.457 1.00 2.55 H new ATOM 0 HD3 ARG A 183 14.133 7.863 13.385 1.00 2.55 H new ATOM 0 HE ARG A 183 14.718 10.324 13.152 1.00 2.52 H new ATOM 0 HH11 ARG A 183 12.486 10.528 10.912 1.00 1.64 H new ATOM 0 HH12 ARG A 183 11.289 11.489 11.786 1.00 1.64 H new ATOM 0 HH21 ARG A 183 12.763 10.945 14.908 1.00 3.22 H new ATOM 0 HH22 ARG A 183 11.444 11.723 14.026 1.00 3.22 H new ATOM 2646 N GLN A 184 15.338 4.420 10.988 1.00 0.57 N ATOM 2647 CA GLN A 184 16.227 3.619 11.877 1.00 0.51 C ATOM 2648 C GLN A 184 17.254 2.842 11.043 1.00 0.43 C ATOM 2649 O GLN A 184 18.122 2.181 11.580 1.00 0.71 O ATOM 2650 CB GLN A 184 15.385 2.639 12.699 1.00 0.70 C ATOM 2651 CG GLN A 184 14.701 1.638 11.770 1.00 1.85 C ATOM 2652 CD GLN A 184 13.678 0.824 12.564 1.00 3.16 C ATOM 2653 OE1 GLN A 184 12.657 0.426 12.039 1.00 4.54 O ATOM 2654 NE2 GLN A 184 13.908 0.557 13.821 1.00 3.09 N ATOM 0 H GLN A 184 14.427 4.006 10.793 1.00 0.57 H new ATOM 0 HA GLN A 184 16.757 4.296 12.547 1.00 0.51 H new ATOM 0 HB2 GLN A 184 16.018 2.112 13.413 1.00 0.70 H new ATOM 0 HB3 GLN A 184 14.637 3.183 13.276 1.00 0.70 H new ATOM 0 HG2 GLN A 184 14.208 2.163 10.952 1.00 1.85 H new ATOM 0 HG3 GLN A 184 15.442 0.975 11.323 1.00 1.85 H new ATOM 0 HE21 GLN A 184 14.764 0.890 14.265 1.00 3.09 H new ATOM 0 HE22 GLN A 184 13.232 0.016 14.359 1.00 3.09 H new ATOM 2663 N MET A 185 17.175 2.911 9.740 1.00 0.23 N ATOM 2664 CA MET A 185 18.158 2.170 8.899 1.00 0.27 C ATOM 2665 C MET A 185 19.518 2.867 8.969 1.00 0.51 C ATOM 2666 O MET A 185 19.764 3.729 8.141 1.00 0.49 O ATOM 2667 CB MET A 185 17.677 2.140 7.447 1.00 0.41 C ATOM 2668 CG MET A 185 16.367 1.354 7.359 1.00 0.83 C ATOM 2669 SD MET A 185 16.564 -0.048 6.232 1.00 0.65 S ATOM 2670 CE MET A 185 14.810 -0.474 6.104 1.00 0.34 C ATOM 2671 OXT MET A 185 20.292 2.527 9.849 1.00 1.65 O ATOM 0 H MET A 185 16.476 3.446 9.225 1.00 0.23 H new ATOM 0 HA MET A 185 18.251 1.149 9.270 1.00 0.27 H new ATOM 0 HB2 MET A 185 17.529 3.156 7.081 1.00 0.41 H new ATOM 0 HB3 MET A 185 18.433 1.679 6.812 1.00 0.41 H new ATOM 0 HG2 MET A 185 16.079 0.999 8.348 1.00 0.83 H new ATOM 0 HG3 MET A 185 15.566 2.004 7.008 1.00 0.83 H new ATOM 0 HE1 MET A 185 14.707 -1.455 5.640 1.00 0.34 H new ATOM 0 HE2 MET A 185 14.367 -0.495 7.100 1.00 0.34 H new ATOM 0 HE3 MET A 185 14.298 0.271 5.495 1.00 0.34 H new TER 2681 MET A 185