USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 713 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 118 MET CE :methyl 148:sc= -0.0222 (180deg=-0.665) USER MOD Set 1.2: A 138 THR OG1 : rot -150:sc= 0 USER MOD Single : A 90 SER OG : rot 30:sc= 0.0717 USER MOD Single : A 92 ASN : amide:sc= -0.0409 K(o=-0.041,f=-1.1) USER MOD Single : A 94 SER OG : rot 180:sc=-0.00331 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot -22:sc= 0.805 USER MOD Single : A 97 THR OG1 : rot -69:sc= 1.13 USER MOD Single : A 98 SER OG : rot 180:sc= -0.203 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot -174:sc= -2.31 USER MOD Single : A 123 ASN : amide:sc= -2.6! K(o=-2.6!,f=-1.3) USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 MET CE :methyl -111:sc= -2.92 (180deg=-9.27!) USER MOD Single : A 129 THR OG1 : rot -160:sc= 0 USER MOD Single : A 140 THR OG1 : rot 64:sc= 0.714 USER MOD Single : A 141 HIS : no HE2:sc= -0.837 X(o=-0.84,f=-0.71) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 146 ASN : amide:sc= -0.438 X(o=-0.44,f=-0.31) USER MOD Single : A 147 HIS : no HD1:sc= -0.935 K(o=-0.94,f=-0.024) USER MOD Single : A 149 CYS SG : rot 180:sc= -3.56! USER MOD Single : A 150 TYR OH : rot 180:sc= -0.291 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 HIS : no HD1:sc= -1.74 K(o=-1.7,f=-1.1) USER MOD Single : A 166 THR OG1 : rot 48:sc= 0.656 USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0.058) USER MOD Single : A 178 THR OG1 : rot 180:sc= 0 USER MOD Single : A 179 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 86 24.214 3.693 3.319 1.00 15.14 N ATOM 2 CA GLY A 86 24.029 4.797 2.395 1.00 10.30 C ATOM 3 C GLY A 86 23.537 4.340 1.036 1.00 73.32 C ATOM 4 O GLY A 86 23.178 3.178 0.841 1.00 21.15 O ATOM 0 HA2 GLY A 86 23.315 5.504 2.817 1.00 10.30 H new ATOM 0 HA3 GLY A 86 24.973 5.329 2.276 1.00 10.30 H new ATOM 8 N PRO A 87 23.515 5.267 0.067 1.00 32.11 N ATOM 9 CA PRO A 87 23.063 4.976 -1.297 1.00 24.11 C ATOM 10 C PRO A 87 24.036 4.072 -2.049 1.00 3.23 C ATOM 11 O PRO A 87 25.014 4.544 -2.629 1.00 24.51 O ATOM 12 CB PRO A 87 23.002 6.357 -1.952 1.00 14.21 C ATOM 13 CG PRO A 87 23.972 7.185 -1.184 1.00 3.35 C ATOM 14 CD PRO A 87 23.928 6.671 0.228 1.00 23.54 C ATOM 0 HA PRO A 87 22.113 4.442 -1.307 1.00 24.11 H new ATOM 0 HB2 PRO A 87 23.273 6.307 -3.007 1.00 14.21 H new ATOM 0 HB3 PRO A 87 21.997 6.775 -1.900 1.00 14.21 H new ATOM 0 HG2 PRO A 87 24.976 7.097 -1.600 1.00 3.35 H new ATOM 0 HG3 PRO A 87 23.702 8.240 -1.224 1.00 3.35 H new ATOM 0 HD2 PRO A 87 24.900 6.751 0.715 1.00 23.54 H new ATOM 0 HD3 PRO A 87 23.219 7.231 0.838 1.00 23.54 H new ATOM 22 N LEU A 88 23.760 2.773 -2.034 1.00 51.23 N ATOM 23 CA LEU A 88 24.610 1.803 -2.715 1.00 62.13 C ATOM 24 C LEU A 88 24.487 1.940 -4.230 1.00 65.12 C ATOM 25 O LEU A 88 25.486 1.912 -4.949 1.00 32.43 O ATOM 26 CB LEU A 88 24.240 0.382 -2.289 1.00 21.14 C ATOM 27 CG LEU A 88 25.261 -0.343 -1.412 1.00 31.23 C ATOM 28 CD1 LEU A 88 24.674 -0.632 -0.039 1.00 24.15 C ATOM 29 CD2 LEU A 88 25.718 -1.632 -2.080 1.00 33.44 C ATOM 0 H LEU A 88 22.954 2.367 -1.558 1.00 51.23 H new ATOM 0 HA LEU A 88 25.644 2.002 -2.433 1.00 62.13 H new ATOM 0 HB2 LEU A 88 23.292 0.420 -1.752 1.00 21.14 H new ATOM 0 HB3 LEU A 88 24.074 -0.213 -3.187 1.00 21.14 H new ATOM 0 HG LEU A 88 26.128 0.305 -1.286 1.00 31.23 H new ATOM 0 HD11 LEU A 88 25.414 -1.148 0.572 1.00 24.15 H new ATOM 0 HD12 LEU A 88 24.396 0.306 0.443 1.00 24.15 H new ATOM 0 HD13 LEU A 88 23.790 -1.261 -0.146 1.00 24.15 H new ATOM 0 HD21 LEU A 88 26.445 -2.135 -1.442 1.00 33.44 H new ATOM 0 HD22 LEU A 88 24.859 -2.285 -2.237 1.00 33.44 H new ATOM 0 HD23 LEU A 88 26.178 -1.401 -3.041 1.00 33.44 H new ATOM 41 N GLY A 89 23.256 2.092 -4.708 1.00 63.11 N ATOM 42 CA GLY A 89 23.026 2.233 -6.134 1.00 1.15 C ATOM 43 C GLY A 89 22.930 0.896 -6.840 1.00 63.34 C ATOM 44 O GLY A 89 23.226 0.793 -8.032 1.00 30.15 O ATOM 0 H GLY A 89 22.414 2.120 -4.133 1.00 63.11 H new ATOM 0 HA2 GLY A 89 22.105 2.793 -6.297 1.00 1.15 H new ATOM 0 HA3 GLY A 89 23.836 2.815 -6.574 1.00 1.15 H new ATOM 48 N SER A 90 22.516 -0.132 -6.107 1.00 24.42 N ATOM 49 CA SER A 90 22.387 -1.471 -6.669 1.00 44.34 C ATOM 50 C SER A 90 21.159 -1.567 -7.569 1.00 11.25 C ATOM 51 O SER A 90 20.054 -1.199 -7.168 1.00 25.31 O ATOM 52 CB SER A 90 22.298 -2.511 -5.551 1.00 11.40 C ATOM 53 OG SER A 90 21.271 -2.183 -4.631 1.00 72.33 O ATOM 0 H SER A 90 22.264 -0.063 -5.121 1.00 24.42 H new ATOM 0 HA SER A 90 23.273 -1.672 -7.271 1.00 44.34 H new ATOM 0 HB2 SER A 90 22.106 -3.495 -5.979 1.00 11.40 H new ATOM 0 HB3 SER A 90 23.253 -2.571 -5.029 1.00 11.40 H new ATOM 0 HG SER A 90 20.557 -1.700 -5.097 1.00 72.33 H new ATOM 59 N GLU A 91 21.360 -2.062 -8.785 1.00 64.12 N ATOM 60 CA GLU A 91 20.269 -2.206 -9.741 1.00 53.33 C ATOM 61 C GLU A 91 19.635 -0.852 -10.051 1.00 23.51 C ATOM 62 O GLU A 91 18.799 -0.359 -9.295 1.00 72.21 O ATOM 63 CB GLU A 91 19.208 -3.166 -9.199 1.00 42.13 C ATOM 64 CG GLU A 91 19.379 -4.596 -9.680 1.00 73.12 C ATOM 65 CD GLU A 91 19.157 -4.741 -11.173 1.00 1.12 C ATOM 66 OE1 GLU A 91 17.986 -4.698 -11.604 1.00 74.23 O ATOM 67 OE2 GLU A 91 20.153 -4.896 -11.909 1.00 61.22 O ATOM 0 H GLU A 91 22.268 -2.370 -9.132 1.00 64.12 H new ATOM 0 HA GLU A 91 20.681 -2.615 -10.663 1.00 53.33 H new ATOM 0 HB2 GLU A 91 19.240 -3.152 -8.110 1.00 42.13 H new ATOM 0 HB3 GLU A 91 18.222 -2.808 -9.494 1.00 42.13 H new ATOM 0 HG2 GLU A 91 20.382 -4.941 -9.431 1.00 73.12 H new ATOM 0 HG3 GLU A 91 18.679 -5.240 -9.148 1.00 73.12 H new ATOM 74 N ASN A 92 20.041 -0.256 -11.167 1.00 73.34 N ATOM 75 CA ASN A 92 19.515 1.041 -11.577 1.00 33.22 C ATOM 76 C ASN A 92 18.767 0.930 -12.903 1.00 34.12 C ATOM 77 O ASN A 92 18.970 1.738 -13.810 1.00 60.43 O ATOM 78 CB ASN A 92 20.649 2.059 -11.702 1.00 24.40 C ATOM 79 CG ASN A 92 20.211 3.462 -11.330 1.00 74.23 C ATOM 80 OD1 ASN A 92 19.016 3.755 -11.267 1.00 72.43 O ATOM 81 ND2 ASN A 92 21.177 4.338 -11.085 1.00 2.11 N ATOM 0 H ASN A 92 20.733 -0.651 -11.804 1.00 73.34 H new ATOM 0 HA ASN A 92 18.816 1.379 -10.813 1.00 33.22 H new ATOM 0 HB2 ASN A 92 21.476 1.758 -11.060 1.00 24.40 H new ATOM 0 HB3 ASN A 92 21.023 2.058 -12.726 1.00 24.40 H new ATOM 0 HD21 ASN A 92 20.943 5.298 -10.833 1.00 2.11 H new ATOM 0 HD22 ASN A 92 22.154 4.051 -11.149 1.00 2.11 H new ATOM 88 N ARG A 93 17.902 -0.073 -13.007 1.00 24.44 N ATOM 89 CA ARG A 93 17.125 -0.289 -14.221 1.00 32.43 C ATOM 90 C ARG A 93 15.697 -0.712 -13.884 1.00 43.31 C ATOM 91 O ARG A 93 15.153 -1.633 -14.493 1.00 34.11 O ATOM 92 CB ARG A 93 17.791 -1.353 -15.095 1.00 30.42 C ATOM 93 CG ARG A 93 19.038 -0.860 -15.809 1.00 72.15 C ATOM 94 CD ARG A 93 19.794 -2.006 -16.464 1.00 0.42 C ATOM 95 NE ARG A 93 20.851 -2.528 -15.601 1.00 51.05 N ATOM 96 CZ ARG A 93 21.569 -3.607 -15.889 1.00 71.33 C ATOM 97 NH1 ARG A 93 21.344 -4.277 -17.012 1.00 45.23 N ATOM 98 NH2 ARG A 93 22.513 -4.020 -15.053 1.00 64.34 N ATOM 0 H ARG A 93 17.722 -0.749 -12.265 1.00 24.44 H new ATOM 0 HA ARG A 93 17.087 0.651 -14.771 1.00 32.43 H new ATOM 0 HB2 ARG A 93 18.053 -2.210 -14.474 1.00 30.42 H new ATOM 0 HB3 ARG A 93 17.073 -1.704 -15.836 1.00 30.42 H new ATOM 0 HG2 ARG A 93 18.759 -0.127 -16.566 1.00 72.15 H new ATOM 0 HG3 ARG A 93 19.689 -0.352 -15.098 1.00 72.15 H new ATOM 0 HD2 ARG A 93 19.097 -2.807 -16.709 1.00 0.42 H new ATOM 0 HD3 ARG A 93 20.229 -1.664 -17.403 1.00 0.42 H new ATOM 0 HE ARG A 93 21.048 -2.036 -14.729 1.00 51.05 H new ATOM 0 HH11 ARG A 93 20.618 -3.963 -17.656 1.00 45.23 H new ATOM 0 HH12 ARG A 93 21.897 -5.106 -17.231 1.00 45.23 H new ATOM 0 HH21 ARG A 93 22.688 -3.508 -14.188 1.00 64.34 H new ATOM 0 HH22 ARG A 93 23.064 -4.849 -15.275 1.00 64.34 H new ATOM 112 N SER A 94 15.098 -0.033 -12.912 1.00 63.21 N ATOM 113 CA SER A 94 13.736 -0.341 -12.492 1.00 21.31 C ATOM 114 C SER A 94 12.962 0.936 -12.179 1.00 44.52 C ATOM 115 O SER A 94 13.486 2.042 -12.312 1.00 2.14 O ATOM 116 CB SER A 94 13.752 -1.253 -11.264 1.00 24.32 C ATOM 117 OG SER A 94 14.747 -2.256 -11.387 1.00 75.04 O ATOM 0 H SER A 94 15.534 0.734 -12.400 1.00 63.21 H new ATOM 0 HA SER A 94 13.237 -0.856 -13.313 1.00 21.31 H new ATOM 0 HB2 SER A 94 13.938 -0.660 -10.369 1.00 24.32 H new ATOM 0 HB3 SER A 94 12.774 -1.719 -11.140 1.00 24.32 H new ATOM 0 HG SER A 94 14.738 -2.825 -10.589 1.00 75.04 H new ATOM 123 N LYS A 95 11.710 0.775 -11.765 1.00 23.13 N ATOM 124 CA LYS A 95 10.862 1.914 -11.431 1.00 73.42 C ATOM 125 C LYS A 95 10.908 2.207 -9.935 1.00 50.43 C ATOM 126 O LYS A 95 10.739 3.351 -9.511 1.00 51.41 O ATOM 127 CB LYS A 95 9.418 1.644 -11.864 1.00 64.43 C ATOM 128 CG LYS A 95 8.773 2.811 -12.590 1.00 12.24 C ATOM 129 CD LYS A 95 9.033 2.751 -14.086 1.00 50.02 C ATOM 130 CE LYS A 95 9.259 4.138 -14.668 1.00 73.55 C ATOM 131 NZ LYS A 95 10.411 4.163 -15.612 1.00 32.14 N ATOM 0 H LYS A 95 11.260 -0.133 -11.653 1.00 23.13 H new ATOM 0 HA LYS A 95 11.240 2.786 -11.966 1.00 73.42 H new ATOM 0 HB2 LYS A 95 9.400 0.768 -12.513 1.00 64.43 H new ATOM 0 HB3 LYS A 95 8.823 1.401 -10.984 1.00 64.43 H new ATOM 0 HG2 LYS A 95 7.699 2.806 -12.406 1.00 12.24 H new ATOM 0 HG3 LYS A 95 9.160 3.748 -12.190 1.00 12.24 H new ATOM 0 HD2 LYS A 95 9.905 2.127 -14.280 1.00 50.02 H new ATOM 0 HD3 LYS A 95 8.186 2.279 -14.585 1.00 50.02 H new ATOM 0 HE2 LYS A 95 8.358 4.466 -15.186 1.00 73.55 H new ATOM 0 HE3 LYS A 95 9.437 4.847 -13.859 1.00 73.55 H new ATOM 0 HZ1 LYS A 95 10.532 5.126 -15.987 1.00 32.14 H new ATOM 0 HZ2 LYS A 95 11.276 3.875 -15.112 1.00 32.14 H new ATOM 0 HZ3 LYS A 95 10.230 3.506 -16.398 1.00 32.14 H new ATOM 145 N THR A 96 11.141 1.168 -9.139 1.00 42.31 N ATOM 146 CA THR A 96 11.210 1.316 -7.691 1.00 24.11 C ATOM 147 C THR A 96 10.006 2.083 -7.158 1.00 42.40 C ATOM 148 O THR A 96 10.137 2.930 -6.272 1.00 62.15 O ATOM 149 CB THR A 96 12.499 2.042 -7.262 1.00 10.14 C ATOM 150 OG1 THR A 96 12.381 3.445 -7.522 1.00 53.14 O ATOM 151 CG2 THR A 96 13.707 1.484 -8.000 1.00 41.11 C ATOM 0 H THR A 96 11.285 0.215 -9.473 1.00 42.31 H new ATOM 0 HA THR A 96 11.211 0.311 -7.270 1.00 24.11 H new ATOM 0 HB THR A 96 12.641 1.882 -6.193 1.00 10.14 H new ATOM 0 HG1 THR A 96 11.701 3.594 -8.211 1.00 53.14 H new ATOM 0 HG21 THR A 96 14.605 2.013 -7.680 1.00 41.11 H new ATOM 0 HG22 THR A 96 13.812 0.422 -7.776 1.00 41.11 H new ATOM 0 HG23 THR A 96 13.571 1.617 -9.073 1.00 41.11 H new ATOM 159 N THR A 97 8.831 1.783 -7.702 1.00 22.41 N ATOM 160 CA THR A 97 7.602 2.445 -7.281 1.00 23.42 C ATOM 161 C THR A 97 6.377 1.617 -7.650 1.00 71.43 C ATOM 162 O THR A 97 6.215 1.210 -8.801 1.00 3.15 O ATOM 163 CB THR A 97 7.473 3.843 -7.913 1.00 53.51 C ATOM 164 OG1 THR A 97 8.041 3.841 -9.228 1.00 3.04 O ATOM 165 CG2 THR A 97 8.167 4.891 -7.057 1.00 4.33 C ATOM 0 H THR A 97 8.704 1.086 -8.435 1.00 22.41 H new ATOM 0 HA THR A 97 7.653 2.548 -6.197 1.00 23.42 H new ATOM 0 HB THR A 97 6.414 4.092 -7.976 1.00 53.51 H new ATOM 0 HG1 THR A 97 9.013 3.735 -9.164 1.00 3.04 H new ATOM 0 HG21 THR A 97 8.062 5.870 -7.524 1.00 4.33 H new ATOM 0 HG22 THR A 97 7.712 4.911 -6.067 1.00 4.33 H new ATOM 0 HG23 THR A 97 9.225 4.644 -6.966 1.00 4.33 H new ATOM 173 N SER A 98 5.516 1.371 -6.668 1.00 42.11 N ATOM 174 CA SER A 98 4.306 0.589 -6.890 1.00 70.32 C ATOM 175 C SER A 98 3.073 1.487 -6.908 1.00 24.14 C ATOM 176 O SER A 98 3.036 2.523 -6.243 1.00 1.33 O ATOM 177 CB SER A 98 4.157 -0.479 -5.804 1.00 44.01 C ATOM 178 OG SER A 98 4.718 -1.712 -6.222 1.00 73.11 O ATOM 0 H SER A 98 5.634 1.702 -5.711 1.00 42.11 H new ATOM 0 HA SER A 98 4.392 0.101 -7.861 1.00 70.32 H new ATOM 0 HB2 SER A 98 4.647 -0.144 -4.890 1.00 44.01 H new ATOM 0 HB3 SER A 98 3.102 -0.617 -5.568 1.00 44.01 H new ATOM 0 HG SER A 98 4.612 -2.378 -5.511 1.00 73.11 H new ATOM 184 N THR A 99 2.065 1.083 -7.673 1.00 32.01 N ATOM 185 CA THR A 99 0.830 1.851 -7.779 1.00 73.31 C ATOM 186 C THR A 99 -0.390 0.937 -7.749 1.00 0.21 C ATOM 187 O THR A 99 -0.395 -0.127 -8.368 1.00 22.34 O ATOM 188 CB THR A 99 0.798 2.688 -9.071 1.00 62.12 C ATOM 189 OG1 THR A 99 1.904 3.598 -9.093 1.00 41.31 O ATOM 190 CG2 THR A 99 -0.505 3.464 -9.183 1.00 31.22 C ATOM 0 H THR A 99 2.079 0.228 -8.229 1.00 32.01 H new ATOM 0 HA THR A 99 0.800 2.521 -6.920 1.00 73.31 H new ATOM 0 HB THR A 99 0.870 2.007 -9.919 1.00 62.12 H new ATOM 0 HG1 THR A 99 1.877 4.125 -9.919 1.00 41.31 H new ATOM 0 HG21 THR A 99 -0.503 4.047 -10.104 1.00 31.22 H new ATOM 0 HG22 THR A 99 -1.343 2.767 -9.196 1.00 31.22 H new ATOM 0 HG23 THR A 99 -0.604 4.134 -8.329 1.00 31.22 H new ATOM 198 N TRP A 100 -1.421 1.359 -7.027 1.00 53.34 N ATOM 199 CA TRP A 100 -2.648 0.579 -6.919 1.00 32.54 C ATOM 200 C TRP A 100 -3.875 1.460 -7.129 1.00 22.43 C ATOM 201 O TRP A 100 -4.069 2.449 -6.423 1.00 43.54 O ATOM 202 CB TRP A 100 -2.723 -0.104 -5.551 1.00 55.34 C ATOM 203 CG TRP A 100 -1.525 -0.951 -5.245 1.00 35.23 C ATOM 204 CD1 TRP A 100 -1.282 -2.219 -5.691 1.00 34.43 C ATOM 205 CD2 TRP A 100 -0.409 -0.592 -4.424 1.00 2.34 C ATOM 206 NE1 TRP A 100 -0.083 -2.670 -5.195 1.00 43.24 N ATOM 207 CE2 TRP A 100 0.474 -1.689 -4.416 1.00 35.42 C ATOM 208 CE3 TRP A 100 -0.068 0.551 -3.696 1.00 25.34 C ATOM 209 CZ2 TRP A 100 1.672 -1.677 -3.708 1.00 5.32 C ATOM 210 CZ3 TRP A 100 1.122 0.563 -2.993 1.00 63.31 C ATOM 211 CH2 TRP A 100 1.981 -0.545 -3.003 1.00 40.35 C ATOM 0 H TRP A 100 -1.432 2.237 -6.508 1.00 53.34 H new ATOM 0 HA TRP A 100 -2.634 -0.183 -7.698 1.00 32.54 H new ATOM 0 HB2 TRP A 100 -2.828 0.657 -4.778 1.00 55.34 H new ATOM 0 HB3 TRP A 100 -3.618 -0.725 -5.511 1.00 55.34 H new ATOM 0 HD1 TRP A 100 -1.936 -2.784 -6.338 1.00 34.43 H new ATOM 0 HE1 TRP A 100 0.327 -3.586 -5.377 1.00 43.24 H new ATOM 0 HE3 TRP A 100 -0.723 1.410 -3.683 1.00 25.34 H new ATOM 0 HZ2 TRP A 100 2.334 -2.530 -3.715 1.00 5.32 H new ATOM 0 HZ3 TRP A 100 1.395 1.441 -2.426 1.00 63.31 H new ATOM 0 HH2 TRP A 100 2.904 -0.505 -2.444 1.00 40.35 H new ATOM 222 N VAL A 101 -4.702 1.092 -8.102 1.00 21.02 N ATOM 223 CA VAL A 101 -5.911 1.849 -8.404 1.00 11.32 C ATOM 224 C VAL A 101 -7.151 1.142 -7.866 1.00 3.03 C ATOM 225 O VAL A 101 -7.496 0.047 -8.311 1.00 13.53 O ATOM 226 CB VAL A 101 -6.075 2.065 -9.920 1.00 0.34 C ATOM 227 CG1 VAL A 101 -7.207 3.041 -10.201 1.00 2.42 C ATOM 228 CG2 VAL A 101 -4.772 2.557 -10.531 1.00 40.50 C ATOM 0 H VAL A 101 -4.557 0.275 -8.695 1.00 21.02 H new ATOM 0 HA VAL A 101 -5.807 2.818 -7.916 1.00 11.32 H new ATOM 0 HB VAL A 101 -6.328 1.110 -10.381 1.00 0.34 H new ATOM 0 HG11 VAL A 101 -7.308 3.181 -11.277 1.00 2.42 H new ATOM 0 HG12 VAL A 101 -8.139 2.644 -9.798 1.00 2.42 H new ATOM 0 HG13 VAL A 101 -6.987 3.999 -9.729 1.00 2.42 H new ATOM 0 HG21 VAL A 101 -4.906 2.704 -11.603 1.00 40.50 H new ATOM 0 HG22 VAL A 101 -4.487 3.501 -10.068 1.00 40.50 H new ATOM 0 HG23 VAL A 101 -3.989 1.818 -10.361 1.00 40.50 H new ATOM 238 N LEU A 102 -7.816 1.775 -6.906 1.00 22.10 N ATOM 239 CA LEU A 102 -9.018 1.207 -6.306 1.00 74.22 C ATOM 240 C LEU A 102 -10.056 2.292 -6.036 1.00 13.32 C ATOM 241 O LEU A 102 -9.710 3.428 -5.710 1.00 55.10 O ATOM 242 CB LEU A 102 -8.670 0.483 -5.005 1.00 53.10 C ATOM 243 CG LEU A 102 -8.278 1.373 -3.825 1.00 12.43 C ATOM 244 CD1 LEU A 102 -8.976 0.915 -2.555 1.00 13.01 C ATOM 245 CD2 LEU A 102 -6.767 1.373 -3.635 1.00 55.03 C ATOM 0 H LEU A 102 -7.543 2.682 -6.526 1.00 22.10 H new ATOM 0 HA LEU A 102 -9.442 0.491 -7.010 1.00 74.22 H new ATOM 0 HB2 LEU A 102 -9.527 -0.122 -4.709 1.00 53.10 H new ATOM 0 HB3 LEU A 102 -7.848 -0.205 -5.204 1.00 53.10 H new ATOM 0 HG LEU A 102 -8.597 2.392 -4.043 1.00 12.43 H new ATOM 0 HD11 LEU A 102 -8.684 1.561 -1.727 1.00 13.01 H new ATOM 0 HD12 LEU A 102 -10.056 0.968 -2.694 1.00 13.01 H new ATOM 0 HD13 LEU A 102 -8.689 -0.113 -2.333 1.00 13.01 H new ATOM 0 HD21 LEU A 102 -6.506 2.012 -2.791 1.00 55.03 H new ATOM 0 HD22 LEU A 102 -6.425 0.357 -3.440 1.00 55.03 H new ATOM 0 HD23 LEU A 102 -6.287 1.751 -4.538 1.00 55.03 H new ATOM 257 N ARG A 103 -11.328 1.933 -6.171 1.00 35.51 N ATOM 258 CA ARG A 103 -12.417 2.876 -5.940 1.00 32.24 C ATOM 259 C ARG A 103 -12.636 3.098 -4.446 1.00 2.53 C ATOM 260 O ARG A 103 -13.363 2.346 -3.795 1.00 2.30 O ATOM 261 CB ARG A 103 -13.707 2.365 -6.584 1.00 54.42 C ATOM 262 CG ARG A 103 -13.552 2.004 -8.052 1.00 73.42 C ATOM 263 CD ARG A 103 -14.840 1.429 -8.623 1.00 42.21 C ATOM 264 NE ARG A 103 -15.392 0.376 -7.775 1.00 51.22 N ATOM 265 CZ ARG A 103 -14.936 -0.871 -7.761 1.00 63.15 C ATOM 266 NH1 ARG A 103 -13.925 -1.219 -8.545 1.00 21.34 N ATOM 267 NH2 ARG A 103 -15.491 -1.773 -6.963 1.00 1.03 N ATOM 0 H ARG A 103 -11.631 0.997 -6.439 1.00 35.51 H new ATOM 0 HA ARG A 103 -12.143 3.828 -6.395 1.00 32.24 H new ATOM 0 HB2 ARG A 103 -14.054 1.488 -6.037 1.00 54.42 H new ATOM 0 HB3 ARG A 103 -14.479 3.128 -6.486 1.00 54.42 H new ATOM 0 HG2 ARG A 103 -13.266 2.891 -8.618 1.00 73.42 H new ATOM 0 HG3 ARG A 103 -12.746 1.279 -8.167 1.00 73.42 H new ATOM 0 HD2 ARG A 103 -15.575 2.226 -8.735 1.00 42.21 H new ATOM 0 HD3 ARG A 103 -14.649 1.029 -9.619 1.00 42.21 H new ATOM 0 HE ARG A 103 -16.171 0.611 -7.160 1.00 51.22 H new ATOM 0 HH11 ARG A 103 -13.496 -0.528 -9.161 1.00 21.34 H new ATOM 0 HH12 ARG A 103 -13.576 -2.178 -8.532 1.00 21.34 H new ATOM 0 HH21 ARG A 103 -16.269 -1.509 -6.359 1.00 1.03 H new ATOM 0 HH22 ARG A 103 -15.140 -2.731 -6.953 1.00 1.03 H new ATOM 281 N LEU A 104 -12.001 4.135 -3.909 1.00 71.43 N ATOM 282 CA LEU A 104 -12.126 4.456 -2.491 1.00 40.42 C ATOM 283 C LEU A 104 -12.571 5.903 -2.299 1.00 24.00 C ATOM 284 O LEU A 104 -12.351 6.751 -3.164 1.00 5.24 O ATOM 285 CB LEU A 104 -10.794 4.221 -1.776 1.00 72.34 C ATOM 286 CG LEU A 104 -10.887 3.739 -0.328 1.00 42.40 C ATOM 287 CD1 LEU A 104 -9.836 2.675 -0.051 1.00 34.11 C ATOM 288 CD2 LEU A 104 -10.729 4.908 0.633 1.00 14.24 C ATOM 0 H LEU A 104 -11.396 4.767 -4.433 1.00 71.43 H new ATOM 0 HA LEU A 104 -12.883 3.801 -2.060 1.00 40.42 H new ATOM 0 HB2 LEU A 104 -10.223 3.488 -2.346 1.00 72.34 H new ATOM 0 HB3 LEU A 104 -10.226 5.151 -1.793 1.00 72.34 H new ATOM 0 HG LEU A 104 -11.872 3.297 -0.175 1.00 42.40 H new ATOM 0 HD11 LEU A 104 -9.917 2.344 0.984 1.00 34.11 H new ATOM 0 HD12 LEU A 104 -9.993 1.826 -0.717 1.00 34.11 H new ATOM 0 HD13 LEU A 104 -8.843 3.091 -0.222 1.00 34.11 H new ATOM 0 HD21 LEU A 104 -10.798 4.547 1.659 1.00 14.24 H new ATOM 0 HD22 LEU A 104 -9.758 5.378 0.478 1.00 14.24 H new ATOM 0 HD23 LEU A 104 -11.518 5.638 0.451 1.00 14.24 H new ATOM 300 N ASP A 105 -13.195 6.178 -1.159 1.00 62.43 N ATOM 301 CA ASP A 105 -13.668 7.522 -0.851 1.00 61.30 C ATOM 302 C ASP A 105 -14.761 7.950 -1.824 1.00 75.13 C ATOM 303 O ASP A 105 -15.098 9.130 -1.916 1.00 72.41 O ATOM 304 CB ASP A 105 -12.508 8.518 -0.898 1.00 60.44 C ATOM 305 CG ASP A 105 -12.658 9.630 0.121 1.00 64.23 C ATOM 306 OD1 ASP A 105 -13.809 9.976 0.455 1.00 20.24 O ATOM 307 OD2 ASP A 105 -11.623 10.156 0.582 1.00 22.40 O ATOM 0 H ASP A 105 -13.385 5.488 -0.433 1.00 62.43 H new ATOM 0 HA ASP A 105 -14.086 7.511 0.155 1.00 61.30 H new ATOM 0 HB2 ASP A 105 -11.572 7.989 -0.719 1.00 60.44 H new ATOM 0 HB3 ASP A 105 -12.444 8.950 -1.897 1.00 60.44 H new ATOM 312 N GLY A 106 -15.312 6.982 -2.551 1.00 75.24 N ATOM 313 CA GLY A 106 -16.360 7.279 -3.510 1.00 12.05 C ATOM 314 C GLY A 106 -15.813 7.638 -4.876 1.00 43.40 C ATOM 315 O GLY A 106 -16.572 7.935 -5.797 1.00 74.20 O ATOM 0 H GLY A 106 -15.051 5.998 -2.493 1.00 75.24 H new ATOM 0 HA2 GLY A 106 -17.019 6.416 -3.602 1.00 12.05 H new ATOM 0 HA3 GLY A 106 -16.966 8.104 -3.137 1.00 12.05 H new ATOM 319 N GLU A 107 -14.490 7.613 -5.007 1.00 73.13 N ATOM 320 CA GLU A 107 -13.842 7.941 -6.271 1.00 2.04 C ATOM 321 C GLU A 107 -12.665 7.006 -6.538 1.00 41.14 C ATOM 322 O GLU A 107 -12.289 6.204 -5.683 1.00 74.33 O ATOM 323 CB GLU A 107 -13.361 9.393 -6.261 1.00 40.41 C ATOM 324 CG GLU A 107 -14.385 10.377 -6.801 1.00 15.10 C ATOM 325 CD GLU A 107 -14.053 11.815 -6.454 1.00 64.10 C ATOM 326 OE1 GLU A 107 -12.875 12.203 -6.596 1.00 41.00 O ATOM 327 OE2 GLU A 107 -14.972 12.553 -6.040 1.00 71.04 O ATOM 0 H GLU A 107 -13.847 7.369 -4.254 1.00 73.13 H new ATOM 0 HA GLU A 107 -14.574 7.813 -7.069 1.00 2.04 H new ATOM 0 HB2 GLU A 107 -13.102 9.674 -5.240 1.00 40.41 H new ATOM 0 HB3 GLU A 107 -12.449 9.469 -6.853 1.00 40.41 H new ATOM 0 HG2 GLU A 107 -14.446 10.274 -7.884 1.00 15.10 H new ATOM 0 HG3 GLU A 107 -15.368 10.128 -6.401 1.00 15.10 H new ATOM 334 N ASP A 108 -12.088 7.117 -7.729 1.00 55.21 N ATOM 335 CA ASP A 108 -10.953 6.283 -8.110 1.00 14.04 C ATOM 336 C ASP A 108 -9.703 6.677 -7.330 1.00 54.21 C ATOM 337 O ASP A 108 -8.915 7.509 -7.781 1.00 5.32 O ATOM 338 CB ASP A 108 -10.690 6.397 -9.613 1.00 11.45 C ATOM 339 CG ASP A 108 -10.547 7.837 -10.067 1.00 1.12 C ATOM 340 OD1 ASP A 108 -11.572 8.549 -10.112 1.00 31.20 O ATOM 341 OD2 ASP A 108 -9.411 8.251 -10.378 1.00 62.32 O ATOM 0 H ASP A 108 -12.387 7.776 -8.448 1.00 55.21 H new ATOM 0 HA ASP A 108 -11.197 5.248 -7.870 1.00 14.04 H new ATOM 0 HB2 ASP A 108 -9.782 5.848 -9.863 1.00 11.45 H new ATOM 0 HB3 ASP A 108 -11.508 5.926 -10.159 1.00 11.45 H new ATOM 346 N LEU A 109 -9.529 6.076 -6.159 1.00 74.02 N ATOM 347 CA LEU A 109 -8.375 6.365 -5.315 1.00 3.44 C ATOM 348 C LEU A 109 -7.096 5.805 -5.932 1.00 10.45 C ATOM 349 O LEU A 109 -6.999 4.609 -6.206 1.00 0.25 O ATOM 350 CB LEU A 109 -8.580 5.778 -3.917 1.00 41.33 C ATOM 351 CG LEU A 109 -7.807 6.455 -2.785 1.00 73.32 C ATOM 352 CD1 LEU A 109 -8.747 7.266 -1.906 1.00 71.51 C ATOM 353 CD2 LEU A 109 -7.060 5.420 -1.957 1.00 24.14 C ATOM 0 H LEU A 109 -10.172 5.385 -5.772 1.00 74.02 H new ATOM 0 HA LEU A 109 -8.275 7.448 -5.236 1.00 3.44 H new ATOM 0 HB2 LEU A 109 -9.643 5.819 -3.680 1.00 41.33 H new ATOM 0 HB3 LEU A 109 -8.300 4.725 -3.942 1.00 41.33 H new ATOM 0 HG LEU A 109 -7.078 7.135 -3.225 1.00 73.32 H new ATOM 0 HD11 LEU A 109 -8.179 7.740 -1.106 1.00 71.51 H new ATOM 0 HD12 LEU A 109 -9.237 8.032 -2.507 1.00 71.51 H new ATOM 0 HD13 LEU A 109 -9.500 6.607 -1.474 1.00 71.51 H new ATOM 0 HD21 LEU A 109 -6.515 5.919 -1.156 1.00 24.14 H new ATOM 0 HD22 LEU A 109 -7.772 4.715 -1.527 1.00 24.14 H new ATOM 0 HD23 LEU A 109 -6.357 4.883 -2.594 1.00 24.14 H new ATOM 365 N ARG A 110 -6.117 6.679 -6.143 1.00 41.14 N ATOM 366 CA ARG A 110 -4.844 6.272 -6.727 1.00 32.03 C ATOM 367 C ARG A 110 -3.770 6.143 -5.650 1.00 45.40 C ATOM 368 O ARG A 110 -3.313 7.142 -5.092 1.00 72.21 O ATOM 369 CB ARG A 110 -4.399 7.279 -7.788 1.00 74.01 C ATOM 370 CG ARG A 110 -3.562 6.664 -8.899 1.00 15.44 C ATOM 371 CD ARG A 110 -3.974 7.193 -10.264 1.00 14.43 C ATOM 372 NE ARG A 110 -3.884 8.650 -10.337 1.00 23.54 N ATOM 373 CZ ARG A 110 -3.945 9.334 -11.473 1.00 70.24 C ATOM 374 NH1 ARG A 110 -4.095 8.698 -12.627 1.00 32.31 N ATOM 375 NH2 ARG A 110 -3.856 10.658 -11.458 1.00 10.13 N ATOM 0 H ARG A 110 -6.181 7.672 -5.919 1.00 41.14 H new ATOM 0 HA ARG A 110 -4.983 5.298 -7.197 1.00 32.03 H new ATOM 0 HB2 ARG A 110 -5.281 7.747 -8.226 1.00 74.01 H new ATOM 0 HB3 ARG A 110 -3.824 8.070 -7.307 1.00 74.01 H new ATOM 0 HG2 ARG A 110 -2.508 6.882 -8.726 1.00 15.44 H new ATOM 0 HG3 ARG A 110 -3.670 5.580 -8.880 1.00 15.44 H new ATOM 0 HD2 ARG A 110 -3.338 6.752 -11.031 1.00 14.43 H new ATOM 0 HD3 ARG A 110 -4.996 6.882 -10.480 1.00 14.43 H new ATOM 0 HE ARG A 110 -3.768 9.170 -9.467 1.00 23.54 H new ATOM 0 HH11 ARG A 110 -4.164 7.680 -12.643 1.00 32.31 H new ATOM 0 HH12 ARG A 110 -4.142 9.226 -13.498 1.00 32.31 H new ATOM 0 HH21 ARG A 110 -3.741 11.151 -10.573 1.00 10.13 H new ATOM 0 HH22 ARG A 110 -3.903 11.182 -12.332 1.00 10.13 H new ATOM 389 N VAL A 111 -3.371 4.908 -5.364 1.00 11.31 N ATOM 390 CA VAL A 111 -2.350 4.649 -4.355 1.00 21.13 C ATOM 391 C VAL A 111 -0.972 4.510 -4.991 1.00 61.52 C ATOM 392 O VAL A 111 -0.809 3.825 -6.001 1.00 70.22 O ATOM 393 CB VAL A 111 -2.665 3.373 -3.552 1.00 74.23 C ATOM 394 CG1 VAL A 111 -1.966 3.404 -2.202 1.00 53.42 C ATOM 395 CG2 VAL A 111 -4.168 3.209 -3.381 1.00 43.30 C ATOM 0 H VAL A 111 -3.739 4.071 -5.816 1.00 11.31 H new ATOM 0 HA VAL A 111 -2.350 5.504 -3.678 1.00 21.13 H new ATOM 0 HB VAL A 111 -2.290 2.513 -4.107 1.00 74.23 H new ATOM 0 HG11 VAL A 111 -2.201 2.494 -1.650 1.00 53.42 H new ATOM 0 HG12 VAL A 111 -0.888 3.470 -2.352 1.00 53.42 H new ATOM 0 HG13 VAL A 111 -2.307 4.271 -1.636 1.00 53.42 H new ATOM 0 HG21 VAL A 111 -4.373 2.302 -2.811 1.00 43.30 H new ATOM 0 HG22 VAL A 111 -4.570 4.071 -2.848 1.00 43.30 H new ATOM 0 HG23 VAL A 111 -4.640 3.136 -4.361 1.00 43.30 H new ATOM 405 N VAL A 112 0.019 5.163 -4.392 1.00 43.52 N ATOM 406 CA VAL A 112 1.385 5.111 -4.900 1.00 31.34 C ATOM 407 C VAL A 112 2.387 4.944 -3.763 1.00 0.13 C ATOM 408 O VAL A 112 2.404 5.731 -2.815 1.00 32.33 O ATOM 409 CB VAL A 112 1.737 6.381 -5.697 1.00 30.52 C ATOM 410 CG1 VAL A 112 3.205 6.372 -6.095 1.00 30.22 C ATOM 411 CG2 VAL A 112 0.845 6.504 -6.922 1.00 53.25 C ATOM 0 H VAL A 112 -0.098 5.734 -3.555 1.00 43.52 H new ATOM 0 HA VAL A 112 1.444 4.248 -5.563 1.00 31.34 H new ATOM 0 HB VAL A 112 1.564 7.249 -5.060 1.00 30.52 H new ATOM 0 HG11 VAL A 112 3.435 7.277 -6.657 1.00 30.22 H new ATOM 0 HG12 VAL A 112 3.825 6.334 -5.199 1.00 30.22 H new ATOM 0 HG13 VAL A 112 3.409 5.498 -6.714 1.00 30.22 H new ATOM 0 HG21 VAL A 112 1.107 7.407 -7.474 1.00 53.25 H new ATOM 0 HG22 VAL A 112 0.985 5.634 -7.563 1.00 53.25 H new ATOM 0 HG23 VAL A 112 -0.198 6.560 -6.609 1.00 53.25 H new ATOM 421 N LEU A 113 3.222 3.916 -3.863 1.00 32.11 N ATOM 422 CA LEU A 113 4.229 3.645 -2.843 1.00 23.03 C ATOM 423 C LEU A 113 5.631 3.922 -3.376 1.00 1.24 C ATOM 424 O LEU A 113 6.160 3.160 -4.183 1.00 20.41 O ATOM 425 CB LEU A 113 4.128 2.193 -2.371 1.00 42.31 C ATOM 426 CG LEU A 113 5.249 1.707 -1.452 1.00 0.35 C ATOM 427 CD1 LEU A 113 5.656 2.804 -0.481 1.00 2.23 C ATOM 428 CD2 LEU A 113 4.816 0.458 -0.698 1.00 34.11 C ATOM 0 H LEU A 113 3.222 3.256 -4.641 1.00 32.11 H new ATOM 0 HA LEU A 113 4.043 4.309 -1.998 1.00 23.03 H new ATOM 0 HB2 LEU A 113 3.178 2.066 -1.851 1.00 42.31 H new ATOM 0 HB3 LEU A 113 4.100 1.548 -3.249 1.00 42.31 H new ATOM 0 HG LEU A 113 6.113 1.455 -2.066 1.00 0.35 H new ATOM 0 HD11 LEU A 113 6.455 2.440 0.165 1.00 2.23 H new ATOM 0 HD12 LEU A 113 6.008 3.672 -1.039 1.00 2.23 H new ATOM 0 HD13 LEU A 113 4.798 3.088 0.128 1.00 2.23 H new ATOM 0 HD21 LEU A 113 5.626 0.126 -0.049 1.00 34.11 H new ATOM 0 HD22 LEU A 113 3.937 0.684 -0.095 1.00 34.11 H new ATOM 0 HD23 LEU A 113 4.575 -0.331 -1.410 1.00 34.11 H new ATOM 440 N GLU A 114 6.228 5.018 -2.914 1.00 71.23 N ATOM 441 CA GLU A 114 7.569 5.394 -3.344 1.00 25.22 C ATOM 442 C GLU A 114 8.628 4.641 -2.544 1.00 23.32 C ATOM 443 O GLU A 114 8.523 4.507 -1.324 1.00 60.24 O ATOM 444 CB GLU A 114 7.774 6.903 -3.188 1.00 71.44 C ATOM 445 CG GLU A 114 8.164 7.600 -4.480 1.00 73.51 C ATOM 446 CD GLU A 114 7.183 8.688 -4.874 1.00 43.21 C ATOM 447 OE1 GLU A 114 6.987 9.627 -4.075 1.00 73.02 O ATOM 448 OE2 GLU A 114 6.614 8.600 -5.982 1.00 71.12 O ATOM 0 H GLU A 114 5.804 5.659 -2.243 1.00 71.23 H new ATOM 0 HA GLU A 114 7.674 5.127 -4.395 1.00 25.22 H new ATOM 0 HB2 GLU A 114 6.855 7.349 -2.808 1.00 71.44 H new ATOM 0 HB3 GLU A 114 8.548 7.081 -2.441 1.00 71.44 H new ATOM 0 HG2 GLU A 114 9.157 8.034 -4.369 1.00 73.51 H new ATOM 0 HG3 GLU A 114 8.226 6.864 -5.281 1.00 73.51 H new ATOM 455 N LYS A 115 9.648 4.149 -3.239 1.00 55.13 N ATOM 456 CA LYS A 115 10.727 3.408 -2.596 1.00 10.33 C ATOM 457 C LYS A 115 11.642 4.348 -1.816 1.00 53.43 C ATOM 458 O LYS A 115 12.419 3.910 -0.968 1.00 52.35 O ATOM 459 CB LYS A 115 11.539 2.640 -3.641 1.00 3.04 C ATOM 460 CG LYS A 115 10.934 1.298 -4.014 1.00 73.32 C ATOM 461 CD LYS A 115 11.596 0.158 -3.258 1.00 62.45 C ATOM 462 CE LYS A 115 13.028 -0.061 -3.723 1.00 11.14 C ATOM 463 NZ LYS A 115 13.506 -1.438 -3.417 1.00 31.50 N ATOM 0 H LYS A 115 9.750 4.250 -4.249 1.00 55.13 H new ATOM 0 HA LYS A 115 10.282 2.699 -1.898 1.00 10.33 H new ATOM 0 HB2 LYS A 115 11.630 3.251 -4.539 1.00 3.04 H new ATOM 0 HB3 LYS A 115 12.548 2.481 -3.260 1.00 3.04 H new ATOM 0 HG2 LYS A 115 9.866 1.307 -3.798 1.00 73.32 H new ATOM 0 HG3 LYS A 115 11.041 1.135 -5.086 1.00 73.32 H new ATOM 0 HD2 LYS A 115 11.588 0.375 -2.190 1.00 62.45 H new ATOM 0 HD3 LYS A 115 11.022 -0.757 -3.401 1.00 62.45 H new ATOM 0 HE2 LYS A 115 13.092 0.116 -4.797 1.00 11.14 H new ATOM 0 HE3 LYS A 115 13.682 0.666 -3.241 1.00 11.14 H new ATOM 0 HZ1 LYS A 115 14.485 -1.547 -3.749 1.00 31.50 H new ATOM 0 HZ2 LYS A 115 13.469 -1.598 -2.390 1.00 31.50 H new ATOM 0 HZ3 LYS A 115 12.898 -2.131 -3.898 1.00 31.50 H new ATOM 477 N ASP A 116 11.542 5.640 -2.109 1.00 45.25 N ATOM 478 CA ASP A 116 12.359 6.642 -1.433 1.00 63.22 C ATOM 479 C ASP A 116 12.261 6.492 0.081 1.00 74.10 C ATOM 480 O ASP A 116 13.273 6.371 0.772 1.00 63.40 O ATOM 481 CB ASP A 116 11.926 8.049 -1.848 1.00 71.21 C ATOM 482 CG ASP A 116 13.010 8.789 -2.606 1.00 52.32 C ATOM 483 OD1 ASP A 116 13.278 8.422 -3.769 1.00 11.22 O ATOM 484 OD2 ASP A 116 13.591 9.736 -2.036 1.00 14.40 O ATOM 0 H ASP A 116 10.904 6.018 -2.809 1.00 45.25 H new ATOM 0 HA ASP A 116 13.397 6.488 -1.729 1.00 63.22 H new ATOM 0 HB2 ASP A 116 11.033 7.983 -2.470 1.00 71.21 H new ATOM 0 HB3 ASP A 116 11.654 8.619 -0.960 1.00 71.21 H new ATOM 489 N THR A 117 11.033 6.502 0.594 1.00 62.25 N ATOM 490 CA THR A 117 10.802 6.369 2.026 1.00 41.32 C ATOM 491 C THR A 117 9.644 5.421 2.311 1.00 54.31 C ATOM 492 O THR A 117 9.093 5.412 3.411 1.00 34.21 O ATOM 493 CB THR A 117 10.506 7.734 2.676 1.00 33.00 C ATOM 494 OG1 THR A 117 10.823 8.791 1.763 1.00 31.21 O ATOM 495 CG2 THR A 117 11.306 7.908 3.958 1.00 32.40 C ATOM 0 H THR A 117 10.184 6.601 0.037 1.00 62.25 H new ATOM 0 HA THR A 117 11.716 5.960 2.457 1.00 41.32 H new ATOM 0 HB THR A 117 9.445 7.772 2.921 1.00 33.00 H new ATOM 0 HG1 THR A 117 10.630 9.655 2.183 1.00 31.21 H new ATOM 0 HG21 THR A 117 11.080 8.879 4.399 1.00 32.40 H new ATOM 0 HG22 THR A 117 11.041 7.119 4.662 1.00 32.40 H new ATOM 0 HG23 THR A 117 12.371 7.850 3.733 1.00 32.40 H new ATOM 503 N MET A 118 9.279 4.624 1.312 1.00 14.10 N ATOM 504 CA MET A 118 8.184 3.670 1.457 1.00 62.34 C ATOM 505 C MET A 118 6.898 4.377 1.869 1.00 32.21 C ATOM 506 O MET A 118 6.022 3.778 2.494 1.00 61.34 O ATOM 507 CB MET A 118 8.546 2.600 2.489 1.00 23.11 C ATOM 508 CG MET A 118 9.436 1.500 1.937 1.00 65.33 C ATOM 509 SD MET A 118 10.012 0.364 3.214 1.00 0.52 S ATOM 510 CE MET A 118 8.470 -0.404 3.703 1.00 1.13 C ATOM 0 H MET A 118 9.724 4.619 0.394 1.00 14.10 H new ATOM 0 HA MET A 118 8.020 3.192 0.491 1.00 62.34 H new ATOM 0 HB2 MET A 118 9.049 3.075 3.331 1.00 23.11 H new ATOM 0 HB3 MET A 118 7.629 2.155 2.875 1.00 23.11 H new ATOM 0 HG2 MET A 118 8.887 0.940 1.179 1.00 65.33 H new ATOM 0 HG3 MET A 118 10.296 1.949 1.441 1.00 65.33 H new ATOM 0 HE1 MET A 118 8.657 -1.434 4.008 1.00 1.13 H new ATOM 0 HE2 MET A 118 8.037 0.149 4.537 1.00 1.13 H new ATOM 0 HE3 MET A 118 7.776 -0.395 2.862 1.00 1.13 H new ATOM 520 N ASP A 119 6.790 5.654 1.517 1.00 73.14 N ATOM 521 CA ASP A 119 5.609 6.442 1.850 1.00 43.21 C ATOM 522 C ASP A 119 4.460 6.128 0.897 1.00 41.42 C ATOM 523 O ASP A 119 4.680 5.750 -0.254 1.00 14.25 O ATOM 524 CB ASP A 119 5.936 7.935 1.800 1.00 4.42 C ATOM 525 CG ASP A 119 5.572 8.650 3.086 1.00 11.31 C ATOM 526 OD1 ASP A 119 4.589 8.238 3.736 1.00 23.24 O ATOM 527 OD2 ASP A 119 6.271 9.623 3.443 1.00 54.43 O ATOM 0 H ASP A 119 7.506 6.165 1.001 1.00 73.14 H new ATOM 0 HA ASP A 119 5.300 6.179 2.862 1.00 43.21 H new ATOM 0 HB2 ASP A 119 7.000 8.065 1.604 1.00 4.42 H new ATOM 0 HB3 ASP A 119 5.401 8.394 0.969 1.00 4.42 H new ATOM 532 N VAL A 120 3.233 6.287 1.385 1.00 62.32 N ATOM 533 CA VAL A 120 2.049 6.020 0.577 1.00 20.24 C ATOM 534 C VAL A 120 1.387 7.318 0.129 1.00 14.13 C ATOM 535 O VAL A 120 1.190 8.234 0.928 1.00 32.43 O ATOM 536 CB VAL A 120 1.022 5.171 1.350 1.00 41.33 C ATOM 537 CG1 VAL A 120 -0.210 4.916 0.496 1.00 41.14 C ATOM 538 CG2 VAL A 120 1.647 3.861 1.804 1.00 45.41 C ATOM 0 H VAL A 120 3.034 6.599 2.335 1.00 62.32 H new ATOM 0 HA VAL A 120 2.381 5.464 -0.300 1.00 20.24 H new ATOM 0 HB VAL A 120 0.712 5.725 2.236 1.00 41.33 H new ATOM 0 HG11 VAL A 120 -0.924 4.315 1.058 1.00 41.14 H new ATOM 0 HG12 VAL A 120 -0.669 5.867 0.226 1.00 41.14 H new ATOM 0 HG13 VAL A 120 0.079 4.383 -0.410 1.00 41.14 H new ATOM 0 HG21 VAL A 120 0.907 3.274 2.348 1.00 45.41 H new ATOM 0 HG22 VAL A 120 1.987 3.299 0.934 1.00 45.41 H new ATOM 0 HG23 VAL A 120 2.496 4.069 2.456 1.00 45.41 H new ATOM 548 N TRP A 121 1.043 7.389 -1.151 1.00 52.42 N ATOM 549 CA TRP A 121 0.401 8.576 -1.706 1.00 21.42 C ATOM 550 C TRP A 121 -0.993 8.246 -2.229 1.00 24.14 C ATOM 551 O TRP A 121 -1.157 7.364 -3.071 1.00 75.13 O ATOM 552 CB TRP A 121 1.254 9.164 -2.830 1.00 40.20 C ATOM 553 CG TRP A 121 1.163 10.658 -2.926 1.00 30.43 C ATOM 554 CD1 TRP A 121 0.399 11.377 -3.799 1.00 53.34 C ATOM 555 CD2 TRP A 121 1.861 11.612 -2.119 1.00 50.34 C ATOM 556 NE1 TRP A 121 0.580 12.723 -3.584 1.00 74.43 N ATOM 557 CE2 TRP A 121 1.472 12.893 -2.559 1.00 54.20 C ATOM 558 CE3 TRP A 121 2.777 11.511 -1.069 1.00 32.33 C ATOM 559 CZ2 TRP A 121 1.967 14.060 -1.984 1.00 45.13 C ATOM 560 CZ3 TRP A 121 3.267 12.670 -0.499 1.00 4.21 C ATOM 561 CH2 TRP A 121 2.862 13.931 -0.957 1.00 31.45 C ATOM 0 H TRP A 121 1.197 6.639 -1.825 1.00 52.42 H new ATOM 0 HA TRP A 121 0.305 9.313 -0.909 1.00 21.42 H new ATOM 0 HB2 TRP A 121 2.295 8.880 -2.673 1.00 40.20 H new ATOM 0 HB3 TRP A 121 0.944 8.727 -3.779 1.00 40.20 H new ATOM 0 HD1 TRP A 121 -0.252 10.951 -4.548 1.00 53.34 H new ATOM 0 HE1 TRP A 121 0.124 13.473 -4.104 1.00 74.43 H new ATOM 0 HE3 TRP A 121 3.096 10.544 -0.709 1.00 32.33 H new ATOM 0 HZ2 TRP A 121 1.656 15.032 -2.336 1.00 45.13 H new ATOM 0 HZ3 TRP A 121 3.975 12.603 0.314 1.00 4.21 H new ATOM 0 HH2 TRP A 121 3.264 14.818 -0.490 1.00 31.45 H new ATOM 572 N CYS A 122 -1.993 8.959 -1.724 1.00 12.33 N ATOM 573 CA CYS A 122 -3.374 8.742 -2.140 1.00 12.14 C ATOM 574 C CYS A 122 -4.051 10.063 -2.493 1.00 65.13 C ATOM 575 O CYS A 122 -3.965 11.035 -1.745 1.00 31.01 O ATOM 576 CB CYS A 122 -4.157 8.035 -1.033 1.00 0.35 C ATOM 577 SG CYS A 122 -3.913 6.244 -0.984 1.00 22.22 S ATOM 0 H CYS A 122 -1.874 9.693 -1.026 1.00 12.33 H new ATOM 0 HA CYS A 122 -3.364 8.111 -3.029 1.00 12.14 H new ATOM 0 HB2 CYS A 122 -3.866 8.457 -0.071 1.00 0.35 H new ATOM 0 HB3 CYS A 122 -5.219 8.243 -1.164 1.00 0.35 H new ATOM 0 HG CYS A 122 -4.709 5.722 -0.099 1.00 22.22 H new ATOM 583 N ASN A 123 -4.721 10.089 -3.641 1.00 2.23 N ATOM 584 CA ASN A 123 -5.409 11.292 -4.096 1.00 35.00 C ATOM 585 C ASN A 123 -4.478 12.500 -4.057 1.00 34.21 C ATOM 586 O ASN A 123 -4.798 13.524 -3.454 1.00 43.34 O ATOM 587 CB ASN A 123 -6.643 11.556 -3.230 1.00 31.32 C ATOM 588 CG ASN A 123 -7.863 10.797 -3.714 1.00 70.25 C ATOM 589 OD1 ASN A 123 -8.159 10.773 -4.909 1.00 15.20 O ATOM 590 ND2 ASN A 123 -8.577 10.171 -2.786 1.00 24.30 N ATOM 0 H ASN A 123 -4.802 9.292 -4.272 1.00 2.23 H new ATOM 0 HA ASN A 123 -5.724 11.133 -5.127 1.00 35.00 H new ATOM 0 HB2 ASN A 123 -6.428 11.273 -2.200 1.00 31.32 H new ATOM 0 HB3 ASN A 123 -6.860 12.624 -3.228 1.00 31.32 H new ATOM 0 HD21 ASN A 123 -9.408 9.643 -3.052 1.00 24.30 H new ATOM 0 HD22 ASN A 123 -8.294 10.218 -1.807 1.00 24.30 H new ATOM 597 N GLY A 124 -3.324 12.372 -4.704 1.00 74.11 N ATOM 598 CA GLY A 124 -2.364 13.460 -4.732 1.00 34.15 C ATOM 599 C GLY A 124 -2.095 14.030 -3.353 1.00 43.42 C ATOM 600 O GLY A 124 -1.963 15.242 -3.191 1.00 50.22 O ATOM 0 H GLY A 124 -3.037 11.534 -5.210 1.00 74.11 H new ATOM 0 HA2 GLY A 124 -1.429 13.104 -5.164 1.00 34.15 H new ATOM 0 HA3 GLY A 124 -2.735 14.251 -5.383 1.00 34.15 H new ATOM 604 N GLN A 125 -2.013 13.153 -2.358 1.00 0.43 N ATOM 605 CA GLN A 125 -1.759 13.577 -0.986 1.00 13.03 C ATOM 606 C GLN A 125 -0.942 12.530 -0.235 1.00 55.40 C ATOM 607 O GLN A 125 -0.967 11.346 -0.575 1.00 13.55 O ATOM 608 CB GLN A 125 -3.079 13.831 -0.256 1.00 74.20 C ATOM 609 CG GLN A 125 -3.344 15.301 0.027 1.00 33.42 C ATOM 610 CD GLN A 125 -3.056 15.680 1.466 1.00 3.12 C ATOM 611 OE1 GLN A 125 -1.988 16.207 1.780 1.00 52.21 O ATOM 612 NE2 GLN A 125 -4.008 15.412 2.352 1.00 34.13 N ATOM 0 H GLN A 125 -2.119 12.145 -2.476 1.00 0.43 H new ATOM 0 HA GLN A 125 -1.186 14.504 -1.019 1.00 13.03 H new ATOM 0 HB2 GLN A 125 -3.898 13.431 -0.854 1.00 74.20 H new ATOM 0 HB3 GLN A 125 -3.075 13.283 0.686 1.00 74.20 H new ATOM 0 HG2 GLN A 125 -2.729 15.911 -0.635 1.00 33.42 H new ATOM 0 HG3 GLN A 125 -4.385 15.529 -0.203 1.00 33.42 H new ATOM 0 HE21 GLN A 125 -4.878 14.974 2.049 1.00 34.13 H new ATOM 0 HE22 GLN A 125 -3.869 15.644 3.336 1.00 34.13 H new ATOM 621 N LYS A 126 -0.219 12.973 0.788 1.00 54.41 N ATOM 622 CA LYS A 126 0.606 12.076 1.589 1.00 75.12 C ATOM 623 C LYS A 126 -0.255 11.248 2.537 1.00 34.43 C ATOM 624 O LYS A 126 -1.390 11.615 2.841 1.00 71.30 O ATOM 625 CB LYS A 126 1.638 12.874 2.387 1.00 11.30 C ATOM 626 CG LYS A 126 2.723 12.013 3.012 1.00 54.13 C ATOM 627 CD LYS A 126 3.927 12.845 3.422 1.00 72.52 C ATOM 628 CE LYS A 126 3.794 13.351 4.850 1.00 62.24 C ATOM 629 NZ LYS A 126 5.115 13.448 5.529 1.00 43.53 N ATOM 0 H LYS A 126 -0.188 13.949 1.082 1.00 54.41 H new ATOM 0 HA LYS A 126 1.125 11.399 0.911 1.00 75.12 H new ATOM 0 HB2 LYS A 126 2.103 13.609 1.730 1.00 11.30 H new ATOM 0 HB3 LYS A 126 1.127 13.428 3.174 1.00 11.30 H new ATOM 0 HG2 LYS A 126 2.322 11.497 3.884 1.00 54.13 H new ATOM 0 HG3 LYS A 126 3.034 11.246 2.303 1.00 54.13 H new ATOM 0 HD2 LYS A 126 4.833 12.246 3.330 1.00 72.52 H new ATOM 0 HD3 LYS A 126 4.034 13.691 2.743 1.00 72.52 H new ATOM 0 HE2 LYS A 126 3.315 14.330 4.845 1.00 62.24 H new ATOM 0 HE3 LYS A 126 3.144 12.681 5.414 1.00 62.24 H new ATOM 0 HZ1 LYS A 126 4.982 13.796 6.500 1.00 43.53 H new ATOM 0 HZ2 LYS A 126 5.561 12.509 5.556 1.00 43.53 H new ATOM 0 HZ3 LYS A 126 5.727 14.107 5.006 1.00 43.53 H new ATOM 643 N MET A 127 0.292 10.129 3.002 1.00 53.55 N ATOM 644 CA MET A 127 -0.426 9.250 3.918 1.00 41.14 C ATOM 645 C MET A 127 0.390 8.998 5.181 1.00 43.22 C ATOM 646 O MET A 127 1.585 9.290 5.226 1.00 24.10 O ATOM 647 CB MET A 127 -0.753 7.922 3.233 1.00 21.10 C ATOM 648 CG MET A 127 -1.748 8.054 2.092 1.00 3.13 C ATOM 649 SD MET A 127 -3.460 7.934 2.645 1.00 41.31 S ATOM 650 CE MET A 127 -3.483 6.272 3.314 1.00 2.20 C ATOM 0 H MET A 127 1.230 9.810 2.759 1.00 53.55 H new ATOM 0 HA MET A 127 -1.356 9.743 4.201 1.00 41.14 H new ATOM 0 HB2 MET A 127 0.169 7.483 2.851 1.00 21.10 H new ATOM 0 HB3 MET A 127 -1.152 7.229 3.974 1.00 21.10 H new ATOM 0 HG2 MET A 127 -1.598 9.011 1.593 1.00 3.13 H new ATOM 0 HG3 MET A 127 -1.553 7.276 1.354 1.00 3.13 H new ATOM 0 HE1 MET A 127 -4.096 5.633 2.679 1.00 2.20 H new ATOM 0 HE2 MET A 127 -2.467 5.880 3.350 1.00 2.20 H new ATOM 0 HE3 MET A 127 -3.900 6.291 4.321 1.00 2.20 H new ATOM 660 N GLU A 128 -0.262 8.455 6.204 1.00 73.21 N ATOM 661 CA GLU A 128 0.405 8.165 7.468 1.00 73.43 C ATOM 662 C GLU A 128 0.350 6.673 7.782 1.00 32.43 C ATOM 663 O GLU A 128 -0.700 6.142 8.149 1.00 21.02 O ATOM 664 CB GLU A 128 -0.239 8.961 8.604 1.00 72.01 C ATOM 665 CG GLU A 128 0.531 10.216 8.980 1.00 14.12 C ATOM 666 CD GLU A 128 0.178 10.724 10.365 1.00 32.11 C ATOM 667 OE1 GLU A 128 0.204 9.916 11.317 1.00 72.03 O ATOM 668 OE2 GLU A 128 -0.126 11.929 10.496 1.00 60.55 O ATOM 0 H GLU A 128 -1.251 8.207 6.182 1.00 73.21 H new ATOM 0 HA GLU A 128 1.450 8.460 7.374 1.00 73.43 H new ATOM 0 HB2 GLU A 128 -1.252 9.240 8.313 1.00 72.01 H new ATOM 0 HB3 GLU A 128 -0.325 8.321 9.482 1.00 72.01 H new ATOM 0 HG2 GLU A 128 1.600 10.009 8.935 1.00 14.12 H new ATOM 0 HG3 GLU A 128 0.326 10.997 8.248 1.00 14.12 H new ATOM 675 N THR A 129 1.486 6.000 7.635 1.00 3.13 N ATOM 676 CA THR A 129 1.569 4.569 7.902 1.00 55.41 C ATOM 677 C THR A 129 2.068 4.301 9.317 1.00 51.35 C ATOM 678 O THR A 129 2.263 5.228 10.102 1.00 43.21 O ATOM 679 CB THR A 129 2.499 3.863 6.898 1.00 63.11 C ATOM 680 OG1 THR A 129 3.866 4.159 7.206 1.00 2.21 O ATOM 681 CG2 THR A 129 2.190 4.299 5.474 1.00 54.22 C ATOM 0 H THR A 129 2.363 6.423 7.332 1.00 3.13 H new ATOM 0 HA THR A 129 0.561 4.169 7.794 1.00 55.41 H new ATOM 0 HB THR A 129 2.333 2.789 6.976 1.00 63.11 H new ATOM 0 HG1 THR A 129 4.423 3.989 6.418 1.00 2.21 H new ATOM 0 HG21 THR A 129 2.860 3.787 4.783 1.00 54.22 H new ATOM 0 HG22 THR A 129 1.157 4.047 5.232 1.00 54.22 H new ATOM 0 HG23 THR A 129 2.331 5.376 5.385 1.00 54.22 H new ATOM 689 N ALA A 130 2.274 3.027 9.634 1.00 5.33 N ATOM 690 CA ALA A 130 2.755 2.638 10.955 1.00 32.32 C ATOM 691 C ALA A 130 4.208 2.179 10.897 1.00 44.11 C ATOM 692 O ALA A 130 4.949 2.310 11.870 1.00 3.23 O ATOM 693 CB ALA A 130 1.875 1.539 11.533 1.00 1.12 C ATOM 0 H ALA A 130 2.116 2.247 8.996 1.00 5.33 H new ATOM 0 HA ALA A 130 2.703 3.511 11.606 1.00 32.32 H new ATOM 0 HB1 ALA A 130 2.245 1.258 12.519 1.00 1.12 H new ATOM 0 HB2 ALA A 130 0.850 1.901 11.619 1.00 1.12 H new ATOM 0 HB3 ALA A 130 1.899 0.670 10.875 1.00 1.12 H new ATOM 699 N GLY A 131 4.609 1.641 9.750 1.00 61.32 N ATOM 700 CA GLY A 131 5.972 1.170 9.587 1.00 25.54 C ATOM 701 C GLY A 131 6.366 0.156 10.643 1.00 12.24 C ATOM 702 O GLY A 131 7.376 0.323 11.326 1.00 71.42 O ATOM 0 H GLY A 131 4.014 1.523 8.930 1.00 61.32 H new ATOM 0 HA2 GLY A 131 6.083 0.723 8.599 1.00 25.54 H new ATOM 0 HA3 GLY A 131 6.654 2.019 9.631 1.00 25.54 H new ATOM 706 N GLU A 132 5.565 -0.895 10.780 1.00 75.42 N ATOM 707 CA GLU A 132 5.834 -1.938 11.763 1.00 14.33 C ATOM 708 C GLU A 132 6.794 -2.982 11.200 1.00 13.43 C ATOM 709 O GLU A 132 6.402 -3.839 10.408 1.00 3.22 O ATOM 710 CB GLU A 132 4.529 -2.611 12.197 1.00 1.13 C ATOM 711 CG GLU A 132 4.315 -2.609 13.701 1.00 21.43 C ATOM 712 CD GLU A 132 2.885 -2.285 14.086 1.00 34.52 C ATOM 713 OE1 GLU A 132 1.976 -3.042 13.686 1.00 74.51 O ATOM 714 OE2 GLU A 132 2.675 -1.274 14.788 1.00 32.44 O ATOM 0 H GLU A 132 4.724 -1.047 10.223 1.00 75.42 H new ATOM 0 HA GLU A 132 6.300 -1.471 12.631 1.00 14.33 H new ATOM 0 HB2 GLU A 132 3.691 -2.103 11.719 1.00 1.13 H new ATOM 0 HB3 GLU A 132 4.524 -3.641 11.839 1.00 1.13 H new ATOM 0 HG2 GLU A 132 4.583 -3.586 14.104 1.00 21.43 H new ATOM 0 HG3 GLU A 132 4.984 -1.881 14.159 1.00 21.43 H new ATOM 721 N PHE A 133 8.054 -2.902 11.615 1.00 23.50 N ATOM 722 CA PHE A 133 9.072 -3.838 11.151 1.00 4.31 C ATOM 723 C PHE A 133 8.947 -5.177 11.871 1.00 61.33 C ATOM 724 O PHE A 133 9.160 -5.268 13.081 1.00 71.44 O ATOM 725 CB PHE A 133 10.469 -3.256 11.373 1.00 30.04 C ATOM 726 CG PHE A 133 11.540 -3.951 10.582 1.00 24.20 C ATOM 727 CD1 PHE A 133 11.527 -3.922 9.197 1.00 34.41 C ATOM 728 CD2 PHE A 133 12.562 -4.632 11.225 1.00 70.12 C ATOM 729 CE1 PHE A 133 12.511 -4.562 8.467 1.00 33.11 C ATOM 730 CE2 PHE A 133 13.550 -5.273 10.500 1.00 51.04 C ATOM 731 CZ PHE A 133 13.524 -5.236 9.120 1.00 72.51 C ATOM 0 H PHE A 133 8.395 -2.199 12.271 1.00 23.50 H new ATOM 0 HA PHE A 133 8.920 -4.003 10.084 1.00 4.31 H new ATOM 0 HB2 PHE A 133 10.460 -2.199 11.107 1.00 30.04 H new ATOM 0 HB3 PHE A 133 10.715 -3.316 12.433 1.00 30.04 H new ATOM 0 HD1 PHE A 133 10.739 -3.393 8.682 1.00 34.41 H new ATOM 0 HD2 PHE A 133 12.587 -4.662 12.304 1.00 70.12 H new ATOM 0 HE1 PHE A 133 12.488 -4.535 7.388 1.00 33.11 H new ATOM 0 HE2 PHE A 133 14.340 -5.801 11.012 1.00 51.04 H new ATOM 0 HZ PHE A 133 14.296 -5.734 8.552 1.00 72.51 H new ATOM 741 N VAL A 134 8.599 -6.217 11.119 1.00 41.45 N ATOM 742 CA VAL A 134 8.446 -7.552 11.683 1.00 1.24 C ATOM 743 C VAL A 134 9.718 -8.373 11.505 1.00 31.42 C ATOM 744 O VAL A 134 10.720 -7.880 10.989 1.00 71.25 O ATOM 745 CB VAL A 134 7.267 -8.304 11.035 1.00 2.34 C ATOM 746 CG1 VAL A 134 5.958 -7.577 11.303 1.00 2.43 C ATOM 747 CG2 VAL A 134 7.499 -8.470 9.541 1.00 40.32 C ATOM 0 H VAL A 134 8.418 -6.160 10.117 1.00 41.45 H new ATOM 0 HA VAL A 134 8.245 -7.425 12.747 1.00 1.24 H new ATOM 0 HB VAL A 134 7.201 -9.296 11.482 1.00 2.34 H new ATOM 0 HG11 VAL A 134 5.137 -8.123 10.838 1.00 2.43 H new ATOM 0 HG12 VAL A 134 5.790 -7.515 12.378 1.00 2.43 H new ATOM 0 HG13 VAL A 134 6.008 -6.571 10.885 1.00 2.43 H new ATOM 0 HG21 VAL A 134 6.657 -9.003 9.099 1.00 40.32 H new ATOM 0 HG22 VAL A 134 7.592 -7.489 9.076 1.00 40.32 H new ATOM 0 HG23 VAL A 134 8.415 -9.038 9.376 1.00 40.32 H new ATOM 757 N ASP A 135 9.669 -9.629 11.935 1.00 21.24 N ATOM 758 CA ASP A 135 10.817 -10.521 11.822 1.00 22.20 C ATOM 759 C ASP A 135 11.243 -10.676 10.366 1.00 64.15 C ATOM 760 O ASP A 135 12.405 -10.960 10.074 1.00 2.42 O ATOM 761 CB ASP A 135 10.488 -11.891 12.418 1.00 54.11 C ATOM 762 CG ASP A 135 10.955 -12.024 13.854 1.00 2.22 C ATOM 763 OD1 ASP A 135 10.257 -11.514 14.756 1.00 53.44 O ATOM 764 OD2 ASP A 135 12.018 -12.641 14.077 1.00 0.43 O ATOM 0 H ASP A 135 8.847 -10.052 12.365 1.00 21.24 H new ATOM 0 HA ASP A 135 11.643 -10.080 12.380 1.00 22.20 H new ATOM 0 HB2 ASP A 135 9.411 -12.055 12.372 1.00 54.11 H new ATOM 0 HB3 ASP A 135 10.955 -12.669 11.814 1.00 54.11 H new ATOM 769 N ASP A 136 10.295 -10.490 9.454 1.00 32.41 N ATOM 770 CA ASP A 136 10.572 -10.609 8.027 1.00 55.04 C ATOM 771 C ASP A 136 9.533 -9.849 7.207 1.00 30.43 C ATOM 772 O ASP A 136 8.414 -10.321 7.015 1.00 14.01 O ATOM 773 CB ASP A 136 10.591 -12.080 7.610 1.00 22.43 C ATOM 774 CG ASP A 136 11.939 -12.511 7.068 1.00 45.54 C ATOM 775 OD1 ASP A 136 12.895 -12.612 7.866 1.00 43.13 O ATOM 776 OD2 ASP A 136 12.040 -12.746 5.845 1.00 43.42 O ATOM 0 H ASP A 136 9.328 -10.256 9.678 1.00 32.41 H new ATOM 0 HA ASP A 136 11.552 -10.172 7.835 1.00 55.04 H new ATOM 0 HB2 ASP A 136 10.332 -12.701 8.468 1.00 22.43 H new ATOM 0 HB3 ASP A 136 9.827 -12.249 6.852 1.00 22.43 H new ATOM 781 N GLY A 137 9.913 -8.670 6.726 1.00 2.23 N ATOM 782 CA GLY A 137 9.003 -7.863 5.934 1.00 43.14 C ATOM 783 C GLY A 137 8.571 -6.601 6.653 1.00 2.11 C ATOM 784 O GLY A 137 9.025 -6.323 7.764 1.00 13.12 O ATOM 0 H GLY A 137 10.835 -8.259 6.870 1.00 2.23 H new ATOM 0 HA2 GLY A 137 9.485 -7.595 4.994 1.00 43.14 H new ATOM 0 HA3 GLY A 137 8.122 -8.454 5.684 1.00 43.14 H new ATOM 788 N THR A 138 7.691 -5.832 6.019 1.00 20.44 N ATOM 789 CA THR A 138 7.199 -4.592 6.604 1.00 15.35 C ATOM 790 C THR A 138 5.688 -4.467 6.440 1.00 64.43 C ATOM 791 O THR A 138 5.157 -4.653 5.345 1.00 45.41 O ATOM 792 CB THR A 138 7.876 -3.363 5.968 1.00 63.21 C ATOM 793 OG1 THR A 138 8.929 -3.783 5.093 1.00 54.52 O ATOM 794 CG2 THR A 138 8.437 -2.439 7.039 1.00 60.04 C ATOM 0 H THR A 138 7.305 -6.047 5.100 1.00 20.44 H new ATOM 0 HA THR A 138 7.445 -4.625 7.665 1.00 15.35 H new ATOM 0 HB THR A 138 7.125 -2.817 5.397 1.00 63.21 H new ATOM 0 HG1 THR A 138 9.628 -3.097 5.070 1.00 54.52 H new ATOM 0 HG21 THR A 138 8.910 -1.579 6.566 1.00 60.04 H new ATOM 0 HG22 THR A 138 7.628 -2.098 7.686 1.00 60.04 H new ATOM 0 HG23 THR A 138 9.175 -2.977 7.634 1.00 60.04 H new ATOM 802 N GLU A 139 5.002 -4.152 7.534 1.00 72.20 N ATOM 803 CA GLU A 139 3.552 -4.004 7.509 1.00 60.15 C ATOM 804 C GLU A 139 3.152 -2.538 7.653 1.00 0.31 C ATOM 805 O GLU A 139 3.076 -2.009 8.762 1.00 20.01 O ATOM 806 CB GLU A 139 2.912 -4.830 8.626 1.00 22.01 C ATOM 807 CG GLU A 139 3.506 -6.221 8.770 1.00 43.00 C ATOM 808 CD GLU A 139 2.887 -7.005 9.912 1.00 12.50 C ATOM 809 OE1 GLU A 139 2.442 -6.373 10.893 1.00 11.12 O ATOM 810 OE2 GLU A 139 2.848 -8.249 9.823 1.00 32.51 O ATOM 0 H GLU A 139 5.427 -3.995 8.448 1.00 72.20 H new ATOM 0 HA GLU A 139 3.193 -4.369 6.547 1.00 60.15 H new ATOM 0 HB2 GLU A 139 3.023 -4.297 9.570 1.00 22.01 H new ATOM 0 HB3 GLU A 139 1.843 -4.919 8.434 1.00 22.01 H new ATOM 0 HG2 GLU A 139 3.365 -6.770 7.839 1.00 43.00 H new ATOM 0 HG3 GLU A 139 4.581 -6.138 8.932 1.00 43.00 H new ATOM 817 N THR A 140 2.899 -1.885 6.522 1.00 64.10 N ATOM 818 CA THR A 140 2.510 -0.481 6.522 1.00 52.25 C ATOM 819 C THR A 140 1.027 -0.321 6.838 1.00 4.21 C ATOM 820 O THR A 140 0.169 -0.681 6.032 1.00 55.40 O ATOM 821 CB THR A 140 2.808 0.184 5.163 1.00 32.04 C ATOM 822 OG1 THR A 140 3.219 -0.805 4.214 1.00 22.52 O ATOM 823 CG2 THR A 140 3.894 1.240 5.305 1.00 71.41 C ATOM 0 H THR A 140 2.957 -2.307 5.595 1.00 64.10 H new ATOM 0 HA THR A 140 3.099 0.010 7.297 1.00 52.25 H new ATOM 0 HB THR A 140 1.896 0.667 4.812 1.00 32.04 H new ATOM 0 HG1 THR A 140 2.481 -1.429 4.052 1.00 22.52 H new ATOM 0 HG21 THR A 140 4.088 1.696 4.334 1.00 71.41 H new ATOM 0 HG22 THR A 140 3.566 2.007 6.007 1.00 71.41 H new ATOM 0 HG23 THR A 140 4.807 0.775 5.676 1.00 71.41 H new ATOM 831 N HIS A 141 0.734 0.221 8.016 1.00 73.25 N ATOM 832 CA HIS A 141 -0.647 0.429 8.438 1.00 40.25 C ATOM 833 C HIS A 141 -1.026 1.905 8.345 1.00 33.42 C ATOM 834 O HIS A 141 -0.592 2.720 9.160 1.00 72.34 O ATOM 835 CB HIS A 141 -0.845 -0.072 9.868 1.00 12.24 C ATOM 836 CG HIS A 141 -0.323 -1.456 10.097 1.00 24.21 C ATOM 837 ND1 HIS A 141 -1.027 -2.592 9.757 1.00 23.14 N ATOM 838 CD2 HIS A 141 0.844 -1.885 10.633 1.00 71.14 C ATOM 839 CE1 HIS A 141 -0.317 -3.659 10.076 1.00 62.13 C ATOM 840 NE2 HIS A 141 0.823 -3.258 10.609 1.00 42.04 N ATOM 0 H HIS A 141 1.433 0.524 8.694 1.00 73.25 H new ATOM 0 HA HIS A 141 -1.296 -0.137 7.770 1.00 40.25 H new ATOM 0 HB2 HIS A 141 -0.349 0.613 10.556 1.00 12.24 H new ATOM 0 HB3 HIS A 141 -1.908 -0.050 10.108 1.00 12.24 H new ATOM 0 HD1 HIS A 141 -1.952 -2.606 9.326 1.00 23.14 H new ATOM 0 HD2 HIS A 141 1.643 -1.263 11.009 1.00 71.14 H new ATOM 0 HE1 HIS A 141 -0.618 -4.685 9.926 1.00 62.13 H new ATOM 848 N PHE A 142 -1.837 2.240 7.347 1.00 3.13 N ATOM 849 CA PHE A 142 -2.274 3.617 7.147 1.00 65.50 C ATOM 850 C PHE A 142 -3.797 3.708 7.131 1.00 25.44 C ATOM 851 O PHE A 142 -4.467 2.963 6.416 1.00 4.03 O ATOM 852 CB PHE A 142 -1.705 4.169 5.838 1.00 43.02 C ATOM 853 CG PHE A 142 -1.843 3.224 4.679 1.00 65.32 C ATOM 854 CD1 PHE A 142 -3.006 3.192 3.929 1.00 55.04 C ATOM 855 CD2 PHE A 142 -0.807 2.367 4.340 1.00 54.41 C ATOM 856 CE1 PHE A 142 -3.136 2.324 2.861 1.00 71.11 C ATOM 857 CE2 PHE A 142 -0.931 1.497 3.273 1.00 1.04 C ATOM 858 CZ PHE A 142 -2.097 1.475 2.534 1.00 35.30 C ATOM 0 H PHE A 142 -2.205 1.577 6.664 1.00 3.13 H new ATOM 0 HA PHE A 142 -1.901 4.215 7.979 1.00 65.50 H new ATOM 0 HB2 PHE A 142 -2.211 5.104 5.597 1.00 43.02 H new ATOM 0 HB3 PHE A 142 -0.650 4.405 5.980 1.00 43.02 H new ATOM 0 HD1 PHE A 142 -3.822 3.853 4.181 1.00 55.04 H new ATOM 0 HD2 PHE A 142 0.107 2.379 4.916 1.00 54.41 H new ATOM 0 HE1 PHE A 142 -4.048 2.310 2.283 1.00 71.11 H new ATOM 0 HE2 PHE A 142 -0.117 0.835 3.018 1.00 1.04 H new ATOM 0 HZ PHE A 142 -2.196 0.795 1.701 1.00 35.30 H new ATOM 868 N SER A 143 -4.337 4.625 7.927 1.00 4.43 N ATOM 869 CA SER A 143 -5.781 4.812 8.009 1.00 20.31 C ATOM 870 C SER A 143 -6.291 5.632 6.828 1.00 65.03 C ATOM 871 O SER A 143 -5.538 6.384 6.209 1.00 40.25 O ATOM 872 CB SER A 143 -6.153 5.503 9.322 1.00 22.53 C ATOM 873 OG SER A 143 -5.586 6.799 9.396 1.00 63.11 O ATOM 0 H SER A 143 -3.796 5.250 8.525 1.00 4.43 H new ATOM 0 HA SER A 143 -6.252 3.829 7.977 1.00 20.31 H new ATOM 0 HB2 SER A 143 -7.238 5.572 9.405 1.00 22.53 H new ATOM 0 HB3 SER A 143 -5.806 4.903 10.163 1.00 22.53 H new ATOM 0 HG SER A 143 -5.840 7.219 10.244 1.00 63.11 H new ATOM 879 N VAL A 144 -7.575 5.480 6.521 1.00 3.02 N ATOM 880 CA VAL A 144 -8.187 6.207 5.415 1.00 60.13 C ATOM 881 C VAL A 144 -9.663 6.477 5.685 1.00 20.31 C ATOM 882 O VAL A 144 -10.512 5.610 5.476 1.00 40.54 O ATOM 883 CB VAL A 144 -8.052 5.432 4.091 1.00 42.21 C ATOM 884 CG1 VAL A 144 -8.719 6.193 2.955 1.00 3.33 C ATOM 885 CG2 VAL A 144 -6.588 5.165 3.777 1.00 3.45 C ATOM 0 H VAL A 144 -8.212 4.860 7.022 1.00 3.02 H new ATOM 0 HA VAL A 144 -7.657 7.155 5.328 1.00 60.13 H new ATOM 0 HB VAL A 144 -8.558 4.473 4.199 1.00 42.21 H new ATOM 0 HG11 VAL A 144 -8.613 5.629 2.028 1.00 3.33 H new ATOM 0 HG12 VAL A 144 -9.777 6.327 3.179 1.00 3.33 H new ATOM 0 HG13 VAL A 144 -8.245 7.168 2.843 1.00 3.33 H new ATOM 0 HG21 VAL A 144 -6.511 4.617 2.838 1.00 3.45 H new ATOM 0 HG22 VAL A 144 -6.056 6.112 3.688 1.00 3.45 H new ATOM 0 HG23 VAL A 144 -6.146 4.574 4.579 1.00 3.45 H new ATOM 895 N GLY A 145 -9.963 7.685 6.150 1.00 15.14 N ATOM 896 CA GLY A 145 -11.338 8.048 6.442 1.00 62.33 C ATOM 897 C GLY A 145 -11.986 7.109 7.439 1.00 35.50 C ATOM 898 O GLY A 145 -11.683 7.152 8.630 1.00 45.20 O ATOM 0 H GLY A 145 -9.279 8.420 6.330 1.00 15.14 H new ATOM 0 HA2 GLY A 145 -11.367 9.065 6.834 1.00 62.33 H new ATOM 0 HA3 GLY A 145 -11.915 8.046 5.517 1.00 62.33 H new ATOM 902 N ASN A 146 -12.885 6.259 6.952 1.00 13.22 N ATOM 903 CA ASN A 146 -13.580 5.307 7.811 1.00 74.51 C ATOM 904 C ASN A 146 -13.244 3.872 7.417 1.00 41.15 C ATOM 905 O ASN A 146 -14.015 2.948 7.677 1.00 61.22 O ATOM 906 CB ASN A 146 -15.092 5.527 7.732 1.00 73.02 C ATOM 907 CG ASN A 146 -15.838 4.830 8.854 1.00 42.31 C ATOM 908 OD1 ASN A 146 -15.750 5.231 10.014 1.00 20.13 O ATOM 909 ND2 ASN A 146 -16.576 3.781 8.511 1.00 13.34 N ATOM 0 H ASN A 146 -13.149 6.210 5.968 1.00 13.22 H new ATOM 0 HA ASN A 146 -13.248 5.471 8.836 1.00 74.51 H new ATOM 0 HB2 ASN A 146 -15.303 6.596 7.768 1.00 73.02 H new ATOM 0 HB3 ASN A 146 -15.460 5.162 6.773 1.00 73.02 H new ATOM 0 HD21 ASN A 146 -17.100 3.272 9.223 1.00 13.34 H new ATOM 0 HD22 ASN A 146 -16.619 3.485 7.536 1.00 13.34 H new ATOM 916 N HIS A 147 -12.085 3.693 6.788 1.00 14.24 N ATOM 917 CA HIS A 147 -11.645 2.371 6.359 1.00 64.51 C ATOM 918 C HIS A 147 -10.355 1.971 7.071 1.00 73.12 C ATOM 919 O HIS A 147 -9.872 2.685 7.948 1.00 40.12 O ATOM 920 CB HIS A 147 -11.435 2.346 4.845 1.00 43.24 C ATOM 921 CG HIS A 147 -12.695 2.550 4.062 1.00 72.05 C ATOM 922 ND1 HIS A 147 -13.852 1.840 4.302 1.00 34.22 N ATOM 923 CD2 HIS A 147 -12.976 3.390 3.039 1.00 42.35 C ATOM 924 CE1 HIS A 147 -14.790 2.235 3.460 1.00 74.43 C ATOM 925 NE2 HIS A 147 -14.284 3.174 2.682 1.00 14.43 N ATOM 0 H HIS A 147 -11.435 4.447 6.565 1.00 14.24 H new ATOM 0 HA HIS A 147 -12.422 1.653 6.621 1.00 64.51 H new ATOM 0 HB2 HIS A 147 -10.719 3.121 4.573 1.00 43.24 H new ATOM 0 HB3 HIS A 147 -10.993 1.390 4.564 1.00 43.24 H new ATOM 0 HD2 HIS A 147 -12.298 4.099 2.587 1.00 42.35 H new ATOM 0 HE1 HIS A 147 -15.800 1.854 3.416 1.00 74.43 H new ATOM 0 HE2 HIS A 147 -14.783 3.660 1.937 1.00 14.43 H new ATOM 933 N ASP A 148 -9.806 0.823 6.687 1.00 50.44 N ATOM 934 CA ASP A 148 -8.573 0.329 7.287 1.00 20.44 C ATOM 935 C ASP A 148 -7.704 -0.371 6.246 1.00 41.13 C ATOM 936 O ASP A 148 -7.667 -1.600 6.178 1.00 21.32 O ATOM 937 CB ASP A 148 -8.889 -0.632 8.435 1.00 75.34 C ATOM 938 CG ASP A 148 -7.638 -1.173 9.098 1.00 0.21 C ATOM 939 OD1 ASP A 148 -6.716 -0.373 9.366 1.00 24.52 O ATOM 940 OD2 ASP A 148 -7.581 -2.394 9.351 1.00 30.12 O ATOM 0 H ASP A 148 -10.195 0.218 5.964 1.00 50.44 H new ATOM 0 HA ASP A 148 -8.021 1.183 7.679 1.00 20.44 H new ATOM 0 HB2 ASP A 148 -9.497 -0.117 9.179 1.00 75.34 H new ATOM 0 HB3 ASP A 148 -9.484 -1.463 8.056 1.00 75.34 H new ATOM 945 N CYS A 149 -7.008 0.420 5.437 1.00 22.12 N ATOM 946 CA CYS A 149 -6.141 -0.123 4.398 1.00 61.42 C ATOM 947 C CYS A 149 -4.708 -0.264 4.903 1.00 13.21 C ATOM 948 O CYS A 149 -4.314 0.389 5.870 1.00 61.33 O ATOM 949 CB CYS A 149 -6.171 0.772 3.158 1.00 15.33 C ATOM 950 SG CYS A 149 -7.831 1.289 2.663 1.00 75.32 S ATOM 0 H CYS A 149 -7.027 1.439 5.481 1.00 22.12 H new ATOM 0 HA CYS A 149 -6.513 -1.112 4.132 1.00 61.42 H new ATOM 0 HB2 CYS A 149 -5.567 1.659 3.348 1.00 15.33 H new ATOM 0 HB3 CYS A 149 -5.705 0.241 2.328 1.00 15.33 H new ATOM 0 HG CYS A 149 -7.754 2.044 1.607 1.00 75.32 H new ATOM 956 N TYR A 150 -3.935 -1.120 4.244 1.00 41.23 N ATOM 957 CA TYR A 150 -2.548 -1.350 4.629 1.00 52.45 C ATOM 958 C TYR A 150 -1.767 -2.001 3.491 1.00 35.32 C ATOM 959 O TYR A 150 -2.302 -2.826 2.751 1.00 71.51 O ATOM 960 CB TYR A 150 -2.482 -2.230 5.878 1.00 45.54 C ATOM 961 CG TYR A 150 -2.980 -3.640 5.652 1.00 24.21 C ATOM 962 CD1 TYR A 150 -2.131 -4.628 5.169 1.00 41.14 C ATOM 963 CD2 TYR A 150 -4.299 -3.984 5.922 1.00 65.04 C ATOM 964 CE1 TYR A 150 -2.581 -5.918 4.961 1.00 52.44 C ATOM 965 CE2 TYR A 150 -4.757 -5.270 5.718 1.00 61.30 C ATOM 966 CZ TYR A 150 -3.895 -6.234 5.236 1.00 51.50 C ATOM 967 OH TYR A 150 -4.347 -7.517 5.031 1.00 53.44 O ATOM 0 H TYR A 150 -4.246 -1.666 3.440 1.00 41.23 H new ATOM 0 HA TYR A 150 -2.094 -0.384 4.850 1.00 52.45 H new ATOM 0 HB2 TYR A 150 -1.451 -2.270 6.230 1.00 45.54 H new ATOM 0 HB3 TYR A 150 -3.072 -1.768 6.670 1.00 45.54 H new ATOM 0 HD1 TYR A 150 -1.102 -4.384 4.952 1.00 41.14 H new ATOM 0 HD2 TYR A 150 -4.977 -3.232 6.298 1.00 65.04 H new ATOM 0 HE1 TYR A 150 -1.908 -6.674 4.585 1.00 52.44 H new ATOM 0 HE2 TYR A 150 -5.785 -5.521 5.935 1.00 61.30 H new ATOM 0 HH TYR A 150 -5.295 -7.573 5.274 1.00 53.44 H new ATOM 977 N ILE A 151 -0.500 -1.625 3.360 1.00 13.35 N ATOM 978 CA ILE A 151 0.355 -2.174 2.315 1.00 44.52 C ATOM 979 C ILE A 151 1.215 -3.313 2.850 1.00 31.11 C ATOM 980 O ILE A 151 2.122 -3.096 3.655 1.00 34.35 O ATOM 981 CB ILE A 151 1.272 -1.093 1.713 1.00 41.51 C ATOM 982 CG1 ILE A 151 0.504 -0.254 0.690 1.00 51.51 C ATOM 983 CG2 ILE A 151 2.494 -1.731 1.071 1.00 72.12 C ATOM 984 CD1 ILE A 151 1.283 0.938 0.178 1.00 73.10 C ATOM 0 H ILE A 151 -0.043 -0.942 3.964 1.00 13.35 H new ATOM 0 HA ILE A 151 -0.305 -2.555 1.536 1.00 44.52 H new ATOM 0 HB ILE A 151 1.609 -0.436 2.515 1.00 41.51 H new ATOM 0 HG12 ILE A 151 0.228 -0.887 -0.153 1.00 51.51 H new ATOM 0 HG13 ILE A 151 -0.424 0.096 1.142 1.00 51.51 H new ATOM 0 HG21 ILE A 151 3.132 -0.954 0.650 1.00 72.12 H new ATOM 0 HG22 ILE A 151 3.051 -2.289 1.824 1.00 72.12 H new ATOM 0 HG23 ILE A 151 2.177 -2.408 0.278 1.00 72.12 H new ATOM 0 HD11 ILE A 151 0.677 1.486 -0.543 1.00 73.10 H new ATOM 0 HD12 ILE A 151 1.536 1.593 1.012 1.00 73.10 H new ATOM 0 HD13 ILE A 151 2.198 0.595 -0.304 1.00 73.10 H new ATOM 996 N LYS A 152 0.927 -4.528 2.397 1.00 51.21 N ATOM 997 CA LYS A 152 1.675 -5.704 2.826 1.00 13.41 C ATOM 998 C LYS A 152 2.992 -5.818 2.066 1.00 2.11 C ATOM 999 O LYS A 152 3.017 -6.233 0.908 1.00 1.51 O ATOM 1000 CB LYS A 152 0.841 -6.969 2.616 1.00 20.33 C ATOM 1001 CG LYS A 152 1.627 -8.255 2.809 1.00 11.42 C ATOM 1002 CD LYS A 152 0.732 -9.477 2.701 1.00 23.35 C ATOM 1003 CE LYS A 152 1.520 -10.764 2.893 1.00 43.14 C ATOM 1004 NZ LYS A 152 0.661 -11.871 3.394 1.00 70.54 N ATOM 0 H LYS A 152 0.179 -4.725 1.731 1.00 51.21 H new ATOM 0 HA LYS A 152 1.897 -5.595 3.888 1.00 13.41 H new ATOM 0 HB2 LYS A 152 0.000 -6.959 3.310 1.00 20.33 H new ATOM 0 HB3 LYS A 152 0.423 -6.956 1.609 1.00 20.33 H new ATOM 0 HG2 LYS A 152 2.418 -8.315 2.061 1.00 11.42 H new ATOM 0 HG3 LYS A 152 2.112 -8.243 3.785 1.00 11.42 H new ATOM 0 HD2 LYS A 152 -0.058 -9.418 3.450 1.00 23.35 H new ATOM 0 HD3 LYS A 152 0.246 -9.489 1.725 1.00 23.35 H new ATOM 0 HE2 LYS A 152 1.974 -11.057 1.946 1.00 43.14 H new ATOM 0 HE3 LYS A 152 2.334 -10.590 3.596 1.00 43.14 H new ATOM 0 HZ1 LYS A 152 1.235 -12.730 3.512 1.00 70.54 H new ATOM 0 HZ2 LYS A 152 0.248 -11.603 4.310 1.00 70.54 H new ATOM 0 HZ3 LYS A 152 -0.101 -12.055 2.711 1.00 70.54 H new ATOM 1018 N ALA A 153 4.086 -5.448 2.725 1.00 14.35 N ATOM 1019 CA ALA A 153 5.406 -5.512 2.113 1.00 22.30 C ATOM 1020 C ALA A 153 6.099 -6.831 2.440 1.00 1.44 C ATOM 1021 O ALA A 153 5.960 -7.360 3.543 1.00 42.13 O ATOM 1022 CB ALA A 153 6.259 -4.338 2.570 1.00 11.21 C ATOM 0 H ALA A 153 4.083 -5.101 3.684 1.00 14.35 H new ATOM 0 HA ALA A 153 5.280 -5.455 1.032 1.00 22.30 H new ATOM 0 HB1 ALA A 153 7.243 -4.400 2.104 1.00 11.21 H new ATOM 0 HB2 ALA A 153 5.778 -3.404 2.280 1.00 11.21 H new ATOM 0 HB3 ALA A 153 6.368 -4.368 3.654 1.00 11.21 H new ATOM 1028 N VAL A 154 6.846 -7.357 1.474 1.00 10.05 N ATOM 1029 CA VAL A 154 7.561 -8.614 1.660 1.00 4.22 C ATOM 1030 C VAL A 154 8.948 -8.555 1.029 1.00 2.14 C ATOM 1031 O VAL A 154 9.085 -8.355 -0.177 1.00 31.41 O ATOM 1032 CB VAL A 154 6.784 -9.797 1.054 1.00 33.32 C ATOM 1033 CG1 VAL A 154 7.438 -11.117 1.433 1.00 21.43 C ATOM 1034 CG2 VAL A 154 5.330 -9.765 1.504 1.00 5.02 C ATOM 0 H VAL A 154 6.972 -6.932 0.555 1.00 10.05 H new ATOM 0 HA VAL A 154 7.659 -8.766 2.735 1.00 4.22 H new ATOM 0 HB VAL A 154 6.808 -9.706 -0.032 1.00 33.32 H new ATOM 0 HG11 VAL A 154 6.874 -11.941 0.995 1.00 21.43 H new ATOM 0 HG12 VAL A 154 8.461 -11.137 1.057 1.00 21.43 H new ATOM 0 HG13 VAL A 154 7.448 -11.220 2.518 1.00 21.43 H new ATOM 0 HG21 VAL A 154 4.795 -10.608 1.067 1.00 5.02 H new ATOM 0 HG22 VAL A 154 5.284 -9.831 2.591 1.00 5.02 H new ATOM 0 HG23 VAL A 154 4.868 -8.833 1.177 1.00 5.02 H new ATOM 1044 N SER A 155 9.975 -8.732 1.855 1.00 65.22 N ATOM 1045 CA SER A 155 11.353 -8.696 1.379 1.00 71.44 C ATOM 1046 C SER A 155 11.812 -10.082 0.937 1.00 72.32 C ATOM 1047 O SER A 155 11.373 -11.096 1.482 1.00 61.25 O ATOM 1048 CB SER A 155 12.280 -8.166 2.474 1.00 11.50 C ATOM 1049 OG SER A 155 12.888 -9.228 3.187 1.00 41.23 O ATOM 0 H SER A 155 9.879 -8.902 2.856 1.00 65.22 H new ATOM 0 HA SER A 155 11.396 -8.026 0.520 1.00 71.44 H new ATOM 0 HB2 SER A 155 13.050 -7.535 2.029 1.00 11.50 H new ATOM 0 HB3 SER A 155 11.713 -7.539 3.163 1.00 11.50 H new ATOM 0 HG SER A 155 13.477 -8.862 3.880 1.00 41.23 H new ATOM 1055 N SER A 156 12.696 -10.118 -0.054 1.00 43.23 N ATOM 1056 CA SER A 156 13.213 -11.379 -0.574 1.00 21.34 C ATOM 1057 C SER A 156 14.653 -11.222 -1.049 1.00 4.10 C ATOM 1058 O SER A 156 15.013 -10.212 -1.651 1.00 44.42 O ATOM 1059 CB SER A 156 12.336 -11.880 -1.723 1.00 52.51 C ATOM 1060 OG SER A 156 13.118 -12.496 -2.730 1.00 71.21 O ATOM 0 H SER A 156 13.070 -9.288 -0.514 1.00 43.23 H new ATOM 0 HA SER A 156 13.194 -12.111 0.234 1.00 21.34 H new ATOM 0 HB2 SER A 156 11.603 -12.591 -1.342 1.00 52.51 H new ATOM 0 HB3 SER A 156 11.779 -11.046 -2.150 1.00 52.51 H new ATOM 0 HG SER A 156 12.534 -12.809 -3.452 1.00 71.21 H new ATOM 1066 N GLY A 157 15.475 -12.231 -0.773 1.00 22.13 N ATOM 1067 CA GLY A 157 16.868 -12.187 -1.179 1.00 55.21 C ATOM 1068 C GLY A 157 17.811 -12.574 -0.058 1.00 23.11 C ATOM 1069 O GLY A 157 17.445 -13.338 0.836 1.00 43.23 O ATOM 0 H GLY A 157 15.201 -13.078 -0.275 1.00 22.13 H new ATOM 0 HA2 GLY A 157 17.018 -12.859 -2.024 1.00 55.21 H new ATOM 0 HA3 GLY A 157 17.111 -11.182 -1.524 1.00 55.21 H new ATOM 1073 N LYS A 158 19.031 -12.048 -0.104 1.00 55.31 N ATOM 1074 CA LYS A 158 20.031 -12.342 0.915 1.00 74.40 C ATOM 1075 C LYS A 158 19.784 -11.518 2.174 1.00 4.10 C ATOM 1076 O LYS A 158 20.106 -11.948 3.281 1.00 5.13 O ATOM 1077 CB LYS A 158 21.435 -12.063 0.376 1.00 53.12 C ATOM 1078 CG LYS A 158 21.999 -13.193 -0.467 1.00 65.31 C ATOM 1079 CD LYS A 158 22.910 -12.670 -1.565 1.00 44.51 C ATOM 1080 CE LYS A 158 23.850 -13.752 -2.073 1.00 60.11 C ATOM 1081 NZ LYS A 158 23.327 -14.408 -3.303 1.00 74.22 N ATOM 0 H LYS A 158 19.351 -11.415 -0.837 1.00 55.31 H new ATOM 0 HA LYS A 158 19.951 -13.398 1.173 1.00 74.40 H new ATOM 0 HB2 LYS A 158 21.411 -11.152 -0.222 1.00 53.12 H new ATOM 0 HB3 LYS A 158 22.106 -11.876 1.214 1.00 53.12 H new ATOM 0 HG2 LYS A 158 22.554 -13.881 0.170 1.00 65.31 H new ATOM 0 HG3 LYS A 158 21.181 -13.760 -0.911 1.00 65.31 H new ATOM 0 HD2 LYS A 158 22.307 -12.294 -2.391 1.00 44.51 H new ATOM 0 HD3 LYS A 158 23.492 -11.830 -1.187 1.00 44.51 H new ATOM 0 HE2 LYS A 158 24.827 -13.316 -2.281 1.00 60.11 H new ATOM 0 HE3 LYS A 158 23.995 -14.502 -1.295 1.00 60.11 H new ATOM 0 HZ1 LYS A 158 23.996 -15.139 -3.618 1.00 74.22 H new ATOM 0 HZ2 LYS A 158 22.406 -14.846 -3.098 1.00 74.22 H new ATOM 0 HZ3 LYS A 158 23.213 -13.697 -4.054 1.00 74.22 H new ATOM 1095 N ARG A 159 19.211 -10.332 1.996 1.00 32.55 N ATOM 1096 CA ARG A 159 18.921 -9.448 3.119 1.00 10.42 C ATOM 1097 C ARG A 159 18.034 -8.287 2.681 1.00 42.24 C ATOM 1098 O ARG A 159 17.107 -7.897 3.390 1.00 35.33 O ATOM 1099 CB ARG A 159 20.220 -8.912 3.722 1.00 23.51 C ATOM 1100 CG ARG A 159 21.181 -8.341 2.691 1.00 52.02 C ATOM 1101 CD ARG A 159 22.494 -7.915 3.328 1.00 11.21 C ATOM 1102 NE ARG A 159 23.532 -7.673 2.331 1.00 4.41 N ATOM 1103 CZ ARG A 159 24.205 -8.642 1.721 1.00 41.55 C ATOM 1104 NH1 ARG A 159 23.948 -9.912 2.004 1.00 43.43 N ATOM 1105 NH2 ARG A 159 25.136 -8.342 0.824 1.00 43.31 N ATOM 0 H ARG A 159 18.939 -9.961 1.086 1.00 32.55 H new ATOM 0 HA ARG A 159 18.388 -10.025 3.875 1.00 10.42 H new ATOM 0 HB2 ARG A 159 19.980 -8.137 4.450 1.00 23.51 H new ATOM 0 HB3 ARG A 159 20.718 -9.716 4.264 1.00 23.51 H new ATOM 0 HG2 ARG A 159 21.375 -9.087 1.920 1.00 52.02 H new ATOM 0 HG3 ARG A 159 20.720 -7.485 2.198 1.00 52.02 H new ATOM 0 HD2 ARG A 159 22.336 -7.010 3.914 1.00 11.21 H new ATOM 0 HD3 ARG A 159 22.829 -8.688 4.020 1.00 11.21 H new ATOM 0 HE ARG A 159 23.753 -6.707 2.089 1.00 4.41 H new ATOM 0 HH11 ARG A 159 23.232 -10.146 2.692 1.00 43.43 H new ATOM 0 HH12 ARG A 159 24.466 -10.654 1.534 1.00 43.43 H new ATOM 0 HH21 ARG A 159 25.335 -7.366 0.603 1.00 43.31 H new ATOM 0 HH22 ARG A 159 25.652 -9.087 0.356 1.00 43.31 H new ATOM 1119 N LYS A 160 18.325 -7.736 1.508 1.00 65.23 N ATOM 1120 CA LYS A 160 17.555 -6.619 0.973 1.00 61.12 C ATOM 1121 C LYS A 160 17.692 -6.541 -0.544 1.00 74.25 C ATOM 1122 O LYS A 160 17.624 -5.459 -1.127 1.00 3.43 O ATOM 1123 CB LYS A 160 18.017 -5.304 1.606 1.00 25.41 C ATOM 1124 CG LYS A 160 16.961 -4.213 1.582 1.00 32.40 C ATOM 1125 CD LYS A 160 17.570 -2.842 1.821 1.00 75.23 C ATOM 1126 CE LYS A 160 17.249 -2.324 3.215 1.00 74.51 C ATOM 1127 NZ LYS A 160 16.039 -1.456 3.218 1.00 30.01 N ATOM 0 H LYS A 160 19.090 -8.045 0.908 1.00 65.23 H new ATOM 0 HA LYS A 160 16.506 -6.784 1.218 1.00 61.12 H new ATOM 0 HB2 LYS A 160 18.310 -5.491 2.639 1.00 25.41 H new ATOM 0 HB3 LYS A 160 18.905 -4.950 1.082 1.00 25.41 H new ATOM 0 HG2 LYS A 160 16.449 -4.222 0.620 1.00 32.40 H new ATOM 0 HG3 LYS A 160 16.209 -4.416 2.345 1.00 32.40 H new ATOM 0 HD2 LYS A 160 18.651 -2.895 1.692 1.00 75.23 H new ATOM 0 HD3 LYS A 160 17.194 -2.141 1.076 1.00 75.23 H new ATOM 0 HE2 LYS A 160 17.093 -3.167 3.889 1.00 74.51 H new ATOM 0 HE3 LYS A 160 18.100 -1.762 3.599 1.00 74.51 H new ATOM 0 HZ1 LYS A 160 15.853 -1.123 4.186 1.00 30.01 H new ATOM 0 HZ2 LYS A 160 16.197 -0.639 2.595 1.00 30.01 H new ATOM 0 HZ3 LYS A 160 15.221 -2.000 2.876 1.00 30.01 H new ATOM 1141 N GLU A 161 17.881 -7.694 -1.177 1.00 62.32 N ATOM 1142 CA GLU A 161 18.026 -7.754 -2.627 1.00 63.12 C ATOM 1143 C GLU A 161 16.817 -7.133 -3.321 1.00 23.35 C ATOM 1144 O GLU A 161 16.942 -6.143 -4.042 1.00 31.53 O ATOM 1145 CB GLU A 161 18.200 -9.204 -3.084 1.00 42.24 C ATOM 1146 CG GLU A 161 19.156 -9.361 -4.256 1.00 24.54 C ATOM 1147 CD GLU A 161 20.160 -10.478 -4.044 1.00 12.24 C ATOM 1148 OE1 GLU A 161 20.699 -10.585 -2.922 1.00 75.21 O ATOM 1149 OE2 GLU A 161 20.407 -11.243 -4.999 1.00 44.13 O ATOM 0 H GLU A 161 17.937 -8.599 -0.709 1.00 62.32 H new ATOM 0 HA GLU A 161 18.914 -7.184 -2.902 1.00 63.12 H new ATOM 0 HB2 GLU A 161 18.564 -9.799 -2.247 1.00 42.24 H new ATOM 0 HB3 GLU A 161 17.227 -9.608 -3.363 1.00 42.24 H new ATOM 0 HG2 GLU A 161 18.584 -9.559 -5.163 1.00 24.54 H new ATOM 0 HG3 GLU A 161 19.689 -8.423 -4.413 1.00 24.54 H new ATOM 1156 N GLY A 162 15.646 -7.722 -3.097 1.00 74.52 N ATOM 1157 CA GLY A 162 14.432 -7.214 -3.708 1.00 74.33 C ATOM 1158 C GLY A 162 13.271 -7.163 -2.735 1.00 70.20 C ATOM 1159 O GLY A 162 13.266 -7.870 -1.727 1.00 50.11 O ATOM 0 H GLY A 162 15.517 -8.541 -2.504 1.00 74.52 H new ATOM 0 HA2 GLY A 162 14.617 -6.214 -4.100 1.00 74.33 H new ATOM 0 HA3 GLY A 162 14.164 -7.845 -4.556 1.00 74.33 H new ATOM 1163 N ILE A 163 12.285 -6.324 -3.035 1.00 71.24 N ATOM 1164 CA ILE A 163 11.114 -6.184 -2.179 1.00 21.34 C ATOM 1165 C ILE A 163 9.843 -6.021 -3.006 1.00 64.44 C ATOM 1166 O ILE A 163 9.866 -5.427 -4.085 1.00 60.32 O ATOM 1167 CB ILE A 163 11.252 -4.980 -1.229 1.00 24.21 C ATOM 1168 CG1 ILE A 163 12.555 -5.078 -0.433 1.00 4.31 C ATOM 1169 CG2 ILE A 163 10.057 -4.905 -0.291 1.00 52.21 C ATOM 1170 CD1 ILE A 163 12.808 -3.884 0.462 1.00 42.41 C ATOM 0 H ILE A 163 12.274 -5.731 -3.865 1.00 71.24 H new ATOM 0 HA ILE A 163 11.045 -7.097 -1.588 1.00 21.34 H new ATOM 0 HB ILE A 163 11.279 -4.068 -1.825 1.00 24.21 H new ATOM 0 HG12 ILE A 163 12.531 -5.981 0.177 1.00 4.31 H new ATOM 0 HG13 ILE A 163 13.388 -5.184 -1.127 1.00 4.31 H new ATOM 0 HG21 ILE A 163 10.170 -4.049 0.374 1.00 52.21 H new ATOM 0 HG22 ILE A 163 9.143 -4.794 -0.874 1.00 52.21 H new ATOM 0 HG23 ILE A 163 10.001 -5.819 0.300 1.00 52.21 H new ATOM 0 HD11 ILE A 163 13.748 -4.022 0.996 1.00 42.41 H new ATOM 0 HD12 ILE A 163 12.864 -2.980 -0.145 1.00 42.41 H new ATOM 0 HD13 ILE A 163 11.994 -3.789 1.181 1.00 42.41 H new ATOM 1182 N ILE A 164 8.739 -6.551 -2.494 1.00 13.24 N ATOM 1183 CA ILE A 164 7.458 -6.461 -3.184 1.00 61.23 C ATOM 1184 C ILE A 164 6.349 -6.024 -2.232 1.00 51.32 C ATOM 1185 O ILE A 164 6.121 -6.651 -1.197 1.00 61.02 O ATOM 1186 CB ILE A 164 7.067 -7.806 -3.824 1.00 64.12 C ATOM 1187 CG1 ILE A 164 8.152 -8.265 -4.802 1.00 2.25 C ATOM 1188 CG2 ILE A 164 5.726 -7.687 -4.531 1.00 65.45 C ATOM 1189 CD1 ILE A 164 8.764 -9.601 -4.442 1.00 3.32 C ATOM 0 H ILE A 164 8.705 -7.048 -1.604 1.00 13.24 H new ATOM 0 HA ILE A 164 7.576 -5.714 -3.969 1.00 61.23 H new ATOM 0 HB ILE A 164 6.975 -8.553 -3.036 1.00 64.12 H new ATOM 0 HG12 ILE A 164 7.725 -8.328 -5.803 1.00 2.25 H new ATOM 0 HG13 ILE A 164 8.939 -7.512 -4.838 1.00 2.25 H new ATOM 0 HG21 ILE A 164 5.464 -8.646 -4.978 1.00 65.45 H new ATOM 0 HG22 ILE A 164 4.959 -7.401 -3.811 1.00 65.45 H new ATOM 0 HG23 ILE A 164 5.792 -6.929 -5.311 1.00 65.45 H new ATOM 0 HD11 ILE A 164 9.524 -9.863 -5.178 1.00 3.32 H new ATOM 0 HD12 ILE A 164 9.221 -9.538 -3.455 1.00 3.32 H new ATOM 0 HD13 ILE A 164 7.988 -10.366 -4.434 1.00 3.32 H new ATOM 1201 N HIS A 165 5.662 -4.944 -2.589 1.00 14.31 N ATOM 1202 CA HIS A 165 4.575 -4.423 -1.768 1.00 31.13 C ATOM 1203 C HIS A 165 3.219 -4.786 -2.368 1.00 4.10 C ATOM 1204 O HIS A 165 3.025 -4.714 -3.582 1.00 21.31 O ATOM 1205 CB HIS A 165 4.694 -2.905 -1.629 1.00 32.13 C ATOM 1206 CG HIS A 165 6.098 -2.432 -1.406 1.00 61.22 C ATOM 1207 ND1 HIS A 165 6.968 -2.145 -2.438 1.00 14.22 N ATOM 1208 CD2 HIS A 165 6.781 -2.196 -0.263 1.00 31.40 C ATOM 1209 CE1 HIS A 165 8.126 -1.753 -1.937 1.00 31.25 C ATOM 1210 NE2 HIS A 165 8.039 -1.775 -0.619 1.00 34.53 N ATOM 0 H HIS A 165 5.839 -4.412 -3.441 1.00 14.31 H new ATOM 0 HA HIS A 165 4.649 -4.877 -0.780 1.00 31.13 H new ATOM 0 HB2 HIS A 165 4.299 -2.434 -2.529 1.00 32.13 H new ATOM 0 HB3 HIS A 165 4.072 -2.575 -0.797 1.00 32.13 H new ATOM 0 HD2 HIS A 165 6.407 -2.316 0.743 1.00 31.40 H new ATOM 0 HE1 HIS A 165 8.996 -1.464 -2.508 1.00 31.25 H new ATOM 0 HE2 HIS A 165 8.785 -1.521 0.029 1.00 34.53 H new ATOM 1218 N THR A 166 2.283 -5.177 -1.508 1.00 13.32 N ATOM 1219 CA THR A 166 0.947 -5.553 -1.952 1.00 52.34 C ATOM 1220 C THR A 166 -0.124 -4.826 -1.148 1.00 73.13 C ATOM 1221 O THR A 166 -0.330 -5.113 0.033 1.00 54.25 O ATOM 1222 CB THR A 166 0.722 -7.071 -1.833 1.00 32.45 C ATOM 1223 OG1 THR A 166 1.842 -7.683 -1.182 1.00 71.52 O ATOM 1224 CG2 THR A 166 0.520 -7.699 -3.204 1.00 42.31 C ATOM 0 H THR A 166 2.426 -5.241 -0.500 1.00 13.32 H new ATOM 0 HA THR A 166 0.869 -5.264 -3.000 1.00 52.34 H new ATOM 0 HB THR A 166 -0.178 -7.237 -1.240 1.00 32.45 H new ATOM 0 HG1 THR A 166 2.072 -7.173 -0.377 1.00 71.52 H new ATOM 0 HG21 THR A 166 0.363 -8.772 -3.093 1.00 42.31 H new ATOM 0 HG22 THR A 166 -0.351 -7.253 -3.684 1.00 42.31 H new ATOM 0 HG23 THR A 166 1.403 -7.523 -3.818 1.00 42.31 H new ATOM 1232 N LEU A 167 -0.805 -3.886 -1.793 1.00 15.33 N ATOM 1233 CA LEU A 167 -1.858 -3.117 -1.137 1.00 32.13 C ATOM 1234 C LEU A 167 -3.052 -4.006 -0.801 1.00 1.03 C ATOM 1235 O LEU A 167 -3.464 -4.840 -1.607 1.00 43.13 O ATOM 1236 CB LEU A 167 -2.306 -1.961 -2.031 1.00 42.51 C ATOM 1237 CG LEU A 167 -3.569 -1.219 -1.590 1.00 23.14 C ATOM 1238 CD1 LEU A 167 -3.433 -0.745 -0.151 1.00 31.02 C ATOM 1239 CD2 LEU A 167 -3.850 -0.046 -2.515 1.00 45.14 C ATOM 0 H LEU A 167 -0.647 -3.637 -2.770 1.00 15.33 H new ATOM 0 HA LEU A 167 -1.454 -2.714 -0.208 1.00 32.13 H new ATOM 0 HB2 LEU A 167 -1.490 -1.241 -2.095 1.00 42.51 H new ATOM 0 HB3 LEU A 167 -2.469 -2.348 -3.037 1.00 42.51 H new ATOM 0 HG LEU A 167 -4.411 -1.909 -1.647 1.00 23.14 H new ATOM 0 HD11 LEU A 167 -4.340 -0.219 0.146 1.00 31.02 H new ATOM 0 HD12 LEU A 167 -3.281 -1.604 0.502 1.00 31.02 H new ATOM 0 HD13 LEU A 167 -2.580 -0.071 -0.069 1.00 31.02 H new ATOM 0 HD21 LEU A 167 -4.752 0.469 -2.185 1.00 45.14 H new ATOM 0 HD22 LEU A 167 -3.008 0.646 -2.492 1.00 45.14 H new ATOM 0 HD23 LEU A 167 -3.992 -0.411 -3.532 1.00 45.14 H new ATOM 1251 N ILE A 168 -3.603 -3.821 0.395 1.00 44.05 N ATOM 1252 CA ILE A 168 -4.750 -4.603 0.835 1.00 13.12 C ATOM 1253 C ILE A 168 -5.769 -3.727 1.557 1.00 50.34 C ATOM 1254 O ILE A 168 -5.422 -2.976 2.469 1.00 34.00 O ATOM 1255 CB ILE A 168 -4.324 -5.751 1.770 1.00 42.31 C ATOM 1256 CG1 ILE A 168 -3.249 -6.609 1.102 1.00 51.22 C ATOM 1257 CG2 ILE A 168 -5.528 -6.600 2.149 1.00 3.13 C ATOM 1258 CD1 ILE A 168 -2.990 -7.917 1.816 1.00 62.04 C ATOM 0 H ILE A 168 -3.273 -3.136 1.075 1.00 44.05 H new ATOM 0 HA ILE A 168 -5.206 -5.025 -0.061 1.00 13.12 H new ATOM 0 HB ILE A 168 -3.906 -5.322 2.681 1.00 42.31 H new ATOM 0 HG12 ILE A 168 -3.549 -6.818 0.075 1.00 51.22 H new ATOM 0 HG13 ILE A 168 -2.320 -6.041 1.054 1.00 51.22 H new ATOM 0 HG21 ILE A 168 -5.211 -7.407 2.810 1.00 3.13 H new ATOM 0 HG22 ILE A 168 -6.264 -5.980 2.661 1.00 3.13 H new ATOM 0 HG23 ILE A 168 -5.973 -7.023 1.248 1.00 3.13 H new ATOM 0 HD11 ILE A 168 -2.216 -8.473 1.287 1.00 62.04 H new ATOM 0 HD12 ILE A 168 -2.660 -7.716 2.835 1.00 62.04 H new ATOM 0 HD13 ILE A 168 -3.907 -8.505 1.841 1.00 62.04 H new ATOM 1270 N VAL A 169 -7.028 -3.829 1.143 1.00 74.34 N ATOM 1271 CA VAL A 169 -8.099 -3.048 1.751 1.00 62.32 C ATOM 1272 C VAL A 169 -9.232 -3.948 2.228 1.00 73.32 C ATOM 1273 O VAL A 169 -9.811 -4.702 1.446 1.00 71.41 O ATOM 1274 CB VAL A 169 -8.664 -2.008 0.766 1.00 41.23 C ATOM 1275 CG1 VAL A 169 -9.772 -1.198 1.421 1.00 2.13 C ATOM 1276 CG2 VAL A 169 -7.555 -1.098 0.260 1.00 51.44 C ATOM 0 H VAL A 169 -7.331 -4.445 0.389 1.00 74.34 H new ATOM 0 HA VAL A 169 -7.666 -2.529 2.606 1.00 62.32 H new ATOM 0 HB VAL A 169 -9.089 -2.535 -0.088 1.00 41.23 H new ATOM 0 HG11 VAL A 169 -10.159 -0.468 0.709 1.00 2.13 H new ATOM 0 HG12 VAL A 169 -10.577 -1.865 1.730 1.00 2.13 H new ATOM 0 HG13 VAL A 169 -9.376 -0.679 2.294 1.00 2.13 H new ATOM 0 HG21 VAL A 169 -7.971 -0.369 -0.435 1.00 51.44 H new ATOM 0 HG22 VAL A 169 -7.099 -0.577 1.102 1.00 51.44 H new ATOM 0 HG23 VAL A 169 -6.799 -1.695 -0.250 1.00 51.44 H new ATOM 1286 N ASP A 170 -9.546 -3.863 3.516 1.00 31.13 N ATOM 1287 CA ASP A 170 -10.613 -4.670 4.099 1.00 43.21 C ATOM 1288 C ASP A 170 -10.333 -6.157 3.912 1.00 63.51 C ATOM 1289 O ASP A 170 -11.235 -6.935 3.603 1.00 74.11 O ATOM 1290 CB ASP A 170 -11.957 -4.308 3.466 1.00 11.12 C ATOM 1291 CG ASP A 170 -12.568 -3.062 4.078 1.00 32.42 C ATOM 1292 OD1 ASP A 170 -12.035 -1.959 3.837 1.00 60.02 O ATOM 1293 OD2 ASP A 170 -13.581 -3.191 4.798 1.00 45.24 O ATOM 0 H ASP A 170 -9.077 -3.243 4.177 1.00 31.13 H new ATOM 0 HA ASP A 170 -10.654 -4.458 5.167 1.00 43.21 H new ATOM 0 HB2 ASP A 170 -11.822 -4.155 2.395 1.00 11.12 H new ATOM 0 HB3 ASP A 170 -12.647 -5.143 3.584 1.00 11.12 H new ATOM 1298 N ASN A 171 -9.076 -6.547 4.101 1.00 1.52 N ATOM 1299 CA ASN A 171 -8.677 -7.941 3.952 1.00 35.43 C ATOM 1300 C ASN A 171 -8.885 -8.416 2.517 1.00 55.12 C ATOM 1301 O ASN A 171 -9.375 -9.522 2.283 1.00 52.31 O ATOM 1302 CB ASN A 171 -9.472 -8.827 4.914 1.00 2.55 C ATOM 1303 CG ASN A 171 -8.623 -9.926 5.523 1.00 50.15 C ATOM 1304 OD1 ASN A 171 -8.095 -10.782 4.813 1.00 54.11 O ATOM 1305 ND2 ASN A 171 -8.489 -9.908 6.844 1.00 43.51 N ATOM 0 H ASN A 171 -8.317 -5.916 4.358 1.00 1.52 H new ATOM 0 HA ASN A 171 -7.616 -8.016 4.191 1.00 35.43 H new ATOM 0 HB2 ASN A 171 -9.890 -8.211 5.710 1.00 2.55 H new ATOM 0 HB3 ASN A 171 -10.312 -9.273 4.382 1.00 2.55 H new ATOM 0 HD21 ASN A 171 -7.930 -10.623 7.310 1.00 43.51 H new ATOM 0 HD22 ASN A 171 -8.945 -9.179 7.393 1.00 43.51 H new ATOM 1312 N ARG A 172 -8.509 -7.574 1.561 1.00 52.44 N ATOM 1313 CA ARG A 172 -8.655 -7.907 0.148 1.00 4.42 C ATOM 1314 C ARG A 172 -7.426 -7.470 -0.643 1.00 41.50 C ATOM 1315 O ARG A 172 -7.031 -6.305 -0.599 1.00 63.43 O ATOM 1316 CB ARG A 172 -9.908 -7.245 -0.427 1.00 13.31 C ATOM 1317 CG ARG A 172 -11.190 -7.644 0.286 1.00 73.45 C ATOM 1318 CD ARG A 172 -12.350 -6.743 -0.109 1.00 23.12 C ATOM 1319 NE ARG A 172 -13.270 -7.408 -1.028 1.00 15.41 N ATOM 1320 CZ ARG A 172 -14.241 -6.776 -1.679 1.00 31.33 C ATOM 1321 NH1 ARG A 172 -14.417 -5.473 -1.514 1.00 2.33 N ATOM 1322 NH2 ARG A 172 -15.039 -7.450 -2.498 1.00 34.54 N ATOM 0 H ARG A 172 -8.101 -6.656 1.738 1.00 52.44 H new ATOM 0 HA ARG A 172 -8.754 -8.989 0.064 1.00 4.42 H new ATOM 0 HB2 ARG A 172 -9.794 -6.162 -0.373 1.00 13.31 H new ATOM 0 HB3 ARG A 172 -9.994 -7.504 -1.482 1.00 13.31 H new ATOM 0 HG2 ARG A 172 -11.434 -8.679 0.047 1.00 73.45 H new ATOM 0 HG3 ARG A 172 -11.039 -7.593 1.364 1.00 73.45 H new ATOM 0 HD2 ARG A 172 -12.891 -6.435 0.786 1.00 23.12 H new ATOM 0 HD3 ARG A 172 -11.963 -5.837 -0.575 1.00 23.12 H new ATOM 0 HE ARG A 172 -13.161 -8.411 -1.178 1.00 15.41 H new ATOM 0 HH11 ARG A 172 -13.806 -4.951 -0.885 1.00 2.33 H new ATOM 0 HH12 ARG A 172 -15.163 -4.992 -2.016 1.00 2.33 H new ATOM 0 HH21 ARG A 172 -14.907 -8.453 -2.628 1.00 34.54 H new ATOM 0 HH22 ARG A 172 -15.784 -6.965 -2.998 1.00 34.54 H new ATOM 1336 N GLU A 173 -6.826 -8.412 -1.364 1.00 55.54 N ATOM 1337 CA GLU A 173 -5.642 -8.123 -2.164 1.00 54.31 C ATOM 1338 C GLU A 173 -5.956 -7.098 -3.251 1.00 62.23 C ATOM 1339 O GLU A 173 -7.064 -7.068 -3.789 1.00 2.23 O ATOM 1340 CB GLU A 173 -5.102 -9.406 -2.798 1.00 60.41 C ATOM 1341 CG GLU A 173 -3.584 -9.471 -2.843 1.00 32.04 C ATOM 1342 CD GLU A 173 -3.055 -10.880 -2.656 1.00 41.45 C ATOM 1343 OE1 GLU A 173 -3.373 -11.749 -3.494 1.00 34.20 O ATOM 1344 OE2 GLU A 173 -2.320 -11.112 -1.673 1.00 54.34 O ATOM 0 H GLU A 173 -7.140 -9.381 -1.410 1.00 55.54 H new ATOM 0 HA GLU A 173 -4.882 -7.705 -1.504 1.00 54.31 H new ATOM 0 HB2 GLU A 173 -5.478 -10.263 -2.239 1.00 60.41 H new ATOM 0 HB3 GLU A 173 -5.491 -9.492 -3.813 1.00 60.41 H new ATOM 0 HG2 GLU A 173 -3.235 -9.080 -3.799 1.00 32.04 H new ATOM 0 HG3 GLU A 173 -3.173 -8.826 -2.066 1.00 32.04 H new ATOM 1351 N ILE A 174 -4.974 -6.262 -3.570 1.00 5.13 N ATOM 1352 CA ILE A 174 -5.144 -5.238 -4.592 1.00 1.11 C ATOM 1353 C ILE A 174 -4.097 -5.379 -5.692 1.00 2.21 C ATOM 1354 O ILE A 174 -2.900 -5.499 -5.431 1.00 32.42 O ATOM 1355 CB ILE A 174 -5.055 -3.823 -3.991 1.00 14.50 C ATOM 1356 CG1 ILE A 174 -6.164 -3.612 -2.958 1.00 72.43 C ATOM 1357 CG2 ILE A 174 -5.142 -2.774 -5.090 1.00 42.45 C ATOM 1358 CD1 ILE A 174 -7.126 -2.503 -3.323 1.00 1.13 C ATOM 0 H ILE A 174 -4.052 -6.274 -3.135 1.00 5.13 H new ATOM 0 HA ILE A 174 -6.137 -5.380 -5.019 1.00 1.11 H new ATOM 0 HB ILE A 174 -4.093 -3.718 -3.490 1.00 14.50 H new ATOM 0 HG12 ILE A 174 -6.721 -4.541 -2.840 1.00 72.43 H new ATOM 0 HG13 ILE A 174 -5.712 -3.387 -1.992 1.00 72.43 H new ATOM 0 HG21 ILE A 174 -5.078 -1.779 -4.649 1.00 42.45 H new ATOM 0 HG22 ILE A 174 -4.320 -2.914 -5.792 1.00 42.45 H new ATOM 0 HG23 ILE A 174 -6.091 -2.877 -5.617 1.00 42.45 H new ATOM 0 HD11 ILE A 174 -7.885 -2.410 -2.546 1.00 1.13 H new ATOM 0 HD12 ILE A 174 -6.581 -1.563 -3.413 1.00 1.13 H new ATOM 0 HD13 ILE A 174 -7.606 -2.736 -4.273 1.00 1.13 H new ATOM 1370 N PRO A 175 -4.557 -5.361 -6.952 1.00 4.15 N ATOM 1371 CA PRO A 175 -3.675 -5.482 -8.117 1.00 72.13 C ATOM 1372 C PRO A 175 -2.800 -4.249 -8.314 1.00 54.04 C ATOM 1373 O PRO A 175 -3.267 -3.119 -8.179 1.00 34.01 O ATOM 1374 CB PRO A 175 -4.651 -5.637 -9.286 1.00 32.54 C ATOM 1375 CG PRO A 175 -5.906 -4.984 -8.820 1.00 14.12 C ATOM 1376 CD PRO A 175 -5.970 -5.219 -7.336 1.00 34.31 C ATOM 0 HA PRO A 175 -2.976 -6.312 -8.014 1.00 72.13 H new ATOM 0 HB2 PRO A 175 -4.268 -5.160 -10.188 1.00 32.54 H new ATOM 0 HB3 PRO A 175 -4.817 -6.687 -9.527 1.00 32.54 H new ATOM 0 HG2 PRO A 175 -5.898 -3.918 -9.046 1.00 14.12 H new ATOM 0 HG3 PRO A 175 -6.776 -5.409 -9.320 1.00 14.12 H new ATOM 0 HD2 PRO A 175 -6.446 -4.386 -6.818 1.00 34.31 H new ATOM 0 HD3 PRO A 175 -6.544 -6.114 -7.095 1.00 34.31 H new ATOM 1384 N GLU A 176 -1.530 -4.475 -8.635 1.00 1.41 N ATOM 1385 CA GLU A 176 -0.591 -3.380 -8.849 1.00 52.03 C ATOM 1386 C GLU A 176 -0.594 -2.940 -10.311 1.00 32.13 C ATOM 1387 O GLU A 176 -1.143 -3.624 -11.176 1.00 13.11 O ATOM 1388 CB GLU A 176 0.820 -3.800 -8.435 1.00 22.10 C ATOM 1389 CG GLU A 176 1.601 -2.702 -7.734 1.00 44.31 C ATOM 1390 CD GLU A 176 2.875 -2.331 -8.469 1.00 53.23 C ATOM 1391 OE1 GLU A 176 3.834 -3.130 -8.433 1.00 1.53 O ATOM 1392 OE2 GLU A 176 2.911 -1.243 -9.081 1.00 1.01 O ATOM 0 H GLU A 176 -1.128 -5.405 -8.752 1.00 1.41 H new ATOM 0 HA GLU A 176 -0.907 -2.538 -8.233 1.00 52.03 H new ATOM 0 HB2 GLU A 176 0.753 -4.665 -7.775 1.00 22.10 H new ATOM 0 HB3 GLU A 176 1.370 -4.117 -9.321 1.00 22.10 H new ATOM 0 HG2 GLU A 176 0.971 -1.818 -7.638 1.00 44.31 H new ATOM 0 HG3 GLU A 176 1.850 -3.027 -6.724 1.00 44.31 H new ATOM 1399 N LEU A 177 0.022 -1.794 -10.578 1.00 73.03 N ATOM 1400 CA LEU A 177 0.091 -1.261 -11.935 1.00 0.31 C ATOM 1401 C LEU A 177 1.536 -1.184 -12.417 1.00 63.04 C ATOM 1402 O LEU A 177 2.343 -0.426 -11.878 1.00 74.31 O ATOM 1403 CB LEU A 177 -0.552 0.126 -11.992 1.00 34.12 C ATOM 1404 CG LEU A 177 -0.622 0.776 -13.374 1.00 41.33 C ATOM 1405 CD1 LEU A 177 -1.836 0.276 -14.140 1.00 64.25 C ATOM 1406 CD2 LEU A 177 -0.656 2.293 -13.248 1.00 23.31 C ATOM 0 H LEU A 177 0.481 -1.216 -9.874 1.00 73.03 H new ATOM 0 HA LEU A 177 -0.456 -1.936 -12.593 1.00 0.31 H new ATOM 0 HB2 LEU A 177 -1.565 0.052 -11.596 1.00 34.12 H new ATOM 0 HB3 LEU A 177 0.002 0.789 -11.328 1.00 34.12 H new ATOM 0 HG LEU A 177 0.272 0.497 -13.931 1.00 41.33 H new ATOM 0 HD11 LEU A 177 -1.868 0.750 -15.121 1.00 64.25 H new ATOM 0 HD12 LEU A 177 -1.769 -0.805 -14.262 1.00 64.25 H new ATOM 0 HD13 LEU A 177 -2.742 0.524 -13.587 1.00 64.25 H new ATOM 0 HD21 LEU A 177 -0.706 2.740 -14.241 1.00 23.31 H new ATOM 0 HD22 LEU A 177 -1.532 2.591 -12.672 1.00 23.31 H new ATOM 0 HD23 LEU A 177 0.246 2.636 -12.741 1.00 23.31 H new ATOM 1418 N THR A 178 1.857 -1.973 -13.438 1.00 53.11 N ATOM 1419 CA THR A 178 3.204 -1.994 -13.993 1.00 73.23 C ATOM 1420 C THR A 178 3.282 -2.911 -15.209 1.00 43.44 C ATOM 1421 O THR A 178 3.997 -2.622 -16.169 1.00 53.00 O ATOM 1422 CB THR A 178 4.236 -2.457 -12.948 1.00 43.31 C ATOM 1423 OG1 THR A 178 5.529 -2.568 -13.552 1.00 42.32 O ATOM 1424 CG2 THR A 178 3.835 -3.796 -12.348 1.00 13.20 C ATOM 0 H THR A 178 1.202 -2.606 -13.897 1.00 53.11 H new ATOM 0 HA THR A 178 3.438 -0.973 -14.295 1.00 73.23 H new ATOM 0 HB THR A 178 4.270 -1.715 -12.151 1.00 43.31 H new ATOM 0 HG1 THR A 178 6.180 -2.861 -12.880 1.00 42.32 H new ATOM 0 HG21 THR A 178 4.579 -4.103 -11.613 1.00 13.20 H new ATOM 0 HG22 THR A 178 2.863 -3.701 -11.863 1.00 13.20 H new ATOM 0 HG23 THR A 178 3.775 -4.545 -13.138 1.00 13.20 H new ATOM 1432 N GLN A 179 2.545 -4.014 -15.162 1.00 13.11 N ATOM 1433 CA GLN A 179 2.532 -4.972 -16.261 1.00 33.43 C ATOM 1434 C GLN A 179 1.164 -5.010 -16.935 1.00 43.51 C ATOM 1435 O GLN A 179 0.608 -3.971 -17.291 1.00 14.31 O ATOM 1436 CB GLN A 179 2.901 -6.368 -15.753 1.00 42.31 C ATOM 1437 CG GLN A 179 3.767 -7.157 -16.721 1.00 71.40 C ATOM 1438 CD GLN A 179 3.836 -8.632 -16.372 1.00 40.13 C ATOM 1439 OE1 GLN A 179 4.865 -9.124 -15.910 1.00 70.53 O ATOM 1440 NE2 GLN A 179 2.738 -9.344 -16.593 1.00 55.02 N ATOM 0 H GLN A 179 1.948 -4.267 -14.375 1.00 13.11 H new ATOM 0 HA GLN A 179 3.271 -4.652 -16.996 1.00 33.43 H new ATOM 0 HB2 GLN A 179 3.426 -6.273 -14.803 1.00 42.31 H new ATOM 0 HB3 GLN A 179 1.987 -6.928 -15.557 1.00 42.31 H new ATOM 0 HG2 GLN A 179 3.372 -7.044 -17.731 1.00 71.40 H new ATOM 0 HG3 GLN A 179 4.774 -6.741 -16.724 1.00 71.40 H new ATOM 0 HE21 GLN A 179 1.907 -8.894 -16.978 1.00 55.02 H new ATOM 0 HE22 GLN A 179 2.725 -10.341 -16.378 1.00 55.02 H new TER 1449 GLN A 179