USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1086 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 65 ASN : amide:sc= -0.147 K(o=-0.47,f=-2.6!) USER MOD Set 1.2: A 69 GLN :FLIP amide:sc= -0.328 F(o=-1,f=-0.47) USER MOD Set 2.1: A 26 SER OG : rot 110:sc= -0.977 USER MOD Set 2.2: A 66 HIS : no HD1:sc= 0 X(o=-0.98,f=-0.85) USER MOD Set 3.1: A 9 THR OG1 : rot 180:sc= -0.194 USER MOD Set 3.2: A 42 MET CE :methyl 176:sc= -1.62 (180deg=-1.74) USER MOD Single : A 5 SER OG : rot -31:sc= 0.00288 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 THR OG1 : rot 98:sc= 1.24 USER MOD Single : A 11 LYS NZ :NH3+ -156:sc= -2.37! (180deg=-4.06!) USER MOD Single : A 13 ASN : amide:sc= 0.0409 X(o=0.041,f=-0.063) USER MOD Single : A 14 THR OG1 : rot -83:sc= -0.569 USER MOD Single : A 18 SER OG : rot 180:sc= 0.155 USER MOD Single : A 19 GLN : amide:sc= 0.0548 X(o=0.055,f=-0.0024) USER MOD Single : A 21 SER OG : rot 160:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0522) USER MOD Single : A 32 GLN : amide:sc= -0.283 X(o=-0.28,f=-0.58) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0029) USER MOD Single : A 44 LYS NZ :NH3+ -108:sc= -0.345 (180deg=-0.419) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -128:sc= -2.87 (180deg=-6.94!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.122 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl -179:sc= 0 (180deg=-0.00138) USER MOD Single : A 70 GLN : amide:sc= -0.029 X(o=-0.029,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 152:sc= -0.246 (180deg=-1.18) USER MOD Single : A 74 GLN : amide:sc= -0.791 X(o=-0.79,f=-0.44) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.14 X(o=-0.14,f=-0.2) USER MOD Single : A 80 GLN : amide:sc= -0.917 X(o=-0.92,f=-0.92) USER MOD Single : A 82 SER OG : rot 170:sc= -0.967 USER MOD Single : A 85 LYS NZ :NH3+ -94:sc=-0.00218 (180deg=-0.403) USER MOD Single : A 95 ASN : amide:sc= -1.67 X(o=-1.7,f=-1.5) USER MOD Single : A 96 GLN : amide:sc= 0.0759 X(o=0.076,f=-0.034) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 141:sc= -0.962 (180deg=-1.9!) USER MOD Single : A 107 SER OG : rot 81:sc= 0.59 USER MOD Single : A 111 ASN : amide:sc= -0.0191 K(o=-0.019,f=-2.2!) USER MOD Single : A 114 LYS NZ :NH3+ -168:sc= -0.3 (180deg=-0.718) USER MOD Single : A 117 ASN : amide:sc= 0.0548 X(o=0.055,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 GLN : amide:sc= -0.0736 K(o=-0.074,f=-0.95) USER MOD Single : A 125 ASN : amide:sc= 0.123 X(o=0.12,f=-0.037) USER MOD Single : A 130 SER OG : rot 160:sc= -1.17 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A 5 1.815 -5.869 1.114 1.00 52.41 N ATOM 43 CA SER A 5 1.211 -5.660 2.425 1.00 40.03 C ATOM 44 C SER A 5 0.776 -6.987 3.040 1.00 53.43 C ATOM 45 O SER A 5 0.726 -7.130 4.261 1.00 43.32 O ATOM 46 CB SER A 5 0.010 -4.718 2.313 1.00 64.44 C ATOM 47 OG SER A 5 -1.060 -5.338 1.621 1.00 14.51 O ATOM 0 HA SER A 5 1.960 -5.206 3.075 1.00 40.03 H new ATOM 0 HB2 SER A 5 -0.319 -4.423 3.309 1.00 64.44 H new ATOM 0 HB3 SER A 5 0.305 -3.807 1.792 1.00 64.44 H new ATOM 0 HG SER A 5 -0.702 -5.973 0.966 1.00 14.51 H new ATOM 53 N GLU A 6 0.461 -7.954 2.183 1.00 10.44 N ATOM 54 CA GLU A 6 0.029 -9.269 2.642 1.00 12.54 C ATOM 55 C GLU A 6 1.161 -9.992 3.365 1.00 4.24 C ATOM 56 O GLU A 6 0.928 -10.735 4.318 1.00 12.22 O ATOM 57 CB GLU A 6 -0.457 -10.111 1.461 1.00 32.12 C ATOM 58 CG GLU A 6 0.590 -10.299 0.376 1.00 54.10 C ATOM 59 CD GLU A 6 0.078 -11.120 -0.792 1.00 3.11 C ATOM 60 OE1 GLU A 6 -0.845 -11.935 -0.584 1.00 52.32 O ATOM 61 OE2 GLU A 6 0.601 -10.948 -1.913 1.00 23.13 O ATOM 0 H GLU A 6 0.497 -7.851 1.169 1.00 10.44 H new ATOM 0 HA GLU A 6 -0.794 -9.129 3.342 1.00 12.54 H new ATOM 0 HB2 GLU A 6 -0.769 -11.089 1.827 1.00 32.12 H new ATOM 0 HB3 GLU A 6 -1.338 -9.638 1.026 1.00 32.12 H new ATOM 0 HG2 GLU A 6 0.913 -9.323 0.015 1.00 54.10 H new ATOM 0 HG3 GLU A 6 1.466 -10.787 0.802 1.00 54.10 H new ATOM 68 N GLN A 7 2.388 -9.768 2.904 1.00 32.52 N ATOM 69 CA GLN A 7 3.556 -10.400 3.506 1.00 44.22 C ATOM 70 C GLN A 7 3.721 -9.967 4.959 1.00 45.32 C ATOM 71 O GLN A 7 3.938 -10.795 5.844 1.00 73.14 O ATOM 72 CB GLN A 7 4.816 -10.052 2.711 1.00 2.42 C ATOM 73 CG GLN A 7 5.279 -11.165 1.786 1.00 60.31 C ATOM 74 CD GLN A 7 6.751 -11.063 1.440 1.00 44.41 C ATOM 75 OE1 GLN A 7 7.114 -10.707 0.318 1.00 1.33 O ATOM 76 NE2 GLN A 7 7.610 -11.374 2.404 1.00 35.32 N ATOM 0 H GLN A 7 2.598 -9.155 2.117 1.00 32.52 H new ATOM 0 HA GLN A 7 3.407 -11.479 3.483 1.00 44.22 H new ATOM 0 HB2 GLN A 7 4.627 -9.156 2.121 1.00 2.42 H new ATOM 0 HB3 GLN A 7 5.620 -9.812 3.407 1.00 2.42 H new ATOM 0 HG2 GLN A 7 5.087 -12.128 2.259 1.00 60.31 H new ATOM 0 HG3 GLN A 7 4.691 -11.137 0.868 1.00 60.31 H new ATOM 0 HE21 GLN A 7 7.266 -11.664 3.319 1.00 35.32 H new ATOM 0 HE22 GLN A 7 8.614 -11.323 2.229 1.00 35.32 H new ATOM 85 N PHE A 8 3.619 -8.664 5.198 1.00 55.50 N ATOM 86 CA PHE A 8 3.758 -8.120 6.544 1.00 51.11 C ATOM 87 C PHE A 8 2.741 -8.749 7.492 1.00 4.14 C ATOM 88 O PHE A 8 3.068 -9.102 8.626 1.00 15.54 O ATOM 89 CB PHE A 8 3.581 -6.600 6.524 1.00 62.22 C ATOM 90 CG PHE A 8 3.985 -5.933 7.808 1.00 55.24 C ATOM 91 CD1 PHE A 8 5.189 -6.245 8.418 1.00 52.05 C ATOM 92 CD2 PHE A 8 3.159 -4.994 8.405 1.00 40.34 C ATOM 93 CE1 PHE A 8 5.563 -5.632 9.599 1.00 61.43 C ATOM 94 CE2 PHE A 8 3.528 -4.378 9.585 1.00 2.44 C ATOM 95 CZ PHE A 8 4.731 -4.698 10.184 1.00 61.31 C ATOM 0 H PHE A 8 3.441 -7.965 4.477 1.00 55.50 H new ATOM 0 HA PHE A 8 4.759 -8.357 6.903 1.00 51.11 H new ATOM 0 HB2 PHE A 8 4.170 -6.184 5.707 1.00 62.22 H new ATOM 0 HB3 PHE A 8 2.537 -6.366 6.315 1.00 62.22 H new ATOM 0 HD1 PHE A 8 5.843 -6.976 7.966 1.00 52.05 H new ATOM 0 HD2 PHE A 8 2.216 -4.741 7.943 1.00 40.34 H new ATOM 0 HE1 PHE A 8 6.505 -5.883 10.064 1.00 61.43 H new ATOM 0 HE2 PHE A 8 2.876 -3.646 10.039 1.00 2.44 H new ATOM 0 HZ PHE A 8 5.020 -4.219 11.108 1.00 61.31 H new ATOM 105 N THR A 9 1.506 -8.886 7.020 1.00 22.23 N ATOM 106 CA THR A 9 0.441 -9.470 7.825 1.00 32.31 C ATOM 107 C THR A 9 0.616 -10.979 7.958 1.00 4.34 C ATOM 108 O THR A 9 0.285 -11.565 8.990 1.00 43.43 O ATOM 109 CB THR A 9 -0.945 -9.178 7.220 1.00 12.31 C ATOM 110 OG1 THR A 9 -1.148 -7.764 7.122 1.00 52.32 O ATOM 111 CG2 THR A 9 -2.047 -9.796 8.068 1.00 40.33 C ATOM 0 H THR A 9 1.219 -8.600 6.084 1.00 22.23 H new ATOM 0 HA THR A 9 0.503 -9.011 8.812 1.00 32.31 H new ATOM 0 HB THR A 9 -0.983 -9.620 6.225 1.00 12.31 H new ATOM 0 HG1 THR A 9 -2.031 -7.586 6.735 1.00 52.32 H new ATOM 0 HG21 THR A 9 -3.017 -9.576 7.621 1.00 40.33 H new ATOM 0 HG22 THR A 9 -1.906 -10.876 8.117 1.00 40.33 H new ATOM 0 HG23 THR A 9 -2.009 -9.379 9.074 1.00 40.33 H new ATOM 119 N THR A 10 1.140 -11.604 6.909 1.00 44.04 N ATOM 120 CA THR A 10 1.360 -13.045 6.908 1.00 13.23 C ATOM 121 C THR A 10 2.483 -13.430 7.864 1.00 30.11 C ATOM 122 O THR A 10 2.367 -14.396 8.618 1.00 33.33 O ATOM 123 CB THR A 10 1.702 -13.561 5.498 1.00 53.32 C ATOM 124 OG1 THR A 10 0.616 -13.296 4.603 1.00 73.22 O ATOM 125 CG2 THR A 10 1.992 -15.054 5.523 1.00 2.34 C ATOM 0 H THR A 10 1.420 -11.134 6.048 1.00 44.04 H new ATOM 0 HA THR A 10 0.430 -13.507 7.239 1.00 13.23 H new ATOM 0 HB THR A 10 2.594 -13.040 5.151 1.00 53.32 H new ATOM 0 HG1 THR A 10 0.801 -12.477 4.098 1.00 73.22 H new ATOM 0 HG21 THR A 10 2.231 -15.395 4.516 1.00 2.34 H new ATOM 0 HG22 THR A 10 2.838 -15.249 6.182 1.00 2.34 H new ATOM 0 HG23 THR A 10 1.116 -15.589 5.889 1.00 2.34 H new ATOM 133 N LYS A 11 3.571 -12.668 7.829 1.00 61.44 N ATOM 134 CA LYS A 11 4.716 -12.928 8.693 1.00 21.22 C ATOM 135 C LYS A 11 4.437 -12.466 10.120 1.00 54.03 C ATOM 136 O LYS A 11 4.926 -13.059 11.082 1.00 10.44 O ATOM 137 CB LYS A 11 5.961 -12.222 8.152 1.00 51.14 C ATOM 138 CG LYS A 11 5.960 -10.721 8.388 1.00 61.52 C ATOM 139 CD LYS A 11 6.683 -10.359 9.674 1.00 64.00 C ATOM 140 CE LYS A 11 7.023 -8.877 9.724 1.00 63.32 C ATOM 141 NZ LYS A 11 7.879 -8.466 8.577 1.00 42.22 N ATOM 0 H LYS A 11 3.684 -11.865 7.211 1.00 61.44 H new ATOM 0 HA LYS A 11 4.892 -14.004 8.705 1.00 21.22 H new ATOM 0 HB2 LYS A 11 6.846 -12.654 8.620 1.00 51.14 H new ATOM 0 HB3 LYS A 11 6.041 -12.413 7.082 1.00 51.14 H new ATOM 0 HG2 LYS A 11 6.438 -10.219 7.547 1.00 61.52 H new ATOM 0 HG3 LYS A 11 4.933 -10.359 8.433 1.00 61.52 H new ATOM 0 HD2 LYS A 11 6.059 -10.619 10.529 1.00 64.00 H new ATOM 0 HD3 LYS A 11 7.598 -10.946 9.756 1.00 64.00 H new ATOM 0 HE2 LYS A 11 6.103 -8.293 9.718 1.00 63.32 H new ATOM 0 HE3 LYS A 11 7.537 -8.653 10.659 1.00 63.32 H new ATOM 0 HZ1 LYS A 11 8.414 -7.611 8.832 1.00 42.22 H new ATOM 0 HZ2 LYS A 11 8.542 -9.233 8.346 1.00 42.22 H new ATOM 0 HZ3 LYS A 11 7.280 -8.266 7.751 1.00 42.22 H new ATOM 155 N LEU A 12 3.646 -11.406 10.249 1.00 25.01 N ATOM 156 CA LEU A 12 3.300 -10.865 11.559 1.00 63.10 C ATOM 157 C LEU A 12 2.587 -11.912 12.409 1.00 52.50 C ATOM 158 O LEU A 12 2.785 -11.981 13.621 1.00 13.32 O ATOM 159 CB LEU A 12 2.415 -9.627 11.404 1.00 72.53 C ATOM 160 CG LEU A 12 3.139 -8.281 11.392 1.00 3.01 C ATOM 161 CD1 LEU A 12 2.196 -7.171 10.956 1.00 13.24 C ATOM 162 CD2 LEU A 12 3.724 -7.978 12.764 1.00 65.41 C ATOM 0 H LEU A 12 3.232 -10.905 9.463 1.00 25.01 H new ATOM 0 HA LEU A 12 4.224 -10.582 12.064 1.00 63.10 H new ATOM 0 HB2 LEU A 12 1.852 -9.722 10.476 1.00 72.53 H new ATOM 0 HB3 LEU A 12 1.690 -9.619 12.218 1.00 72.53 H new ATOM 0 HG LEU A 12 3.957 -8.337 10.674 1.00 3.01 H new ATOM 0 HD11 LEU A 12 2.729 -6.220 10.954 1.00 13.24 H new ATOM 0 HD12 LEU A 12 1.825 -7.382 9.953 1.00 13.24 H new ATOM 0 HD13 LEU A 12 1.356 -7.114 11.649 1.00 13.24 H new ATOM 0 HD21 LEU A 12 4.236 -7.016 12.737 1.00 65.41 H new ATOM 0 HD22 LEU A 12 2.922 -7.942 13.502 1.00 65.41 H new ATOM 0 HD23 LEU A 12 4.434 -8.759 13.038 1.00 65.41 H new ATOM 174 N ASN A 13 1.758 -12.725 11.764 1.00 75.44 N ATOM 175 CA ASN A 13 1.016 -13.770 12.460 1.00 34.03 C ATOM 176 C ASN A 13 1.928 -14.940 12.817 1.00 40.41 C ATOM 177 O ASN A 13 1.735 -15.605 13.835 1.00 12.01 O ATOM 178 CB ASN A 13 -0.148 -14.261 11.596 1.00 24.12 C ATOM 179 CG ASN A 13 -1.372 -13.375 11.718 1.00 74.12 C ATOM 180 OD1 ASN A 13 -1.914 -13.193 12.808 1.00 54.50 O ATOM 181 ND2 ASN A 13 -1.815 -12.820 10.595 1.00 4.14 N ATOM 0 H ASN A 13 1.583 -12.681 10.760 1.00 75.44 H new ATOM 0 HA ASN A 13 0.621 -13.346 13.383 1.00 34.03 H new ATOM 0 HB2 ASN A 13 0.168 -14.299 10.553 1.00 24.12 H new ATOM 0 HB3 ASN A 13 -0.409 -15.279 11.887 1.00 24.12 H new ATOM 0 HD21 ASN A 13 -2.636 -12.215 10.614 1.00 4.14 H new ATOM 0 HD22 ASN A 13 -1.334 -12.999 9.713 1.00 4.14 H new ATOM 188 N THR A 14 2.924 -15.185 11.972 1.00 63.24 N ATOM 189 CA THR A 14 3.867 -16.274 12.196 1.00 34.04 C ATOM 190 C THR A 14 5.107 -15.784 12.934 1.00 22.14 C ATOM 191 O THR A 14 6.161 -16.420 12.888 1.00 2.31 O ATOM 192 CB THR A 14 4.297 -16.927 10.870 1.00 61.35 C ATOM 193 OG1 THR A 14 4.710 -15.920 9.939 1.00 25.41 O ATOM 194 CG2 THR A 14 3.158 -17.740 10.272 1.00 24.21 C ATOM 0 H THR A 14 3.099 -14.644 11.125 1.00 63.24 H new ATOM 0 HA THR A 14 3.353 -17.016 12.807 1.00 34.04 H new ATOM 0 HB THR A 14 5.132 -17.597 11.075 1.00 61.35 H new ATOM 0 HG1 THR A 14 3.923 -15.547 9.490 1.00 25.41 H new ATOM 0 HG21 THR A 14 3.486 -18.192 9.336 1.00 24.21 H new ATOM 0 HG22 THR A 14 2.865 -18.524 10.970 1.00 24.21 H new ATOM 0 HG23 THR A 14 2.306 -17.087 10.081 1.00 24.21 H new ATOM 202 N LEU A 15 4.976 -14.651 13.615 1.00 34.14 N ATOM 203 CA LEU A 15 6.087 -14.076 14.365 1.00 11.31 C ATOM 204 C LEU A 15 6.342 -14.860 15.648 1.00 24.11 C ATOM 205 O LEU A 15 5.424 -15.108 16.428 1.00 13.22 O ATOM 206 CB LEU A 15 5.799 -12.611 14.698 1.00 11.23 C ATOM 207 CG LEU A 15 6.361 -11.577 13.722 1.00 63.22 C ATOM 208 CD1 LEU A 15 5.957 -10.172 14.141 1.00 64.15 C ATOM 209 CD2 LEU A 15 7.876 -11.695 13.634 1.00 31.13 C ATOM 0 H LEU A 15 4.111 -14.112 13.663 1.00 34.14 H new ATOM 0 HA LEU A 15 6.980 -14.132 13.743 1.00 11.31 H new ATOM 0 HB2 LEU A 15 4.719 -12.478 14.755 1.00 11.23 H new ATOM 0 HB3 LEU A 15 6.199 -12.400 15.690 1.00 11.23 H new ATOM 0 HG LEU A 15 5.943 -11.773 12.734 1.00 63.22 H new ATOM 0 HD11 LEU A 15 6.366 -9.450 13.434 1.00 64.15 H new ATOM 0 HD12 LEU A 15 4.870 -10.094 14.151 1.00 64.15 H new ATOM 0 HD13 LEU A 15 6.345 -9.964 15.138 1.00 64.15 H new ATOM 0 HD21 LEU A 15 8.259 -10.952 12.935 1.00 31.13 H new ATOM 0 HD22 LEU A 15 8.312 -11.526 14.619 1.00 31.13 H new ATOM 0 HD23 LEU A 15 8.144 -12.692 13.285 1.00 31.13 H new ATOM 221 N GLU A 16 7.597 -15.246 15.860 1.00 12.10 N ATOM 222 CA GLU A 16 7.972 -16.001 17.050 1.00 45.14 C ATOM 223 C GLU A 16 9.075 -15.284 17.824 1.00 51.25 C ATOM 224 O GLU A 16 9.763 -14.416 17.285 1.00 72.41 O ATOM 225 CB GLU A 16 8.437 -17.407 16.663 1.00 2.40 C ATOM 226 CG GLU A 16 7.323 -18.440 16.672 1.00 3.11 C ATOM 227 CD GLU A 16 7.773 -19.787 16.142 1.00 62.43 C ATOM 228 OE1 GLU A 16 8.834 -19.841 15.484 1.00 75.31 O ATOM 229 OE2 GLU A 16 7.066 -20.787 16.384 1.00 75.23 O ATOM 0 H GLU A 16 8.370 -15.049 15.224 1.00 12.10 H new ATOM 0 HA GLU A 16 7.094 -16.080 17.691 1.00 45.14 H new ATOM 0 HB2 GLU A 16 8.881 -17.373 15.668 1.00 2.40 H new ATOM 0 HB3 GLU A 16 9.221 -17.724 17.351 1.00 2.40 H new ATOM 0 HG2 GLU A 16 6.952 -18.560 17.690 1.00 3.11 H new ATOM 0 HG3 GLU A 16 6.490 -18.076 16.070 1.00 3.11 H new ATOM 236 N ASP A 17 9.236 -15.652 19.090 1.00 41.03 N ATOM 237 CA ASP A 17 10.255 -15.045 19.939 1.00 73.13 C ATOM 238 C ASP A 17 11.635 -15.612 19.621 1.00 10.13 C ATOM 239 O ASP A 17 12.073 -16.586 20.233 1.00 35.23 O ATOM 240 CB ASP A 17 9.922 -15.274 21.414 1.00 63.51 C ATOM 241 CG ASP A 17 10.446 -14.165 22.305 1.00 52.04 C ATOM 242 OD1 ASP A 17 11.183 -13.295 21.797 1.00 44.05 O ATOM 243 OD2 ASP A 17 10.119 -14.167 23.510 1.00 34.10 O ATOM 0 H ASP A 17 8.674 -16.368 19.551 1.00 41.03 H new ATOM 0 HA ASP A 17 10.268 -13.973 19.740 1.00 73.13 H new ATOM 0 HB2 ASP A 17 8.841 -15.350 21.532 1.00 63.51 H new ATOM 0 HB3 ASP A 17 10.346 -16.225 21.736 1.00 63.51 H new ATOM 248 N SER A 18 12.315 -14.996 18.660 1.00 5.31 N ATOM 249 CA SER A 18 13.644 -15.442 18.258 1.00 42.32 C ATOM 250 C SER A 18 14.498 -14.262 17.802 1.00 24.54 C ATOM 251 O SER A 18 14.061 -13.440 16.998 1.00 32.23 O ATOM 252 CB SER A 18 13.540 -16.475 17.134 1.00 0.41 C ATOM 253 OG SER A 18 14.710 -16.478 16.335 1.00 61.34 O ATOM 0 H SER A 18 11.968 -14.187 18.145 1.00 5.31 H new ATOM 0 HA SER A 18 14.123 -15.903 19.122 1.00 42.32 H new ATOM 0 HB2 SER A 18 13.384 -17.466 17.560 1.00 0.41 H new ATOM 0 HB3 SER A 18 12.672 -16.255 16.513 1.00 0.41 H new ATOM 0 HG SER A 18 14.620 -17.147 15.625 1.00 61.34 H new ATOM 259 N GLN A 19 15.719 -14.188 18.323 1.00 30.03 N ATOM 260 CA GLN A 19 16.635 -13.109 17.971 1.00 33.42 C ATOM 261 C GLN A 19 16.778 -12.990 16.458 1.00 45.34 C ATOM 262 O GLN A 19 16.882 -11.888 15.920 1.00 2.44 O ATOM 263 CB GLN A 19 18.005 -13.347 18.608 1.00 10.13 C ATOM 264 CG GLN A 19 19.039 -12.297 18.236 1.00 1.45 C ATOM 265 CD GLN A 19 18.751 -10.946 18.863 1.00 71.52 C ATOM 266 OE1 GLN A 19 19.342 -10.582 19.880 1.00 34.30 O ATOM 267 NE2 GLN A 19 17.839 -10.195 18.257 1.00 32.11 N ATOM 0 H GLN A 19 16.096 -14.862 18.990 1.00 30.03 H new ATOM 0 HA GLN A 19 16.222 -12.175 18.353 1.00 33.42 H new ATOM 0 HB2 GLN A 19 17.894 -13.367 19.692 1.00 10.13 H new ATOM 0 HB3 GLN A 19 18.371 -14.328 18.307 1.00 10.13 H new ATOM 0 HG2 GLN A 19 20.026 -12.637 18.551 1.00 1.45 H new ATOM 0 HG3 GLN A 19 19.070 -12.191 17.152 1.00 1.45 H new ATOM 0 HE21 GLN A 19 17.374 -10.537 17.416 1.00 32.11 H new ATOM 0 HE22 GLN A 19 17.604 -9.276 18.632 1.00 32.11 H new ATOM 276 N GLU A 20 16.784 -14.131 15.776 1.00 21.34 N ATOM 277 CA GLU A 20 16.917 -14.153 14.324 1.00 15.14 C ATOM 278 C GLU A 20 15.609 -13.743 13.653 1.00 70.44 C ATOM 279 O GLU A 20 15.613 -13.084 12.613 1.00 34.21 O ATOM 280 CB GLU A 20 17.332 -15.547 13.849 1.00 44.53 C ATOM 281 CG GLU A 20 18.837 -15.736 13.763 1.00 65.34 C ATOM 282 CD GLU A 20 19.544 -15.390 15.059 1.00 43.55 C ATOM 283 OE1 GLU A 20 19.436 -16.177 16.022 1.00 62.44 O ATOM 284 OE2 GLU A 20 20.205 -14.331 15.110 1.00 72.20 O ATOM 0 H GLU A 20 16.698 -15.052 16.206 1.00 21.34 H new ATOM 0 HA GLU A 20 17.690 -13.437 14.044 1.00 15.14 H new ATOM 0 HB2 GLU A 20 16.919 -16.292 14.529 1.00 44.53 H new ATOM 0 HB3 GLU A 20 16.894 -15.733 12.868 1.00 44.53 H new ATOM 0 HG2 GLU A 20 19.055 -16.771 13.500 1.00 65.34 H new ATOM 0 HG3 GLU A 20 19.232 -15.113 12.961 1.00 65.34 H new ATOM 291 N SER A 21 14.492 -14.140 14.254 1.00 10.33 N ATOM 292 CA SER A 21 13.177 -13.818 13.713 1.00 73.31 C ATOM 293 C SER A 21 12.960 -12.309 13.673 1.00 53.30 C ATOM 294 O SER A 21 12.517 -11.761 12.663 1.00 51.11 O ATOM 295 CB SER A 21 12.081 -14.480 14.551 1.00 62.52 C ATOM 296 OG SER A 21 10.804 -14.281 13.970 1.00 1.30 O ATOM 0 H SER A 21 14.471 -14.685 15.116 1.00 10.33 H new ATOM 0 HA SER A 21 13.127 -14.202 12.694 1.00 73.31 H new ATOM 0 HB2 SER A 21 12.281 -15.548 14.639 1.00 62.52 H new ATOM 0 HB3 SER A 21 12.093 -14.069 15.561 1.00 62.52 H new ATOM 0 HG SER A 21 10.179 -14.952 14.316 1.00 1.30 H new ATOM 302 N ILE A 22 13.275 -11.643 14.779 1.00 53.33 N ATOM 303 CA ILE A 22 13.116 -10.197 14.870 1.00 14.35 C ATOM 304 C ILE A 22 13.861 -9.489 13.744 1.00 74.12 C ATOM 305 O ILE A 22 13.289 -8.666 13.029 1.00 3.42 O ATOM 306 CB ILE A 22 13.621 -9.659 16.222 1.00 25.42 C ATOM 307 CG1 ILE A 22 12.877 -10.335 17.375 1.00 33.14 C ATOM 308 CG2 ILE A 22 13.453 -8.149 16.288 1.00 13.23 C ATOM 309 CD1 ILE A 22 11.402 -10.000 17.421 1.00 23.30 C ATOM 0 H ILE A 22 13.642 -12.081 15.624 1.00 53.33 H new ATOM 0 HA ILE A 22 12.049 -9.991 14.782 1.00 14.35 H new ATOM 0 HB ILE A 22 14.682 -9.890 16.315 1.00 25.42 H new ATOM 0 HG12 ILE A 22 12.993 -11.415 17.288 1.00 33.14 H new ATOM 0 HG13 ILE A 22 13.338 -10.039 18.317 1.00 33.14 H new ATOM 0 HG21 ILE A 22 13.814 -7.784 17.250 1.00 13.23 H new ATOM 0 HG22 ILE A 22 14.025 -7.684 15.485 1.00 13.23 H new ATOM 0 HG23 ILE A 22 12.399 -7.895 16.177 1.00 13.23 H new ATOM 0 HD11 ILE A 22 10.938 -10.514 18.263 1.00 23.30 H new ATOM 0 HD12 ILE A 22 11.277 -8.924 17.539 1.00 23.30 H new ATOM 0 HD13 ILE A 22 10.927 -10.321 16.494 1.00 23.30 H new ATOM 321 N SER A 23 15.139 -9.817 13.590 1.00 64.32 N ATOM 322 CA SER A 23 15.964 -9.212 12.551 1.00 42.22 C ATOM 323 C SER A 23 15.519 -9.673 11.166 1.00 1.23 C ATOM 324 O SER A 23 15.673 -8.952 10.181 1.00 44.15 O ATOM 325 CB SER A 23 17.437 -9.564 12.769 1.00 31.22 C ATOM 326 OG SER A 23 18.286 -8.636 12.117 1.00 54.15 O ATOM 0 H SER A 23 15.626 -10.499 14.172 1.00 64.32 H new ATOM 0 HA SER A 23 15.844 -8.130 12.611 1.00 42.22 H new ATOM 0 HB2 SER A 23 17.657 -9.575 13.836 1.00 31.22 H new ATOM 0 HB3 SER A 23 17.634 -10.568 12.393 1.00 31.22 H new ATOM 0 HG SER A 23 19.221 -8.883 12.273 1.00 54.15 H new ATOM 332 N SER A 24 14.966 -10.880 11.101 1.00 50.31 N ATOM 333 CA SER A 24 14.501 -11.440 9.837 1.00 24.14 C ATOM 334 C SER A 24 13.429 -10.554 9.212 1.00 53.23 C ATOM 335 O SER A 24 13.500 -10.214 8.031 1.00 11.11 O ATOM 336 CB SER A 24 13.951 -12.851 10.053 1.00 61.33 C ATOM 337 OG SER A 24 13.593 -13.453 8.821 1.00 41.45 O ATOM 0 H SER A 24 14.829 -11.489 11.908 1.00 50.31 H new ATOM 0 HA SER A 24 15.350 -11.489 9.155 1.00 24.14 H new ATOM 0 HB2 SER A 24 14.699 -13.463 10.557 1.00 61.33 H new ATOM 0 HB3 SER A 24 13.080 -12.809 10.707 1.00 61.33 H new ATOM 0 HG SER A 24 13.246 -14.354 8.986 1.00 41.45 H new ATOM 343 N ALA A 25 12.435 -10.183 10.013 1.00 61.23 N ATOM 344 CA ALA A 25 11.348 -9.335 9.539 1.00 22.14 C ATOM 345 C ALA A 25 11.784 -7.876 9.464 1.00 54.40 C ATOM 346 O ALA A 25 11.465 -7.172 8.506 1.00 42.32 O ATOM 347 CB ALA A 25 10.134 -9.479 10.445 1.00 73.45 C ATOM 0 H ALA A 25 12.360 -10.456 10.993 1.00 61.23 H new ATOM 0 HA ALA A 25 11.078 -9.659 8.534 1.00 22.14 H new ATOM 0 HB1 ALA A 25 9.330 -8.840 10.080 1.00 73.45 H new ATOM 0 HB2 ALA A 25 9.801 -10.517 10.446 1.00 73.45 H new ATOM 0 HB3 ALA A 25 10.400 -9.183 11.460 1.00 73.45 H new ATOM 353 N SER A 26 12.513 -7.427 10.481 1.00 72.12 N ATOM 354 CA SER A 26 12.988 -6.050 10.532 1.00 41.55 C ATOM 355 C SER A 26 13.747 -5.689 9.258 1.00 71.41 C ATOM 356 O SER A 26 13.541 -4.622 8.679 1.00 64.40 O ATOM 357 CB SER A 26 13.889 -5.843 11.751 1.00 72.01 C ATOM 358 OG SER A 26 15.218 -6.253 11.479 1.00 74.13 O ATOM 0 H SER A 26 12.787 -7.997 11.281 1.00 72.12 H new ATOM 0 HA SER A 26 12.120 -5.396 10.615 1.00 41.55 H new ATOM 0 HB2 SER A 26 13.881 -4.792 12.038 1.00 72.01 H new ATOM 0 HB3 SER A 26 13.497 -6.408 12.597 1.00 72.01 H new ATOM 0 HG SER A 26 15.800 -5.466 11.431 1.00 74.13 H new ATOM 364 N LYS A 27 14.626 -6.588 8.826 1.00 13.33 N ATOM 365 CA LYS A 27 15.416 -6.368 7.621 1.00 51.02 C ATOM 366 C LYS A 27 14.515 -6.066 6.427 1.00 22.43 C ATOM 367 O LYS A 27 14.800 -5.169 5.634 1.00 22.21 O ATOM 368 CB LYS A 27 16.281 -7.594 7.323 1.00 25.40 C ATOM 369 CG LYS A 27 17.563 -7.647 8.137 1.00 14.13 C ATOM 370 CD LYS A 27 17.985 -9.079 8.421 1.00 52.31 C ATOM 371 CE LYS A 27 18.876 -9.626 7.316 1.00 34.44 C ATOM 372 NZ LYS A 27 18.081 -10.156 6.174 1.00 55.52 N ATOM 0 H LYS A 27 14.809 -7.476 9.293 1.00 13.33 H new ATOM 0 HA LYS A 27 16.063 -5.507 7.793 1.00 51.02 H new ATOM 0 HB2 LYS A 27 15.699 -8.495 7.518 1.00 25.40 H new ATOM 0 HB3 LYS A 27 16.533 -7.601 6.263 1.00 25.40 H new ATOM 0 HG2 LYS A 27 18.359 -7.132 7.598 1.00 14.13 H new ATOM 0 HG3 LYS A 27 17.420 -7.116 9.078 1.00 14.13 H new ATOM 0 HD2 LYS A 27 18.515 -9.121 9.372 1.00 52.31 H new ATOM 0 HD3 LYS A 27 17.100 -9.707 8.521 1.00 52.31 H new ATOM 0 HE2 LYS A 27 19.540 -8.838 6.961 1.00 34.44 H new ATOM 0 HE3 LYS A 27 19.508 -10.418 7.718 1.00 34.44 H new ATOM 0 HZ1 LYS A 27 18.706 -10.684 5.531 1.00 55.52 H new ATOM 0 HZ2 LYS A 27 17.338 -10.789 6.532 1.00 55.52 H new ATOM 0 HZ3 LYS A 27 17.643 -9.365 5.659 1.00 55.52 H new ATOM 386 N TRP A 28 13.428 -6.820 6.307 1.00 2.24 N ATOM 387 CA TRP A 28 12.485 -6.631 5.211 1.00 61.42 C ATOM 388 C TRP A 28 11.806 -5.269 5.305 1.00 63.34 C ATOM 389 O TRP A 28 11.727 -4.535 4.319 1.00 73.02 O ATOM 390 CB TRP A 28 11.433 -7.741 5.220 1.00 74.23 C ATOM 391 CG TRP A 28 10.474 -7.660 4.070 1.00 20.04 C ATOM 392 CD1 TRP A 28 10.785 -7.685 2.741 1.00 53.32 C ATOM 393 CD2 TRP A 28 9.050 -7.539 4.149 1.00 34.15 C ATOM 394 NE1 TRP A 28 9.639 -7.586 1.988 1.00 21.44 N ATOM 395 CE2 TRP A 28 8.561 -7.497 2.829 1.00 42.32 C ATOM 396 CE3 TRP A 28 8.139 -7.465 5.207 1.00 41.51 C ATOM 397 CZ2 TRP A 28 7.204 -7.382 2.541 1.00 51.01 C ATOM 398 CZ3 TRP A 28 6.792 -7.350 4.919 1.00 23.34 C ATOM 399 CH2 TRP A 28 6.335 -7.311 3.596 1.00 52.25 C ATOM 0 H TRP A 28 13.178 -7.567 6.955 1.00 2.24 H new ATOM 0 HA TRP A 28 13.041 -6.674 4.275 1.00 61.42 H new ATOM 0 HB2 TRP A 28 11.935 -8.708 5.197 1.00 74.23 H new ATOM 0 HB3 TRP A 28 10.874 -7.694 6.154 1.00 74.23 H new ATOM 0 HD1 TRP A 28 11.784 -7.770 2.340 1.00 53.32 H new ATOM 0 HE1 TRP A 28 9.598 -7.580 0.969 1.00 21.44 H new ATOM 0 HE3 TRP A 28 8.482 -7.497 6.231 1.00 41.51 H new ATOM 0 HZ2 TRP A 28 6.849 -7.350 1.521 1.00 51.01 H new ATOM 0 HZ3 TRP A 28 6.080 -7.289 5.728 1.00 23.34 H new ATOM 0 HH2 TRP A 28 5.276 -7.223 3.404 1.00 52.25 H new ATOM 410 N LEU A 29 11.318 -4.937 6.495 1.00 65.03 N ATOM 411 CA LEU A 29 10.646 -3.662 6.717 1.00 42.40 C ATOM 412 C LEU A 29 11.579 -2.494 6.411 1.00 13.10 C ATOM 413 O LEU A 29 11.138 -1.434 5.963 1.00 21.41 O ATOM 414 CB LEU A 29 10.151 -3.569 8.161 1.00 12.42 C ATOM 415 CG LEU A 29 8.851 -4.311 8.474 1.00 1.01 C ATOM 416 CD1 LEU A 29 8.878 -4.860 9.892 1.00 11.32 C ATOM 417 CD2 LEU A 29 7.653 -3.394 8.278 1.00 73.14 C ATOM 0 H LEU A 29 11.375 -5.533 7.321 1.00 65.03 H new ATOM 0 HA LEU A 29 9.792 -3.607 6.042 1.00 42.40 H new ATOM 0 HB2 LEU A 29 10.932 -3.953 8.817 1.00 12.42 H new ATOM 0 HB3 LEU A 29 10.014 -2.517 8.410 1.00 12.42 H new ATOM 0 HG LEU A 29 8.758 -5.149 7.783 1.00 1.01 H new ATOM 0 HD11 LEU A 29 7.945 -5.385 10.097 1.00 11.32 H new ATOM 0 HD12 LEU A 29 9.714 -5.551 9.999 1.00 11.32 H new ATOM 0 HD13 LEU A 29 8.995 -4.038 10.598 1.00 11.32 H new ATOM 0 HD21 LEU A 29 6.737 -3.939 8.505 1.00 73.14 H new ATOM 0 HD22 LEU A 29 7.739 -2.535 8.944 1.00 73.14 H new ATOM 0 HD23 LEU A 29 7.624 -3.050 7.244 1.00 73.14 H new ATOM 429 N LEU A 30 12.869 -2.695 6.654 1.00 62.15 N ATOM 430 CA LEU A 30 13.865 -1.660 6.402 1.00 45.42 C ATOM 431 C LEU A 30 13.838 -1.221 4.941 1.00 23.41 C ATOM 432 O LEU A 30 14.187 -0.086 4.616 1.00 44.22 O ATOM 433 CB LEU A 30 15.261 -2.167 6.768 1.00 62.31 C ATOM 434 CG LEU A 30 16.163 -1.178 7.507 1.00 32.02 C ATOM 435 CD1 LEU A 30 16.247 0.137 6.749 1.00 52.35 C ATOM 436 CD2 LEU A 30 15.654 -0.948 8.923 1.00 41.22 C ATOM 0 H LEU A 30 13.250 -3.565 7.025 1.00 62.15 H new ATOM 0 HA LEU A 30 13.623 -0.799 7.025 1.00 45.42 H new ATOM 0 HB2 LEU A 30 15.151 -3.059 7.385 1.00 62.31 H new ATOM 0 HB3 LEU A 30 15.766 -2.474 5.852 1.00 62.31 H new ATOM 0 HG LEU A 30 17.165 -1.604 7.567 1.00 32.02 H new ATOM 0 HD11 LEU A 30 16.893 0.828 7.290 1.00 52.35 H new ATOM 0 HD12 LEU A 30 16.658 -0.041 5.755 1.00 52.35 H new ATOM 0 HD13 LEU A 30 15.250 0.568 6.657 1.00 52.35 H new ATOM 0 HD21 LEU A 30 16.308 -0.242 9.434 1.00 41.22 H new ATOM 0 HD22 LEU A 30 14.642 -0.544 8.885 1.00 41.22 H new ATOM 0 HD23 LEU A 30 15.647 -1.894 9.465 1.00 41.22 H new ATOM 448 N LEU A 31 13.420 -2.128 4.065 1.00 53.33 N ATOM 449 CA LEU A 31 13.344 -1.834 2.638 1.00 62.43 C ATOM 450 C LEU A 31 11.943 -1.373 2.250 1.00 0.30 C ATOM 451 O LEU A 31 11.592 -1.348 1.071 1.00 42.32 O ATOM 452 CB LEU A 31 13.730 -3.069 1.822 1.00 24.50 C ATOM 453 CG LEU A 31 14.876 -3.913 2.383 1.00 34.21 C ATOM 454 CD1 LEU A 31 15.199 -5.066 1.445 1.00 12.21 C ATOM 455 CD2 LEU A 31 16.108 -3.052 2.617 1.00 40.43 C ATOM 0 H LEU A 31 13.129 -3.072 4.317 1.00 53.33 H new ATOM 0 HA LEU A 31 14.045 -1.028 2.421 1.00 62.43 H new ATOM 0 HB2 LEU A 31 12.850 -3.705 1.725 1.00 24.50 H new ATOM 0 HB3 LEU A 31 14.002 -2.746 0.817 1.00 24.50 H new ATOM 0 HG LEU A 31 14.561 -4.328 3.340 1.00 34.21 H new ATOM 0 HD11 LEU A 31 16.016 -5.655 1.861 1.00 12.21 H new ATOM 0 HD12 LEU A 31 14.319 -5.698 1.329 1.00 12.21 H new ATOM 0 HD13 LEU A 31 15.494 -4.672 0.472 1.00 12.21 H new ATOM 0 HD21 LEU A 31 16.913 -3.669 3.016 1.00 40.43 H new ATOM 0 HD22 LEU A 31 16.425 -2.607 1.674 1.00 40.43 H new ATOM 0 HD23 LEU A 31 15.870 -2.262 3.329 1.00 40.43 H new ATOM 467 N GLN A 32 11.148 -1.006 3.250 1.00 24.44 N ATOM 468 CA GLN A 32 9.786 -0.544 3.013 1.00 1.12 C ATOM 469 C GLN A 32 9.611 0.897 3.480 1.00 4.42 C ATOM 470 O GLN A 32 8.533 1.289 3.928 1.00 44.11 O ATOM 471 CB GLN A 32 8.785 -1.450 3.732 1.00 71.24 C ATOM 472 CG GLN A 32 8.998 -2.930 3.458 1.00 65.14 C ATOM 473 CD GLN A 32 9.313 -3.215 2.002 1.00 11.22 C ATOM 474 OE1 GLN A 32 10.263 -3.933 1.689 1.00 33.23 O ATOM 475 NE2 GLN A 32 8.515 -2.652 1.103 1.00 54.33 N ATOM 0 H GLN A 32 11.424 -1.020 4.232 1.00 24.44 H new ATOM 0 HA GLN A 32 9.597 -0.585 1.940 1.00 1.12 H new ATOM 0 HB2 GLN A 32 8.854 -1.274 4.805 1.00 71.24 H new ATOM 0 HB3 GLN A 32 7.775 -1.174 3.428 1.00 71.24 H new ATOM 0 HG2 GLN A 32 9.814 -3.297 4.081 1.00 65.14 H new ATOM 0 HG3 GLN A 32 8.103 -3.482 3.747 1.00 65.14 H new ATOM 0 HE21 GLN A 32 7.739 -2.064 1.407 1.00 54.33 H new ATOM 0 HE22 GLN A 32 8.678 -2.808 0.108 1.00 54.33 H new ATOM 484 N TYR A 33 10.678 1.682 3.373 1.00 31.13 N ATOM 485 CA TYR A 33 10.643 3.080 3.787 1.00 23.54 C ATOM 486 C TYR A 33 9.550 3.841 3.044 1.00 32.15 C ATOM 487 O TYR A 33 9.064 4.869 3.516 1.00 51.21 O ATOM 488 CB TYR A 33 12.000 3.741 3.538 1.00 31.23 C ATOM 489 CG TYR A 33 12.580 3.438 2.175 1.00 22.34 C ATOM 490 CD1 TYR A 33 12.011 3.966 1.023 1.00 35.13 C ATOM 491 CD2 TYR A 33 13.697 2.623 2.039 1.00 20.34 C ATOM 492 CE1 TYR A 33 12.537 3.691 -0.224 1.00 53.33 C ATOM 493 CE2 TYR A 33 14.231 2.344 0.796 1.00 32.12 C ATOM 494 CZ TYR A 33 13.647 2.880 -0.333 1.00 0.34 C ATOM 495 OH TYR A 33 14.175 2.604 -1.573 1.00 31.21 O ATOM 0 H TYR A 33 11.577 1.374 3.003 1.00 31.13 H new ATOM 0 HA TYR A 33 10.421 3.111 4.854 1.00 23.54 H new ATOM 0 HB2 TYR A 33 11.894 4.820 3.647 1.00 31.23 H new ATOM 0 HB3 TYR A 33 12.702 3.411 4.304 1.00 31.23 H new ATOM 0 HD1 TYR A 33 11.142 4.603 1.104 1.00 35.13 H new ATOM 0 HD2 TYR A 33 14.156 2.200 2.921 1.00 20.34 H new ATOM 0 HE1 TYR A 33 12.081 4.109 -1.109 1.00 53.33 H new ATOM 0 HE2 TYR A 33 15.101 1.710 0.709 1.00 32.12 H new ATOM 0 HH TYR A 33 14.955 2.019 -1.474 1.00 31.21 H new ATOM 505 N ARG A 34 9.167 3.328 1.880 1.00 62.51 N ATOM 506 CA ARG A 34 8.132 3.958 1.070 1.00 14.12 C ATOM 507 C ARG A 34 6.754 3.752 1.693 1.00 11.30 C ATOM 508 O ARG A 34 5.873 4.603 1.571 1.00 51.53 O ATOM 509 CB ARG A 34 8.150 3.392 -0.351 1.00 3.21 C ATOM 510 CG ARG A 34 9.457 3.639 -1.088 1.00 14.33 C ATOM 511 CD ARG A 34 9.239 3.738 -2.589 1.00 50.55 C ATOM 512 NE ARG A 34 9.097 2.424 -3.210 1.00 43.00 N ATOM 513 CZ ARG A 34 8.899 2.243 -4.511 1.00 44.00 C ATOM 514 NH1 ARG A 34 8.821 3.287 -5.325 1.00 34.05 N ATOM 515 NH2 ARG A 34 8.780 1.016 -5.001 1.00 23.42 N ATOM 0 H ARG A 34 9.558 2.477 1.476 1.00 62.51 H new ATOM 0 HA ARG A 34 8.339 5.028 1.030 1.00 14.12 H new ATOM 0 HB2 ARG A 34 7.964 2.319 -0.308 1.00 3.21 H new ATOM 0 HB3 ARG A 34 7.332 3.835 -0.920 1.00 3.21 H new ATOM 0 HG2 ARG A 34 9.913 4.560 -0.724 1.00 14.33 H new ATOM 0 HG3 ARG A 34 10.156 2.830 -0.873 1.00 14.33 H new ATOM 0 HD2 ARG A 34 8.346 4.331 -2.787 1.00 50.55 H new ATOM 0 HD3 ARG A 34 10.078 4.265 -3.043 1.00 50.55 H new ATOM 0 HE ARG A 34 9.153 1.600 -2.612 1.00 43.00 H new ATOM 0 HH11 ARG A 34 8.913 4.232 -4.953 1.00 34.05 H new ATOM 0 HH12 ARG A 34 8.669 3.145 -6.324 1.00 34.05 H new ATOM 0 HH21 ARG A 34 8.840 0.210 -4.379 1.00 23.42 H new ATOM 0 HH22 ARG A 34 8.628 0.878 -6.000 1.00 23.42 H new ATOM 529 N ASP A 35 6.576 2.617 2.360 1.00 14.41 N ATOM 530 CA ASP A 35 5.306 2.300 3.003 1.00 73.43 C ATOM 531 C ASP A 35 5.308 2.746 4.461 1.00 11.33 C ATOM 532 O ASP A 35 4.825 2.033 5.340 1.00 63.41 O ATOM 533 CB ASP A 35 5.028 0.798 2.917 1.00 51.04 C ATOM 534 CG ASP A 35 5.540 0.187 1.627 1.00 4.41 C ATOM 535 OD1 ASP A 35 5.268 0.759 0.550 1.00 23.13 O ATOM 536 OD2 ASP A 35 6.214 -0.862 1.695 1.00 43.53 O ATOM 0 H ASP A 35 7.295 1.901 2.470 1.00 14.41 H new ATOM 0 HA ASP A 35 4.517 2.839 2.478 1.00 73.43 H new ATOM 0 HB2 ASP A 35 5.496 0.296 3.764 1.00 51.04 H new ATOM 0 HB3 ASP A 35 3.955 0.625 2.997 1.00 51.04 H new ATOM 541 N ALA A 36 5.855 3.931 4.711 1.00 4.31 N ATOM 542 CA ALA A 36 5.920 4.473 6.063 1.00 53.44 C ATOM 543 C ALA A 36 4.547 4.456 6.727 1.00 62.01 C ATOM 544 O ALA A 36 4.339 3.820 7.761 1.00 42.34 O ATOM 545 CB ALA A 36 6.478 5.889 6.038 1.00 61.54 C ATOM 0 H ALA A 36 6.260 4.534 3.995 1.00 4.31 H new ATOM 0 HA ALA A 36 6.587 3.841 6.650 1.00 53.44 H new ATOM 0 HB1 ALA A 36 6.521 6.281 7.054 1.00 61.54 H new ATOM 0 HB2 ALA A 36 7.481 5.877 5.611 1.00 61.54 H new ATOM 0 HB3 ALA A 36 5.832 6.524 5.431 1.00 61.54 H new ATOM 551 N PRO A 37 3.587 5.171 6.122 1.00 72.41 N ATOM 552 CA PRO A 37 2.217 5.253 6.638 1.00 3.11 C ATOM 553 C PRO A 37 1.463 3.935 6.495 1.00 44.43 C ATOM 554 O PRO A 37 0.661 3.570 7.354 1.00 11.41 O ATOM 555 CB PRO A 37 1.574 6.335 5.766 1.00 22.35 C ATOM 556 CG PRO A 37 2.357 6.315 4.499 1.00 31.30 C ATOM 557 CD PRO A 37 3.764 5.953 4.887 1.00 71.32 C ATOM 0 HA PRO A 37 2.196 5.477 7.704 1.00 3.11 H new ATOM 0 HB2 PRO A 37 0.521 6.122 5.584 1.00 22.35 H new ATOM 0 HB3 PRO A 37 1.623 7.312 6.247 1.00 22.35 H new ATOM 0 HG2 PRO A 37 1.946 5.588 3.798 1.00 31.30 H new ATOM 0 HG3 PRO A 37 2.326 7.287 4.006 1.00 31.30 H new ATOM 0 HD2 PRO A 37 4.258 5.370 4.110 1.00 71.32 H new ATOM 0 HD3 PRO A 37 4.375 6.840 5.057 1.00 71.32 H new ATOM 565 N LYS A 38 1.727 3.224 5.404 1.00 54.34 N ATOM 566 CA LYS A 38 1.075 1.945 5.148 1.00 54.54 C ATOM 567 C LYS A 38 1.394 0.942 6.251 1.00 72.53 C ATOM 568 O LYS A 38 0.492 0.378 6.871 1.00 0.22 O ATOM 569 CB LYS A 38 1.515 1.387 3.792 1.00 2.44 C ATOM 570 CG LYS A 38 0.536 1.678 2.668 1.00 64.22 C ATOM 571 CD LYS A 38 -0.793 0.977 2.891 1.00 14.52 C ATOM 572 CE LYS A 38 -1.721 1.149 1.698 1.00 61.31 C ATOM 573 NZ LYS A 38 -2.208 2.550 1.571 1.00 54.11 N ATOM 0 H LYS A 38 2.388 3.512 4.683 1.00 54.34 H new ATOM 0 HA LYS A 38 -0.002 2.111 5.133 1.00 54.54 H new ATOM 0 HB2 LYS A 38 2.487 1.807 3.534 1.00 2.44 H new ATOM 0 HB3 LYS A 38 1.647 0.308 3.878 1.00 2.44 H new ATOM 0 HG2 LYS A 38 0.373 2.753 2.595 1.00 64.22 H new ATOM 0 HG3 LYS A 38 0.964 1.355 1.719 1.00 64.22 H new ATOM 0 HD2 LYS A 38 -0.620 -0.084 3.069 1.00 14.52 H new ATOM 0 HD3 LYS A 38 -1.271 1.377 3.786 1.00 14.52 H new ATOM 0 HE2 LYS A 38 -1.197 0.863 0.786 1.00 61.31 H new ATOM 0 HE3 LYS A 38 -2.573 0.476 1.801 1.00 61.31 H new ATOM 0 HZ1 LYS A 38 -2.851 2.622 0.756 1.00 54.11 H new ATOM 0 HZ2 LYS A 38 -2.716 2.821 2.437 1.00 54.11 H new ATOM 0 HZ3 LYS A 38 -1.398 3.188 1.430 1.00 54.11 H new ATOM 587 N VAL A 39 2.683 0.723 6.491 1.00 12.11 N ATOM 588 CA VAL A 39 3.121 -0.211 7.521 1.00 12.04 C ATOM 589 C VAL A 39 2.725 0.278 8.910 1.00 21.33 C ATOM 590 O VAL A 39 2.378 -0.517 9.784 1.00 63.05 O ATOM 591 CB VAL A 39 4.646 -0.420 7.478 1.00 42.30 C ATOM 592 CG1 VAL A 39 5.067 -1.493 8.471 1.00 51.25 C ATOM 593 CG2 VAL A 39 5.094 -0.779 6.069 1.00 24.45 C ATOM 0 H VAL A 39 3.442 1.180 5.986 1.00 12.11 H new ATOM 0 HA VAL A 39 2.626 -1.161 7.318 1.00 12.04 H new ATOM 0 HB VAL A 39 5.132 0.513 7.762 1.00 42.30 H new ATOM 0 HG11 VAL A 39 6.148 -1.626 8.426 1.00 51.25 H new ATOM 0 HG12 VAL A 39 4.780 -1.189 9.478 1.00 51.25 H new ATOM 0 HG13 VAL A 39 4.575 -2.433 8.222 1.00 51.25 H new ATOM 0 HG21 VAL A 39 6.174 -0.923 6.056 1.00 24.45 H new ATOM 0 HG22 VAL A 39 4.601 -1.699 5.754 1.00 24.45 H new ATOM 0 HG23 VAL A 39 4.828 0.028 5.386 1.00 24.45 H new ATOM 603 N ALA A 40 2.779 1.591 9.107 1.00 20.11 N ATOM 604 CA ALA A 40 2.424 2.186 10.389 1.00 13.42 C ATOM 605 C ALA A 40 0.970 1.895 10.746 1.00 51.34 C ATOM 606 O ALA A 40 0.671 1.444 11.851 1.00 42.32 O ATOM 607 CB ALA A 40 2.672 3.687 10.361 1.00 52.32 C ATOM 0 H ALA A 40 3.065 2.263 8.395 1.00 20.11 H new ATOM 0 HA ALA A 40 3.056 1.738 11.156 1.00 13.42 H new ATOM 0 HB1 ALA A 40 2.402 4.118 11.325 1.00 52.32 H new ATOM 0 HB2 ALA A 40 3.726 3.878 10.160 1.00 52.32 H new ATOM 0 HB3 ALA A 40 2.065 4.141 9.578 1.00 52.32 H new ATOM 613 N GLU A 41 0.070 2.157 9.803 1.00 42.14 N ATOM 614 CA GLU A 41 -1.353 1.924 10.019 1.00 22.05 C ATOM 615 C GLU A 41 -1.647 0.432 10.146 1.00 25.14 C ATOM 616 O GLU A 41 -2.338 0.001 11.069 1.00 4.10 O ATOM 617 CB GLU A 41 -2.171 2.520 8.872 1.00 43.10 C ATOM 618 CG GLU A 41 -3.673 2.424 9.081 1.00 64.32 C ATOM 619 CD GLU A 41 -4.457 2.712 7.816 1.00 52.33 C ATOM 620 OE1 GLU A 41 -4.785 3.893 7.576 1.00 1.25 O ATOM 621 OE2 GLU A 41 -4.743 1.756 7.065 1.00 51.24 O ATOM 0 H GLU A 41 0.301 2.531 8.882 1.00 42.14 H new ATOM 0 HA GLU A 41 -1.637 2.414 10.950 1.00 22.05 H new ATOM 0 HB2 GLU A 41 -1.896 3.567 8.747 1.00 43.10 H new ATOM 0 HB3 GLU A 41 -1.908 2.009 7.946 1.00 43.10 H new ATOM 0 HG2 GLU A 41 -3.923 1.426 9.440 1.00 64.32 H new ATOM 0 HG3 GLU A 41 -3.974 3.127 9.858 1.00 64.32 H new ATOM 628 N MET A 42 -1.117 -0.351 9.212 1.00 23.03 N ATOM 629 CA MET A 42 -1.321 -1.795 9.220 1.00 53.13 C ATOM 630 C MET A 42 -0.815 -2.409 10.521 1.00 61.11 C ATOM 631 O MET A 42 -1.504 -3.214 11.148 1.00 52.35 O ATOM 632 CB MET A 42 -0.610 -2.438 8.028 1.00 72.43 C ATOM 633 CG MET A 42 -0.196 -3.880 8.273 1.00 33.31 C ATOM 634 SD MET A 42 -1.600 -4.956 8.624 1.00 53.21 S ATOM 635 CE MET A 42 -0.827 -6.194 9.661 1.00 31.34 C ATOM 0 H MET A 42 -0.543 -0.010 8.441 1.00 23.03 H new ATOM 0 HA MET A 42 -2.391 -1.986 9.142 1.00 53.13 H new ATOM 0 HB2 MET A 42 -1.268 -2.400 7.159 1.00 72.43 H new ATOM 0 HB3 MET A 42 0.275 -1.851 7.784 1.00 72.43 H new ATOM 0 HG2 MET A 42 0.334 -4.255 7.398 1.00 33.31 H new ATOM 0 HG3 MET A 42 0.503 -3.916 9.109 1.00 33.31 H new ATOM 0 HE1 MET A 42 -1.583 -6.893 10.019 1.00 31.34 H new ATOM 0 HE2 MET A 42 -0.077 -6.735 9.084 1.00 31.34 H new ATOM 0 HE3 MET A 42 -0.350 -5.709 10.512 1.00 31.34 H new ATOM 645 N TRP A 43 0.392 -2.025 10.921 1.00 51.05 N ATOM 646 CA TRP A 43 0.990 -2.539 12.147 1.00 1.15 C ATOM 647 C TRP A 43 0.146 -2.168 13.362 1.00 53.24 C ATOM 648 O TRP A 43 -0.190 -3.022 14.182 1.00 61.51 O ATOM 649 CB TRP A 43 2.410 -1.996 12.313 1.00 3.22 C ATOM 650 CG TRP A 43 3.132 -2.571 13.494 1.00 63.32 C ATOM 651 CD1 TRP A 43 3.801 -3.761 13.545 1.00 32.15 C ATOM 652 CD2 TRP A 43 3.256 -1.983 14.793 1.00 42.50 C ATOM 653 NE1 TRP A 43 4.333 -3.947 14.799 1.00 73.54 N ATOM 654 CE2 TRP A 43 4.014 -2.870 15.582 1.00 35.22 C ATOM 655 CE3 TRP A 43 2.803 -0.791 15.366 1.00 60.22 C ATOM 656 CZ2 TRP A 43 4.325 -2.603 16.913 1.00 51.55 C ATOM 657 CZ3 TRP A 43 3.113 -0.527 16.686 1.00 34.24 C ATOM 658 CH2 TRP A 43 3.868 -1.429 17.448 1.00 42.22 C ATOM 0 H TRP A 43 0.975 -1.359 10.414 1.00 51.05 H new ATOM 0 HA TRP A 43 1.030 -3.626 12.074 1.00 1.15 H new ATOM 0 HB2 TRP A 43 2.980 -2.208 11.409 1.00 3.22 H new ATOM 0 HB3 TRP A 43 2.367 -0.912 12.415 1.00 3.22 H new ATOM 0 HD1 TRP A 43 3.898 -4.453 12.722 1.00 32.15 H new ATOM 0 HE1 TRP A 43 4.877 -4.756 15.098 1.00 73.54 H new ATOM 0 HE3 TRP A 43 2.221 -0.089 14.787 1.00 60.22 H new ATOM 0 HZ2 TRP A 43 4.906 -3.297 17.502 1.00 51.55 H new ATOM 0 HZ3 TRP A 43 2.767 0.391 17.139 1.00 34.24 H new ATOM 0 HH2 TRP A 43 4.094 -1.193 18.477 1.00 42.22 H new ATOM 669 N LYS A 44 -0.195 -0.888 13.471 1.00 73.30 N ATOM 670 CA LYS A 44 -1.002 -0.404 14.584 1.00 13.45 C ATOM 671 C LYS A 44 -2.366 -1.086 14.605 1.00 14.24 C ATOM 672 O LYS A 44 -2.734 -1.728 15.589 1.00 42.52 O ATOM 673 CB LYS A 44 -1.180 1.113 14.490 1.00 53.43 C ATOM 674 CG LYS A 44 -2.092 1.687 15.561 1.00 70.14 C ATOM 675 CD LYS A 44 -3.220 2.505 14.954 1.00 65.15 C ATOM 676 CE LYS A 44 -2.859 3.981 14.878 1.00 72.32 C ATOM 677 NZ LYS A 44 -3.290 4.720 16.096 1.00 12.24 N ATOM 0 H LYS A 44 0.075 -0.167 12.802 1.00 73.30 H new ATOM 0 HA LYS A 44 -0.480 -0.646 15.510 1.00 13.45 H new ATOM 0 HB2 LYS A 44 -0.203 1.590 14.563 1.00 53.43 H new ATOM 0 HB3 LYS A 44 -1.584 1.363 13.509 1.00 53.43 H new ATOM 0 HG2 LYS A 44 -2.510 0.876 16.157 1.00 70.14 H new ATOM 0 HG3 LYS A 44 -1.511 2.313 16.238 1.00 70.14 H new ATOM 0 HD2 LYS A 44 -3.444 2.132 13.955 1.00 65.15 H new ATOM 0 HD3 LYS A 44 -4.123 2.380 15.551 1.00 65.15 H new ATOM 0 HE2 LYS A 44 -1.781 4.085 14.752 1.00 72.32 H new ATOM 0 HE3 LYS A 44 -3.327 4.425 13.999 1.00 72.32 H new ATOM 0 HZ1 LYS A 44 -4.100 5.329 15.864 1.00 12.24 H new ATOM 0 HZ2 LYS A 44 -3.567 4.041 16.834 1.00 12.24 H new ATOM 0 HZ3 LYS A 44 -2.504 5.306 16.442 1.00 12.24 H new ATOM 691 N GLU A 45 -3.111 -0.943 13.513 1.00 32.35 N ATOM 692 CA GLU A 45 -4.434 -1.547 13.408 1.00 73.20 C ATOM 693 C GLU A 45 -4.378 -3.039 13.724 1.00 12.01 C ATOM 694 O GLU A 45 -5.303 -3.594 14.318 1.00 2.25 O ATOM 695 CB GLU A 45 -5.007 -1.333 12.005 1.00 24.02 C ATOM 696 CG GLU A 45 -4.394 -2.242 10.953 1.00 41.44 C ATOM 697 CD GLU A 45 -5.037 -2.072 9.590 1.00 44.43 C ATOM 698 OE1 GLU A 45 -4.890 -0.982 8.997 1.00 12.13 O ATOM 699 OE2 GLU A 45 -5.686 -3.027 9.116 1.00 64.32 O ATOM 0 H GLU A 45 -2.821 -0.415 12.690 1.00 32.35 H new ATOM 0 HA GLU A 45 -5.085 -1.063 14.136 1.00 73.20 H new ATOM 0 HB2 GLU A 45 -6.084 -1.498 12.032 1.00 24.02 H new ATOM 0 HB3 GLU A 45 -4.851 -0.295 11.712 1.00 24.02 H new ATOM 0 HG2 GLU A 45 -3.327 -2.034 10.876 1.00 41.44 H new ATOM 0 HG3 GLU A 45 -4.495 -3.280 11.271 1.00 41.44 H new ATOM 706 N TYR A 46 -3.288 -3.682 13.322 1.00 62.21 N ATOM 707 CA TYR A 46 -3.112 -5.110 13.559 1.00 44.01 C ATOM 708 C TYR A 46 -2.761 -5.381 15.019 1.00 41.31 C ATOM 709 O TYR A 46 -3.071 -6.443 15.556 1.00 31.44 O ATOM 710 CB TYR A 46 -2.017 -5.668 12.648 1.00 61.20 C ATOM 711 CG TYR A 46 -1.468 -7.000 13.107 1.00 3.03 C ATOM 712 CD1 TYR A 46 -0.392 -7.064 13.985 1.00 70.53 C ATOM 713 CD2 TYR A 46 -2.023 -8.193 12.664 1.00 73.55 C ATOM 714 CE1 TYR A 46 0.114 -8.279 14.407 1.00 53.14 C ATOM 715 CE2 TYR A 46 -1.525 -9.412 13.081 1.00 31.33 C ATOM 716 CZ TYR A 46 -0.457 -9.450 13.953 1.00 45.24 C ATOM 717 OH TYR A 46 0.044 -10.662 14.370 1.00 54.00 O ATOM 0 H TYR A 46 -2.513 -3.237 12.830 1.00 62.21 H new ATOM 0 HA TYR A 46 -4.054 -5.609 13.332 1.00 44.01 H new ATOM 0 HB2 TYR A 46 -2.416 -5.777 11.639 1.00 61.20 H new ATOM 0 HB3 TYR A 46 -1.201 -4.948 12.592 1.00 61.20 H new ATOM 0 HD1 TYR A 46 0.056 -6.149 14.343 1.00 70.53 H new ATOM 0 HD2 TYR A 46 -2.859 -8.167 11.981 1.00 73.55 H new ATOM 0 HE1 TYR A 46 0.951 -8.312 15.088 1.00 53.14 H new ATOM 0 HE2 TYR A 46 -1.969 -10.330 12.726 1.00 31.33 H new ATOM 0 HH TYR A 46 -0.471 -11.388 13.959 1.00 54.00 H new ATOM 727 N MET A 47 -2.113 -4.410 15.655 1.00 64.25 N ATOM 728 CA MET A 47 -1.721 -4.542 17.053 1.00 1.01 C ATOM 729 C MET A 47 -2.885 -4.203 17.978 1.00 14.31 C ATOM 730 O MET A 47 -2.901 -4.599 19.144 1.00 20.13 O ATOM 731 CB MET A 47 -0.530 -3.632 17.359 1.00 25.31 C ATOM 732 CG MET A 47 0.761 -4.075 16.689 1.00 51.45 C ATOM 733 SD MET A 47 1.695 -5.250 17.687 1.00 72.31 S ATOM 734 CE MET A 47 2.394 -4.162 18.925 1.00 4.15 C ATOM 0 H MET A 47 -1.849 -3.524 15.224 1.00 64.25 H new ATOM 0 HA MET A 47 -1.431 -5.578 17.227 1.00 1.01 H new ATOM 0 HB2 MET A 47 -0.767 -2.617 17.038 1.00 25.31 H new ATOM 0 HB3 MET A 47 -0.377 -3.598 18.438 1.00 25.31 H new ATOM 0 HG2 MET A 47 0.529 -4.528 15.725 1.00 51.45 H new ATOM 0 HG3 MET A 47 1.381 -3.201 16.490 1.00 51.45 H new ATOM 0 HE1 MET A 47 3.471 -4.318 18.979 1.00 4.15 H new ATOM 0 HE2 MET A 47 2.190 -3.126 18.656 1.00 4.15 H new ATOM 0 HE3 MET A 47 1.947 -4.379 19.895 1.00 4.15 H new ATOM 744 N LEU A 48 -3.858 -3.467 17.452 1.00 74.44 N ATOM 745 CA LEU A 48 -5.028 -3.075 18.231 1.00 44.54 C ATOM 746 C LEU A 48 -6.221 -3.968 17.909 1.00 15.30 C ATOM 747 O LEU A 48 -7.366 -3.513 17.903 1.00 65.14 O ATOM 748 CB LEU A 48 -5.381 -1.612 17.954 1.00 31.23 C ATOM 749 CG LEU A 48 -4.265 -0.595 18.193 1.00 24.00 C ATOM 750 CD1 LEU A 48 -4.698 0.790 17.738 1.00 20.11 C ATOM 751 CD2 LEU A 48 -3.866 -0.576 19.661 1.00 0.45 C ATOM 0 H LEU A 48 -3.860 -3.130 16.489 1.00 74.44 H new ATOM 0 HA LEU A 48 -4.787 -3.191 19.288 1.00 44.54 H new ATOM 0 HB2 LEU A 48 -5.706 -1.528 16.917 1.00 31.23 H new ATOM 0 HB3 LEU A 48 -6.232 -1.340 18.578 1.00 31.23 H new ATOM 0 HG LEU A 48 -3.397 -0.893 17.605 1.00 24.00 H new ATOM 0 HD11 LEU A 48 -3.891 1.500 17.916 1.00 20.11 H new ATOM 0 HD12 LEU A 48 -4.933 0.767 16.674 1.00 20.11 H new ATOM 0 HD13 LEU A 48 -5.582 1.097 18.298 1.00 20.11 H new ATOM 0 HD21 LEU A 48 -3.070 0.154 19.812 1.00 0.45 H new ATOM 0 HD22 LEU A 48 -4.729 -0.304 20.269 1.00 0.45 H new ATOM 0 HD23 LEU A 48 -3.513 -1.564 19.955 1.00 0.45 H new ATOM 763 N ARG A 49 -5.947 -5.241 17.645 1.00 51.04 N ATOM 764 CA ARG A 49 -6.999 -6.198 17.323 1.00 23.34 C ATOM 765 C ARG A 49 -7.106 -7.271 18.404 1.00 53.52 C ATOM 766 O ARG A 49 -6.139 -7.588 19.096 1.00 13.15 O ATOM 767 CB ARG A 49 -6.726 -6.851 15.967 1.00 33.41 C ATOM 768 CG ARG A 49 -7.310 -6.083 14.793 1.00 52.11 C ATOM 769 CD ARG A 49 -6.631 -6.461 13.486 1.00 23.42 C ATOM 770 NE ARG A 49 -7.331 -7.542 12.798 1.00 72.30 N ATOM 771 CZ ARG A 49 -6.795 -8.257 11.815 1.00 40.21 C ATOM 772 NH1 ARG A 49 -5.558 -8.006 11.407 1.00 35.51 N ATOM 773 NH2 ARG A 49 -7.496 -9.225 11.238 1.00 41.42 N ATOM 0 H ARG A 49 -5.006 -5.634 17.648 1.00 51.04 H new ATOM 0 HA ARG A 49 -7.945 -5.658 17.275 1.00 23.34 H new ATOM 0 HB2 ARG A 49 -5.649 -6.945 15.829 1.00 33.41 H new ATOM 0 HB3 ARG A 49 -7.137 -7.861 15.970 1.00 33.41 H new ATOM 0 HG2 ARG A 49 -8.379 -6.285 14.721 1.00 52.11 H new ATOM 0 HG3 ARG A 49 -7.199 -5.013 14.966 1.00 52.11 H new ATOM 0 HD2 ARG A 49 -6.585 -5.587 12.836 1.00 23.42 H new ATOM 0 HD3 ARG A 49 -5.603 -6.764 13.686 1.00 23.42 H new ATOM 0 HE ARG A 49 -8.284 -7.760 13.088 1.00 72.30 H new ATOM 0 HH11 ARG A 49 -5.016 -7.263 11.848 1.00 35.51 H new ATOM 0 HH12 ARG A 49 -5.148 -8.556 10.652 1.00 35.51 H new ATOM 0 HH21 ARG A 49 -8.447 -9.421 11.549 1.00 41.42 H new ATOM 0 HH22 ARG A 49 -7.083 -9.773 10.483 1.00 41.42 H new ATOM 787 N PRO A 50 -8.311 -7.842 18.553 1.00 64.24 N ATOM 788 CA PRO A 50 -8.573 -8.887 19.547 1.00 74.04 C ATOM 789 C PRO A 50 -7.883 -10.202 19.202 1.00 70.24 C ATOM 790 O PRO A 50 -7.324 -10.868 20.073 1.00 31.01 O ATOM 791 CB PRO A 50 -10.094 -9.052 19.494 1.00 14.23 C ATOM 792 CG PRO A 50 -10.477 -8.603 18.126 1.00 31.42 C ATOM 793 CD PRO A 50 -9.508 -7.513 17.761 1.00 11.15 C ATOM 0 HA PRO A 50 -8.193 -8.617 20.532 1.00 74.04 H new ATOM 0 HB2 PRO A 50 -10.386 -10.088 19.667 1.00 14.23 H new ATOM 0 HB3 PRO A 50 -10.584 -8.451 20.260 1.00 14.23 H new ATOM 0 HG2 PRO A 50 -10.423 -9.428 17.415 1.00 31.42 H new ATOM 0 HG3 PRO A 50 -11.503 -8.235 18.109 1.00 31.42 H new ATOM 0 HD2 PRO A 50 -9.294 -7.507 16.692 1.00 11.15 H new ATOM 0 HD3 PRO A 50 -9.898 -6.527 18.013 1.00 11.15 H new ATOM 801 N SER A 51 -7.925 -10.570 17.925 1.00 33.52 N ATOM 802 CA SER A 51 -7.306 -11.808 17.466 1.00 74.32 C ATOM 803 C SER A 51 -5.870 -11.917 17.969 1.00 33.04 C ATOM 804 O SER A 51 -5.449 -12.965 18.458 1.00 33.54 O ATOM 805 CB SER A 51 -7.330 -11.878 15.938 1.00 64.53 C ATOM 806 OG SER A 51 -7.261 -13.220 15.488 1.00 73.53 O ATOM 0 H SER A 51 -8.381 -10.029 17.191 1.00 33.52 H new ATOM 0 HA SER A 51 -7.878 -12.643 17.870 1.00 74.32 H new ATOM 0 HB2 SER A 51 -8.242 -11.412 15.564 1.00 64.53 H new ATOM 0 HB3 SER A 51 -6.492 -11.311 15.532 1.00 64.53 H new ATOM 0 HG SER A 51 -7.280 -13.238 14.508 1.00 73.53 H new ATOM 812 N VAL A 52 -5.122 -10.825 17.846 1.00 73.10 N ATOM 813 CA VAL A 52 -3.734 -10.796 18.289 1.00 45.20 C ATOM 814 C VAL A 52 -3.633 -10.997 19.797 1.00 73.12 C ATOM 815 O VAL A 52 -4.310 -10.320 20.570 1.00 71.52 O ATOM 816 CB VAL A 52 -3.053 -9.466 17.913 1.00 24.32 C ATOM 817 CG1 VAL A 52 -1.573 -9.506 18.265 1.00 52.11 C ATOM 818 CG2 VAL A 52 -3.250 -9.166 16.435 1.00 22.30 C ATOM 0 H VAL A 52 -5.455 -9.949 17.443 1.00 73.10 H new ATOM 0 HA VAL A 52 -3.223 -11.614 17.782 1.00 45.20 H new ATOM 0 HB VAL A 52 -3.517 -8.665 18.488 1.00 24.32 H new ATOM 0 HG11 VAL A 52 -1.108 -8.558 17.992 1.00 52.11 H new ATOM 0 HG12 VAL A 52 -1.458 -9.672 19.336 1.00 52.11 H new ATOM 0 HG13 VAL A 52 -1.091 -10.317 17.719 1.00 52.11 H new ATOM 0 HG21 VAL A 52 -2.763 -8.223 16.187 1.00 22.30 H new ATOM 0 HG22 VAL A 52 -2.813 -9.968 15.840 1.00 22.30 H new ATOM 0 HG23 VAL A 52 -4.316 -9.092 16.218 1.00 22.30 H new ATOM 828 N ASN A 53 -2.783 -11.932 20.208 1.00 33.32 N ATOM 829 CA ASN A 53 -2.594 -12.223 21.625 1.00 60.43 C ATOM 830 C ASN A 53 -1.416 -11.435 22.189 1.00 12.14 C ATOM 831 O ASN A 53 -0.705 -10.748 21.455 1.00 11.55 O ATOM 832 CB ASN A 53 -2.366 -13.722 21.833 1.00 44.13 C ATOM 833 CG ASN A 53 -3.410 -14.569 21.131 1.00 44.32 C ATOM 834 OD1 ASN A 53 -3.176 -15.079 20.035 1.00 35.20 O ATOM 835 ND2 ASN A 53 -4.569 -14.721 21.761 1.00 65.42 N ATOM 0 H ASN A 53 -2.214 -12.501 19.581 1.00 33.32 H new ATOM 0 HA ASN A 53 -3.497 -11.923 22.156 1.00 60.43 H new ATOM 0 HB2 ASN A 53 -1.376 -13.991 21.464 1.00 44.13 H new ATOM 0 HB3 ASN A 53 -2.380 -13.944 22.900 1.00 44.13 H new ATOM 0 HD21 ASN A 53 -5.310 -15.279 21.338 1.00 65.42 H new ATOM 0 HD22 ASN A 53 -4.718 -14.279 22.668 1.00 65.42 H new ATOM 842 N THR A 54 -1.215 -11.539 23.499 1.00 23.24 N ATOM 843 CA THR A 54 -0.124 -10.836 24.163 1.00 32.33 C ATOM 844 C THR A 54 1.214 -11.150 23.504 1.00 50.41 C ATOM 845 O THR A 54 1.979 -10.245 23.170 1.00 50.31 O ATOM 846 CB THR A 54 -0.046 -11.204 25.657 1.00 11.21 C ATOM 847 OG1 THR A 54 -0.940 -12.286 25.943 1.00 45.31 O ATOM 848 CG2 THR A 54 -0.396 -10.007 26.528 1.00 54.41 C ATOM 0 H THR A 54 -1.794 -12.103 24.121 1.00 23.24 H new ATOM 0 HA THR A 54 -0.331 -9.770 24.069 1.00 32.33 H new ATOM 0 HB THR A 54 0.976 -11.509 25.880 1.00 11.21 H new ATOM 0 HG1 THR A 54 -0.883 -12.515 26.894 1.00 45.31 H new ATOM 0 HG21 THR A 54 -0.334 -10.291 27.579 1.00 54.41 H new ATOM 0 HG22 THR A 54 0.304 -9.196 26.330 1.00 54.41 H new ATOM 0 HG23 THR A 54 -1.409 -9.676 26.301 1.00 54.41 H new ATOM 856 N ARG A 55 1.490 -12.436 23.319 1.00 63.33 N ATOM 857 CA ARG A 55 2.737 -12.869 22.699 1.00 3.52 C ATOM 858 C ARG A 55 2.965 -12.146 21.375 1.00 45.21 C ATOM 859 O ARG A 55 4.006 -11.521 21.169 1.00 51.23 O ATOM 860 CB ARG A 55 2.721 -14.381 22.471 1.00 74.12 C ATOM 861 CG ARG A 55 4.098 -14.975 22.225 1.00 71.05 C ATOM 862 CD ARG A 55 4.095 -16.484 22.412 1.00 63.13 C ATOM 863 NE ARG A 55 5.439 -17.049 22.325 1.00 44.31 N ATOM 864 CZ ARG A 55 6.359 -16.906 23.273 1.00 41.24 C ATOM 865 NH1 ARG A 55 6.081 -16.221 24.373 1.00 11.31 N ATOM 866 NH2 ARG A 55 7.560 -17.449 23.121 1.00 60.42 N ATOM 0 H ARG A 55 0.867 -13.197 23.589 1.00 63.33 H new ATOM 0 HA ARG A 55 3.555 -12.620 23.375 1.00 3.52 H new ATOM 0 HB2 ARG A 55 2.275 -14.866 23.339 1.00 74.12 H new ATOM 0 HB3 ARG A 55 2.081 -14.604 21.618 1.00 74.12 H new ATOM 0 HG2 ARG A 55 4.424 -14.733 21.213 1.00 71.05 H new ATOM 0 HG3 ARG A 55 4.817 -14.524 22.908 1.00 71.05 H new ATOM 0 HD2 ARG A 55 3.661 -16.728 23.382 1.00 63.13 H new ATOM 0 HD3 ARG A 55 3.459 -16.942 21.654 1.00 63.13 H new ATOM 0 HE ARG A 55 5.685 -17.582 21.491 1.00 44.31 H new ATOM 0 HH11 ARG A 55 5.159 -15.802 24.493 1.00 11.31 H new ATOM 0 HH12 ARG A 55 6.789 -16.113 25.099 1.00 11.31 H new ATOM 0 HH21 ARG A 55 7.778 -17.977 22.276 1.00 60.42 H new ATOM 0 HH22 ARG A 55 8.266 -17.339 23.849 1.00 60.42 H new ATOM 880 N ARG A 56 1.986 -12.236 20.481 1.00 63.52 N ATOM 881 CA ARG A 56 2.081 -11.593 19.176 1.00 21.00 C ATOM 882 C ARG A 56 2.400 -10.108 19.324 1.00 63.20 C ATOM 883 O ARG A 56 3.202 -9.556 18.570 1.00 73.01 O ATOM 884 CB ARG A 56 0.774 -11.770 18.400 1.00 4.24 C ATOM 885 CG ARG A 56 0.513 -13.203 17.966 1.00 43.34 C ATOM 886 CD ARG A 56 1.631 -13.728 17.078 1.00 53.22 C ATOM 887 NE ARG A 56 2.615 -14.498 17.834 1.00 14.21 N ATOM 888 CZ ARG A 56 2.418 -15.749 18.235 1.00 43.02 C ATOM 889 NH1 ARG A 56 1.281 -16.368 17.952 1.00 35.24 N ATOM 890 NH2 ARG A 56 3.362 -16.383 18.919 1.00 33.51 N ATOM 0 H ARG A 56 1.118 -12.748 20.637 1.00 63.52 H new ATOM 0 HA ARG A 56 2.891 -12.068 18.623 1.00 21.00 H new ATOM 0 HB2 ARG A 56 -0.056 -11.430 19.020 1.00 4.24 H new ATOM 0 HB3 ARG A 56 0.796 -11.130 17.518 1.00 4.24 H new ATOM 0 HG2 ARG A 56 0.416 -13.839 18.846 1.00 43.34 H new ATOM 0 HG3 ARG A 56 -0.434 -13.255 17.429 1.00 43.34 H new ATOM 0 HD2 ARG A 56 1.207 -14.354 16.293 1.00 53.22 H new ATOM 0 HD3 ARG A 56 2.126 -12.891 16.586 1.00 53.22 H new ATOM 0 HE ARG A 56 3.502 -14.051 18.067 1.00 14.21 H new ATOM 0 HH11 ARG A 56 0.554 -15.884 17.425 1.00 35.24 H new ATOM 0 HH12 ARG A 56 1.133 -17.329 18.261 1.00 35.24 H new ATOM 0 HH21 ARG A 56 4.239 -15.910 19.137 1.00 33.51 H new ATOM 0 HH22 ARG A 56 3.211 -17.344 19.227 1.00 33.51 H new ATOM 904 N LYS A 57 1.768 -9.467 20.300 1.00 15.25 N ATOM 905 CA LYS A 57 1.984 -8.046 20.549 1.00 35.41 C ATOM 906 C LYS A 57 3.411 -7.788 21.022 1.00 54.45 C ATOM 907 O LYS A 57 4.108 -6.928 20.481 1.00 11.23 O ATOM 908 CB LYS A 57 0.989 -7.533 21.593 1.00 74.24 C ATOM 909 CG LYS A 57 -0.457 -7.875 21.275 1.00 63.32 C ATOM 910 CD LYS A 57 -1.287 -6.625 21.037 1.00 5.21 C ATOM 911 CE LYS A 57 -2.760 -6.958 20.865 1.00 35.30 C ATOM 912 NZ LYS A 57 -3.624 -6.126 21.748 1.00 72.04 N ATOM 0 H LYS A 57 1.101 -9.909 20.933 1.00 15.25 H new ATOM 0 HA LYS A 57 1.827 -7.510 19.613 1.00 35.41 H new ATOM 0 HB2 LYS A 57 1.247 -7.952 22.566 1.00 74.24 H new ATOM 0 HB3 LYS A 57 1.088 -6.451 21.676 1.00 74.24 H new ATOM 0 HG2 LYS A 57 -0.495 -8.512 20.391 1.00 63.32 H new ATOM 0 HG3 LYS A 57 -0.886 -8.446 22.098 1.00 63.32 H new ATOM 0 HD2 LYS A 57 -1.163 -5.940 21.876 1.00 5.21 H new ATOM 0 HD3 LYS A 57 -0.923 -6.109 20.148 1.00 5.21 H new ATOM 0 HE2 LYS A 57 -3.048 -6.804 19.825 1.00 35.30 H new ATOM 0 HE3 LYS A 57 -2.922 -8.013 21.088 1.00 35.30 H new ATOM 0 HZ1 LYS A 57 -4.621 -6.383 21.601 1.00 72.04 H new ATOM 0 HZ2 LYS A 57 -3.367 -6.292 22.742 1.00 72.04 H new ATOM 0 HZ3 LYS A 57 -3.489 -5.121 21.519 1.00 72.04 H new ATOM 926 N LEU A 58 3.840 -8.537 22.031 1.00 14.31 N ATOM 927 CA LEU A 58 5.185 -8.389 22.575 1.00 21.44 C ATOM 928 C LEU A 58 6.231 -8.454 21.467 1.00 30.50 C ATOM 929 O LEU A 58 7.166 -7.654 21.433 1.00 2.44 O ATOM 930 CB LEU A 58 5.458 -9.478 23.615 1.00 62.24 C ATOM 931 CG LEU A 58 6.791 -9.378 24.357 1.00 62.20 C ATOM 932 CD1 LEU A 58 7.918 -9.948 23.510 1.00 61.42 C ATOM 933 CD2 LEU A 58 7.084 -7.934 24.735 1.00 42.51 C ATOM 0 H LEU A 58 3.276 -9.253 22.489 1.00 14.31 H new ATOM 0 HA LEU A 58 5.251 -7.412 23.054 1.00 21.44 H new ATOM 0 HB2 LEU A 58 4.654 -9.460 24.350 1.00 62.24 H new ATOM 0 HB3 LEU A 58 5.414 -10.447 23.118 1.00 62.24 H new ATOM 0 HG LEU A 58 6.720 -9.965 25.273 1.00 62.20 H new ATOM 0 HD11 LEU A 58 8.859 -9.868 24.055 1.00 61.42 H new ATOM 0 HD12 LEU A 58 7.714 -10.996 23.290 1.00 61.42 H new ATOM 0 HD13 LEU A 58 7.990 -9.389 22.577 1.00 61.42 H new ATOM 0 HD21 LEU A 58 8.037 -7.882 25.262 1.00 42.51 H new ATOM 0 HD22 LEU A 58 7.135 -7.325 23.833 1.00 42.51 H new ATOM 0 HD23 LEU A 58 6.291 -7.559 25.381 1.00 42.51 H new ATOM 945 N LEU A 59 6.066 -9.411 20.560 1.00 32.35 N ATOM 946 CA LEU A 59 6.994 -9.580 19.448 1.00 5.11 C ATOM 947 C LEU A 59 6.910 -8.400 18.485 1.00 64.10 C ATOM 948 O LEU A 59 7.930 -7.844 18.078 1.00 75.35 O ATOM 949 CB LEU A 59 6.698 -10.883 18.704 1.00 41.24 C ATOM 950 CG LEU A 59 6.820 -12.167 19.524 1.00 61.40 C ATOM 951 CD1 LEU A 59 6.619 -13.387 18.639 1.00 63.44 C ATOM 952 CD2 LEU A 59 8.171 -12.229 20.221 1.00 5.40 C ATOM 0 H LEU A 59 5.298 -10.082 20.573 1.00 32.35 H new ATOM 0 HA LEU A 59 8.005 -9.623 19.854 1.00 5.11 H new ATOM 0 HB2 LEU A 59 5.686 -10.827 18.303 1.00 41.24 H new ATOM 0 HB3 LEU A 59 7.375 -10.954 17.853 1.00 41.24 H new ATOM 0 HG LEU A 59 6.040 -12.164 20.286 1.00 61.40 H new ATOM 0 HD11 LEU A 59 6.709 -14.292 19.240 1.00 63.44 H new ATOM 0 HD12 LEU A 59 5.628 -13.349 18.187 1.00 63.44 H new ATOM 0 HD13 LEU A 59 7.375 -13.396 17.854 1.00 63.44 H new ATOM 0 HD21 LEU A 59 8.240 -13.150 20.800 1.00 5.40 H new ATOM 0 HD22 LEU A 59 8.966 -12.209 19.476 1.00 5.40 H new ATOM 0 HD23 LEU A 59 8.276 -11.373 20.887 1.00 5.40 H new ATOM 964 N GLY A 60 5.687 -8.021 18.126 1.00 23.32 N ATOM 965 CA GLY A 60 5.493 -6.908 17.216 1.00 74.34 C ATOM 966 C GLY A 60 6.204 -5.651 17.676 1.00 60.42 C ATOM 967 O GLY A 60 6.814 -4.945 16.872 1.00 1.42 O ATOM 0 H GLY A 60 4.828 -8.465 18.449 1.00 23.32 H new ATOM 0 HA2 GLY A 60 5.856 -7.185 16.226 1.00 74.34 H new ATOM 0 HA3 GLY A 60 4.427 -6.704 17.119 1.00 74.34 H new ATOM 971 N LEU A 61 6.126 -5.370 18.972 1.00 55.04 N ATOM 972 CA LEU A 61 6.766 -4.188 19.538 1.00 10.01 C ATOM 973 C LEU A 61 8.267 -4.199 19.266 1.00 52.30 C ATOM 974 O LEU A 61 8.831 -3.208 18.801 1.00 52.03 O ATOM 975 CB LEU A 61 6.510 -4.117 21.044 1.00 33.35 C ATOM 976 CG LEU A 61 6.400 -2.714 21.642 1.00 41.14 C ATOM 977 CD1 LEU A 61 6.325 -2.784 23.159 1.00 52.21 C ATOM 978 CD2 LEU A 61 7.577 -1.854 21.203 1.00 31.42 C ATOM 0 H LEU A 61 5.626 -5.944 19.650 1.00 55.04 H new ATOM 0 HA LEU A 61 6.335 -3.308 19.061 1.00 10.01 H new ATOM 0 HB2 LEU A 61 5.588 -4.656 21.261 1.00 33.35 H new ATOM 0 HB3 LEU A 61 7.315 -4.645 21.554 1.00 33.35 H new ATOM 0 HG LEU A 61 5.482 -2.254 21.275 1.00 41.14 H new ATOM 0 HD11 LEU A 61 6.247 -1.776 23.566 1.00 52.21 H new ATOM 0 HD12 LEU A 61 5.450 -3.363 23.454 1.00 52.21 H new ATOM 0 HD13 LEU A 61 7.224 -3.263 23.546 1.00 52.21 H new ATOM 0 HD21 LEU A 61 7.483 -0.859 21.638 1.00 31.42 H new ATOM 0 HD22 LEU A 61 8.507 -2.311 21.541 1.00 31.42 H new ATOM 0 HD23 LEU A 61 7.585 -1.776 20.116 1.00 31.42 H new ATOM 990 N TYR A 62 8.907 -5.325 19.557 1.00 24.31 N ATOM 991 CA TYR A 62 10.343 -5.465 19.344 1.00 30.21 C ATOM 992 C TYR A 62 10.685 -5.371 17.860 1.00 4.44 C ATOM 993 O TYR A 62 11.765 -4.909 17.488 1.00 22.33 O ATOM 994 CB TYR A 62 10.836 -6.799 19.909 1.00 50.43 C ATOM 995 CG TYR A 62 11.198 -6.738 21.376 1.00 72.55 C ATOM 996 CD1 TYR A 62 12.319 -6.039 21.806 1.00 34.24 C ATOM 997 CD2 TYR A 62 10.420 -7.381 22.330 1.00 32.43 C ATOM 998 CE1 TYR A 62 12.654 -5.982 23.146 1.00 54.05 C ATOM 999 CE2 TYR A 62 10.746 -7.328 23.671 1.00 23.25 C ATOM 1000 CZ TYR A 62 11.864 -6.628 24.074 1.00 1.41 C ATOM 1001 OH TYR A 62 12.194 -6.574 25.409 1.00 15.51 O ATOM 0 H TYR A 62 8.455 -6.155 19.941 1.00 24.31 H new ATOM 0 HA TYR A 62 10.843 -4.650 19.866 1.00 30.21 H new ATOM 0 HB2 TYR A 62 10.062 -7.553 19.765 1.00 50.43 H new ATOM 0 HB3 TYR A 62 11.708 -7.125 19.341 1.00 50.43 H new ATOM 0 HD1 TYR A 62 12.939 -5.532 21.082 1.00 34.24 H new ATOM 0 HD2 TYR A 62 9.545 -7.932 22.018 1.00 32.43 H new ATOM 0 HE1 TYR A 62 13.529 -5.435 23.464 1.00 54.05 H new ATOM 0 HE2 TYR A 62 10.129 -7.832 24.400 1.00 23.25 H new ATOM 0 HH TYR A 62 11.535 -7.080 25.930 1.00 15.51 H new ATOM 1011 N LEU A 63 9.758 -5.810 17.017 1.00 60.10 N ATOM 1012 CA LEU A 63 9.959 -5.775 15.573 1.00 62.15 C ATOM 1013 C LEU A 63 10.037 -4.338 15.068 1.00 4.32 C ATOM 1014 O LEU A 63 11.008 -3.949 14.420 1.00 64.24 O ATOM 1015 CB LEU A 63 8.825 -6.516 14.862 1.00 63.13 C ATOM 1016 CG LEU A 63 9.100 -6.936 13.417 1.00 31.44 C ATOM 1017 CD1 LEU A 63 9.846 -8.261 13.380 1.00 43.13 C ATOM 1018 CD2 LEU A 63 7.799 -7.033 12.634 1.00 42.35 C ATOM 0 H LEU A 63 8.859 -6.195 17.308 1.00 60.10 H new ATOM 0 HA LEU A 63 10.904 -6.270 15.351 1.00 62.15 H new ATOM 0 HB2 LEU A 63 8.583 -7.409 15.439 1.00 63.13 H new ATOM 0 HB3 LEU A 63 7.940 -5.880 14.872 1.00 63.13 H new ATOM 0 HG LEU A 63 9.727 -6.176 12.950 1.00 31.44 H new ATOM 0 HD11 LEU A 63 10.033 -8.544 12.344 1.00 43.13 H new ATOM 0 HD12 LEU A 63 10.795 -8.159 13.905 1.00 43.13 H new ATOM 0 HD13 LEU A 63 9.245 -9.031 13.864 1.00 43.13 H new ATOM 0 HD21 LEU A 63 8.013 -7.333 11.608 1.00 42.35 H new ATOM 0 HD22 LEU A 63 7.148 -7.773 13.100 1.00 42.35 H new ATOM 0 HD23 LEU A 63 7.302 -6.063 12.632 1.00 42.35 H new ATOM 1030 N MET A 64 9.009 -3.553 15.373 1.00 43.53 N ATOM 1031 CA MET A 64 8.964 -2.157 14.953 1.00 13.30 C ATOM 1032 C MET A 64 10.084 -1.355 15.608 1.00 32.05 C ATOM 1033 O MET A 64 10.595 -0.398 15.029 1.00 11.54 O ATOM 1034 CB MET A 64 7.608 -1.541 15.303 1.00 53.31 C ATOM 1035 CG MET A 64 7.508 -1.070 16.745 1.00 72.31 C ATOM 1036 SD MET A 64 7.921 0.674 16.937 1.00 51.44 S ATOM 1037 CE MET A 64 7.160 1.031 18.519 1.00 63.54 C ATOM 0 H MET A 64 8.197 -3.859 15.909 1.00 43.53 H new ATOM 0 HA MET A 64 9.102 -2.124 13.872 1.00 13.30 H new ATOM 0 HB2 MET A 64 7.420 -0.697 14.640 1.00 53.31 H new ATOM 0 HB3 MET A 64 6.825 -2.275 15.114 1.00 53.31 H new ATOM 0 HG2 MET A 64 6.495 -1.242 17.110 1.00 72.31 H new ATOM 0 HG3 MET A 64 8.176 -1.668 17.365 1.00 72.31 H new ATOM 0 HE1 MET A 64 7.314 2.081 18.768 1.00 63.54 H new ATOM 0 HE2 MET A 64 6.091 0.824 18.464 1.00 63.54 H new ATOM 0 HE3 MET A 64 7.611 0.405 19.289 1.00 63.54 H new ATOM 1047 N ASN A 65 10.460 -1.753 16.820 1.00 71.05 N ATOM 1048 CA ASN A 65 11.519 -1.070 17.554 1.00 61.43 C ATOM 1049 C ASN A 65 12.885 -1.375 16.947 1.00 42.04 C ATOM 1050 O ASN A 65 13.782 -0.531 16.954 1.00 60.12 O ATOM 1051 CB ASN A 65 11.498 -1.487 19.026 1.00 63.43 C ATOM 1052 CG ASN A 65 12.047 -0.409 19.940 1.00 70.01 C ATOM 1053 OD1 ASN A 65 12.194 0.745 19.538 1.00 43.30 O ATOM 1054 ND2 ASN A 65 12.353 -0.782 21.177 1.00 12.22 N ATOM 0 H ASN A 65 10.047 -2.544 17.314 1.00 71.05 H new ATOM 0 HA ASN A 65 11.342 0.003 17.485 1.00 61.43 H new ATOM 0 HB2 ASN A 65 10.475 -1.722 19.320 1.00 63.43 H new ATOM 0 HB3 ASN A 65 12.083 -2.398 19.151 1.00 63.43 H new ATOM 0 HD21 ASN A 65 12.727 -0.100 21.838 1.00 12.22 H new ATOM 0 HD22 ASN A 65 12.214 -1.750 21.467 1.00 12.22 H new ATOM 1061 N HIS A 66 13.036 -2.587 16.421 1.00 43.52 N ATOM 1062 CA HIS A 66 14.293 -3.003 15.808 1.00 52.30 C ATOM 1063 C HIS A 66 14.492 -2.319 14.459 1.00 50.42 C ATOM 1064 O HIS A 66 15.585 -1.846 14.146 1.00 70.40 O ATOM 1065 CB HIS A 66 14.320 -4.521 15.632 1.00 64.20 C ATOM 1066 CG HIS A 66 15.703 -5.088 15.538 1.00 24.31 C ATOM 1067 ND1 HIS A 66 16.450 -5.438 16.643 1.00 20.23 N ATOM 1068 CD2 HIS A 66 16.475 -5.367 14.461 1.00 34.52 C ATOM 1069 CE1 HIS A 66 17.621 -5.906 16.251 1.00 62.45 C ATOM 1070 NE2 HIS A 66 17.661 -5.875 14.931 1.00 42.43 N ATOM 0 H HIS A 66 12.304 -3.297 16.407 1.00 43.52 H new ATOM 0 HA HIS A 66 15.107 -2.707 16.469 1.00 52.30 H new ATOM 0 HB2 HIS A 66 13.802 -4.985 16.471 1.00 64.20 H new ATOM 0 HB3 HIS A 66 13.766 -4.784 14.731 1.00 64.20 H new ATOM 0 HD2 HIS A 66 16.208 -5.218 13.425 1.00 34.52 H new ATOM 0 HE1 HIS A 66 18.411 -6.255 16.899 1.00 62.45 H new ATOM 0 HE2 HIS A 66 18.446 -6.179 14.354 1.00 42.43 H new ATOM 1078 N VAL A 67 13.429 -2.270 13.663 1.00 55.33 N ATOM 1079 CA VAL A 67 13.486 -1.643 12.347 1.00 24.44 C ATOM 1080 C VAL A 67 13.729 -0.143 12.463 1.00 10.24 C ATOM 1081 O VAL A 67 14.535 0.426 11.727 1.00 71.34 O ATOM 1082 CB VAL A 67 12.188 -1.883 11.554 1.00 11.42 C ATOM 1083 CG1 VAL A 67 10.982 -1.405 12.348 1.00 55.52 C ATOM 1084 CG2 VAL A 67 12.255 -1.190 10.202 1.00 41.15 C ATOM 0 H VAL A 67 12.517 -2.657 13.906 1.00 55.33 H new ATOM 0 HA VAL A 67 14.318 -2.102 11.813 1.00 24.44 H new ATOM 0 HB VAL A 67 12.079 -2.954 11.383 1.00 11.42 H new ATOM 0 HG11 VAL A 67 10.074 -1.582 11.772 1.00 55.52 H new ATOM 0 HG12 VAL A 67 10.927 -1.951 13.290 1.00 55.52 H new ATOM 0 HG13 VAL A 67 11.080 -0.339 12.552 1.00 55.52 H new ATOM 0 HG21 VAL A 67 11.330 -1.370 9.655 1.00 41.15 H new ATOM 0 HG22 VAL A 67 12.387 -0.118 10.349 1.00 41.15 H new ATOM 0 HG23 VAL A 67 13.096 -1.585 9.632 1.00 41.15 H new ATOM 1094 N VAL A 68 13.026 0.495 13.395 1.00 62.54 N ATOM 1095 CA VAL A 68 13.166 1.930 13.609 1.00 20.11 C ATOM 1096 C VAL A 68 14.522 2.265 14.221 1.00 71.44 C ATOM 1097 O VAL A 68 15.119 3.293 13.904 1.00 12.22 O ATOM 1098 CB VAL A 68 12.054 2.471 14.527 1.00 54.23 C ATOM 1099 CG1 VAL A 68 10.685 2.224 13.910 1.00 22.22 C ATOM 1100 CG2 VAL A 68 12.148 1.839 15.907 1.00 13.22 C ATOM 0 H VAL A 68 12.354 0.040 14.013 1.00 62.54 H new ATOM 0 HA VAL A 68 13.084 2.405 12.631 1.00 20.11 H new ATOM 0 HB VAL A 68 12.188 3.547 14.636 1.00 54.23 H new ATOM 0 HG11 VAL A 68 9.912 2.613 14.573 1.00 22.22 H new ATOM 0 HG12 VAL A 68 10.624 2.729 12.946 1.00 22.22 H new ATOM 0 HG13 VAL A 68 10.537 1.153 13.769 1.00 22.22 H new ATOM 0 HG21 VAL A 68 11.355 2.233 16.542 1.00 13.22 H new ATOM 0 HG22 VAL A 68 12.040 0.758 15.820 1.00 13.22 H new ATOM 0 HG23 VAL A 68 13.117 2.073 16.349 1.00 13.22 H new ATOM 1110 N GLN A 69 15.002 1.389 15.097 1.00 30.33 N ATOM 1111 CA GLN A 69 16.288 1.592 15.753 1.00 1.15 C ATOM 1112 C GLN A 69 17.424 1.596 14.736 1.00 51.24 C ATOM 1113 O GLN A 69 18.300 2.460 14.774 1.00 71.44 O ATOM 1114 CB GLN A 69 16.529 0.502 16.799 1.00 11.25 C ATOM 1115 CG GLN A 69 16.023 0.867 18.186 1.00 44.31 C ATOM 1116 CD GLN A 69 16.194 -0.260 19.185 1.00 73.22 C ATOM 1117 OE1 GLN A 69 15.236 -0.395 20.095 1.00 22.43 O flip ATOM 1118 NE2 GLN A 69 17.175 -1.002 19.139 1.00 3.31 N flip ATOM 0 H GLN A 69 14.520 0.532 15.369 1.00 30.33 H new ATOM 0 HA GLN A 69 16.265 2.563 16.248 1.00 1.15 H new ATOM 0 HB2 GLN A 69 16.041 -0.417 16.473 1.00 11.25 H new ATOM 0 HB3 GLN A 69 17.597 0.293 16.854 1.00 11.25 H new ATOM 0 HG2 GLN A 69 16.557 1.748 18.543 1.00 44.31 H new ATOM 0 HG3 GLN A 69 14.969 1.136 18.125 1.00 44.31 H new ATOM 0 HE21 GLN A 69 17.887 -0.862 18.422 1.00 3.31 H new ATOM 0 HE22 GLN A 69 17.276 -1.757 19.817 1.00 3.31 H new ATOM 1127 N GLN A 70 17.402 0.626 13.828 1.00 73.24 N ATOM 1128 CA GLN A 70 18.431 0.518 12.800 1.00 31.14 C ATOM 1129 C GLN A 70 18.245 1.587 11.729 1.00 11.30 C ATOM 1130 O GLN A 70 19.213 2.054 11.129 1.00 30.23 O ATOM 1131 CB GLN A 70 18.400 -0.872 12.162 1.00 52.45 C ATOM 1132 CG GLN A 70 19.139 -1.928 12.967 1.00 60.13 C ATOM 1133 CD GLN A 70 20.610 -2.009 12.611 1.00 24.31 C ATOM 1134 OE1 GLN A 70 21.477 -1.710 13.433 1.00 1.20 O ATOM 1135 NE2 GLN A 70 20.901 -2.416 11.381 1.00 71.31 N ATOM 0 H GLN A 70 16.683 -0.096 13.783 1.00 73.24 H new ATOM 0 HA GLN A 70 19.400 0.671 13.274 1.00 31.14 H new ATOM 0 HB2 GLN A 70 17.363 -1.182 12.037 1.00 52.45 H new ATOM 0 HB3 GLN A 70 18.838 -0.815 11.165 1.00 52.45 H new ATOM 0 HG2 GLN A 70 19.038 -1.706 14.029 1.00 60.13 H new ATOM 0 HG3 GLN A 70 18.674 -2.899 12.798 1.00 60.13 H new ATOM 0 HE21 GLN A 70 20.151 -2.654 10.732 1.00 71.31 H new ATOM 0 HE22 GLN A 70 21.874 -2.491 11.085 1.00 71.31 H new ATOM 1144 N ALA A 71 16.994 1.971 11.494 1.00 64.14 N ATOM 1145 CA ALA A 71 16.682 2.986 10.496 1.00 51.42 C ATOM 1146 C ALA A 71 17.521 4.242 10.708 1.00 24.43 C ATOM 1147 O ALA A 71 17.841 4.956 9.758 1.00 54.21 O ATOM 1148 CB ALA A 71 15.200 3.327 10.536 1.00 13.51 C ATOM 0 H ALA A 71 16.181 1.594 11.981 1.00 64.14 H new ATOM 0 HA ALA A 71 16.925 2.580 9.514 1.00 51.42 H new ATOM 0 HB1 ALA A 71 14.981 4.086 9.785 1.00 13.51 H new ATOM 0 HB2 ALA A 71 14.615 2.431 10.328 1.00 13.51 H new ATOM 0 HB3 ALA A 71 14.941 3.708 11.524 1.00 13.51 H new ATOM 1154 N LYS A 72 17.876 4.505 11.961 1.00 1.34 N ATOM 1155 CA LYS A 72 18.679 5.674 12.300 1.00 43.21 C ATOM 1156 C LYS A 72 19.982 5.687 11.507 1.00 42.22 C ATOM 1157 O LYS A 72 20.448 6.742 11.077 1.00 72.54 O ATOM 1158 CB LYS A 72 18.983 5.693 13.800 1.00 54.23 C ATOM 1159 CG LYS A 72 17.898 6.356 14.631 1.00 2.52 C ATOM 1160 CD LYS A 72 18.134 7.852 14.765 1.00 23.51 C ATOM 1161 CE LYS A 72 19.039 8.169 15.946 1.00 14.41 C ATOM 1162 NZ LYS A 72 20.478 8.132 15.568 1.00 65.01 N ATOM 0 H LYS A 72 17.620 3.924 12.759 1.00 1.34 H new ATOM 0 HA LYS A 72 18.106 6.564 12.040 1.00 43.21 H new ATOM 0 HB2 LYS A 72 19.121 4.669 14.147 1.00 54.23 H new ATOM 0 HB3 LYS A 72 19.926 6.215 13.965 1.00 54.23 H new ATOM 0 HG2 LYS A 72 16.926 6.180 14.170 1.00 2.52 H new ATOM 0 HG3 LYS A 72 17.868 5.901 15.621 1.00 2.52 H new ATOM 0 HD2 LYS A 72 18.583 8.234 13.848 1.00 23.51 H new ATOM 0 HD3 LYS A 72 17.179 8.363 14.889 1.00 23.51 H new ATOM 0 HE2 LYS A 72 18.792 9.156 16.338 1.00 14.41 H new ATOM 0 HE3 LYS A 72 18.855 7.453 16.747 1.00 14.41 H new ATOM 0 HZ1 LYS A 72 21.016 8.774 16.185 1.00 65.01 H new ATOM 0 HZ2 LYS A 72 20.841 7.163 15.676 1.00 65.01 H new ATOM 0 HZ3 LYS A 72 20.585 8.433 14.578 1.00 65.01 H new ATOM 1176 N GLY A 73 20.566 4.508 11.316 1.00 74.31 N ATOM 1177 CA GLY A 73 21.808 4.406 10.574 1.00 44.35 C ATOM 1178 C GLY A 73 21.591 4.420 9.074 1.00 54.15 C ATOM 1179 O GLY A 73 22.487 4.785 8.314 1.00 42.22 O ATOM 0 H GLY A 73 20.200 3.621 11.662 1.00 74.31 H new ATOM 0 HA2 GLY A 73 22.462 5.233 10.851 1.00 44.35 H new ATOM 0 HA3 GLY A 73 22.321 3.486 10.855 1.00 44.35 H new ATOM 1183 N GLN A 74 20.397 4.020 8.647 1.00 42.03 N ATOM 1184 CA GLN A 74 20.066 3.986 7.227 1.00 22.11 C ATOM 1185 C GLN A 74 19.489 5.322 6.770 1.00 20.34 C ATOM 1186 O GLN A 74 18.996 5.447 5.649 1.00 24.30 O ATOM 1187 CB GLN A 74 19.069 2.862 6.941 1.00 21.42 C ATOM 1188 CG GLN A 74 19.722 1.501 6.759 1.00 22.01 C ATOM 1189 CD GLN A 74 20.671 1.153 7.889 1.00 32.02 C ATOM 1190 OE1 GLN A 74 21.877 1.380 7.795 1.00 43.43 O ATOM 1191 NE2 GLN A 74 20.129 0.598 8.967 1.00 3.13 N ATOM 0 H GLN A 74 19.644 3.715 9.263 1.00 42.03 H new ATOM 0 HA GLN A 74 20.984 3.798 6.670 1.00 22.11 H new ATOM 0 HB2 GLN A 74 18.353 2.805 7.761 1.00 21.42 H new ATOM 0 HB3 GLN A 74 18.505 3.108 6.041 1.00 21.42 H new ATOM 0 HG2 GLN A 74 18.948 0.737 6.692 1.00 22.01 H new ATOM 0 HG3 GLN A 74 20.267 1.487 5.815 1.00 22.01 H new ATOM 0 HE21 GLN A 74 19.124 0.428 9.002 1.00 3.13 H new ATOM 0 HE22 GLN A 74 20.718 0.342 9.760 1.00 3.13 H new ATOM 1200 N LYS A 75 19.553 6.319 7.647 1.00 72.54 N ATOM 1201 CA LYS A 75 19.038 7.646 7.334 1.00 13.43 C ATOM 1202 C LYS A 75 17.560 7.583 6.961 1.00 21.20 C ATOM 1203 O LYS A 75 17.149 8.105 5.924 1.00 25.11 O ATOM 1204 CB LYS A 75 19.838 8.270 6.188 1.00 32.24 C ATOM 1205 CG LYS A 75 21.158 8.878 6.629 1.00 51.31 C ATOM 1206 CD LYS A 75 22.288 7.864 6.567 1.00 53.13 C ATOM 1207 CE LYS A 75 23.645 8.532 6.723 1.00 23.22 C ATOM 1208 NZ LYS A 75 23.840 9.078 8.095 1.00 52.33 N ATOM 0 H LYS A 75 19.957 6.232 8.580 1.00 72.54 H new ATOM 0 HA LYS A 75 19.144 8.267 8.223 1.00 13.43 H new ATOM 0 HB2 LYS A 75 20.033 7.507 5.434 1.00 32.24 H new ATOM 0 HB3 LYS A 75 19.233 9.042 5.712 1.00 32.24 H new ATOM 0 HG2 LYS A 75 21.397 9.730 5.993 1.00 51.31 H new ATOM 0 HG3 LYS A 75 21.063 9.257 7.647 1.00 51.31 H new ATOM 0 HD2 LYS A 75 22.155 7.121 7.353 1.00 53.13 H new ATOM 0 HD3 LYS A 75 22.250 7.333 5.616 1.00 53.13 H new ATOM 0 HE2 LYS A 75 24.432 7.811 6.504 1.00 23.22 H new ATOM 0 HE3 LYS A 75 23.739 9.338 5.995 1.00 23.22 H new ATOM 0 HZ1 LYS A 75 24.777 9.525 8.161 1.00 52.33 H new ATOM 0 HZ2 LYS A 75 23.104 9.785 8.295 1.00 52.33 H new ATOM 0 HZ3 LYS A 75 23.776 8.306 8.788 1.00 52.33 H new ATOM 1222 N ILE A 76 16.766 6.942 7.812 1.00 25.04 N ATOM 1223 CA ILE A 76 15.335 6.813 7.572 1.00 15.43 C ATOM 1224 C ILE A 76 14.530 7.566 8.627 1.00 25.43 C ATOM 1225 O ILE A 76 14.502 7.176 9.795 1.00 72.41 O ATOM 1226 CB ILE A 76 14.895 5.337 7.564 1.00 4.22 C ATOM 1227 CG1 ILE A 76 15.915 4.483 6.808 1.00 2.21 C ATOM 1228 CG2 ILE A 76 13.515 5.199 6.941 1.00 75.12 C ATOM 1229 CD1 ILE A 76 16.149 4.940 5.385 1.00 21.11 C ATOM 0 H ILE A 76 17.090 6.504 8.674 1.00 25.04 H new ATOM 0 HA ILE A 76 15.140 7.247 6.591 1.00 15.43 H new ATOM 0 HB ILE A 76 14.844 4.983 8.593 1.00 4.22 H new ATOM 0 HG12 ILE A 76 16.862 4.500 7.347 1.00 2.21 H new ATOM 0 HG13 ILE A 76 15.573 3.448 6.797 1.00 2.21 H new ATOM 0 HG21 ILE A 76 13.218 4.150 6.943 1.00 75.12 H new ATOM 0 HG22 ILE A 76 12.796 5.781 7.518 1.00 75.12 H new ATOM 0 HG23 ILE A 76 13.540 5.567 5.915 1.00 75.12 H new ATOM 0 HD11 ILE A 76 16.883 4.289 4.910 1.00 21.11 H new ATOM 0 HD12 ILE A 76 15.212 4.896 4.830 1.00 21.11 H new ATOM 0 HD13 ILE A 76 16.521 5.965 5.388 1.00 21.11 H new ATOM 1241 N ILE A 77 13.877 8.644 8.208 1.00 45.11 N ATOM 1242 CA ILE A 77 13.070 9.449 9.116 1.00 3.12 C ATOM 1243 C ILE A 77 11.583 9.176 8.918 1.00 1.43 C ATOM 1244 O ILE A 77 10.768 9.467 9.793 1.00 33.30 O ATOM 1245 CB ILE A 77 13.335 10.954 8.922 1.00 62.35 C ATOM 1246 CG1 ILE A 77 14.838 11.238 8.955 1.00 64.55 C ATOM 1247 CG2 ILE A 77 12.615 11.761 9.991 1.00 54.01 C ATOM 1248 CD1 ILE A 77 15.491 10.885 10.273 1.00 62.44 C ATOM 0 H ILE A 77 13.891 8.980 7.245 1.00 45.11 H new ATOM 0 HA ILE A 77 13.357 9.166 10.129 1.00 3.12 H new ATOM 0 HB ILE A 77 12.949 11.253 7.947 1.00 62.35 H new ATOM 0 HG12 ILE A 77 15.323 10.677 8.157 1.00 64.55 H new ATOM 0 HG13 ILE A 77 15.004 12.295 8.748 1.00 64.55 H new ATOM 0 HG21 ILE A 77 12.812 12.822 9.840 1.00 54.01 H new ATOM 0 HG22 ILE A 77 11.543 11.578 9.924 1.00 54.01 H new ATOM 0 HG23 ILE A 77 12.973 11.462 10.976 1.00 54.01 H new ATOM 0 HD11 ILE A 77 16.556 11.113 10.224 1.00 62.44 H new ATOM 0 HD12 ILE A 77 15.032 11.466 11.073 1.00 62.44 H new ATOM 0 HD13 ILE A 77 15.356 9.822 10.473 1.00 62.44 H new ATOM 1260 N GLN A 78 11.238 8.615 7.764 1.00 44.43 N ATOM 1261 CA GLN A 78 9.849 8.302 7.452 1.00 51.42 C ATOM 1262 C GLN A 78 9.310 7.225 8.388 1.00 42.34 C ATOM 1263 O GLN A 78 8.135 7.237 8.754 1.00 53.45 O ATOM 1264 CB GLN A 78 9.721 7.842 5.999 1.00 45.34 C ATOM 1265 CG GLN A 78 9.869 8.969 4.989 1.00 60.24 C ATOM 1266 CD GLN A 78 11.317 9.270 4.658 1.00 5.31 C ATOM 1267 OE1 GLN A 78 12.053 8.401 4.190 1.00 43.22 O ATOM 1268 NE2 GLN A 78 11.735 10.507 4.901 1.00 42.35 N ATOM 0 H GLN A 78 11.901 8.368 7.030 1.00 44.43 H new ATOM 0 HA GLN A 78 9.259 9.208 7.592 1.00 51.42 H new ATOM 0 HB2 GLN A 78 10.478 7.084 5.799 1.00 45.34 H new ATOM 0 HB3 GLN A 78 8.750 7.367 5.861 1.00 45.34 H new ATOM 0 HG2 GLN A 78 9.339 8.704 4.074 1.00 60.24 H new ATOM 0 HG3 GLN A 78 9.396 9.869 5.382 1.00 60.24 H new ATOM 0 HE21 GLN A 78 11.091 11.196 5.289 1.00 42.35 H new ATOM 0 HE22 GLN A 78 12.700 10.768 4.699 1.00 42.35 H new ATOM 1277 N PHE A 79 10.177 6.294 8.771 1.00 4.34 N ATOM 1278 CA PHE A 79 9.788 5.209 9.664 1.00 63.41 C ATOM 1279 C PHE A 79 9.648 5.708 11.099 1.00 64.10 C ATOM 1280 O PHE A 79 8.708 5.343 11.804 1.00 23.04 O ATOM 1281 CB PHE A 79 10.817 4.077 9.604 1.00 53.24 C ATOM 1282 CG PHE A 79 10.419 2.954 8.689 1.00 31.35 C ATOM 1283 CD1 PHE A 79 9.199 2.315 8.845 1.00 2.12 C ATOM 1284 CD2 PHE A 79 11.264 2.537 7.674 1.00 24.42 C ATOM 1285 CE1 PHE A 79 8.831 1.281 8.006 1.00 63.51 C ATOM 1286 CE2 PHE A 79 10.902 1.503 6.831 1.00 33.24 C ATOM 1287 CZ PHE A 79 9.683 0.875 6.997 1.00 31.30 C ATOM 0 H PHE A 79 11.153 6.269 8.477 1.00 4.34 H new ATOM 0 HA PHE A 79 8.821 4.830 9.334 1.00 63.41 H new ATOM 0 HB2 PHE A 79 11.773 4.483 9.274 1.00 53.24 H new ATOM 0 HB3 PHE A 79 10.969 3.681 10.608 1.00 53.24 H new ATOM 0 HD1 PHE A 79 8.529 2.629 9.631 1.00 2.12 H new ATOM 0 HD2 PHE A 79 12.218 3.026 7.539 1.00 24.42 H new ATOM 0 HE1 PHE A 79 7.878 0.790 8.139 1.00 63.51 H new ATOM 0 HE2 PHE A 79 11.571 1.187 6.044 1.00 33.24 H new ATOM 0 HZ PHE A 79 9.396 0.068 6.339 1.00 31.30 H new ATOM 1297 N GLN A 80 10.591 6.544 11.523 1.00 72.31 N ATOM 1298 CA GLN A 80 10.573 7.092 12.874 1.00 43.11 C ATOM 1299 C GLN A 80 9.275 7.848 13.138 1.00 45.32 C ATOM 1300 O GLN A 80 8.691 7.740 14.216 1.00 53.03 O ATOM 1301 CB GLN A 80 11.770 8.020 13.086 1.00 45.44 C ATOM 1302 CG GLN A 80 13.109 7.300 13.070 1.00 41.31 C ATOM 1303 CD GLN A 80 14.284 8.250 13.192 1.00 3.14 C ATOM 1304 OE1 GLN A 80 14.115 9.428 13.507 1.00 52.52 O ATOM 1305 NE2 GLN A 80 15.485 7.741 12.944 1.00 5.22 N ATOM 0 H GLN A 80 11.376 6.856 10.951 1.00 72.31 H new ATOM 0 HA GLN A 80 10.637 6.261 13.577 1.00 43.11 H new ATOM 0 HB2 GLN A 80 11.769 8.784 12.309 1.00 45.44 H new ATOM 0 HB3 GLN A 80 11.655 8.535 14.040 1.00 45.44 H new ATOM 0 HG2 GLN A 80 13.141 6.582 13.889 1.00 41.31 H new ATOM 0 HG3 GLN A 80 13.201 6.732 12.144 1.00 41.31 H new ATOM 0 HE21 GLN A 80 15.579 6.759 12.686 1.00 5.22 H new ATOM 0 HE22 GLN A 80 16.313 8.332 13.012 1.00 5.22 H new ATOM 1314 N ASP A 81 8.831 8.614 12.147 1.00 31.23 N ATOM 1315 CA ASP A 81 7.601 9.388 12.272 1.00 23.11 C ATOM 1316 C ASP A 81 6.377 8.482 12.184 1.00 63.31 C ATOM 1317 O ASP A 81 5.469 8.567 13.010 1.00 54.11 O ATOM 1318 CB ASP A 81 7.536 10.461 11.184 1.00 24.11 C ATOM 1319 CG ASP A 81 8.253 11.736 11.585 1.00 74.44 C ATOM 1320 OD1 ASP A 81 8.776 11.791 12.717 1.00 72.01 O ATOM 1321 OD2 ASP A 81 8.289 12.678 10.766 1.00 43.31 O ATOM 0 H ASP A 81 9.304 8.715 11.249 1.00 31.23 H new ATOM 0 HA ASP A 81 7.603 9.871 13.249 1.00 23.11 H new ATOM 0 HB2 ASP A 81 7.978 10.072 10.267 1.00 24.11 H new ATOM 0 HB3 ASP A 81 6.493 10.688 10.963 1.00 24.11 H new ATOM 1326 N SER A 82 6.360 7.615 11.176 1.00 23.03 N ATOM 1327 CA SER A 82 5.246 6.696 10.977 1.00 13.21 C ATOM 1328 C SER A 82 5.038 5.820 12.208 1.00 35.53 C ATOM 1329 O SER A 82 3.940 5.760 12.764 1.00 63.43 O ATOM 1330 CB SER A 82 5.494 5.819 9.748 1.00 34.15 C ATOM 1331 OG SER A 82 6.623 4.985 9.937 1.00 25.41 O ATOM 0 H SER A 82 7.105 7.530 10.485 1.00 23.03 H new ATOM 0 HA SER A 82 4.344 7.287 10.817 1.00 13.21 H new ATOM 0 HB2 SER A 82 4.614 5.206 9.551 1.00 34.15 H new ATOM 0 HB3 SER A 82 5.646 6.450 8.872 1.00 34.15 H new ATOM 0 HG SER A 82 6.667 4.325 9.214 1.00 25.41 H new ATOM 1337 N PHE A 83 6.099 5.141 12.630 1.00 63.43 N ATOM 1338 CA PHE A 83 6.034 4.266 13.795 1.00 64.34 C ATOM 1339 C PHE A 83 5.935 5.080 15.081 1.00 24.34 C ATOM 1340 O PHE A 83 5.506 4.574 16.117 1.00 23.15 O ATOM 1341 CB PHE A 83 7.265 3.357 13.846 1.00 54.22 C ATOM 1342 CG PHE A 83 7.134 2.123 13.000 1.00 33.34 C ATOM 1343 CD1 PHE A 83 6.030 1.295 13.126 1.00 31.44 C ATOM 1344 CD2 PHE A 83 8.114 1.790 12.079 1.00 1.54 C ATOM 1345 CE1 PHE A 83 5.908 0.158 12.350 1.00 35.32 C ATOM 1346 CE2 PHE A 83 7.997 0.655 11.300 1.00 31.11 C ATOM 1347 CZ PHE A 83 6.892 -0.162 11.435 1.00 15.01 C ATOM 0 H PHE A 83 7.015 5.180 12.183 1.00 63.43 H new ATOM 0 HA PHE A 83 5.139 3.650 13.706 1.00 64.34 H new ATOM 0 HB2 PHE A 83 8.138 3.922 13.518 1.00 54.22 H new ATOM 0 HB3 PHE A 83 7.446 3.062 14.879 1.00 54.22 H new ATOM 0 HD1 PHE A 83 5.256 1.541 13.838 1.00 31.44 H new ATOM 0 HD2 PHE A 83 8.980 2.426 11.969 1.00 1.54 H new ATOM 0 HE1 PHE A 83 5.044 -0.480 12.459 1.00 35.32 H new ATOM 0 HE2 PHE A 83 8.769 0.407 10.586 1.00 31.11 H new ATOM 0 HZ PHE A 83 6.797 -1.049 10.827 1.00 15.01 H new ATOM 1357 N GLY A 84 6.337 6.345 15.007 1.00 51.24 N ATOM 1358 CA GLY A 84 6.287 7.209 16.171 1.00 14.43 C ATOM 1359 C GLY A 84 4.903 7.782 16.409 1.00 45.31 C ATOM 1360 O GLY A 84 4.530 8.073 17.545 1.00 2.35 O ATOM 0 H GLY A 84 6.697 6.787 14.161 1.00 51.24 H new ATOM 0 HA2 GLY A 84 6.600 6.647 17.051 1.00 14.43 H new ATOM 0 HA3 GLY A 84 6.998 8.025 16.045 1.00 14.43 H new ATOM 1364 N LYS A 85 4.140 7.947 15.334 1.00 63.23 N ATOM 1365 CA LYS A 85 2.790 8.489 15.429 1.00 43.31 C ATOM 1366 C LYS A 85 1.792 7.401 15.812 1.00 5.24 C ATOM 1367 O LYS A 85 0.623 7.682 16.076 1.00 42.12 O ATOM 1368 CB LYS A 85 2.380 9.127 14.100 1.00 72.25 C ATOM 1369 CG LYS A 85 2.310 8.140 12.947 1.00 24.33 C ATOM 1370 CD LYS A 85 1.342 8.604 11.872 1.00 2.44 C ATOM 1371 CE LYS A 85 1.855 9.846 11.159 1.00 2.12 C ATOM 1372 NZ LYS A 85 2.663 9.501 9.957 1.00 43.01 N ATOM 0 H LYS A 85 4.434 7.713 14.386 1.00 63.23 H new ATOM 0 HA LYS A 85 2.786 9.251 16.208 1.00 43.31 H new ATOM 0 HB2 LYS A 85 1.406 9.602 14.220 1.00 72.25 H new ATOM 0 HB3 LYS A 85 3.091 9.915 13.850 1.00 72.25 H new ATOM 0 HG2 LYS A 85 3.302 8.014 12.514 1.00 24.33 H new ATOM 0 HG3 LYS A 85 1.999 7.164 13.321 1.00 24.33 H new ATOM 0 HD2 LYS A 85 1.190 7.804 11.148 1.00 2.44 H new ATOM 0 HD3 LYS A 85 0.372 8.816 12.321 1.00 2.44 H new ATOM 0 HE2 LYS A 85 1.011 10.469 10.863 1.00 2.12 H new ATOM 0 HE3 LYS A 85 2.461 10.436 11.847 1.00 2.12 H new ATOM 0 HZ1 LYS A 85 3.670 9.468 10.214 1.00 43.01 H new ATOM 0 HZ2 LYS A 85 2.367 8.572 9.595 1.00 43.01 H new ATOM 0 HZ3 LYS A 85 2.516 10.222 9.222 1.00 43.01 H new ATOM 1386 N VAL A 86 2.262 6.158 15.843 1.00 2.03 N ATOM 1387 CA VAL A 86 1.412 5.028 16.197 1.00 14.05 C ATOM 1388 C VAL A 86 1.978 4.266 17.390 1.00 2.33 C ATOM 1389 O VAL A 86 1.352 3.339 17.902 1.00 14.12 O ATOM 1390 CB VAL A 86 1.247 4.057 15.013 1.00 32.25 C ATOM 1391 CG1 VAL A 86 0.621 4.767 13.823 1.00 42.31 C ATOM 1392 CG2 VAL A 86 2.588 3.446 14.636 1.00 74.53 C ATOM 0 H VAL A 86 3.227 5.908 15.627 1.00 2.03 H new ATOM 0 HA VAL A 86 0.437 5.437 16.461 1.00 14.05 H new ATOM 0 HB VAL A 86 0.579 3.251 15.316 1.00 32.25 H new ATOM 0 HG11 VAL A 86 0.512 4.065 12.996 1.00 42.31 H new ATOM 0 HG12 VAL A 86 -0.359 5.152 14.103 1.00 42.31 H new ATOM 0 HG13 VAL A 86 1.261 5.594 13.515 1.00 42.31 H new ATOM 0 HG21 VAL A 86 2.454 2.762 13.798 1.00 74.53 H new ATOM 0 HG22 VAL A 86 3.281 4.237 14.351 1.00 74.53 H new ATOM 0 HG23 VAL A 86 2.991 2.900 15.489 1.00 74.53 H new ATOM 1402 N ALA A 87 3.168 4.665 17.829 1.00 70.42 N ATOM 1403 CA ALA A 87 3.819 4.021 18.963 1.00 15.24 C ATOM 1404 C ALA A 87 3.141 4.405 20.275 1.00 45.43 C ATOM 1405 O ALA A 87 2.761 3.541 21.064 1.00 54.42 O ATOM 1406 CB ALA A 87 5.295 4.387 19.002 1.00 11.24 C ATOM 0 H ALA A 87 3.700 5.431 17.416 1.00 70.42 H new ATOM 0 HA ALA A 87 3.727 2.942 18.839 1.00 15.24 H new ATOM 0 HB1 ALA A 87 5.768 3.899 19.854 1.00 11.24 H new ATOM 0 HB2 ALA A 87 5.776 4.057 18.081 1.00 11.24 H new ATOM 0 HB3 ALA A 87 5.399 5.468 19.099 1.00 11.24 H new ATOM 1412 N ALA A 88 2.996 5.707 20.501 1.00 75.22 N ATOM 1413 CA ALA A 88 2.363 6.205 21.716 1.00 22.10 C ATOM 1414 C ALA A 88 0.953 5.646 21.870 1.00 72.13 C ATOM 1415 O ALA A 88 0.467 5.463 22.985 1.00 34.21 O ATOM 1416 CB ALA A 88 2.332 7.726 21.710 1.00 44.14 C ATOM 0 H ALA A 88 3.308 6.435 19.859 1.00 75.22 H new ATOM 0 HA ALA A 88 2.954 5.868 22.568 1.00 22.10 H new ATOM 0 HB1 ALA A 88 1.857 8.084 22.623 1.00 44.14 H new ATOM 0 HB2 ALA A 88 3.351 8.110 21.657 1.00 44.14 H new ATOM 0 HB3 ALA A 88 1.767 8.075 20.846 1.00 44.14 H new ATOM 1422 N GLU A 89 0.301 5.378 20.742 1.00 23.33 N ATOM 1423 CA GLU A 89 -1.054 4.841 20.753 1.00 15.05 C ATOM 1424 C GLU A 89 -1.044 3.344 21.047 1.00 74.41 C ATOM 1425 O GLU A 89 -1.628 2.888 22.030 1.00 14.35 O ATOM 1426 CB GLU A 89 -1.742 5.104 19.412 1.00 11.42 C ATOM 1427 CG GLU A 89 -3.259 5.079 19.491 1.00 73.24 C ATOM 1428 CD GLU A 89 -3.806 6.041 20.527 1.00 12.11 C ATOM 1429 OE1 GLU A 89 -3.291 7.175 20.615 1.00 51.21 O ATOM 1430 OE2 GLU A 89 -4.750 5.659 21.251 1.00 50.35 O ATOM 0 H GLU A 89 0.690 5.524 19.810 1.00 23.33 H new ATOM 0 HA GLU A 89 -1.610 5.345 21.543 1.00 15.05 H new ATOM 0 HB2 GLU A 89 -1.422 6.075 19.033 1.00 11.42 H new ATOM 0 HB3 GLU A 89 -1.412 4.356 18.691 1.00 11.42 H new ATOM 0 HG2 GLU A 89 -3.674 5.328 18.514 1.00 73.24 H new ATOM 0 HG3 GLU A 89 -3.590 4.068 19.729 1.00 73.24 H new ATOM 1437 N VAL A 90 -0.377 2.582 20.186 1.00 41.22 N ATOM 1438 CA VAL A 90 -0.290 1.136 20.352 1.00 44.33 C ATOM 1439 C VAL A 90 0.330 0.774 21.697 1.00 61.13 C ATOM 1440 O VAL A 90 -0.275 0.062 22.500 1.00 44.31 O ATOM 1441 CB VAL A 90 0.540 0.491 19.226 1.00 44.21 C ATOM 1442 CG1 VAL A 90 0.650 -1.011 19.437 1.00 72.23 C ATOM 1443 CG2 VAL A 90 -0.070 0.804 17.868 1.00 1.32 C ATOM 0 H VAL A 90 0.111 2.942 19.366 1.00 41.22 H new ATOM 0 HA VAL A 90 -1.309 0.750 20.309 1.00 44.33 H new ATOM 0 HB VAL A 90 1.545 0.912 19.253 1.00 44.21 H new ATOM 0 HG11 VAL A 90 1.240 -1.449 18.632 1.00 72.23 H new ATOM 0 HG12 VAL A 90 1.136 -1.210 20.392 1.00 72.23 H new ATOM 0 HG13 VAL A 90 -0.347 -1.452 19.438 1.00 72.23 H new ATOM 0 HG21 VAL A 90 0.529 0.340 17.084 1.00 1.32 H new ATOM 0 HG22 VAL A 90 -1.086 0.413 17.827 1.00 1.32 H new ATOM 0 HG23 VAL A 90 -0.090 1.883 17.718 1.00 1.32 H new ATOM 1453 N LEU A 91 1.540 1.268 21.937 1.00 73.03 N ATOM 1454 CA LEU A 91 2.243 0.997 23.186 1.00 52.02 C ATOM 1455 C LEU A 91 1.355 1.303 24.388 1.00 72.32 C ATOM 1456 O LEU A 91 1.419 0.620 25.409 1.00 11.24 O ATOM 1457 CB LEU A 91 3.526 1.826 23.262 1.00 62.23 C ATOM 1458 CG LEU A 91 4.562 1.561 22.168 1.00 13.02 C ATOM 1459 CD1 LEU A 91 5.464 2.771 21.983 1.00 54.43 C ATOM 1460 CD2 LEU A 91 5.386 0.326 22.502 1.00 74.24 C ATOM 0 H LEU A 91 2.054 1.858 21.283 1.00 73.03 H new ATOM 0 HA LEU A 91 2.500 -0.062 23.207 1.00 52.02 H new ATOM 0 HB2 LEU A 91 3.255 2.881 23.230 1.00 62.23 H new ATOM 0 HB3 LEU A 91 3.994 1.646 24.230 1.00 62.23 H new ATOM 0 HG LEU A 91 4.035 1.380 21.231 1.00 13.02 H new ATOM 0 HD11 LEU A 91 6.195 2.564 21.201 1.00 54.43 H new ATOM 0 HD12 LEU A 91 4.862 3.634 21.698 1.00 54.43 H new ATOM 0 HD13 LEU A 91 5.983 2.984 22.917 1.00 54.43 H new ATOM 0 HD21 LEU A 91 6.118 0.153 21.713 1.00 74.24 H new ATOM 0 HD22 LEU A 91 5.903 0.479 23.449 1.00 74.24 H new ATOM 0 HD23 LEU A 91 4.728 -0.539 22.583 1.00 74.24 H new ATOM 1472 N GLY A 92 0.524 2.333 24.257 1.00 23.21 N ATOM 1473 CA GLY A 92 -0.367 2.709 25.339 1.00 5.41 C ATOM 1474 C GLY A 92 -1.538 1.759 25.483 1.00 75.13 C ATOM 1475 O GLY A 92 -2.054 1.561 26.583 1.00 74.23 O ATOM 0 H GLY A 92 0.452 2.913 23.421 1.00 23.21 H new ATOM 0 HA2 GLY A 92 0.193 2.735 26.274 1.00 5.41 H new ATOM 0 HA3 GLY A 92 -0.741 3.718 25.163 1.00 5.41 H new ATOM 1479 N ARG A 93 -1.961 1.171 24.368 1.00 31.45 N ATOM 1480 CA ARG A 93 -3.082 0.238 24.375 1.00 42.03 C ATOM 1481 C ARG A 93 -2.635 -1.145 24.839 1.00 34.23 C ATOM 1482 O ARG A 93 -3.324 -1.799 25.623 1.00 23.33 O ATOM 1483 CB ARG A 93 -3.702 0.144 22.979 1.00 30.44 C ATOM 1484 CG ARG A 93 -4.850 1.115 22.756 1.00 24.11 C ATOM 1485 CD ARG A 93 -6.075 0.726 23.569 1.00 5.42 C ATOM 1486 NE ARG A 93 -7.008 1.839 23.718 1.00 53.40 N ATOM 1487 CZ ARG A 93 -8.147 1.757 24.397 1.00 53.45 C ATOM 1488 NH1 ARG A 93 -8.491 0.621 24.986 1.00 73.41 N ATOM 1489 NH2 ARG A 93 -8.945 2.814 24.487 1.00 43.10 N ATOM 0 H ARG A 93 -1.545 1.324 23.449 1.00 31.45 H new ATOM 0 HA ARG A 93 -3.830 0.612 25.074 1.00 42.03 H new ATOM 0 HB2 ARG A 93 -2.929 0.331 22.234 1.00 30.44 H new ATOM 0 HB3 ARG A 93 -4.061 -0.873 22.818 1.00 30.44 H new ATOM 0 HG2 ARG A 93 -4.535 2.122 23.030 1.00 24.11 H new ATOM 0 HG3 ARG A 93 -5.107 1.139 21.697 1.00 24.11 H new ATOM 0 HD2 ARG A 93 -6.581 -0.109 23.085 1.00 5.42 H new ATOM 0 HD3 ARG A 93 -5.762 0.381 24.554 1.00 5.42 H new ATOM 0 HE ARG A 93 -6.773 2.728 23.277 1.00 53.40 H new ATOM 0 HH11 ARG A 93 -7.881 -0.194 24.919 1.00 73.41 H new ATOM 0 HH12 ARG A 93 -9.366 0.561 25.507 1.00 73.41 H new ATOM 0 HH21 ARG A 93 -8.684 3.690 24.035 1.00 43.10 H new ATOM 0 HH22 ARG A 93 -9.819 2.750 25.009 1.00 43.10 H new ATOM 1503 N ILE A 94 -1.481 -1.584 24.350 1.00 44.20 N ATOM 1504 CA ILE A 94 -0.943 -2.888 24.716 1.00 61.45 C ATOM 1505 C ILE A 94 -0.395 -2.878 26.139 1.00 41.04 C ATOM 1506 O ILE A 94 -0.395 -3.901 26.822 1.00 40.12 O ATOM 1507 CB ILE A 94 0.174 -3.327 23.750 1.00 23.35 C ATOM 1508 CG1 ILE A 94 1.386 -2.403 23.884 1.00 51.42 C ATOM 1509 CG2 ILE A 94 -0.337 -3.336 22.318 1.00 61.34 C ATOM 1510 CD1 ILE A 94 2.543 -2.789 22.989 1.00 75.21 C ATOM 0 H ILE A 94 -0.900 -1.056 23.699 1.00 44.20 H new ATOM 0 HA ILE A 94 -1.767 -3.598 24.653 1.00 61.45 H new ATOM 0 HB ILE A 94 0.482 -4.339 24.011 1.00 23.35 H new ATOM 0 HG12 ILE A 94 1.082 -1.382 23.651 1.00 51.42 H new ATOM 0 HG13 ILE A 94 1.722 -2.407 24.921 1.00 51.42 H new ATOM 0 HG21 ILE A 94 0.464 -3.648 21.648 1.00 61.34 H new ATOM 0 HG22 ILE A 94 -1.172 -4.031 22.234 1.00 61.34 H new ATOM 0 HG23 ILE A 94 -0.670 -2.335 22.044 1.00 61.34 H new ATOM 0 HD11 ILE A 94 3.366 -2.090 23.137 1.00 75.21 H new ATOM 0 HD12 ILE A 94 2.874 -3.798 23.237 1.00 75.21 H new ATOM 0 HD13 ILE A 94 2.223 -2.758 21.947 1.00 75.21 H new ATOM 1522 N ASN A 95 0.070 -1.713 26.579 1.00 21.53 N ATOM 1523 CA ASN A 95 0.620 -1.569 27.922 1.00 30.03 C ATOM 1524 C ASN A 95 -0.395 -2.003 28.975 1.00 20.43 C ATOM 1525 O ASN A 95 -0.045 -2.664 29.953 1.00 3.41 O ATOM 1526 CB ASN A 95 1.040 -0.119 28.171 1.00 43.04 C ATOM 1527 CG ASN A 95 1.270 0.173 29.641 1.00 72.21 C ATOM 1528 OD1 ASN A 95 2.196 -0.359 30.254 1.00 73.24 O ATOM 1529 ND2 ASN A 95 0.425 1.022 30.214 1.00 31.24 N ATOM 0 H ASN A 95 0.077 -0.856 26.026 1.00 21.53 H new ATOM 0 HA ASN A 95 1.496 -2.213 27.999 1.00 30.03 H new ATOM 0 HB2 ASN A 95 1.953 0.092 27.614 1.00 43.04 H new ATOM 0 HB3 ASN A 95 0.270 0.550 27.787 1.00 43.04 H new ATOM 0 HD21 ASN A 95 0.529 1.257 31.201 1.00 31.24 H new ATOM 0 HD22 ASN A 95 -0.328 1.439 29.667 1.00 31.24 H new ATOM 1536 N GLN A 96 -1.653 -1.628 28.767 1.00 21.40 N ATOM 1537 CA GLN A 96 -2.718 -1.979 29.699 1.00 74.45 C ATOM 1538 C GLN A 96 -3.112 -3.445 29.548 1.00 22.33 C ATOM 1539 O GLN A 96 -3.256 -4.163 30.537 1.00 10.25 O ATOM 1540 CB GLN A 96 -3.939 -1.086 29.471 1.00 43.33 C ATOM 1541 CG GLN A 96 -3.621 0.400 29.514 1.00 11.33 C ATOM 1542 CD GLN A 96 -4.827 1.264 29.200 1.00 44.21 C ATOM 1543 OE1 GLN A 96 -5.905 1.075 29.764 1.00 25.02 O ATOM 1544 NE2 GLN A 96 -4.650 2.220 28.295 1.00 35.00 N ATOM 0 H GLN A 96 -1.959 -1.082 27.962 1.00 21.40 H new ATOM 0 HA GLN A 96 -2.346 -1.823 30.712 1.00 74.45 H new ATOM 0 HB2 GLN A 96 -4.380 -1.327 28.504 1.00 43.33 H new ATOM 0 HB3 GLN A 96 -4.690 -1.311 30.228 1.00 43.33 H new ATOM 0 HG2 GLN A 96 -3.241 0.658 30.503 1.00 11.33 H new ATOM 0 HG3 GLN A 96 -2.826 0.619 28.800 1.00 11.33 H new ATOM 0 HE21 GLN A 96 -3.739 2.341 27.852 1.00 35.00 H new ATOM 0 HE22 GLN A 96 -5.425 2.833 28.043 1.00 35.00 H new ATOM 1553 N GLU A 97 -3.284 -3.882 28.305 1.00 70.33 N ATOM 1554 CA GLU A 97 -3.662 -5.263 28.026 1.00 11.14 C ATOM 1555 C GLU A 97 -2.575 -6.229 28.489 1.00 10.43 C ATOM 1556 O GLU A 97 -2.840 -7.404 28.743 1.00 41.04 O ATOM 1557 CB GLU A 97 -3.924 -5.452 26.531 1.00 53.32 C ATOM 1558 CG GLU A 97 -5.167 -4.732 26.035 1.00 11.41 C ATOM 1559 CD GLU A 97 -6.401 -5.613 26.061 1.00 11.52 C ATOM 1560 OE1 GLU A 97 -6.461 -6.524 26.913 1.00 2.22 O ATOM 1561 OE2 GLU A 97 -7.306 -5.391 25.230 1.00 34.22 O ATOM 0 H GLU A 97 -3.168 -3.300 27.475 1.00 70.33 H new ATOM 0 HA GLU A 97 -4.577 -5.480 28.578 1.00 11.14 H new ATOM 0 HB2 GLU A 97 -3.060 -5.095 25.971 1.00 53.32 H new ATOM 0 HB3 GLU A 97 -4.023 -6.517 26.320 1.00 53.32 H new ATOM 0 HG2 GLU A 97 -5.342 -3.850 26.651 1.00 11.41 H new ATOM 0 HG3 GLU A 97 -4.997 -4.381 25.017 1.00 11.41 H new ATOM 1568 N PHE A 98 -1.350 -5.724 28.597 1.00 53.02 N ATOM 1569 CA PHE A 98 -0.222 -6.541 29.027 1.00 21.14 C ATOM 1570 C PHE A 98 -0.250 -6.755 30.538 1.00 53.11 C ATOM 1571 O PHE A 98 -0.639 -5.876 31.308 1.00 44.04 O ATOM 1572 CB PHE A 98 1.097 -5.882 28.619 1.00 64.41 C ATOM 1573 CG PHE A 98 1.542 -6.241 27.230 1.00 73.43 C ATOM 1574 CD1 PHE A 98 0.612 -6.540 26.246 1.00 3.04 C ATOM 1575 CD2 PHE A 98 2.889 -6.280 26.907 1.00 14.31 C ATOM 1576 CE1 PHE A 98 1.019 -6.871 24.968 1.00 73.44 C ATOM 1577 CE2 PHE A 98 3.301 -6.610 25.630 1.00 71.12 C ATOM 1578 CZ PHE A 98 2.364 -6.905 24.659 1.00 65.24 C ATOM 0 H PHE A 98 -1.114 -4.753 28.393 1.00 53.02 H new ATOM 0 HA PHE A 98 -0.302 -7.512 28.538 1.00 21.14 H new ATOM 0 HB2 PHE A 98 0.990 -4.800 28.689 1.00 64.41 H new ATOM 0 HB3 PHE A 98 1.873 -6.172 29.327 1.00 64.41 H new ATOM 0 HD1 PHE A 98 -0.442 -6.514 26.481 1.00 3.04 H new ATOM 0 HD2 PHE A 98 3.626 -6.050 27.662 1.00 14.31 H new ATOM 0 HE1 PHE A 98 0.285 -7.103 24.211 1.00 73.44 H new ATOM 0 HE2 PHE A 98 4.354 -6.637 25.392 1.00 71.12 H new ATOM 0 HZ PHE A 98 2.683 -7.162 23.660 1.00 65.24 H new ATOM 1588 N PRO A 99 0.170 -7.952 30.974 1.00 44.34 N ATOM 1589 CA PRO A 99 0.203 -8.310 32.395 1.00 61.24 C ATOM 1590 C PRO A 99 1.276 -7.545 33.161 1.00 2.41 C ATOM 1591 O PRO A 99 2.130 -6.889 32.564 1.00 63.10 O ATOM 1592 CB PRO A 99 0.524 -9.807 32.376 1.00 45.33 C ATOM 1593 CG PRO A 99 1.243 -10.024 31.089 1.00 54.44 C ATOM 1594 CD PRO A 99 0.647 -9.047 30.112 1.00 2.04 C ATOM 0 HA PRO A 99 -0.733 -8.067 32.898 1.00 61.24 H new ATOM 0 HB2 PRO A 99 1.143 -10.090 33.228 1.00 45.33 H new ATOM 0 HB3 PRO A 99 -0.384 -10.407 32.428 1.00 45.33 H new ATOM 0 HG2 PRO A 99 2.313 -9.855 31.207 1.00 54.44 H new ATOM 0 HG3 PRO A 99 1.119 -11.049 30.741 1.00 54.44 H new ATOM 0 HD2 PRO A 99 1.386 -8.698 29.391 1.00 2.04 H new ATOM 0 HD3 PRO A 99 -0.168 -9.494 29.542 1.00 2.04 H new ATOM 1602 N ARG A 100 1.227 -7.632 34.486 1.00 32.52 N ATOM 1603 CA ARG A 100 2.195 -6.947 35.334 1.00 33.00 C ATOM 1604 C ARG A 100 3.613 -7.424 35.035 1.00 41.30 C ATOM 1605 O ARG A 100 4.585 -6.715 35.298 1.00 21.51 O ATOM 1606 CB ARG A 100 1.867 -7.180 36.810 1.00 24.50 C ATOM 1607 CG ARG A 100 0.758 -6.285 37.337 1.00 73.33 C ATOM 1608 CD ARG A 100 0.929 -6.001 38.821 1.00 54.33 C ATOM 1609 NE ARG A 100 0.802 -7.211 39.628 1.00 13.13 N ATOM 1610 CZ ARG A 100 0.599 -7.201 40.941 1.00 4.51 C ATOM 1611 NH1 ARG A 100 0.501 -6.049 41.591 1.00 60.10 N ATOM 1612 NH2 ARG A 100 0.494 -8.344 41.606 1.00 4.25 N ATOM 0 H ARG A 100 0.527 -8.171 34.996 1.00 32.52 H new ATOM 0 HA ARG A 100 2.137 -5.880 35.120 1.00 33.00 H new ATOM 0 HB2 ARG A 100 1.578 -8.222 36.949 1.00 24.50 H new ATOM 0 HB3 ARG A 100 2.767 -7.017 37.403 1.00 24.50 H new ATOM 0 HG2 ARG A 100 0.753 -5.346 36.784 1.00 73.33 H new ATOM 0 HG3 ARG A 100 -0.208 -6.761 37.165 1.00 73.33 H new ATOM 0 HD2 ARG A 100 1.907 -5.551 38.994 1.00 54.33 H new ATOM 0 HD3 ARG A 100 0.183 -5.273 39.139 1.00 54.33 H new ATOM 0 HE ARG A 100 0.873 -8.114 39.158 1.00 13.13 H new ATOM 0 HH11 ARG A 100 0.581 -5.168 41.083 1.00 60.10 H new ATOM 0 HH12 ARG A 100 0.345 -6.044 42.599 1.00 60.10 H new ATOM 0 HH21 ARG A 100 0.569 -9.232 41.109 1.00 4.25 H new ATOM 0 HH22 ARG A 100 0.338 -8.335 42.614 1.00 4.25 H new ATOM 1626 N ASP A 101 3.723 -8.628 34.485 1.00 42.34 N ATOM 1627 CA ASP A 101 5.022 -9.199 34.149 1.00 22.22 C ATOM 1628 C ASP A 101 5.593 -8.551 32.891 1.00 34.24 C ATOM 1629 O ASP A 101 6.750 -8.130 32.867 1.00 13.34 O ATOM 1630 CB ASP A 101 4.902 -10.711 33.949 1.00 0.24 C ATOM 1631 CG ASP A 101 4.792 -11.461 35.262 1.00 34.31 C ATOM 1632 OD1 ASP A 101 5.716 -11.342 36.094 1.00 61.45 O ATOM 1633 OD2 ASP A 101 3.780 -12.167 35.458 1.00 3.23 O ATOM 0 H ASP A 101 2.928 -9.228 34.262 1.00 42.34 H new ATOM 0 HA ASP A 101 5.702 -9.002 34.978 1.00 22.22 H new ATOM 0 HB2 ASP A 101 4.026 -10.925 33.337 1.00 0.24 H new ATOM 0 HB3 ASP A 101 5.771 -11.072 33.399 1.00 0.24 H new ATOM 1638 N LEU A 102 4.774 -8.476 31.848 1.00 41.21 N ATOM 1639 CA LEU A 102 5.197 -7.880 30.585 1.00 10.13 C ATOM 1640 C LEU A 102 5.372 -6.371 30.727 1.00 63.32 C ATOM 1641 O LEU A 102 6.220 -5.769 30.068 1.00 62.12 O ATOM 1642 CB LEU A 102 4.177 -8.186 29.487 1.00 14.53 C ATOM 1643 CG LEU A 102 4.086 -9.646 29.043 1.00 14.13 C ATOM 1644 CD1 LEU A 102 3.136 -9.787 27.864 1.00 52.01 C ATOM 1645 CD2 LEU A 102 5.464 -10.182 28.687 1.00 5.01 C ATOM 0 H LEU A 102 3.814 -8.820 31.851 1.00 41.21 H new ATOM 0 HA LEU A 102 6.158 -8.314 30.310 1.00 10.13 H new ATOM 0 HB2 LEU A 102 3.193 -7.871 29.835 1.00 14.53 H new ATOM 0 HB3 LEU A 102 4.417 -7.577 28.616 1.00 14.53 H new ATOM 0 HG LEU A 102 3.693 -10.234 29.872 1.00 14.13 H new ATOM 0 HD11 LEU A 102 3.084 -10.833 27.562 1.00 52.01 H new ATOM 0 HD12 LEU A 102 2.143 -9.443 28.154 1.00 52.01 H new ATOM 0 HD13 LEU A 102 3.499 -9.186 27.030 1.00 52.01 H new ATOM 0 HD21 LEU A 102 5.380 -11.222 28.373 1.00 5.01 H new ATOM 0 HD22 LEU A 102 5.885 -9.591 27.874 1.00 5.01 H new ATOM 0 HD23 LEU A 102 6.116 -10.117 29.558 1.00 5.01 H new ATOM 1657 N LYS A 103 4.566 -5.766 31.592 1.00 3.14 N ATOM 1658 CA LYS A 103 4.633 -4.328 31.824 1.00 25.05 C ATOM 1659 C LYS A 103 6.059 -3.896 32.155 1.00 74.21 C ATOM 1660 O LYS A 103 6.526 -2.856 31.692 1.00 44.42 O ATOM 1661 CB LYS A 103 3.692 -3.930 32.963 1.00 13.21 C ATOM 1662 CG LYS A 103 2.245 -3.771 32.528 1.00 1.54 C ATOM 1663 CD LYS A 103 1.607 -2.542 33.155 1.00 74.21 C ATOM 1664 CE LYS A 103 0.090 -2.654 33.180 1.00 51.35 C ATOM 1665 NZ LYS A 103 -0.487 -2.098 34.435 1.00 42.31 N ATOM 0 H LYS A 103 3.858 -6.249 32.145 1.00 3.14 H new ATOM 0 HA LYS A 103 4.321 -3.823 30.910 1.00 25.05 H new ATOM 0 HB2 LYS A 103 3.746 -4.684 33.748 1.00 13.21 H new ATOM 0 HB3 LYS A 103 4.037 -2.992 33.398 1.00 13.21 H new ATOM 0 HG2 LYS A 103 2.197 -3.693 31.442 1.00 1.54 H new ATOM 0 HG3 LYS A 103 1.680 -4.659 32.809 1.00 1.54 H new ATOM 0 HD2 LYS A 103 1.980 -2.415 34.171 1.00 74.21 H new ATOM 0 HD3 LYS A 103 1.898 -1.653 32.595 1.00 74.21 H new ATOM 0 HE2 LYS A 103 -0.327 -2.125 32.323 1.00 51.35 H new ATOM 0 HE3 LYS A 103 -0.199 -3.700 33.080 1.00 51.35 H new ATOM 0 HZ1 LYS A 103 -1.522 -2.193 34.413 1.00 42.31 H new ATOM 0 HZ2 LYS A 103 -0.109 -2.619 35.252 1.00 42.31 H new ATOM 0 HZ3 LYS A 103 -0.234 -1.093 34.518 1.00 42.31 H new ATOM 1679 N LYS A 104 6.745 -4.702 32.957 1.00 23.52 N ATOM 1680 CA LYS A 104 8.118 -4.406 33.348 1.00 64.02 C ATOM 1681 C LYS A 104 9.064 -4.544 32.159 1.00 41.21 C ATOM 1682 O LYS A 104 10.002 -3.761 32.004 1.00 54.12 O ATOM 1683 CB LYS A 104 8.562 -5.339 34.477 1.00 61.13 C ATOM 1684 CG LYS A 104 9.553 -4.704 35.437 1.00 62.14 C ATOM 1685 CD LYS A 104 8.846 -3.983 36.572 1.00 42.22 C ATOM 1686 CE LYS A 104 9.836 -3.271 37.482 1.00 74.30 C ATOM 1687 NZ LYS A 104 9.147 -2.429 38.499 1.00 60.10 N ATOM 0 H LYS A 104 6.372 -5.567 33.350 1.00 23.52 H new ATOM 0 HA LYS A 104 8.154 -3.376 33.702 1.00 64.02 H new ATOM 0 HB2 LYS A 104 7.684 -5.663 35.036 1.00 61.13 H new ATOM 0 HB3 LYS A 104 9.011 -6.233 34.043 1.00 61.13 H new ATOM 0 HG2 LYS A 104 10.209 -5.473 35.846 1.00 62.14 H new ATOM 0 HG3 LYS A 104 10.185 -4.000 34.896 1.00 62.14 H new ATOM 0 HD2 LYS A 104 8.141 -3.259 36.162 1.00 42.22 H new ATOM 0 HD3 LYS A 104 8.265 -4.699 37.154 1.00 42.22 H new ATOM 0 HE2 LYS A 104 10.462 -4.008 37.985 1.00 74.30 H new ATOM 0 HE3 LYS A 104 10.498 -2.647 36.881 1.00 74.30 H new ATOM 0 HZ1 LYS A 104 9.855 -1.961 39.099 1.00 60.10 H new ATOM 0 HZ2 LYS A 104 8.569 -1.709 38.020 1.00 60.10 H new ATOM 0 HZ3 LYS A 104 8.535 -3.028 39.089 1.00 60.10 H new ATOM 1701 N LYS A 105 8.811 -5.543 31.321 1.00 64.25 N ATOM 1702 CA LYS A 105 9.638 -5.783 30.143 1.00 10.44 C ATOM 1703 C LYS A 105 9.435 -4.685 29.104 1.00 72.24 C ATOM 1704 O LYS A 105 10.376 -4.285 28.417 1.00 55.14 O ATOM 1705 CB LYS A 105 9.308 -7.146 29.532 1.00 24.43 C ATOM 1706 CG LYS A 105 9.217 -8.265 30.555 1.00 20.33 C ATOM 1707 CD LYS A 105 10.533 -8.458 31.290 1.00 62.33 C ATOM 1708 CE LYS A 105 11.619 -8.978 30.360 1.00 2.50 C ATOM 1709 NZ LYS A 105 12.371 -7.868 29.711 1.00 10.10 N ATOM 0 H LYS A 105 8.040 -6.200 31.435 1.00 64.25 H new ATOM 0 HA LYS A 105 10.682 -5.775 30.455 1.00 10.44 H new ATOM 0 HB2 LYS A 105 8.361 -7.076 28.998 1.00 24.43 H new ATOM 0 HB3 LYS A 105 10.071 -7.399 28.796 1.00 24.43 H new ATOM 0 HG2 LYS A 105 8.428 -8.040 31.273 1.00 20.33 H new ATOM 0 HG3 LYS A 105 8.938 -9.193 30.056 1.00 20.33 H new ATOM 0 HD2 LYS A 105 10.849 -7.511 31.727 1.00 62.33 H new ATOM 0 HD3 LYS A 105 10.392 -9.158 32.114 1.00 62.33 H new ATOM 0 HE2 LYS A 105 12.310 -9.605 30.923 1.00 2.50 H new ATOM 0 HE3 LYS A 105 11.169 -9.609 29.593 1.00 2.50 H new ATOM 0 HZ1 LYS A 105 13.380 -8.116 29.659 1.00 10.10 H new ATOM 0 HZ2 LYS A 105 12.003 -7.714 28.751 1.00 10.10 H new ATOM 0 HZ3 LYS A 105 12.256 -6.998 30.269 1.00 10.10 H new ATOM 1723 N LEU A 106 8.202 -4.202 28.994 1.00 44.42 N ATOM 1724 CA LEU A 106 7.876 -3.149 28.038 1.00 1.55 C ATOM 1725 C LEU A 106 8.297 -1.782 28.569 1.00 23.03 C ATOM 1726 O LEU A 106 8.761 -0.928 27.814 1.00 1.32 O ATOM 1727 CB LEU A 106 6.376 -3.152 27.739 1.00 41.43 C ATOM 1728 CG LEU A 106 5.833 -1.918 27.016 1.00 24.11 C ATOM 1729 CD1 LEU A 106 4.691 -2.302 26.089 1.00 33.21 C ATOM 1730 CD2 LEU A 106 5.379 -0.869 28.020 1.00 14.11 C ATOM 0 H LEU A 106 7.412 -4.522 29.554 1.00 44.42 H new ATOM 0 HA LEU A 106 8.425 -3.345 27.117 1.00 1.55 H new ATOM 0 HB2 LEU A 106 6.148 -4.031 27.136 1.00 41.43 H new ATOM 0 HB3 LEU A 106 5.838 -3.263 28.681 1.00 41.43 H new ATOM 0 HG LEU A 106 6.635 -1.491 26.413 1.00 24.11 H new ATOM 0 HD11 LEU A 106 4.318 -1.411 25.583 1.00 33.21 H new ATOM 0 HD12 LEU A 106 5.049 -3.017 25.348 1.00 33.21 H new ATOM 0 HD13 LEU A 106 3.887 -2.753 26.670 1.00 33.21 H new ATOM 0 HD21 LEU A 106 4.996 0.002 27.488 1.00 14.11 H new ATOM 0 HD22 LEU A 106 4.593 -1.285 28.650 1.00 14.11 H new ATOM 0 HD23 LEU A 106 6.223 -0.572 28.642 1.00 14.11 H new ATOM 1742 N SER A 107 8.135 -1.584 29.874 1.00 54.35 N ATOM 1743 CA SER A 107 8.497 -0.320 30.506 1.00 75.44 C ATOM 1744 C SER A 107 9.934 0.064 30.167 1.00 14.40 C ATOM 1745 O SER A 107 10.214 1.210 29.813 1.00 22.34 O ATOM 1746 CB SER A 107 8.327 -0.418 32.023 1.00 54.11 C ATOM 1747 OG SER A 107 6.987 -0.157 32.404 1.00 72.32 O ATOM 0 H SER A 107 7.756 -2.282 30.514 1.00 54.35 H new ATOM 0 HA SER A 107 7.832 0.454 30.122 1.00 75.44 H new ATOM 0 HB2 SER A 107 8.617 -1.413 32.361 1.00 54.11 H new ATOM 0 HB3 SER A 107 8.993 0.292 32.513 1.00 54.11 H new ATOM 0 HG SER A 107 6.448 -0.966 32.279 1.00 72.32 H new ATOM 1753 N ARG A 108 10.840 -0.901 30.278 1.00 32.33 N ATOM 1754 CA ARG A 108 12.248 -0.665 29.986 1.00 43.34 C ATOM 1755 C ARG A 108 12.460 -0.417 28.495 1.00 73.42 C ATOM 1756 O ARG A 108 13.342 0.345 28.100 1.00 21.01 O ATOM 1757 CB ARG A 108 13.093 -1.856 30.441 1.00 71.24 C ATOM 1758 CG ARG A 108 12.585 -3.194 29.929 1.00 75.04 C ATOM 1759 CD ARG A 108 13.662 -4.264 30.001 1.00 23.32 C ATOM 1760 NE ARG A 108 14.382 -4.231 31.272 1.00 74.42 N ATOM 1761 CZ ARG A 108 13.846 -4.602 32.429 1.00 31.24 C ATOM 1762 NH1 ARG A 108 12.593 -5.032 32.476 1.00 34.02 N ATOM 1763 NH2 ARG A 108 14.565 -4.544 33.543 1.00 15.24 N ATOM 0 H ARG A 108 10.624 -1.855 30.568 1.00 32.33 H new ATOM 0 HA ARG A 108 12.562 0.224 30.533 1.00 43.34 H new ATOM 0 HB2 ARG A 108 14.119 -1.713 30.103 1.00 71.24 H new ATOM 0 HB3 ARG A 108 13.117 -1.879 31.531 1.00 71.24 H new ATOM 0 HG2 ARG A 108 11.722 -3.505 30.517 1.00 75.04 H new ATOM 0 HG3 ARG A 108 12.247 -3.086 28.898 1.00 75.04 H new ATOM 0 HD2 ARG A 108 13.207 -5.246 29.867 1.00 23.32 H new ATOM 0 HD3 ARG A 108 14.367 -4.125 29.181 1.00 23.32 H new ATOM 0 HE ARG A 108 15.349 -3.905 31.271 1.00 74.42 H new ATOM 0 HH11 ARG A 108 12.037 -5.079 31.622 1.00 34.02 H new ATOM 0 HH12 ARG A 108 12.184 -5.316 33.366 1.00 34.02 H new ATOM 0 HH21 ARG A 108 15.530 -4.214 33.511 1.00 15.24 H new ATOM 0 HH22 ARG A 108 14.153 -4.829 34.431 1.00 15.24 H new ATOM 1777 N VAL A 109 11.644 -1.068 27.671 1.00 41.33 N ATOM 1778 CA VAL A 109 11.741 -0.918 26.224 1.00 61.44 C ATOM 1779 C VAL A 109 11.401 0.504 25.794 1.00 4.41 C ATOM 1780 O VAL A 109 12.126 1.117 25.010 1.00 52.42 O ATOM 1781 CB VAL A 109 10.805 -1.900 25.494 1.00 22.41 C ATOM 1782 CG1 VAL A 109 10.836 -1.653 23.994 1.00 40.24 C ATOM 1783 CG2 VAL A 109 11.188 -3.338 25.814 1.00 41.44 C ATOM 0 H VAL A 109 10.909 -1.704 27.981 1.00 41.33 H new ATOM 0 HA VAL A 109 12.773 -1.140 25.952 1.00 61.44 H new ATOM 0 HB VAL A 109 9.787 -1.732 25.844 1.00 22.41 H new ATOM 0 HG11 VAL A 109 10.169 -2.356 23.496 1.00 40.24 H new ATOM 0 HG12 VAL A 109 10.510 -0.634 23.786 1.00 40.24 H new ATOM 0 HG13 VAL A 109 11.852 -1.792 23.623 1.00 40.24 H new ATOM 0 HG21 VAL A 109 10.517 -4.018 25.290 1.00 41.44 H new ATOM 0 HG22 VAL A 109 12.213 -3.521 25.493 1.00 41.44 H new ATOM 0 HG23 VAL A 109 11.109 -3.505 26.888 1.00 41.44 H new ATOM 1793 N VAL A 110 10.294 1.025 26.314 1.00 43.33 N ATOM 1794 CA VAL A 110 9.858 2.377 25.986 1.00 44.45 C ATOM 1795 C VAL A 110 10.959 3.394 26.270 1.00 34.31 C ATOM 1796 O VAL A 110 11.106 4.381 25.552 1.00 50.42 O ATOM 1797 CB VAL A 110 8.596 2.768 26.777 1.00 4.04 C ATOM 1798 CG1 VAL A 110 8.186 4.197 26.457 1.00 75.04 C ATOM 1799 CG2 VAL A 110 7.461 1.799 26.482 1.00 5.11 C ATOM 0 H VAL A 110 9.683 0.531 26.964 1.00 43.33 H new ATOM 0 HA VAL A 110 9.626 2.385 24.921 1.00 44.45 H new ATOM 0 HB VAL A 110 8.823 2.711 27.842 1.00 4.04 H new ATOM 0 HG11 VAL A 110 7.292 4.455 27.025 1.00 75.04 H new ATOM 0 HG12 VAL A 110 8.995 4.876 26.725 1.00 75.04 H new ATOM 0 HG13 VAL A 110 7.976 4.285 25.391 1.00 75.04 H new ATOM 0 HG21 VAL A 110 6.577 2.090 27.049 1.00 5.11 H new ATOM 0 HG22 VAL A 110 7.232 1.821 25.417 1.00 5.11 H new ATOM 0 HG23 VAL A 110 7.760 0.791 26.768 1.00 5.11 H new ATOM 1809 N ASN A 111 11.729 3.144 27.324 1.00 65.44 N ATOM 1810 CA ASN A 111 12.817 4.037 27.704 1.00 44.31 C ATOM 1811 C ASN A 111 13.930 4.015 26.660 1.00 53.21 C ATOM 1812 O ASN A 111 14.627 5.010 26.460 1.00 11.40 O ATOM 1813 CB ASN A 111 13.378 3.640 29.071 1.00 72.51 C ATOM 1814 CG ASN A 111 12.468 4.053 30.211 1.00 11.44 C ATOM 1815 OD1 ASN A 111 11.721 5.026 30.103 1.00 42.22 O ATOM 1816 ND2 ASN A 111 12.527 3.314 31.313 1.00 10.41 N ATOM 0 H ASN A 111 11.620 2.331 27.930 1.00 65.44 H new ATOM 0 HA ASN A 111 12.418 5.049 27.763 1.00 44.31 H new ATOM 0 HB2 ASN A 111 13.526 2.560 29.100 1.00 72.51 H new ATOM 0 HB3 ASN A 111 14.357 4.100 29.206 1.00 72.51 H new ATOM 0 HD21 ASN A 111 11.938 3.544 32.114 1.00 10.41 H new ATOM 0 HD22 ASN A 111 13.161 2.516 31.359 1.00 10.41 H new ATOM 1823 N ILE A 112 14.089 2.875 25.997 1.00 30.31 N ATOM 1824 CA ILE A 112 15.115 2.724 24.973 1.00 71.22 C ATOM 1825 C ILE A 112 15.006 3.821 23.920 1.00 53.24 C ATOM 1826 O ILE A 112 16.014 4.359 23.461 1.00 42.32 O ATOM 1827 CB ILE A 112 15.021 1.352 24.280 1.00 61.42 C ATOM 1828 CG1 ILE A 112 15.133 0.227 25.311 1.00 64.43 C ATOM 1829 CG2 ILE A 112 16.105 1.218 23.221 1.00 25.42 C ATOM 1830 CD1 ILE A 112 15.049 -1.157 24.706 1.00 23.52 C ATOM 0 H ILE A 112 13.520 2.042 26.151 1.00 30.31 H new ATOM 0 HA ILE A 112 16.078 2.802 25.477 1.00 71.22 H new ATOM 0 HB ILE A 112 14.051 1.275 23.790 1.00 61.42 H new ATOM 0 HG12 ILE A 112 16.079 0.325 25.843 1.00 64.43 H new ATOM 0 HG13 ILE A 112 14.339 0.341 26.049 1.00 64.43 H new ATOM 0 HG21 ILE A 112 16.025 0.243 22.740 1.00 25.42 H new ATOM 0 HG22 ILE A 112 15.983 2.002 22.474 1.00 25.42 H new ATOM 0 HG23 ILE A 112 17.085 1.313 23.689 1.00 25.42 H new ATOM 0 HD11 ILE A 112 15.136 -1.905 25.494 1.00 23.52 H new ATOM 0 HD12 ILE A 112 14.092 -1.275 24.198 1.00 23.52 H new ATOM 0 HD13 ILE A 112 15.859 -1.290 23.989 1.00 23.52 H new ATOM 1842 N LEU A 113 13.775 4.150 23.541 1.00 24.03 N ATOM 1843 CA LEU A 113 13.533 5.186 22.543 1.00 60.41 C ATOM 1844 C LEU A 113 14.267 6.473 22.905 1.00 52.15 C ATOM 1845 O LEU A 113 14.734 7.201 22.029 1.00 51.53 O ATOM 1846 CB LEU A 113 12.033 5.458 22.416 1.00 2.40 C ATOM 1847 CG LEU A 113 11.246 4.487 21.536 1.00 64.41 C ATOM 1848 CD1 LEU A 113 11.721 4.569 20.093 1.00 12.13 C ATOM 1849 CD2 LEU A 113 11.378 3.065 22.062 1.00 74.31 C ATOM 0 H LEU A 113 12.930 3.714 23.910 1.00 24.03 H new ATOM 0 HA LEU A 113 13.914 4.830 21.586 1.00 60.41 H new ATOM 0 HB2 LEU A 113 11.596 5.447 23.415 1.00 2.40 H new ATOM 0 HB3 LEU A 113 11.899 6.465 22.021 1.00 2.40 H new ATOM 0 HG LEU A 113 10.194 4.769 21.567 1.00 64.41 H new ATOM 0 HD11 LEU A 113 11.149 3.871 19.482 1.00 12.13 H new ATOM 0 HD12 LEU A 113 11.575 5.582 19.719 1.00 12.13 H new ATOM 0 HD13 LEU A 113 12.779 4.313 20.043 1.00 12.13 H new ATOM 0 HD21 LEU A 113 10.812 2.387 21.424 1.00 74.31 H new ATOM 0 HD22 LEU A 113 12.428 2.773 22.061 1.00 74.31 H new ATOM 0 HD23 LEU A 113 10.989 3.016 23.079 1.00 74.31 H new ATOM 1861 N LYS A 114 14.367 6.747 24.201 1.00 74.11 N ATOM 1862 CA LYS A 114 15.047 7.944 24.680 1.00 14.23 C ATOM 1863 C LYS A 114 16.558 7.812 24.523 1.00 71.34 C ATOM 1864 O LYS A 114 17.250 8.791 24.244 1.00 33.54 O ATOM 1865 CB LYS A 114 14.697 8.201 26.148 1.00 51.21 C ATOM 1866 CG LYS A 114 13.215 8.063 26.453 1.00 25.04 C ATOM 1867 CD LYS A 114 12.810 8.916 27.644 1.00 73.51 C ATOM 1868 CE LYS A 114 11.661 8.284 28.416 1.00 50.54 C ATOM 1869 NZ LYS A 114 10.337 8.686 27.866 1.00 74.24 N ATOM 0 H LYS A 114 13.985 6.156 24.939 1.00 74.11 H new ATOM 0 HA LYS A 114 14.710 8.788 24.078 1.00 14.23 H new ATOM 0 HB2 LYS A 114 15.255 7.504 26.773 1.00 51.21 H new ATOM 0 HB3 LYS A 114 15.024 9.205 26.420 1.00 51.21 H new ATOM 0 HG2 LYS A 114 12.634 8.357 25.579 1.00 25.04 H new ATOM 0 HG3 LYS A 114 12.980 7.018 26.656 1.00 25.04 H new ATOM 0 HD2 LYS A 114 13.666 9.048 28.306 1.00 73.51 H new ATOM 0 HD3 LYS A 114 12.517 9.908 27.300 1.00 73.51 H new ATOM 0 HE2 LYS A 114 11.754 7.199 28.382 1.00 50.54 H new ATOM 0 HE3 LYS A 114 11.723 8.577 29.464 1.00 50.54 H new ATOM 0 HZ1 LYS A 114 9.586 8.407 28.530 1.00 74.24 H new ATOM 0 HZ2 LYS A 114 10.315 9.717 27.732 1.00 74.24 H new ATOM 0 HZ3 LYS A 114 10.183 8.215 26.952 1.00 74.24 H new ATOM 1883 N GLU A 115 17.063 6.595 24.701 1.00 74.22 N ATOM 1884 CA GLU A 115 18.492 6.336 24.577 1.00 23.21 C ATOM 1885 C GLU A 115 18.939 6.432 23.121 1.00 33.11 C ATOM 1886 O GLU A 115 19.903 7.127 22.801 1.00 12.40 O ATOM 1887 CB GLU A 115 18.833 4.953 25.136 1.00 31.22 C ATOM 1888 CG GLU A 115 18.953 4.921 26.651 1.00 52.14 C ATOM 1889 CD GLU A 115 20.217 5.593 27.150 1.00 62.02 C ATOM 1890 OE1 GLU A 115 21.055 5.981 26.309 1.00 23.34 O ATOM 1891 OE2 GLU A 115 20.368 5.731 28.382 1.00 50.11 O ATOM 0 H GLU A 115 16.504 5.774 24.931 1.00 74.22 H new ATOM 0 HA GLU A 115 19.023 7.094 25.153 1.00 23.21 H new ATOM 0 HB2 GLU A 115 18.064 4.245 24.826 1.00 31.22 H new ATOM 0 HB3 GLU A 115 19.772 4.615 24.698 1.00 31.22 H new ATOM 0 HG2 GLU A 115 18.086 5.414 27.091 1.00 52.14 H new ATOM 0 HG3 GLU A 115 18.938 3.886 26.991 1.00 52.14 H new ATOM 1898 N ARG A 116 18.231 5.728 22.244 1.00 53.44 N ATOM 1899 CA ARG A 116 18.554 5.732 20.822 1.00 3.41 C ATOM 1900 C ARG A 116 18.089 7.027 20.162 1.00 11.12 C ATOM 1901 O ARG A 116 18.527 7.368 19.065 1.00 44.24 O ATOM 1902 CB ARG A 116 17.909 4.532 20.127 1.00 54.41 C ATOM 1903 CG ARG A 116 18.126 3.217 20.856 1.00 32.41 C ATOM 1904 CD ARG A 116 19.605 2.935 21.068 1.00 61.42 C ATOM 1905 NE ARG A 116 19.875 1.506 21.211 1.00 11.54 N ATOM 1906 CZ ARG A 116 21.084 0.971 21.086 1.00 21.15 C ATOM 1907 NH1 ARG A 116 22.129 1.741 20.817 1.00 23.15 N ATOM 1908 NH2 ARG A 116 21.250 -0.338 21.231 1.00 14.33 N ATOM 0 H ARG A 116 17.430 5.148 22.493 1.00 53.44 H new ATOM 0 HA ARG A 116 19.637 5.662 20.721 1.00 3.41 H new ATOM 0 HB2 ARG A 116 16.838 4.711 20.030 1.00 54.41 H new ATOM 0 HB3 ARG A 116 18.311 4.448 19.117 1.00 54.41 H new ATOM 0 HG2 ARG A 116 17.618 3.246 21.820 1.00 32.41 H new ATOM 0 HG3 ARG A 116 17.678 2.404 20.284 1.00 32.41 H new ATOM 0 HD2 ARG A 116 20.174 3.329 20.225 1.00 61.42 H new ATOM 0 HD3 ARG A 116 19.950 3.460 21.959 1.00 61.42 H new ATOM 0 HE ARG A 116 19.092 0.886 21.418 1.00 11.54 H new ATOM 0 HH11 ARG A 116 22.006 2.747 20.705 1.00 23.15 H new ATOM 0 HH12 ARG A 116 23.056 1.327 20.722 1.00 23.15 H new ATOM 0 HH21 ARG A 116 20.449 -0.934 21.439 1.00 14.33 H new ATOM 0 HH22 ARG A 116 22.179 -0.748 21.135 1.00 14.33 H new ATOM 1922 N ASN A 117 17.198 7.743 20.840 1.00 55.33 N ATOM 1923 CA ASN A 117 16.672 9.000 20.319 1.00 73.13 C ATOM 1924 C ASN A 117 15.998 8.789 18.966 1.00 21.32 C ATOM 1925 O ASN A 117 16.230 9.544 18.022 1.00 73.14 O ATOM 1926 CB ASN A 117 17.794 10.031 20.186 1.00 24.15 C ATOM 1927 CG ASN A 117 18.248 10.567 21.530 1.00 24.15 C ATOM 1928 OD1 ASN A 117 17.719 11.562 22.025 1.00 0.13 O ATOM 1929 ND2 ASN A 117 19.234 9.907 22.128 1.00 42.52 N ATOM 0 H ASN A 117 16.825 7.475 21.751 1.00 55.33 H new ATOM 0 HA ASN A 117 15.927 9.372 21.023 1.00 73.13 H new ATOM 0 HB2 ASN A 117 18.642 9.577 19.674 1.00 24.15 H new ATOM 0 HB3 ASN A 117 17.452 10.858 19.565 1.00 24.15 H new ATOM 0 HD21 ASN A 117 19.582 10.221 23.034 1.00 42.52 H new ATOM 0 HD22 ASN A 117 19.643 9.087 21.681 1.00 42.52 H new ATOM 1936 N ILE A 118 15.164 7.758 18.881 1.00 20.14 N ATOM 1937 CA ILE A 118 14.456 7.449 17.646 1.00 72.45 C ATOM 1938 C ILE A 118 13.385 8.494 17.349 1.00 25.50 C ATOM 1939 O ILE A 118 13.506 9.270 16.401 1.00 70.52 O ATOM 1940 CB ILE A 118 13.797 6.058 17.707 1.00 15.13 C ATOM 1941 CG1 ILE A 118 14.808 5.011 18.179 1.00 75.24 C ATOM 1942 CG2 ILE A 118 13.229 5.680 16.347 1.00 10.13 C ATOM 1943 CD1 ILE A 118 16.034 4.915 17.298 1.00 54.32 C ATOM 0 H ILE A 118 14.962 7.123 19.653 1.00 20.14 H new ATOM 0 HA ILE A 118 15.198 7.456 16.848 1.00 72.45 H new ATOM 0 HB ILE A 118 12.977 6.092 18.424 1.00 15.13 H new ATOM 0 HG12 ILE A 118 15.119 5.251 19.196 1.00 75.24 H new ATOM 0 HG13 ILE A 118 14.320 4.037 18.216 1.00 75.24 H new ATOM 0 HG21 ILE A 118 12.767 4.695 16.407 1.00 10.13 H new ATOM 0 HG22 ILE A 118 12.481 6.414 16.048 1.00 10.13 H new ATOM 0 HG23 ILE A 118 14.032 5.660 15.610 1.00 10.13 H new ATOM 0 HD11 ILE A 118 16.707 4.153 17.692 1.00 54.32 H new ATOM 0 HD12 ILE A 118 15.734 4.645 16.285 1.00 54.32 H new ATOM 0 HD13 ILE A 118 16.546 5.877 17.280 1.00 54.32 H new ATOM 1955 N PHE A 119 12.339 8.509 18.168 1.00 53.14 N ATOM 1956 CA PHE A 119 11.247 9.460 17.994 1.00 74.30 C ATOM 1957 C PHE A 119 11.610 10.819 18.585 1.00 73.05 C ATOM 1958 O PHE A 119 12.560 10.938 19.358 1.00 51.00 O ATOM 1959 CB PHE A 119 9.971 8.929 18.652 1.00 2.32 C ATOM 1960 CG PHE A 119 9.614 7.533 18.228 1.00 13.42 C ATOM 1961 CD1 PHE A 119 9.656 7.169 16.892 1.00 33.32 C ATOM 1962 CD2 PHE A 119 9.235 6.586 19.166 1.00 42.01 C ATOM 1963 CE1 PHE A 119 9.328 5.885 16.499 1.00 72.13 C ATOM 1964 CE2 PHE A 119 8.907 5.301 18.778 1.00 34.34 C ATOM 1965 CZ PHE A 119 8.952 4.950 17.443 1.00 13.12 C ATOM 0 H PHE A 119 12.224 7.874 18.958 1.00 53.14 H new ATOM 0 HA PHE A 119 11.072 9.584 16.925 1.00 74.30 H new ATOM 0 HB2 PHE A 119 10.094 8.951 19.735 1.00 2.32 H new ATOM 0 HB3 PHE A 119 9.143 9.596 18.412 1.00 2.32 H new ATOM 0 HD1 PHE A 119 9.948 7.897 16.149 1.00 33.32 H new ATOM 0 HD2 PHE A 119 9.196 6.855 20.211 1.00 42.01 H new ATOM 0 HE1 PHE A 119 9.366 5.613 15.454 1.00 72.13 H new ATOM 0 HE2 PHE A 119 8.615 4.571 19.519 1.00 34.34 H new ATOM 0 HZ PHE A 119 8.694 3.947 17.138 1.00 13.12 H new ATOM 1975 N SER A 120 10.846 11.842 18.213 1.00 21.24 N ATOM 1976 CA SER A 120 11.089 13.194 18.702 1.00 22.01 C ATOM 1977 C SER A 120 10.478 13.389 20.086 1.00 3.34 C ATOM 1978 O SER A 120 9.830 12.492 20.625 1.00 71.55 O ATOM 1979 CB SER A 120 10.512 14.223 17.728 1.00 71.42 C ATOM 1980 OG SER A 120 11.258 15.427 17.756 1.00 21.14 O ATOM 0 H SER A 120 10.054 11.760 17.575 1.00 21.24 H new ATOM 0 HA SER A 120 12.167 13.339 18.776 1.00 22.01 H new ATOM 0 HB2 SER A 120 10.515 13.813 16.718 1.00 71.42 H new ATOM 0 HB3 SER A 120 9.473 14.429 17.986 1.00 71.42 H new ATOM 0 HG SER A 120 10.870 16.067 17.124 1.00 21.14 H new ATOM 1986 N LYS A 121 10.690 14.570 20.658 1.00 22.34 N ATOM 1987 CA LYS A 121 10.161 14.886 21.980 1.00 52.34 C ATOM 1988 C LYS A 121 8.636 14.857 21.976 1.00 73.11 C ATOM 1989 O LYS A 121 8.015 14.319 22.892 1.00 32.21 O ATOM 1990 CB LYS A 121 10.654 16.262 22.433 1.00 52.31 C ATOM 1991 CG LYS A 121 10.571 16.474 23.935 1.00 71.23 C ATOM 1992 CD LYS A 121 11.519 17.567 24.397 1.00 1.40 C ATOM 1993 CE LYS A 121 11.234 17.982 25.832 1.00 0.14 C ATOM 1994 NZ LYS A 121 11.596 19.405 26.081 1.00 42.01 N ATOM 0 H LYS A 121 11.225 15.324 20.227 1.00 22.34 H new ATOM 0 HA LYS A 121 10.520 14.130 22.678 1.00 52.34 H new ATOM 0 HB2 LYS A 121 11.688 16.392 22.113 1.00 52.31 H new ATOM 0 HB3 LYS A 121 10.066 17.032 21.933 1.00 52.31 H new ATOM 0 HG2 LYS A 121 9.550 16.737 24.210 1.00 71.23 H new ATOM 0 HG3 LYS A 121 10.810 15.543 24.449 1.00 71.23 H new ATOM 0 HD2 LYS A 121 12.548 17.216 24.316 1.00 1.40 H new ATOM 0 HD3 LYS A 121 11.425 18.433 23.741 1.00 1.40 H new ATOM 0 HE2 LYS A 121 10.176 17.833 26.050 1.00 0.14 H new ATOM 0 HE3 LYS A 121 11.793 17.341 26.513 1.00 0.14 H new ATOM 0 HZ1 LYS A 121 11.387 19.649 27.070 1.00 42.01 H new ATOM 0 HZ2 LYS A 121 12.611 19.542 25.898 1.00 42.01 H new ATOM 0 HZ3 LYS A 121 11.044 20.019 25.449 1.00 42.01 H new ATOM 2008 N GLN A 122 8.040 15.437 20.939 1.00 14.24 N ATOM 2009 CA GLN A 122 6.587 15.476 20.818 1.00 61.05 C ATOM 2010 C GLN A 122 6.002 14.068 20.829 1.00 21.43 C ATOM 2011 O GLN A 122 4.891 13.850 21.313 1.00 23.41 O ATOM 2012 CB GLN A 122 6.181 16.199 19.532 1.00 22.10 C ATOM 2013 CG GLN A 122 6.272 17.713 19.631 1.00 44.11 C ATOM 2014 CD GLN A 122 5.181 18.308 20.499 1.00 42.00 C ATOM 2015 OE1 GLN A 122 4.063 17.795 20.549 1.00 52.21 O ATOM 2016 NE2 GLN A 122 5.501 19.396 21.189 1.00 11.34 N ATOM 0 H GLN A 122 8.540 15.886 20.171 1.00 14.24 H new ATOM 0 HA GLN A 122 6.191 16.021 21.675 1.00 61.05 H new ATOM 0 HB2 GLN A 122 6.818 15.858 18.716 1.00 22.10 H new ATOM 0 HB3 GLN A 122 5.159 15.921 19.276 1.00 22.10 H new ATOM 0 HG2 GLN A 122 7.245 17.989 20.037 1.00 44.11 H new ATOM 0 HG3 GLN A 122 6.211 18.143 18.631 1.00 44.11 H new ATOM 0 HE21 GLN A 122 6.440 19.787 21.117 1.00 11.34 H new ATOM 0 HE22 GLN A 122 4.808 19.841 21.791 1.00 11.34 H new ATOM 2025 N VAL A 123 6.757 13.114 20.293 1.00 60.11 N ATOM 2026 CA VAL A 123 6.314 11.726 20.242 1.00 32.13 C ATOM 2027 C VAL A 123 6.505 11.038 21.590 1.00 50.45 C ATOM 2028 O VAL A 123 5.565 10.475 22.150 1.00 12.55 O ATOM 2029 CB VAL A 123 7.073 10.933 19.162 1.00 51.34 C ATOM 2030 CG1 VAL A 123 6.565 9.501 19.094 1.00 50.23 C ATOM 2031 CG2 VAL A 123 6.943 11.618 17.809 1.00 4.35 C ATOM 0 H VAL A 123 7.679 13.277 19.888 1.00 60.11 H new ATOM 0 HA VAL A 123 5.253 11.742 19.992 1.00 32.13 H new ATOM 0 HB VAL A 123 8.129 10.906 19.431 1.00 51.34 H new ATOM 0 HG11 VAL A 123 7.113 8.957 18.325 1.00 50.23 H new ATOM 0 HG12 VAL A 123 6.714 9.016 20.059 1.00 50.23 H new ATOM 0 HG13 VAL A 123 5.503 9.503 18.849 1.00 50.23 H new ATOM 0 HG21 VAL A 123 7.485 11.044 17.057 1.00 4.35 H new ATOM 0 HG22 VAL A 123 5.891 11.677 17.531 1.00 4.35 H new ATOM 0 HG23 VAL A 123 7.360 12.623 17.869 1.00 4.35 H new ATOM 2041 N VAL A 124 7.729 11.088 22.105 1.00 43.42 N ATOM 2042 CA VAL A 124 8.045 10.472 23.388 1.00 75.11 C ATOM 2043 C VAL A 124 7.129 10.995 24.489 1.00 75.24 C ATOM 2044 O VAL A 124 6.629 10.228 25.311 1.00 4.00 O ATOM 2045 CB VAL A 124 9.509 10.728 23.789 1.00 3.51 C ATOM 2046 CG1 VAL A 124 9.806 10.114 25.149 1.00 42.15 C ATOM 2047 CG2 VAL A 124 10.455 10.182 22.730 1.00 52.20 C ATOM 0 H VAL A 124 8.519 11.549 21.653 1.00 43.42 H new ATOM 0 HA VAL A 124 7.891 9.399 23.270 1.00 75.11 H new ATOM 0 HB VAL A 124 9.664 11.804 23.862 1.00 3.51 H new ATOM 0 HG11 VAL A 124 10.845 10.305 25.415 1.00 42.15 H new ATOM 0 HG12 VAL A 124 9.152 10.558 25.899 1.00 42.15 H new ATOM 0 HG13 VAL A 124 9.634 9.038 25.108 1.00 42.15 H new ATOM 0 HG21 VAL A 124 11.486 10.372 23.030 1.00 52.20 H new ATOM 0 HG22 VAL A 124 10.300 9.108 22.623 1.00 52.20 H new ATOM 0 HG23 VAL A 124 10.258 10.674 21.778 1.00 52.20 H new ATOM 2057 N ASN A 125 6.912 12.306 24.497 1.00 14.02 N ATOM 2058 CA ASN A 125 6.055 12.932 25.498 1.00 51.55 C ATOM 2059 C ASN A 125 4.665 12.303 25.494 1.00 1.24 C ATOM 2060 O ASN A 125 3.987 12.266 26.521 1.00 30.03 O ATOM 2061 CB ASN A 125 5.947 14.436 25.237 1.00 53.31 C ATOM 2062 CG ASN A 125 6.953 15.236 26.041 1.00 1.32 C ATOM 2063 OD1 ASN A 125 6.585 15.998 26.936 1.00 71.32 O ATOM 2064 ND2 ASN A 125 8.232 15.067 25.725 1.00 33.11 N ATOM 0 H ASN A 125 7.317 12.955 23.823 1.00 14.02 H new ATOM 0 HA ASN A 125 6.504 12.771 26.478 1.00 51.55 H new ATOM 0 HB2 ASN A 125 6.098 14.629 24.175 1.00 53.31 H new ATOM 0 HB3 ASN A 125 4.940 14.773 25.482 1.00 53.31 H new ATOM 0 HD21 ASN A 125 8.954 15.579 26.231 1.00 33.11 H new ATOM 0 HD22 ASN A 125 8.492 14.425 24.976 1.00 33.11 H new ATOM 2071 N ASP A 126 4.248 11.809 24.334 1.00 51.51 N ATOM 2072 CA ASP A 126 2.940 11.180 24.197 1.00 73.12 C ATOM 2073 C ASP A 126 2.939 9.787 24.818 1.00 23.32 C ATOM 2074 O ASP A 126 1.956 9.371 25.432 1.00 61.53 O ATOM 2075 CB ASP A 126 2.543 11.094 22.722 1.00 3.10 C ATOM 2076 CG ASP A 126 1.040 11.056 22.528 1.00 63.52 C ATOM 2077 OD1 ASP A 126 0.339 10.537 23.422 1.00 2.43 O ATOM 2078 OD2 ASP A 126 0.565 11.544 21.482 1.00 51.22 O ATOM 0 H ASP A 126 4.797 11.832 23.475 1.00 51.51 H new ATOM 0 HA ASP A 126 2.212 11.795 24.726 1.00 73.12 H new ATOM 0 HB2 ASP A 126 2.954 11.951 22.188 1.00 3.10 H new ATOM 0 HB3 ASP A 126 2.986 10.201 22.281 1.00 3.10 H new ATOM 2083 N ILE A 127 4.047 9.071 24.654 1.00 33.01 N ATOM 2084 CA ILE A 127 4.173 7.725 25.199 1.00 5.00 C ATOM 2085 C ILE A 127 4.178 7.747 26.724 1.00 43.42 C ATOM 2086 O ILE A 127 3.672 6.830 27.369 1.00 51.21 O ATOM 2087 CB ILE A 127 5.458 7.035 24.703 1.00 41.51 C ATOM 2088 CG1 ILE A 127 5.466 6.962 23.175 1.00 73.44 C ATOM 2089 CG2 ILE A 127 5.580 5.644 25.306 1.00 15.35 C ATOM 2090 CD1 ILE A 127 6.854 6.874 22.581 1.00 61.32 C ATOM 0 H ILE A 127 4.869 9.401 24.149 1.00 33.01 H new ATOM 0 HA ILE A 127 3.308 7.161 24.849 1.00 5.00 H new ATOM 0 HB ILE A 127 6.316 7.625 25.025 1.00 41.51 H new ATOM 0 HG12 ILE A 127 4.888 6.094 22.858 1.00 73.44 H new ATOM 0 HG13 ILE A 127 4.964 7.843 22.775 1.00 73.44 H new ATOM 0 HG21 ILE A 127 6.493 5.170 24.946 1.00 15.35 H new ATOM 0 HG22 ILE A 127 5.615 5.720 26.393 1.00 15.35 H new ATOM 0 HG23 ILE A 127 4.719 5.043 25.012 1.00 15.35 H new ATOM 0 HD11 ILE A 127 6.782 6.825 21.494 1.00 61.32 H new ATOM 0 HD12 ILE A 127 7.429 7.755 22.868 1.00 61.32 H new ATOM 0 HD13 ILE A 127 7.352 5.979 22.952 1.00 61.32 H new ATOM 2102 N GLU A 128 4.753 8.803 27.293 1.00 74.31 N ATOM 2103 CA GLU A 128 4.822 8.945 28.743 1.00 71.45 C ATOM 2104 C GLU A 128 3.445 9.249 29.326 1.00 61.11 C ATOM 2105 O GLU A 128 3.029 8.642 30.313 1.00 64.31 O ATOM 2106 CB GLU A 128 5.805 10.054 29.122 1.00 23.32 C ATOM 2107 CG GLU A 128 7.252 9.723 28.795 1.00 32.22 C ATOM 2108 CD GLU A 128 8.232 10.410 29.726 1.00 41.13 C ATOM 2109 OE1 GLU A 128 8.417 11.638 29.592 1.00 62.31 O ATOM 2110 OE2 GLU A 128 8.814 9.719 30.588 1.00 2.53 O ATOM 0 H GLU A 128 5.177 9.571 26.773 1.00 74.31 H new ATOM 0 HA GLU A 128 5.173 8.001 29.159 1.00 71.45 H new ATOM 0 HB2 GLU A 128 5.524 10.970 28.602 1.00 23.32 H new ATOM 0 HB3 GLU A 128 5.719 10.254 30.190 1.00 23.32 H new ATOM 0 HG2 GLU A 128 7.396 8.644 28.854 1.00 32.22 H new ATOM 0 HG3 GLU A 128 7.465 10.018 27.767 1.00 32.22 H new ATOM 2117 N ARG A 129 2.743 10.194 28.709 1.00 61.44 N ATOM 2118 CA ARG A 129 1.414 10.580 29.167 1.00 42.41 C ATOM 2119 C ARG A 129 0.399 9.478 28.882 1.00 34.45 C ATOM 2120 O ARG A 129 -0.485 9.208 29.696 1.00 4.45 O ATOM 2121 CB ARG A 129 0.976 11.880 28.489 1.00 73.43 C ATOM 2122 CG ARG A 129 0.886 11.776 26.975 1.00 41.21 C ATOM 2123 CD ARG A 129 0.698 13.142 26.333 1.00 13.14 C ATOM 2124 NE ARG A 129 1.826 14.031 26.597 1.00 64.35 N ATOM 2125 CZ ARG A 129 1.895 15.282 26.156 1.00 13.11 C ATOM 2126 NH1 ARG A 129 0.904 15.790 25.435 1.00 24.33 N ATOM 2127 NH2 ARG A 129 2.955 16.029 26.437 1.00 21.40 N ATOM 0 H ARG A 129 3.073 10.706 27.891 1.00 61.44 H new ATOM 0 HA ARG A 129 1.460 10.737 30.245 1.00 42.41 H new ATOM 0 HB2 ARG A 129 0.004 12.176 28.883 1.00 73.43 H new ATOM 0 HB3 ARG A 129 1.679 12.671 28.749 1.00 73.43 H new ATOM 0 HG2 ARG A 129 1.793 11.312 26.587 1.00 41.21 H new ATOM 0 HG3 ARG A 129 0.054 11.127 26.703 1.00 41.21 H new ATOM 0 HD2 ARG A 129 0.575 13.023 25.257 1.00 13.14 H new ATOM 0 HD3 ARG A 129 -0.218 13.597 26.710 1.00 13.14 H new ATOM 0 HE ARG A 129 2.604 13.672 27.151 1.00 64.35 H new ATOM 0 HH11 ARG A 129 0.087 15.220 25.218 1.00 24.33 H new ATOM 0 HH12 ARG A 129 0.959 16.751 25.098 1.00 24.33 H new ATOM 0 HH21 ARG A 129 3.718 15.643 26.992 1.00 21.40 H new ATOM 0 HH22 ARG A 129 3.006 16.989 26.098 1.00 21.40 H new ATOM 2141 N SER A 130 0.531 8.844 27.722 1.00 72.52 N ATOM 2142 CA SER A 130 -0.378 7.773 27.328 1.00 43.12 C ATOM 2143 C SER A 130 -0.452 6.699 28.408 1.00 31.52 C ATOM 2144 O SER A 130 -1.499 6.492 29.024 1.00 62.32 O ATOM 2145 CB SER A 130 0.075 7.152 26.005 1.00 25.11 C ATOM 2146 OG SER A 130 1.420 6.710 26.083 1.00 12.41 O ATOM 0 H SER A 130 1.258 9.053 27.038 1.00 72.52 H new ATOM 0 HA SER A 130 -1.372 8.202 27.198 1.00 43.12 H new ATOM 0 HB2 SER A 130 -0.573 6.313 25.753 1.00 25.11 H new ATOM 0 HB3 SER A 130 -0.025 7.884 25.203 1.00 25.11 H new ATOM 0 HG SER A 130 1.589 6.051 25.378 1.00 12.41 H new ATOM 2152 N LEU A 131 0.666 6.017 28.634 1.00 74.14 N ATOM 2153 CA LEU A 131 0.729 4.963 29.640 1.00 62.42 C ATOM 2154 C LEU A 131 0.291 5.485 31.004 1.00 31.03 C ATOM 2155 O LEU A 131 -0.418 4.802 31.743 1.00 51.22 O ATOM 2156 CB LEU A 131 2.149 4.400 29.728 1.00 32.14 C ATOM 2157 CG LEU A 131 2.508 3.321 28.706 1.00 21.12 C ATOM 2158 CD1 LEU A 131 2.298 3.835 27.291 1.00 53.43 C ATOM 2159 CD2 LEU A 131 3.945 2.860 28.900 1.00 5.20 C ATOM 0 H LEU A 131 1.541 6.175 28.134 1.00 74.14 H new ATOM 0 HA LEU A 131 0.047 4.167 29.341 1.00 62.42 H new ATOM 0 HB2 LEU A 131 2.853 5.225 29.618 1.00 32.14 H new ATOM 0 HB3 LEU A 131 2.294 3.989 30.727 1.00 32.14 H new ATOM 0 HG LEU A 131 1.849 2.467 28.862 1.00 21.12 H new ATOM 0 HD11 LEU A 131 2.559 3.053 26.578 1.00 53.43 H new ATOM 0 HD12 LEU A 131 1.253 4.115 27.157 1.00 53.43 H new ATOM 0 HD13 LEU A 131 2.931 4.706 27.122 1.00 53.43 H new ATOM 0 HD21 LEU A 131 4.183 2.092 28.164 1.00 5.20 H new ATOM 0 HD22 LEU A 131 4.619 3.707 28.772 1.00 5.20 H new ATOM 0 HD23 LEU A 131 4.063 2.450 29.903 1.00 5.20 H new