USER MOD reduce.3.24.130724 H: found=0, std=0, add=1175, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1174 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 119 ASN : amide:sc= -1.82 K(o=-2,f=-2.8!) USER MOD Set 1.2: A 120 SER OG : rot 180:sc= -0.199 USER MOD Set 2.1: A 76 MET CE :methyl -162:sc= -0.265 (180deg=-1.05) USER MOD Set 2.2: A 78 HIS : no HD1:sc= -1.12 K(o=-1.4,f=-4.1!) USER MOD Set 3.1: A 31 ASN : amide:sc= -1.02 X(o=-1.1,f=-0.9) USER MOD Set 3.2: A 35 GLN : amide:sc= -0.0642 K(o=-1.1,f=-4.2!) USER MOD Set 4.1: A 1 MET CE :methyl -160:sc= -0.174 (180deg=-0.834) USER MOD Set 4.2: A 34 MET CE :methyl -136:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -1:sc= 0.427 USER MOD Single : A 3 THR OG1 : rot -160:sc= 0 USER MOD Single : A 10 MET CE :methyl -121:sc= -0.891 (180deg=-2.89!) USER MOD Single : A 14 LYS NZ :NH3+ -164:sc= -0.0695 (180deg=-0.34) USER MOD Single : A 17 GLN : amide:sc= 0.0433 K(o=0.043,f=-0.57) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.0693 X(o=-0.069,f=0) USER MOD Single : A 37 ASN : amide:sc= -0.0208 X(o=-0.021,f=0) USER MOD Single : A 46 THR OG1 : rot -62:sc= 1.07 USER MOD Single : A 52 THR OG1 : rot -156:sc= 0.395 USER MOD Single : A 54 LYS NZ :NH3+ -132:sc= -0.199 (180deg=-1.2) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0.0733 K(o=0.073,f=-5.5!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 150:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -1.53 K(o=-1.5,f=-3.3) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 59:sc= 0.411 USER MOD Single : A 88 CYS SG : rot -109:sc= 0.0879 USER MOD Single : A 93 GLN : amide:sc= -2.95 X(o=-3,f=-2.6!) USER MOD Single : A 94 ASN : amide:sc= -0.135 K(o=-0.13,f=-5!) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 142:sc= 0.16 USER MOD Single : A 107 THR OG1 : rot -18:sc= 0.186 USER MOD Single : A 108 SER OG : rot 82:sc= 1.28 USER MOD Single : A 110 GLN : amide:sc= -0.479 K(o=-0.48,f=-1.3) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -3.72! K(o=-3.7!,f=0.13) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= -4.55! C(o=-4.6!,f=-5.9!) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= -1.03 K(o=-1,f=-0.0019) USER MOD Single : A 133 ASN : amide:sc=-0.00325 K(o=-0.0032,f=-0.87) USER MOD Single : A 134 LYS NZ :NH3+ -161:sc= -0.113 (180deg=-0.54) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot -16:sc= 0.433 USER MOD Single : A 147 GLN : amide:sc= -2.74! K(o=-2.7!,f=-0.32) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 150 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.530 -1.908 12.903 1.00 0.00 N ATOM 2 CA MET A 1 -23.623 -1.354 11.867 1.00 0.00 C ATOM 3 C MET A 1 -24.401 -0.949 10.620 0.75 0.00 C ATOM 4 O MET A 1 -24.914 -1.799 9.893 0.20 0.00 O ATOM 5 CB MET A 1 -22.555 -2.384 11.495 1.00 0.00 C ATOM 6 CG MET A 1 -21.545 -1.875 10.481 0.06 0.00 C ATOM 7 SD MET A 1 -20.317 -3.119 10.036 0.17 0.00 S ATOM 8 CE MET A 1 -19.588 -3.465 11.635 0.27 0.00 C ATOM 0 H1 MET A 1 -23.976 -2.176 13.742 1.00 0.00 H new ATOM 0 H2 MET A 1 -25.234 -1.190 13.168 1.00 0.00 H new ATOM 0 H3 MET A 1 -25.016 -2.747 12.526 1.00 0.00 H new ATOM 0 HA MET A 1 -23.142 -0.467 12.279 1.00 0.00 H new ATOM 0 HB2 MET A 1 -22.027 -2.690 12.398 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.043 -3.272 11.094 1.00 0.00 H new ATOM 0 HG2 MET A 1 -22.070 -1.551 9.582 0.06 0.00 H new ATOM 0 HG3 MET A 1 -21.038 -0.999 10.887 0.06 0.00 H new ATOM 0 HE1 MET A 1 -18.609 -3.924 11.497 0.27 0.00 H new ATOM 0 HE2 MET A 1 -19.478 -2.535 12.193 0.27 0.00 H new ATOM 0 HE3 MET A 1 -20.233 -4.147 12.189 0.27 0.00 H new ATOM 20 N SER A 2 -24.487 0.356 10.382 0.06 0.00 N ATOM 21 CA SER A 2 -25.204 0.877 9.223 0.09 0.00 C ATOM 22 C SER A 2 -24.684 2.256 8.835 1.00 0.00 C ATOM 23 O SER A 2 -24.856 3.224 9.575 0.39 0.00 O ATOM 24 CB SER A 2 -26.704 0.950 9.514 1.00 0.00 C ATOM 25 OG SER A 2 -27.235 -0.335 9.786 1.00 0.00 O ATOM 0 H SER A 2 -24.069 1.072 10.976 0.06 0.00 H new ATOM 0 HA SER A 2 -25.035 0.196 8.389 0.09 0.00 H new ATOM 0 HB2 SER A 2 -26.881 1.607 10.365 1.00 0.00 H new ATOM 0 HB3 SER A 2 -27.222 1.388 8.661 1.00 0.00 H new ATOM 0 HG SER A 2 -26.524 -1.005 9.711 1.00 0.00 H new ATOM 31 N THR A 3 -24.049 2.336 7.669 0.46 0.00 N ATOM 32 CA THR A 3 -23.504 3.595 7.178 1.00 0.00 C ATOM 33 C THR A 3 -23.473 3.630 5.652 0.23 0.00 C ATOM 34 O THR A 3 -23.414 2.585 5.003 0.06 0.00 O ATOM 35 CB THR A 3 -22.083 3.847 7.715 0.13 0.00 C ATOM 36 OG1 THR A 3 -21.378 2.607 7.843 0.06 0.00 O ATOM 37 CG2 THR A 3 -22.131 4.558 9.058 1.00 0.00 C ATOM 0 H THR A 3 -23.900 1.542 7.047 0.46 0.00 H new ATOM 0 HA THR A 3 -24.165 4.382 7.542 1.00 0.00 H new ATOM 0 HB THR A 3 -21.557 4.486 7.005 0.13 0.00 H new ATOM 0 HG1 THR A 3 -20.626 2.721 8.461 0.06 0.00 H new ATOM 0 HG21 THR A 3 -21.116 4.725 9.418 1.00 0.00 H new ATOM 0 HG22 THR A 3 -22.638 5.516 8.945 1.00 0.00 H new ATOM 0 HG23 THR A 3 -22.673 3.943 9.776 1.00 0.00 H new ATOM 45 N PRO A 4 -23.508 4.839 5.059 0.19 0.00 N ATOM 46 CA PRO A 4 -23.488 5.008 3.600 1.00 0.00 C ATOM 47 C PRO A 4 -22.161 4.579 2.980 0.29 0.00 C ATOM 48 O PRO A 4 -22.117 4.145 1.829 0.22 0.00 O ATOM 49 CB PRO A 4 -23.703 6.512 3.410 0.34 0.00 C ATOM 50 CG PRO A 4 -23.241 7.126 4.686 1.00 0.00 C ATOM 51 CD PRO A 4 -23.574 6.134 5.761 0.09 0.00 C ATOM 0 HA PRO A 4 -24.242 4.390 3.112 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -23.133 6.889 2.561 0.34 0.00 H new ATOM 0 HB3 PRO A 4 -24.751 6.741 3.218 0.34 0.00 H new ATOM 0 HG2 PRO A 4 -22.170 7.327 4.658 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -23.740 8.079 4.865 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -22.863 6.181 6.586 0.09 0.00 H new ATOM 0 HD3 PRO A 4 -24.563 6.314 6.182 0.09 0.00 H new ATOM 59 N ALA A 5 -21.082 4.703 3.748 1.00 0.00 N ATOM 60 CA ALA A 5 -19.757 4.329 3.267 1.00 0.00 C ATOM 61 C ALA A 5 -19.612 2.815 3.172 1.00 0.00 C ATOM 62 O ALA A 5 -18.999 2.296 2.240 1.00 0.00 O ATOM 63 CB ALA A 5 -18.684 4.907 4.176 1.00 0.00 C ATOM 0 H ALA A 5 -21.100 5.059 4.704 1.00 0.00 H new ATOM 0 HA ALA A 5 -19.632 4.742 2.266 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -17.700 4.620 3.805 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -18.764 5.994 4.188 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -18.817 4.522 5.187 1.00 0.00 H new ATOM 69 N ARG A 6 -20.181 2.110 4.146 0.12 0.00 N ATOM 70 CA ARG A 6 -20.115 0.655 4.171 0.16 0.00 C ATOM 71 C ARG A 6 -20.888 0.059 2.999 0.20 0.00 C ATOM 72 O ARG A 6 -20.540 -1.006 2.490 0.05 0.00 O ATOM 73 CB ARG A 6 -20.671 0.125 5.497 0.38 0.00 C ATOM 74 CG ARG A 6 -20.519 -1.380 5.671 0.88 0.00 C ATOM 75 CD ARG A 6 -21.741 -2.130 5.161 0.59 0.00 C ATOM 76 NE ARG A 6 -22.958 -1.722 5.854 0.12 0.00 N ATOM 77 CZ ARG A 6 -24.146 -2.286 5.657 0.35 0.00 C ATOM 78 NH1 ARG A 6 -24.280 -3.279 4.787 1.00 0.00 N ATOM 79 NH2 ARG A 6 -25.204 -1.856 6.330 1.00 0.00 N ATOM 0 H ARG A 6 -20.692 2.523 4.926 0.12 0.00 H new ATOM 0 HA ARG A 6 -19.071 0.356 4.080 0.16 0.00 H new ATOM 0 HB2 ARG A 6 -20.164 0.629 6.320 0.38 0.00 H new ATOM 0 HB3 ARG A 6 -21.727 0.384 5.567 0.38 0.00 H new ATOM 0 HG2 ARG A 6 -19.633 -1.721 5.136 0.88 0.00 H new ATOM 0 HG3 ARG A 6 -20.363 -1.611 6.725 0.88 0.00 H new ATOM 0 HD2 ARG A 6 -21.855 -1.953 4.092 0.59 0.00 H new ATOM 0 HD3 ARG A 6 -21.590 -3.202 5.292 0.59 0.00 H new ATOM 0 HE ARG A 6 -22.894 -0.960 6.529 0.12 0.00 H new ATOM 0 HH11 ARG A 6 -23.469 -3.613 4.266 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -25.194 -3.708 4.640 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -25.107 -1.092 6.999 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -26.115 -2.289 6.179 1.00 0.00 H new ATOM 93 N ARG A 7 -21.937 0.756 2.575 0.93 0.00 N ATOM 94 CA ARG A 7 -22.758 0.299 1.462 0.55 0.00 C ATOM 95 C ARG A 7 -21.981 0.370 0.151 0.22 0.00 C ATOM 96 O ARG A 7 -22.016 -0.560 -0.656 0.22 0.00 O ATOM 97 CB ARG A 7 -24.030 1.144 1.362 0.26 0.00 C ATOM 98 CG ARG A 7 -24.955 0.722 0.233 0.09 0.00 C ATOM 99 CD ARG A 7 -26.224 1.559 0.210 0.10 0.00 C ATOM 100 NE ARG A 7 -26.997 1.414 1.440 1.00 0.00 N ATOM 101 CZ ARG A 7 -28.232 1.881 1.595 0.06 0.00 C ATOM 102 NH1 ARG A 7 -28.836 2.515 0.598 0.64 0.00 N ATOM 103 NH2 ARG A 7 -28.865 1.712 2.747 0.13 0.00 N ATOM 0 H ARG A 7 -22.238 1.640 2.986 0.93 0.00 H new ATOM 0 HA ARG A 7 -23.033 -0.740 1.645 0.55 0.00 H new ATOM 0 HB2 ARG A 7 -24.572 1.083 2.306 0.26 0.00 H new ATOM 0 HB3 ARG A 7 -23.752 2.188 1.221 0.26 0.00 H new ATOM 0 HG2 ARG A 7 -24.436 0.820 -0.720 0.09 0.00 H new ATOM 0 HG3 ARG A 7 -25.214 -0.331 0.348 0.09 0.00 H new ATOM 0 HD2 ARG A 7 -25.964 2.608 0.067 0.10 0.00 H new ATOM 0 HD3 ARG A 7 -26.838 1.264 -0.641 0.10 0.00 H new ATOM 0 HE ARG A 7 -26.565 0.927 2.225 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -28.353 2.645 -0.291 0.64 0.00 H new ATOM 0 HH12 ARG A 7 -29.784 2.872 0.720 0.64 0.00 H new ATOM 0 HH21 ARG A 7 -28.405 1.224 3.515 0.13 0.00 H new ATOM 0 HH22 ARG A 7 -29.813 2.070 2.866 0.13 0.00 H new ATOM 117 N ARG A 8 -21.282 1.482 -0.054 0.15 0.00 N ATOM 118 CA ARG A 8 -20.492 1.681 -1.263 1.00 0.00 C ATOM 119 C ARG A 8 -19.427 0.599 -1.408 0.52 0.00 C ATOM 120 O ARG A 8 -19.224 0.058 -2.497 1.00 0.00 O ATOM 121 CB ARG A 8 -19.834 3.063 -1.241 0.27 0.00 C ATOM 122 CG ARG A 8 -20.829 4.213 -1.250 0.62 0.00 C ATOM 123 CD ARG A 8 -21.599 4.278 -2.559 0.55 0.00 C ATOM 124 NE ARG A 8 -20.715 4.484 -3.702 0.67 0.00 N ATOM 125 CZ ARG A 8 -21.108 5.028 -4.851 0.73 0.00 C ATOM 126 NH1 ARG A 8 -22.364 5.423 -5.011 1.00 0.00 N ATOM 127 NH2 ARG A 8 -20.239 5.179 -5.843 0.14 0.00 N ATOM 0 H ARG A 8 -21.247 2.261 0.604 0.15 0.00 H new ATOM 0 HA ARG A 8 -21.163 1.616 -2.120 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -19.207 3.143 -0.353 0.27 0.00 H new ATOM 0 HB3 ARG A 8 -19.176 3.156 -2.105 0.27 0.00 H new ATOM 0 HG2 ARG A 8 -21.528 4.096 -0.422 0.62 0.00 H new ATOM 0 HG3 ARG A 8 -20.301 5.153 -1.091 0.62 0.00 H new ATOM 0 HD2 ARG A 8 -22.160 3.354 -2.696 0.55 0.00 H new ATOM 0 HD3 ARG A 8 -22.326 5.088 -2.512 0.55 0.00 H new ATOM 0 HE ARG A 8 -19.741 4.195 -3.615 0.67 0.00 H new ATOM 0 HH11 ARG A 8 -23.035 5.310 -4.251 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -22.659 5.839 -5.894 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -19.272 4.878 -5.724 0.14 0.00 H new ATOM 0 HH22 ARG A 8 -20.539 5.596 -6.724 0.14 0.00 H new ATOM 141 N LEU A 9 -18.752 0.288 -0.305 0.11 0.00 N ATOM 142 CA LEU A 9 -17.700 -0.727 -0.309 0.10 0.00 C ATOM 143 C LEU A 9 -18.220 -2.068 -0.817 0.31 0.00 C ATOM 144 O LEU A 9 -17.464 -2.860 -1.381 1.00 0.00 O ATOM 145 CB LEU A 9 -17.119 -0.894 1.097 1.00 0.00 C ATOM 146 CG LEU A 9 -16.178 0.223 1.549 0.58 0.00 C ATOM 147 CD1 LEU A 9 -15.979 0.175 3.056 1.00 0.00 C ATOM 148 CD2 LEU A 9 -14.837 0.116 0.832 0.22 0.00 C ATOM 0 H LEU A 9 -18.914 0.723 0.603 0.11 0.00 H new ATOM 0 HA LEU A 9 -16.916 -0.389 -0.986 0.10 0.00 H new ATOM 0 HB2 LEU A 9 -17.943 -0.963 1.807 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -16.581 -1.841 1.140 1.00 0.00 H new ATOM 0 HG LEU A 9 -16.632 1.180 1.291 0.58 0.00 H new ATOM 0 HD11 LEU A 9 -15.306 0.977 3.360 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -16.941 0.299 3.554 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -15.547 -0.786 3.336 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -14.180 0.919 1.166 0.22 0.00 H new ATOM 0 HD22 LEU A 9 -14.378 -0.846 1.060 0.22 0.00 H new ATOM 0 HD23 LEU A 9 -14.992 0.198 -0.244 0.22 0.00 H new ATOM 160 N MET A 10 -19.509 -2.321 -0.613 0.29 0.00 N ATOM 161 CA MET A 10 -20.113 -3.572 -1.059 1.00 0.00 C ATOM 162 C MET A 10 -20.146 -3.643 -2.581 1.00 0.00 C ATOM 163 O MET A 10 -19.948 -4.708 -3.167 1.00 0.00 O ATOM 164 CB MET A 10 -21.529 -3.721 -0.498 0.09 0.00 C ATOM 165 CG MET A 10 -21.582 -3.787 1.021 0.52 0.00 C ATOM 166 SD MET A 10 -23.173 -4.373 1.636 0.09 0.00 S ATOM 167 CE MET A 10 -24.279 -3.140 0.954 1.00 0.00 C ATOM 0 H MET A 10 -20.152 -1.682 -0.145 0.29 0.00 H new ATOM 0 HA MET A 10 -19.501 -4.392 -0.684 1.00 0.00 H new ATOM 0 HB2 MET A 10 -22.135 -2.881 -0.838 0.09 0.00 H new ATOM 0 HB3 MET A 10 -21.979 -4.625 -0.908 0.09 0.00 H new ATOM 0 HG2 MET A 10 -20.793 -4.447 1.380 0.52 0.00 H new ATOM 0 HG3 MET A 10 -21.381 -2.797 1.431 0.52 0.00 H new ATOM 0 HE1 MET A 10 -24.816 -2.645 1.763 1.00 0.00 H new ATOM 0 HE2 MET A 10 -23.702 -2.402 0.397 1.00 0.00 H new ATOM 0 HE3 MET A 10 -24.993 -3.622 0.286 1.00 0.00 H new ATOM 177 N ARG A 11 -20.397 -2.503 -3.218 0.79 0.00 N ATOM 178 CA ARG A 11 -20.451 -2.438 -4.673 0.66 0.00 C ATOM 179 C ARG A 11 -19.048 -2.500 -5.268 0.55 0.00 C ATOM 180 O ARG A 11 -18.860 -2.977 -6.389 0.05 0.00 O ATOM 181 CB ARG A 11 -21.156 -1.158 -5.129 0.12 0.00 C ATOM 182 CG ARG A 11 -22.471 -0.898 -4.411 0.59 0.00 C ATOM 183 CD ARG A 11 -23.366 0.036 -5.209 1.00 0.00 C ATOM 184 NE ARG A 11 -22.640 1.202 -5.705 0.42 0.00 N ATOM 185 CZ ARG A 11 -23.210 2.189 -6.390 0.06 0.00 C ATOM 186 NH1 ARG A 11 -24.513 2.158 -6.642 0.87 0.00 N ATOM 187 NH2 ARG A 11 -22.480 3.205 -6.822 1.00 0.00 N ATOM 0 H ARG A 11 -20.566 -1.613 -2.749 0.79 0.00 H new ATOM 0 HA ARG A 11 -21.019 -3.298 -5.028 0.66 0.00 H new ATOM 0 HB2 ARG A 11 -20.490 -0.310 -4.969 0.12 0.00 H new ATOM 0 HB3 ARG A 11 -21.343 -1.218 -6.201 0.12 0.00 H new ATOM 0 HG2 ARG A 11 -22.988 -1.843 -4.242 0.59 0.00 H new ATOM 0 HG3 ARG A 11 -22.272 -0.464 -3.431 0.59 0.00 H new ATOM 0 HD2 ARG A 11 -23.797 -0.507 -6.050 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -24.195 0.365 -4.583 1.00 0.00 H new ATOM 0 HE ARG A 11 -21.640 1.263 -5.515 0.42 0.00 H new ATOM 0 HH11 ARG A 11 -25.078 1.376 -6.310 0.87 0.00 H new ATOM 0 HH12 ARG A 11 -24.949 2.916 -7.168 0.87 0.00 H new ATOM 0 HH21 ARG A 11 -21.479 3.232 -6.630 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -22.919 3.961 -7.347 1.00 0.00 H new ATOM 201 N ASP A 12 -18.066 -2.017 -4.514 0.08 0.00 N ATOM 202 CA ASP A 12 -16.680 -2.023 -4.969 1.00 0.00 C ATOM 203 C ASP A 12 -16.102 -3.432 -4.927 1.00 0.00 C ATOM 204 O ASP A 12 -15.369 -3.838 -5.828 0.18 0.00 O ATOM 205 CB ASP A 12 -15.830 -1.084 -4.111 0.07 0.00 C ATOM 206 CG ASP A 12 -16.224 0.371 -4.278 0.79 0.00 C ATOM 207 OD1 ASP A 12 -15.856 0.970 -5.312 0.30 0.00 O ATOM 208 OD2 ASP A 12 -16.898 0.911 -3.378 0.64 0.00 O ATOM 0 H ASP A 12 -18.204 -1.617 -3.586 0.08 0.00 H new ATOM 0 HA ASP A 12 -16.663 -1.671 -6.001 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -15.929 -1.366 -3.063 0.07 0.00 H new ATOM 0 HB3 ASP A 12 -14.780 -1.205 -4.376 0.07 0.00 H new ATOM 213 N PHE A 13 -16.435 -4.172 -3.872 1.00 0.00 N ATOM 214 CA PHE A 13 -15.948 -5.537 -3.718 0.99 0.00 C ATOM 215 C PHE A 13 -16.399 -6.404 -4.888 0.42 0.00 C ATOM 216 O PHE A 13 -15.644 -7.243 -5.378 1.00 0.00 O ATOM 217 CB PHE A 13 -16.437 -6.136 -2.397 0.13 0.00 C ATOM 218 CG PHE A 13 -15.978 -7.551 -2.172 0.42 0.00 C ATOM 219 CD1 PHE A 13 -14.660 -7.910 -2.409 0.43 0.00 C ATOM 220 CD2 PHE A 13 -16.863 -8.520 -1.725 0.08 0.00 C ATOM 221 CE1 PHE A 13 -14.233 -9.208 -2.204 0.44 0.00 C ATOM 222 CE2 PHE A 13 -16.441 -9.819 -1.517 0.35 0.00 C ATOM 223 CZ PHE A 13 -15.124 -10.163 -1.758 0.06 0.00 C ATOM 0 H PHE A 13 -17.038 -3.849 -3.115 1.00 0.00 H new ATOM 0 HA PHE A 13 -14.858 -5.510 -3.706 0.99 0.00 H new ATOM 0 HB2 PHE A 13 -16.087 -5.514 -1.574 0.13 0.00 H new ATOM 0 HB3 PHE A 13 -17.526 -6.108 -2.376 0.13 0.00 H new ATOM 0 HD1 PHE A 13 -13.959 -7.166 -2.758 0.43 0.00 H new ATOM 0 HD2 PHE A 13 -17.893 -8.257 -1.537 0.08 0.00 H new ATOM 0 HE1 PHE A 13 -13.204 -9.475 -2.392 0.44 0.00 H new ATOM 0 HE2 PHE A 13 -17.139 -10.565 -1.167 0.35 0.00 H new ATOM 0 HZ PHE A 13 -14.793 -11.178 -1.597 0.06 0.00 H new ATOM 233 N LYS A 14 -17.636 -6.201 -5.326 0.10 0.00 N ATOM 234 CA LYS A 14 -18.184 -6.956 -6.443 0.05 0.00 C ATOM 235 C LYS A 14 -17.367 -6.722 -7.707 1.00 0.00 C ATOM 236 O LYS A 14 -16.943 -7.670 -8.370 1.00 0.00 O ATOM 237 CB LYS A 14 -19.633 -6.561 -6.677 0.47 0.00 C ATOM 238 CG LYS A 14 -20.567 -7.752 -6.675 1.00 0.00 C ATOM 239 CD LYS A 14 -22.014 -7.323 -6.791 1.00 0.00 C ATOM 240 CE LYS A 14 -22.470 -6.538 -5.570 0.39 0.00 C ATOM 241 NZ LYS A 14 -22.311 -7.323 -4.314 0.73 0.00 N ATOM 0 H LYS A 14 -18.278 -5.519 -4.923 0.10 0.00 H new ATOM 0 HA LYS A 14 -18.138 -8.017 -6.197 0.05 0.00 H new ATOM 0 HB2 LYS A 14 -19.944 -5.858 -5.904 0.47 0.00 H new ATOM 0 HB3 LYS A 14 -19.715 -6.041 -7.632 0.47 0.00 H new ATOM 0 HG2 LYS A 14 -20.315 -8.414 -7.503 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -20.428 -8.323 -5.757 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -22.141 -6.712 -7.684 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -22.645 -8.203 -6.914 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -21.895 -5.615 -5.496 0.39 0.00 H new ATOM 0 HE3 LYS A 14 -23.515 -6.254 -5.691 0.39 0.00 H new ATOM 0 HZ1 LYS A 14 -22.869 -6.881 -3.555 0.73 0.00 H new ATOM 0 HZ2 LYS A 14 -22.645 -8.296 -4.468 0.73 0.00 H new ATOM 0 HZ3 LYS A 14 -21.308 -7.341 -4.041 0.73 0.00 H new ATOM 255 N ARG A 15 -17.153 -5.453 -8.035 0.24 0.00 N ATOM 256 CA ARG A 15 -16.385 -5.084 -9.217 0.18 0.00 C ATOM 257 C ARG A 15 -14.981 -5.682 -9.161 1.00 0.00 C ATOM 258 O ARG A 15 -14.385 -5.981 -10.196 1.00 0.00 O ATOM 259 CB ARG A 15 -16.296 -3.561 -9.336 0.10 0.00 C ATOM 260 CG ARG A 15 -16.019 -3.075 -10.749 1.00 0.00 C ATOM 261 CD ARG A 15 -17.302 -2.954 -11.558 0.10 0.00 C ATOM 262 NE ARG A 15 -17.987 -4.236 -11.703 0.26 0.00 N ATOM 263 CZ ARG A 15 -19.225 -4.361 -12.173 0.40 0.00 C ATOM 264 NH1 ARG A 15 -19.905 -3.289 -12.558 0.13 0.00 N ATOM 265 NH2 ARG A 15 -19.784 -5.560 -12.261 0.28 0.00 N ATOM 0 H ARG A 15 -17.502 -4.660 -7.496 0.24 0.00 H new ATOM 0 HA ARG A 15 -16.897 -5.482 -10.093 0.18 0.00 H new ATOM 0 HB2 ARG A 15 -17.231 -3.123 -8.987 0.10 0.00 H new ATOM 0 HB3 ARG A 15 -15.508 -3.199 -8.675 0.10 0.00 H new ATOM 0 HG2 ARG A 15 -15.519 -2.107 -10.711 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -15.338 -3.766 -11.246 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -17.969 -2.241 -11.074 0.10 0.00 H new ATOM 0 HD3 ARG A 15 -17.070 -2.554 -12.545 0.10 0.00 H new ATOM 0 HE ARG A 15 -17.488 -5.082 -11.429 0.26 0.00 H new ATOM 0 HH11 ARG A 15 -19.479 -2.365 -12.494 0.13 0.00 H new ATOM 0 HH12 ARG A 15 -20.854 -3.389 -12.918 0.13 0.00 H new ATOM 0 HH21 ARG A 15 -19.265 -6.388 -11.968 0.28 0.00 H new ATOM 0 HH22 ARG A 15 -20.733 -5.655 -12.622 0.28 0.00 H new ATOM 279 N LEU A 16 -14.460 -5.852 -7.949 0.10 0.00 N ATOM 280 CA LEU A 16 -13.129 -6.414 -7.766 1.00 0.00 C ATOM 281 C LEU A 16 -13.060 -7.834 -8.320 0.67 0.00 C ATOM 282 O LEU A 16 -12.103 -8.199 -9.003 0.67 0.00 O ATOM 283 CB LEU A 16 -12.745 -6.417 -6.285 0.08 0.00 C ATOM 284 CG LEU A 16 -11.356 -6.982 -5.981 0.27 0.00 C ATOM 285 CD1 LEU A 16 -10.274 -6.075 -6.548 1.00 0.00 C ATOM 286 CD2 LEU A 16 -11.168 -7.167 -4.484 1.00 0.00 C ATOM 0 H LEU A 16 -14.939 -5.609 -7.082 0.10 0.00 H new ATOM 0 HA LEU A 16 -12.423 -5.789 -8.314 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.796 -5.395 -5.909 0.08 0.00 H new ATOM 0 HB3 LEU A 16 -13.486 -6.996 -5.734 0.08 0.00 H new ATOM 0 HG LEU A 16 -11.272 -7.958 -6.459 0.27 0.00 H new ATOM 0 HD11 LEU A 16 -9.293 -6.493 -6.322 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.395 -5.996 -7.628 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -10.358 -5.085 -6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.174 -7.570 -4.289 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.275 -6.205 -3.982 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.920 -7.859 -4.106 1.00 0.00 H new ATOM 298 N GLN A 17 -14.082 -8.631 -8.022 0.87 0.00 N ATOM 299 CA GLN A 17 -14.144 -10.005 -8.487 0.08 0.00 C ATOM 300 C GLN A 17 -14.252 -10.068 -10.007 0.13 0.00 C ATOM 301 O GLN A 17 -13.565 -10.856 -10.655 0.51 0.00 O ATOM 302 CB GLN A 17 -15.341 -10.712 -7.855 0.35 0.00 C ATOM 303 CG GLN A 17 -15.342 -10.672 -6.336 0.07 0.00 C ATOM 304 CD GLN A 17 -16.565 -11.337 -5.736 0.16 0.00 C ATOM 305 OE1 GLN A 17 -17.120 -12.275 -6.309 1.00 0.00 O ATOM 306 NE2 GLN A 17 -16.997 -10.848 -4.580 0.08 0.00 N ATOM 0 H GLN A 17 -14.881 -8.343 -7.457 0.87 0.00 H new ATOM 0 HA GLN A 17 -13.223 -10.506 -8.189 0.08 0.00 H new ATOM 0 HB2 GLN A 17 -16.259 -10.252 -8.222 0.35 0.00 H new ATOM 0 HB3 GLN A 17 -15.352 -11.752 -8.182 0.35 0.00 H new ATOM 0 HG2 GLN A 17 -14.445 -11.166 -5.963 0.07 0.00 H new ATOM 0 HG3 GLN A 17 -15.297 -9.635 -6.004 0.07 0.00 H new ATOM 0 HE21 GLN A 17 -16.506 -10.069 -4.140 0.08 0.00 H new ATOM 0 HE22 GLN A 17 -17.820 -11.251 -4.131 0.08 0.00 H new ATOM 315 N GLU A 18 -15.120 -9.231 -10.566 0.45 0.00 N ATOM 316 CA GLU A 18 -15.326 -9.193 -12.011 0.10 0.00 C ATOM 317 C GLU A 18 -14.049 -8.787 -12.739 0.53 0.00 C ATOM 318 O GLU A 18 -13.856 -9.129 -13.907 0.08 0.00 O ATOM 319 CB GLU A 18 -16.454 -8.220 -12.359 1.00 0.00 C ATOM 320 CG GLU A 18 -17.741 -8.478 -11.591 0.67 0.00 C ATOM 321 CD GLU A 18 -18.303 -9.863 -11.844 1.00 0.00 C ATOM 322 OE1 GLU A 18 -19.094 -10.018 -12.798 0.33 0.00 O ATOM 323 OE2 GLU A 18 -17.952 -10.794 -11.087 1.00 0.00 O ATOM 0 H GLU A 18 -15.692 -8.570 -10.041 0.45 0.00 H new ATOM 0 HA GLU A 18 -15.602 -10.196 -12.337 0.10 0.00 H new ATOM 0 HB2 GLU A 18 -16.119 -7.202 -12.158 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -16.660 -8.283 -13.428 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -17.554 -8.355 -10.524 0.67 0.00 H new ATOM 0 HG3 GLU A 18 -18.484 -7.732 -11.873 0.67 0.00 H new ATOM 330 N ASP A 19 -13.176 -8.060 -12.047 1.00 0.00 N ATOM 331 CA ASP A 19 -11.922 -7.609 -12.639 0.29 0.00 C ATOM 332 C ASP A 19 -10.907 -7.224 -11.563 0.10 0.00 C ATOM 333 O ASP A 19 -10.764 -6.048 -11.228 1.00 0.00 O ATOM 334 CB ASP A 19 -12.171 -6.420 -13.568 0.32 0.00 C ATOM 335 CG ASP A 19 -10.900 -5.928 -14.231 0.10 0.00 C ATOM 336 OD1 ASP A 19 -10.454 -6.567 -15.207 0.19 0.00 O ATOM 337 OD2 ASP A 19 -10.350 -4.902 -13.775 0.06 0.00 O ATOM 0 H ASP A 19 -13.314 -7.772 -11.078 1.00 0.00 H new ATOM 0 HA ASP A 19 -11.510 -8.436 -13.216 0.29 0.00 H new ATOM 0 HB2 ASP A 19 -12.890 -6.706 -14.335 0.32 0.00 H new ATOM 0 HB3 ASP A 19 -12.619 -5.606 -12.999 0.32 0.00 H new ATOM 342 N PRO A 20 -10.195 -8.216 -10.996 0.99 0.00 N ATOM 343 CA PRO A 20 -9.182 -7.972 -9.967 0.29 0.00 C ATOM 344 C PRO A 20 -7.873 -7.467 -10.570 0.09 0.00 C ATOM 345 O PRO A 20 -7.552 -7.786 -11.715 0.41 0.00 O ATOM 346 CB PRO A 20 -8.986 -9.354 -9.346 0.07 0.00 C ATOM 347 CG PRO A 20 -9.265 -10.303 -10.458 0.58 0.00 C ATOM 348 CD PRO A 20 -10.328 -9.655 -11.307 0.48 0.00 C ATOM 0 HA PRO A 20 -9.486 -7.207 -9.253 0.29 0.00 H new ATOM 0 HB2 PRO A 20 -7.973 -9.477 -8.963 0.07 0.00 H new ATOM 0 HB3 PRO A 20 -9.665 -9.513 -8.508 0.07 0.00 H new ATOM 0 HG2 PRO A 20 -8.364 -10.495 -11.041 0.58 0.00 H new ATOM 0 HG3 PRO A 20 -9.606 -11.264 -10.073 0.58 0.00 H new ATOM 0 HD2 PRO A 20 -10.169 -9.852 -12.367 0.48 0.00 H new ATOM 0 HD3 PRO A 20 -11.322 -10.028 -11.059 0.48 0.00 H new ATOM 356 N PRO A 21 -7.094 -6.669 -9.815 0.39 0.00 N ATOM 357 CA PRO A 21 -5.821 -6.134 -10.303 0.48 0.00 C ATOM 358 C PRO A 21 -4.753 -7.215 -10.435 0.18 0.00 C ATOM 359 O PRO A 21 -4.660 -8.113 -9.596 0.21 0.00 O ATOM 360 CB PRO A 21 -5.424 -5.118 -9.231 0.08 0.00 C ATOM 361 CG PRO A 21 -6.097 -5.595 -7.993 0.16 0.00 C ATOM 362 CD PRO A 21 -7.386 -6.227 -8.438 0.95 0.00 C ATOM 0 HA PRO A 21 -5.916 -5.703 -11.300 0.48 0.00 H new ATOM 0 HB2 PRO A 21 -4.342 -5.078 -9.104 0.08 0.00 H new ATOM 0 HB3 PRO A 21 -5.751 -4.113 -9.497 0.08 0.00 H new ATOM 0 HG2 PRO A 21 -5.473 -6.314 -7.462 0.16 0.00 H new ATOM 0 HG3 PRO A 21 -6.284 -4.768 -7.308 0.16 0.00 H new ATOM 0 HD2 PRO A 21 -7.665 -7.064 -7.798 0.95 0.00 H new ATOM 0 HD3 PRO A 21 -8.212 -5.516 -8.411 0.95 0.00 H new ATOM 370 N VAL A 22 -3.954 -7.124 -11.490 1.00 0.00 N ATOM 371 CA VAL A 22 -2.894 -8.093 -11.735 1.00 0.00 C ATOM 372 C VAL A 22 -1.613 -7.695 -11.006 0.51 0.00 C ATOM 373 O VAL A 22 -1.233 -6.523 -10.994 0.69 0.00 O ATOM 374 CB VAL A 22 -2.600 -8.236 -13.243 0.20 0.00 C ATOM 375 CG1 VAL A 22 -2.215 -6.894 -13.845 1.00 0.00 C ATOM 376 CG2 VAL A 22 -1.509 -9.270 -13.483 0.07 0.00 C ATOM 0 H VAL A 22 -4.020 -6.387 -12.192 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.242 -9.053 -11.353 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.508 -8.581 -13.737 0.20 0.00 H new ATOM 0 HG11 VAL A 22 -2.012 -7.017 -14.909 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.034 -6.187 -13.711 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -1.323 -6.514 -13.347 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -1.317 -9.355 -14.553 0.07 0.00 H new ATOM 0 HG22 VAL A 22 -0.596 -8.960 -12.974 0.07 0.00 H new ATOM 0 HG23 VAL A 22 -1.831 -10.236 -13.094 0.07 0.00 H new ATOM 386 N GLY A 23 -0.957 -8.676 -10.395 1.00 0.00 N ATOM 387 CA GLY A 23 0.274 -8.408 -9.672 0.22 0.00 C ATOM 388 C GLY A 23 0.029 -8.035 -8.222 0.17 0.00 C ATOM 389 O GLY A 23 0.945 -8.084 -7.401 1.00 0.00 O ATOM 0 H GLY A 23 -1.255 -9.651 -10.387 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.915 -9.289 -9.714 0.22 0.00 H new ATOM 0 HA3 GLY A 23 0.812 -7.599 -10.166 0.22 0.00 H new ATOM 393 N VAL A 24 -1.208 -7.661 -7.908 0.59 0.00 N ATOM 394 CA VAL A 24 -1.569 -7.279 -6.546 1.00 0.00 C ATOM 395 C VAL A 24 -2.989 -7.716 -6.201 0.52 0.00 C ATOM 396 O VAL A 24 -3.854 -7.796 -7.073 0.14 0.00 O ATOM 397 CB VAL A 24 -1.458 -5.756 -6.336 0.06 0.00 C ATOM 398 CG1 VAL A 24 -0.008 -5.311 -6.406 1.00 0.00 C ATOM 399 CG2 VAL A 24 -2.301 -5.010 -7.360 0.10 0.00 C ATOM 0 H VAL A 24 -1.976 -7.614 -8.577 0.59 0.00 H new ATOM 0 HA VAL A 24 -0.863 -7.786 -5.888 1.00 0.00 H new ATOM 0 HB VAL A 24 -1.840 -5.518 -5.343 0.06 0.00 H new ATOM 0 HG11 VAL A 24 0.049 -4.233 -6.255 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.566 -5.817 -5.630 1.00 0.00 H new ATOM 0 HG13 VAL A 24 0.403 -5.563 -7.383 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -2.209 -3.937 -7.195 0.10 0.00 H new ATOM 0 HG22 VAL A 24 -1.954 -5.254 -8.364 0.10 0.00 H new ATOM 0 HG23 VAL A 24 -3.345 -5.305 -7.256 0.10 0.00 H new ATOM 409 N SER A 25 -3.219 -8.001 -4.923 0.29 0.00 N ATOM 410 CA SER A 25 -4.536 -8.420 -4.458 0.19 0.00 C ATOM 411 C SER A 25 -4.986 -7.568 -3.278 0.76 0.00 C ATOM 412 O SER A 25 -4.164 -7.079 -2.505 0.34 0.00 O ATOM 413 CB SER A 25 -4.515 -9.896 -4.056 1.00 0.00 C ATOM 414 OG SER A 25 -5.791 -10.321 -3.608 0.79 0.00 O ATOM 0 H SER A 25 -2.510 -7.949 -4.191 0.29 0.00 H new ATOM 0 HA SER A 25 -5.244 -8.285 -5.276 0.19 0.00 H new ATOM 0 HB2 SER A 25 -4.204 -10.503 -4.906 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.779 -10.051 -3.267 1.00 0.00 H new ATOM 0 HG SER A 25 -5.751 -11.268 -3.359 0.79 0.00 H new ATOM 420 N GLY A 26 -6.296 -7.390 -3.147 0.17 0.00 N ATOM 421 CA GLY A 26 -6.834 -6.597 -2.057 1.00 0.00 C ATOM 422 C GLY A 26 -8.285 -6.922 -1.766 0.10 0.00 C ATOM 423 O GLY A 26 -9.190 -6.256 -2.271 1.00 0.00 O ATOM 0 H GLY A 26 -6.996 -7.781 -3.777 0.17 0.00 H new ATOM 0 HA2 GLY A 26 -6.239 -6.768 -1.160 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -6.744 -5.539 -2.303 1.00 0.00 H new ATOM 427 N ALA A 27 -8.508 -7.944 -0.948 0.31 0.00 N ATOM 428 CA ALA A 27 -9.859 -8.358 -0.593 0.23 0.00 C ATOM 429 C ALA A 27 -9.937 -8.780 0.873 1.00 0.00 C ATOM 430 O ALA A 27 -8.942 -9.215 1.452 0.17 0.00 O ATOM 431 CB ALA A 27 -10.310 -9.498 -1.494 0.10 0.00 C ATOM 0 H ALA A 27 -7.770 -8.501 -0.518 0.31 0.00 H new ATOM 0 HA ALA A 27 -10.525 -7.507 -0.735 0.23 0.00 H new ATOM 0 HB1 ALA A 27 -11.321 -9.800 -1.220 0.10 0.00 H new ATOM 0 HB2 ALA A 27 -10.299 -9.167 -2.533 0.10 0.00 H new ATOM 0 HB3 ALA A 27 -9.634 -10.345 -1.376 0.10 0.00 H new ATOM 437 N PRO A 28 -11.124 -8.651 1.498 0.06 0.00 N ATOM 438 CA PRO A 28 -11.317 -9.027 2.901 0.92 0.00 C ATOM 439 C PRO A 28 -11.386 -10.541 3.083 0.24 0.00 C ATOM 440 O PRO A 28 -12.303 -11.195 2.586 1.00 0.00 O ATOM 441 CB PRO A 28 -12.653 -8.378 3.258 0.37 0.00 C ATOM 442 CG PRO A 28 -13.399 -8.310 1.970 0.21 0.00 C ATOM 443 CD PRO A 28 -12.364 -8.129 0.891 0.88 0.00 C ATOM 0 HA PRO A 28 -10.492 -8.702 3.534 0.92 0.00 H new ATOM 0 HB2 PRO A 28 -13.194 -8.968 3.998 0.37 0.00 H new ATOM 0 HB3 PRO A 28 -12.509 -7.385 3.685 0.37 0.00 H new ATOM 0 HG2 PRO A 28 -13.976 -9.220 1.806 0.21 0.00 H new ATOM 0 HG3 PRO A 28 -14.106 -7.481 1.974 0.21 0.00 H new ATOM 0 HD2 PRO A 28 -12.629 -8.678 -0.013 0.88 0.00 H new ATOM 0 HD3 PRO A 28 -12.260 -7.081 0.608 0.88 0.00 H new ATOM 451 N SER A 29 -10.410 -11.090 3.801 0.68 0.00 N ATOM 452 CA SER A 29 -10.354 -12.529 4.041 0.39 0.00 C ATOM 453 C SER A 29 -11.211 -12.924 5.243 1.00 0.00 C ATOM 454 O SER A 29 -12.385 -13.262 5.093 0.24 0.00 O ATOM 455 CB SER A 29 -8.906 -12.974 4.260 1.00 0.00 C ATOM 456 OG SER A 29 -8.834 -14.363 4.527 0.06 0.00 O ATOM 0 H SER A 29 -9.648 -10.561 4.226 0.68 0.00 H new ATOM 0 HA SER A 29 -10.753 -13.031 3.160 0.39 0.00 H new ATOM 0 HB2 SER A 29 -8.313 -12.739 3.376 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.473 -12.418 5.092 1.00 0.00 H new ATOM 0 HG SER A 29 -7.899 -14.622 4.661 0.06 0.00 H new ATOM 462 N GLU A 30 -10.618 -12.878 6.433 0.48 0.00 N ATOM 463 CA GLU A 30 -11.331 -13.228 7.656 1.00 0.00 C ATOM 464 C GLU A 30 -11.727 -11.972 8.423 1.00 0.00 C ATOM 465 O GLU A 30 -12.433 -12.039 9.429 0.12 0.00 O ATOM 466 CB GLU A 30 -10.465 -14.129 8.538 0.06 0.00 C ATOM 467 CG GLU A 30 -9.967 -15.377 7.827 0.10 0.00 C ATOM 468 CD GLU A 30 -9.115 -16.257 8.721 0.09 0.00 C ATOM 469 OE1 GLU A 30 -7.888 -16.033 8.779 0.08 0.00 O ATOM 470 OE2 GLU A 30 -9.675 -17.170 9.363 0.63 0.00 O ATOM 0 H GLU A 30 -9.646 -12.602 6.575 0.48 0.00 H new ATOM 0 HA GLU A 30 -12.237 -13.769 7.381 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.608 -13.558 8.896 0.06 0.00 H new ATOM 0 HB3 GLU A 30 -11.040 -14.425 9.416 0.06 0.00 H new ATOM 0 HG2 GLU A 30 -10.821 -15.950 7.467 0.10 0.00 H new ATOM 0 HG3 GLU A 30 -9.387 -15.085 6.952 0.10 0.00 H new ATOM 477 N ASN A 31 -11.264 -10.827 7.933 1.00 0.00 N ATOM 478 CA ASN A 31 -11.563 -9.546 8.558 0.11 0.00 C ATOM 479 C ASN A 31 -12.900 -9.003 8.066 0.10 0.00 C ATOM 480 O ASN A 31 -13.276 -9.210 6.911 0.54 0.00 O ATOM 481 CB ASN A 31 -10.449 -8.540 8.263 0.14 0.00 C ATOM 482 CG ASN A 31 -9.101 -8.992 8.786 1.00 0.00 C ATOM 483 OD1 ASN A 31 -8.064 -8.721 8.180 0.79 0.00 O ATOM 484 ND2 ASN A 31 -9.107 -9.682 9.922 0.17 0.00 N ATOM 0 H ASN A 31 -10.678 -10.761 7.101 1.00 0.00 H new ATOM 0 HA ASN A 31 -11.628 -9.699 9.635 0.11 0.00 H new ATOM 0 HB2 ASN A 31 -10.383 -8.383 7.186 0.14 0.00 H new ATOM 0 HB3 ASN A 31 -10.704 -7.579 8.710 0.14 0.00 H new ATOM 0 HD21 ASN A 31 -8.229 -10.009 10.325 0.17 0.00 H new ATOM 0 HD22 ASN A 31 -9.990 -9.884 10.391 0.17 0.00 H new ATOM 491 N ASN A 32 -13.614 -8.313 8.949 0.40 0.00 N ATOM 492 CA ASN A 32 -14.913 -7.742 8.610 0.11 0.00 C ATOM 493 C ASN A 32 -14.790 -6.714 7.487 0.21 0.00 C ATOM 494 O ASN A 32 -13.719 -6.535 6.908 0.59 0.00 O ATOM 495 CB ASN A 32 -15.543 -7.093 9.843 0.58 0.00 C ATOM 496 CG ASN A 32 -15.844 -8.101 10.934 0.15 0.00 C ATOM 497 OD1 ASN A 32 -16.938 -8.662 10.993 0.36 0.00 O ATOM 498 ND2 ASN A 32 -14.871 -8.336 11.807 1.00 0.00 N ATOM 0 H ASN A 32 -13.314 -8.135 9.908 0.40 0.00 H new ATOM 0 HA ASN A 32 -15.554 -8.552 8.262 0.11 0.00 H new ATOM 0 HB2 ASN A 32 -14.870 -6.329 10.233 0.58 0.00 H new ATOM 0 HB3 ASN A 32 -16.465 -6.588 9.554 0.58 0.00 H new ATOM 0 HD21 ASN A 32 -15.015 -9.004 12.564 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -13.979 -7.848 11.720 1.00 0.00 H new ATOM 505 N ILE A 33 -15.898 -6.041 7.186 0.39 0.00 N ATOM 506 CA ILE A 33 -15.924 -5.033 6.132 0.65 0.00 C ATOM 507 C ILE A 33 -14.944 -3.898 6.423 0.60 0.00 C ATOM 508 O ILE A 33 -14.455 -3.235 5.508 0.09 0.00 O ATOM 509 CB ILE A 33 -17.342 -4.446 5.954 1.00 0.00 C ATOM 510 CG1 ILE A 33 -17.383 -3.480 4.766 0.61 0.00 C ATOM 511 CG2 ILE A 33 -17.791 -3.743 7.226 0.12 0.00 C ATOM 512 CD1 ILE A 33 -17.178 -4.152 3.426 0.22 0.00 C ATOM 0 H ILE A 33 -16.791 -6.177 7.659 0.39 0.00 H new ATOM 0 HA ILE A 33 -15.625 -5.532 5.210 0.65 0.00 H new ATOM 0 HB ILE A 33 -18.029 -5.268 5.751 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -18.344 -2.966 4.761 0.61 0.00 H new ATOM 0 HG13 ILE A 33 -16.615 -2.719 4.902 0.61 0.00 H new ATOM 0 HG21 ILE A 33 -18.792 -3.336 7.083 0.12 0.00 H new ATOM 0 HG22 ILE A 33 -17.804 -4.456 8.050 0.12 0.00 H new ATOM 0 HG23 ILE A 33 -17.099 -2.933 7.458 0.12 0.00 H new ATOM 0 HD11 ILE A 33 -17.220 -3.404 2.634 0.22 0.00 H new ATOM 0 HD12 ILE A 33 -16.205 -4.643 3.410 0.22 0.00 H new ATOM 0 HD13 ILE A 33 -17.961 -4.893 3.267 0.22 0.00 H new ATOM 524 N MET A 34 -14.658 -3.684 7.705 1.00 0.00 N ATOM 525 CA MET A 34 -13.744 -2.623 8.118 1.00 0.00 C ATOM 526 C MET A 34 -12.328 -2.874 7.608 0.38 0.00 C ATOM 527 O MET A 34 -11.842 -2.167 6.724 0.09 0.00 O ATOM 528 CB MET A 34 -13.726 -2.498 9.643 0.93 0.00 C ATOM 529 CG MET A 34 -15.064 -2.084 10.234 0.75 0.00 C ATOM 530 SD MET A 34 -15.000 -1.898 12.025 1.00 0.00 S ATOM 531 CE MET A 34 -16.667 -1.340 12.365 1.00 0.00 C ATOM 0 H MET A 34 -15.045 -4.230 8.474 1.00 0.00 H new ATOM 0 HA MET A 34 -14.105 -1.692 7.681 1.00 0.00 H new ATOM 0 HB2 MET A 34 -13.427 -3.453 10.074 0.93 0.00 H new ATOM 0 HB3 MET A 34 -12.969 -1.768 9.931 0.93 0.00 H new ATOM 0 HG2 MET A 34 -15.380 -1.142 9.785 0.75 0.00 H new ATOM 0 HG3 MET A 34 -15.817 -2.828 9.976 0.75 0.00 H new ATOM 0 HE1 MET A 34 -16.637 -0.515 13.077 1.00 0.00 H new ATOM 0 HE2 MET A 34 -17.134 -1.003 11.439 1.00 0.00 H new ATOM 0 HE3 MET A 34 -17.247 -2.161 12.786 1.00 0.00 H new ATOM 541 N GLN A 35 -11.672 -3.884 8.170 0.46 0.00 N ATOM 542 CA GLN A 35 -10.308 -4.221 7.783 1.00 0.00 C ATOM 543 C GLN A 35 -10.286 -5.196 6.610 0.23 0.00 C ATOM 544 O GLN A 35 -11.105 -6.112 6.533 0.08 0.00 O ATOM 545 CB GLN A 35 -9.554 -4.816 8.973 0.42 0.00 C ATOM 546 CG GLN A 35 -8.102 -5.145 8.672 0.14 0.00 C ATOM 547 CD GLN A 35 -7.366 -5.692 9.879 0.17 0.00 C ATOM 548 OE1 GLN A 35 -7.319 -6.902 10.099 0.08 0.00 O ATOM 549 NE2 GLN A 35 -6.787 -4.799 10.672 0.17 0.00 N ATOM 0 H GLN A 35 -12.064 -4.484 8.896 0.46 0.00 H new ATOM 0 HA GLN A 35 -9.814 -3.302 7.466 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -9.593 -4.113 9.805 0.42 0.00 H new ATOM 0 HB3 GLN A 35 -10.063 -5.723 9.298 0.42 0.00 H new ATOM 0 HG2 GLN A 35 -8.059 -5.875 7.863 0.14 0.00 H new ATOM 0 HG3 GLN A 35 -7.596 -4.247 8.318 0.14 0.00 H new ATOM 0 HE21 GLN A 35 -6.850 -3.805 10.452 0.17 0.00 H new ATOM 0 HE22 GLN A 35 -6.279 -5.107 11.501 0.17 0.00 H new ATOM 558 N TRP A 36 -9.342 -4.985 5.699 1.00 0.00 N ATOM 559 CA TRP A 36 -9.193 -5.838 4.524 0.07 0.00 C ATOM 560 C TRP A 36 -7.809 -6.480 4.500 1.00 0.00 C ATOM 561 O TRP A 36 -6.948 -6.147 5.313 0.33 0.00 O ATOM 562 CB TRP A 36 -9.413 -5.026 3.240 0.05 0.00 C ATOM 563 CG TRP A 36 -10.859 -4.837 2.880 0.13 0.00 C ATOM 564 CD1 TRP A 36 -11.915 -4.708 3.739 0.57 0.00 C ATOM 565 CD2 TRP A 36 -11.406 -4.749 1.559 0.14 0.00 C ATOM 566 NE1 TRP A 36 -13.083 -4.556 3.031 0.10 0.00 N ATOM 567 CE2 TRP A 36 -12.796 -4.574 1.693 0.12 0.00 C ATOM 568 CE3 TRP A 36 -10.856 -4.802 0.273 1.00 0.00 C ATOM 569 CZ2 TRP A 36 -13.642 -4.453 0.594 0.06 0.00 C ATOM 570 CZ3 TRP A 36 -11.697 -4.680 -0.817 0.23 0.00 C ATOM 571 CH2 TRP A 36 -13.077 -4.507 -0.651 0.60 0.00 C ATOM 0 H TRP A 36 -8.664 -4.225 5.752 1.00 0.00 H new ATOM 0 HA TRP A 36 -9.945 -6.625 4.578 0.07 0.00 H new ATOM 0 HB2 TRP A 36 -8.947 -4.048 3.356 0.05 0.00 H new ATOM 0 HB3 TRP A 36 -8.905 -5.525 2.415 0.05 0.00 H new ATOM 0 HD1 TRP A 36 -11.842 -4.723 4.816 0.57 0.00 H new ATOM 0 HE1 TRP A 36 -14.013 -4.447 3.437 0.10 0.00 H new ATOM 0 HE3 TRP A 36 -9.793 -4.936 0.135 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -14.707 -4.321 0.720 0.06 0.00 H new ATOM 0 HZ3 TRP A 36 -11.283 -4.719 -1.814 0.23 0.00 H new ATOM 0 HH2 TRP A 36 -13.708 -4.414 -1.523 0.60 0.00 H new ATOM 582 N ASN A 37 -7.602 -7.405 3.568 0.05 0.00 N ATOM 583 CA ASN A 37 -6.317 -8.085 3.439 0.48 0.00 C ATOM 584 C ASN A 37 -5.783 -7.951 2.018 0.17 0.00 C ATOM 585 O ASN A 37 -6.356 -8.497 1.076 0.11 0.00 O ATOM 586 CB ASN A 37 -6.454 -9.564 3.810 1.00 0.00 C ATOM 587 CG ASN A 37 -5.110 -10.258 3.928 0.65 0.00 C ATOM 588 OD1 ASN A 37 -4.510 -10.295 5.002 1.00 0.00 O ATOM 589 ND2 ASN A 37 -4.630 -10.809 2.820 0.92 0.00 N ATOM 0 H ASN A 37 -8.306 -7.701 2.892 0.05 0.00 H new ATOM 0 HA ASN A 37 -5.611 -7.615 4.124 0.48 0.00 H new ATOM 0 HB2 ASN A 37 -6.989 -9.650 4.756 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -7.056 -10.071 3.056 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -3.729 -11.287 2.837 0.92 0.00 H new ATOM 0 HD22 ASN A 37 -5.162 -10.754 1.951 0.92 0.00 H new ATOM 596 N ALA A 38 -4.683 -7.219 1.869 1.00 0.00 N ATOM 597 CA ALA A 38 -4.081 -7.007 0.559 0.97 0.00 C ATOM 598 C ALA A 38 -2.604 -7.385 0.552 0.12 0.00 C ATOM 599 O ALA A 38 -1.923 -7.294 1.570 0.24 0.00 O ATOM 600 CB ALA A 38 -4.256 -5.561 0.128 0.49 0.00 C ATOM 0 H ALA A 38 -4.192 -6.764 2.638 1.00 0.00 H new ATOM 0 HA ALA A 38 -4.593 -7.656 -0.151 0.97 0.00 H new ATOM 0 HB1 ALA A 38 -3.802 -5.416 -0.852 0.49 0.00 H new ATOM 0 HB2 ALA A 38 -5.318 -5.323 0.074 0.49 0.00 H new ATOM 0 HB3 ALA A 38 -3.773 -4.905 0.852 0.49 0.00 H new ATOM 606 N VAL A 39 -2.121 -7.814 -0.610 1.00 0.00 N ATOM 607 CA VAL A 39 -0.727 -8.205 -0.762 0.35 0.00 C ATOM 608 C VAL A 39 -0.145 -7.651 -2.059 0.13 0.00 C ATOM 609 O VAL A 39 -0.751 -7.764 -3.125 1.00 0.00 O ATOM 610 CB VAL A 39 -0.573 -9.738 -0.744 0.36 0.00 C ATOM 611 CG1 VAL A 39 -1.507 -10.377 -1.753 0.24 0.00 C ATOM 612 CG2 VAL A 39 0.870 -10.144 -1.010 0.83 0.00 C ATOM 0 H VAL A 39 -2.677 -7.899 -1.461 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.179 -7.787 0.083 0.35 0.00 H new ATOM 0 HB VAL A 39 -0.843 -10.096 0.249 0.36 0.00 H new ATOM 0 HG11 VAL A 39 -1.385 -11.460 -1.727 0.24 0.00 H new ATOM 0 HG12 VAL A 39 -2.538 -10.122 -1.507 0.24 0.00 H new ATOM 0 HG13 VAL A 39 -1.271 -10.009 -2.751 0.24 0.00 H new ATOM 0 HG21 VAL A 39 0.951 -11.231 -0.992 0.83 0.00 H new ATOM 0 HG22 VAL A 39 1.178 -9.773 -1.988 0.83 0.00 H new ATOM 0 HG23 VAL A 39 1.515 -9.719 -0.241 0.83 0.00 H new ATOM 622 N ILE A 40 1.033 -7.046 -1.956 1.00 0.00 N ATOM 623 CA ILE A 40 1.704 -6.466 -3.110 1.00 0.00 C ATOM 624 C ILE A 40 3.063 -7.123 -3.335 0.59 0.00 C ATOM 625 O ILE A 40 3.879 -7.212 -2.416 1.00 0.00 O ATOM 626 CB ILE A 40 1.896 -4.948 -2.935 0.75 0.00 C ATOM 627 CG1 ILE A 40 0.540 -4.262 -2.757 0.30 0.00 C ATOM 628 CG2 ILE A 40 2.645 -4.363 -4.125 0.12 0.00 C ATOM 629 CD1 ILE A 40 0.643 -2.800 -2.380 1.00 0.00 C ATOM 0 H ILE A 40 1.544 -6.945 -1.079 1.00 0.00 H new ATOM 0 HA ILE A 40 1.070 -6.645 -3.978 1.00 0.00 H new ATOM 0 HB ILE A 40 2.493 -4.772 -2.040 0.75 0.00 H new ATOM 0 HG12 ILE A 40 -0.026 -4.350 -3.684 0.30 0.00 H new ATOM 0 HG13 ILE A 40 -0.025 -4.788 -1.987 0.30 0.00 H new ATOM 0 HG21 ILE A 40 2.771 -3.290 -3.984 0.12 0.00 H new ATOM 0 HG22 ILE A 40 3.624 -4.836 -4.207 0.12 0.00 H new ATOM 0 HG23 ILE A 40 2.077 -4.544 -5.037 0.12 0.00 H new ATOM 0 HD11 ILE A 40 -0.357 -2.381 -2.271 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.181 -2.704 -1.437 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.180 -2.260 -3.160 1.00 0.00 H new ATOM 641 N PHE A 41 3.298 -7.577 -4.559 0.56 0.00 N ATOM 642 CA PHE A 41 4.554 -8.229 -4.903 0.55 0.00 C ATOM 643 C PHE A 41 5.478 -7.274 -5.649 0.18 0.00 C ATOM 644 O PHE A 41 5.025 -6.463 -6.459 0.26 0.00 O ATOM 645 CB PHE A 41 4.287 -9.472 -5.751 0.06 0.00 C ATOM 646 CG PHE A 41 3.317 -10.428 -5.116 0.34 0.00 C ATOM 647 CD1 PHE A 41 3.682 -11.171 -4.006 0.34 0.00 C ATOM 648 CD2 PHE A 41 2.041 -10.583 -5.632 0.24 0.00 C ATOM 649 CE1 PHE A 41 2.792 -12.051 -3.419 0.25 0.00 C ATOM 650 CE2 PHE A 41 1.145 -11.462 -5.051 0.09 0.00 C ATOM 651 CZ PHE A 41 1.522 -12.196 -3.943 0.13 0.00 C ATOM 0 H PHE A 41 2.635 -7.506 -5.331 0.56 0.00 H new ATOM 0 HA PHE A 41 5.047 -8.528 -3.978 0.55 0.00 H new ATOM 0 HB2 PHE A 41 3.900 -9.164 -6.722 0.06 0.00 H new ATOM 0 HB3 PHE A 41 5.229 -9.989 -5.933 0.06 0.00 H new ATOM 0 HD1 PHE A 41 4.674 -11.062 -3.594 0.34 0.00 H new ATOM 0 HD2 PHE A 41 1.742 -10.011 -6.498 0.24 0.00 H new ATOM 0 HE1 PHE A 41 3.089 -12.624 -2.553 0.25 0.00 H new ATOM 0 HE2 PHE A 41 0.153 -11.574 -5.463 0.09 0.00 H new ATOM 0 HZ PHE A 41 0.824 -12.883 -3.487 0.13 0.00 H new ATOM 661 N GLY A 42 6.774 -7.377 -5.370 0.11 0.00 N ATOM 662 CA GLY A 42 7.744 -6.517 -6.019 0.15 0.00 C ATOM 663 C GLY A 42 7.738 -6.673 -7.532 0.49 0.00 C ATOM 664 O GLY A 42 7.636 -7.790 -8.037 0.29 0.00 O ATOM 0 H GLY A 42 7.169 -8.042 -4.705 0.11 0.00 H new ATOM 0 HA2 GLY A 42 7.533 -5.479 -5.763 0.15 0.00 H new ATOM 0 HA3 GLY A 42 8.739 -6.744 -5.637 0.15 0.00 H new ATOM 668 N PRO A 43 7.848 -5.561 -8.289 1.00 0.00 N ATOM 669 CA PRO A 43 7.855 -5.606 -9.755 0.14 0.00 C ATOM 670 C PRO A 43 9.152 -6.189 -10.304 1.00 0.00 C ATOM 671 O PRO A 43 10.174 -6.206 -9.620 0.20 0.00 O ATOM 672 CB PRO A 43 7.715 -4.135 -10.156 1.00 0.00 C ATOM 673 CG PRO A 43 8.284 -3.374 -9.009 0.27 0.00 C ATOM 674 CD PRO A 43 7.970 -4.181 -7.779 0.07 0.00 C ATOM 0 HA PRO A 43 7.064 -6.244 -10.150 0.14 0.00 H new ATOM 0 HB2 PRO A 43 8.255 -3.923 -11.079 1.00 0.00 H new ATOM 0 HB3 PRO A 43 6.672 -3.869 -10.329 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.360 -3.241 -9.124 0.27 0.00 H new ATOM 0 HG3 PRO A 43 7.845 -2.378 -8.945 0.27 0.00 H new ATOM 0 HD2 PRO A 43 8.760 -4.098 -7.033 0.07 0.00 H new ATOM 0 HD3 PRO A 43 7.047 -3.846 -7.305 0.07 0.00 H new ATOM 682 N GLU A 44 9.103 -6.664 -11.545 0.10 0.00 N ATOM 683 CA GLU A 44 10.279 -7.250 -12.184 0.09 0.00 C ATOM 684 C GLU A 44 11.341 -6.187 -12.443 0.07 0.00 C ATOM 685 O GLU A 44 11.124 -5.252 -13.214 1.00 0.00 O ATOM 686 CB GLU A 44 9.889 -7.929 -13.499 0.06 0.00 C ATOM 687 CG GLU A 44 11.041 -8.655 -14.174 0.67 0.00 C ATOM 688 CD GLU A 44 10.637 -9.299 -15.486 0.14 0.00 C ATOM 689 OE1 GLU A 44 10.185 -10.464 -15.463 0.05 0.00 O ATOM 690 OE2 GLU A 44 10.771 -8.638 -16.538 0.05 0.00 O ATOM 0 H GLU A 44 8.265 -6.655 -12.127 0.10 0.00 H new ATOM 0 HA GLU A 44 10.694 -7.998 -11.508 0.09 0.00 H new ATOM 0 HB2 GLU A 44 9.085 -8.640 -13.307 0.06 0.00 H new ATOM 0 HB3 GLU A 44 9.493 -7.178 -14.183 0.06 0.00 H new ATOM 0 HG2 GLU A 44 11.853 -7.951 -14.354 0.67 0.00 H new ATOM 0 HG3 GLU A 44 11.427 -9.421 -13.501 0.67 0.00 H new ATOM 697 N GLY A 45 12.490 -6.337 -11.790 0.12 0.00 N ATOM 698 CA GLY A 45 13.571 -5.384 -11.963 0.05 0.00 C ATOM 699 C GLY A 45 13.932 -4.675 -10.672 0.43 0.00 C ATOM 700 O GLY A 45 14.711 -3.721 -10.677 0.07 0.00 O ATOM 0 H GLY A 45 12.691 -7.101 -11.145 0.12 0.00 H new ATOM 0 HA2 GLY A 45 14.450 -5.902 -12.347 0.05 0.00 H new ATOM 0 HA3 GLY A 45 13.284 -4.645 -12.711 0.05 0.00 H new ATOM 704 N THR A 46 13.362 -5.140 -9.564 0.08 0.00 N ATOM 705 CA THR A 46 13.628 -4.547 -8.259 0.18 0.00 C ATOM 706 C THR A 46 14.071 -5.612 -7.259 0.46 0.00 C ATOM 707 O THR A 46 13.780 -6.792 -7.439 0.09 0.00 O ATOM 708 CB THR A 46 12.383 -3.831 -7.704 0.99 0.00 C ATOM 709 OG1 THR A 46 11.298 -4.758 -7.585 0.05 0.00 O ATOM 710 CG2 THR A 46 11.973 -2.676 -8.606 0.25 0.00 C ATOM 0 H THR A 46 12.713 -5.926 -9.545 0.08 0.00 H new ATOM 0 HA THR A 46 14.427 -3.818 -8.396 0.18 0.00 H new ATOM 0 HB THR A 46 12.630 -3.432 -6.720 0.99 0.00 H new ATOM 0 HG1 THR A 46 11.071 -5.112 -8.470 0.05 0.00 H new ATOM 0 HG21 THR A 46 11.091 -2.187 -8.192 0.25 0.00 H new ATOM 0 HG22 THR A 46 12.790 -1.957 -8.671 0.25 0.00 H new ATOM 0 HG23 THR A 46 11.744 -3.056 -9.602 0.25 0.00 H new ATOM 718 N PRO A 47 14.783 -5.213 -6.187 1.00 0.00 N ATOM 719 CA PRO A 47 15.251 -6.156 -5.165 0.16 0.00 C ATOM 720 C PRO A 47 14.100 -6.768 -4.372 0.07 0.00 C ATOM 721 O PRO A 47 14.313 -7.604 -3.494 0.20 0.00 O ATOM 722 CB PRO A 47 16.129 -5.293 -4.252 1.00 0.00 C ATOM 723 CG PRO A 47 15.639 -3.902 -4.457 0.61 0.00 C ATOM 724 CD PRO A 47 15.192 -3.828 -5.889 1.00 0.00 C ATOM 0 HA PRO A 47 15.778 -7.003 -5.606 0.16 0.00 H new ATOM 0 HB2 PRO A 47 16.034 -5.596 -3.209 1.00 0.00 H new ATOM 0 HB3 PRO A 47 17.183 -5.384 -4.515 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.816 -3.674 -3.779 0.61 0.00 H new ATOM 0 HG3 PRO A 47 16.428 -3.177 -4.256 0.61 0.00 H new ATOM 0 HD2 PRO A 47 14.366 -3.128 -6.017 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.996 -3.496 -6.545 1.00 0.00 H new ATOM 732 N PHE A 48 12.879 -6.346 -4.691 0.52 0.00 N ATOM 733 CA PHE A 48 11.692 -6.849 -4.009 1.00 0.00 C ATOM 734 C PHE A 48 10.934 -7.837 -4.890 0.07 0.00 C ATOM 735 O PHE A 48 9.964 -8.456 -4.454 0.07 0.00 O ATOM 736 CB PHE A 48 10.771 -5.691 -3.622 0.06 0.00 C ATOM 737 CG PHE A 48 11.487 -4.535 -2.984 0.24 0.00 C ATOM 738 CD1 PHE A 48 11.743 -4.529 -1.624 1.00 0.00 C ATOM 739 CD2 PHE A 48 11.901 -3.455 -3.747 0.81 0.00 C ATOM 740 CE1 PHE A 48 12.401 -3.464 -1.034 0.78 0.00 C ATOM 741 CE2 PHE A 48 12.558 -2.388 -3.163 0.33 0.00 C ATOM 742 CZ PHE A 48 12.807 -2.392 -1.805 0.10 0.00 C ATOM 0 H PHE A 48 12.687 -5.657 -5.418 0.52 0.00 H new ATOM 0 HA PHE A 48 12.017 -7.367 -3.107 1.00 0.00 H new ATOM 0 HB2 PHE A 48 10.252 -5.338 -4.513 0.06 0.00 H new ATOM 0 HB3 PHE A 48 10.009 -6.059 -2.935 0.06 0.00 H new ATOM 0 HD1 PHE A 48 11.426 -5.364 -1.017 1.00 0.00 H new ATOM 0 HD2 PHE A 48 11.708 -3.447 -4.810 0.81 0.00 H new ATOM 0 HE1 PHE A 48 12.597 -3.471 0.028 0.78 0.00 H new ATOM 0 HE2 PHE A 48 12.876 -1.552 -3.768 0.33 0.00 H new ATOM 0 HZ PHE A 48 13.318 -1.559 -1.346 0.10 0.00 H new ATOM 752 N GLU A 49 11.381 -7.976 -6.137 1.00 0.00 N ATOM 753 CA GLU A 49 10.743 -8.885 -7.083 0.36 0.00 C ATOM 754 C GLU A 49 10.736 -10.319 -6.557 0.20 0.00 C ATOM 755 O GLU A 49 9.818 -11.087 -6.841 1.00 0.00 O ATOM 756 CB GLU A 49 11.458 -8.832 -8.437 0.05 0.00 C ATOM 757 CG GLU A 49 12.835 -9.478 -8.432 0.18 0.00 C ATOM 758 CD GLU A 49 13.509 -9.423 -9.788 0.20 0.00 C ATOM 759 OE1 GLU A 49 14.186 -8.412 -10.074 0.70 0.00 O ATOM 760 OE2 GLU A 49 13.362 -10.389 -10.566 1.00 0.00 O ATOM 0 H GLU A 49 12.182 -7.470 -6.514 1.00 0.00 H new ATOM 0 HA GLU A 49 9.710 -8.562 -7.208 0.36 0.00 H new ATOM 0 HB2 GLU A 49 10.838 -9.327 -9.184 0.05 0.00 H new ATOM 0 HB3 GLU A 49 11.557 -7.791 -8.744 0.05 0.00 H new ATOM 0 HG2 GLU A 49 13.465 -8.977 -7.697 0.18 0.00 H new ATOM 0 HG3 GLU A 49 12.743 -10.518 -8.118 0.18 0.00 H new ATOM 767 N ASP A 50 11.762 -10.670 -5.788 0.34 0.00 N ATOM 768 CA ASP A 50 11.872 -12.012 -5.228 1.00 0.00 C ATOM 769 C ASP A 50 11.041 -12.143 -3.957 0.24 0.00 C ATOM 770 O ASP A 50 10.315 -13.119 -3.775 1.00 0.00 O ATOM 771 CB ASP A 50 13.334 -12.345 -4.925 0.07 0.00 C ATOM 772 CG ASP A 50 14.214 -12.267 -6.158 1.00 0.00 C ATOM 773 OD1 ASP A 50 14.359 -13.296 -6.851 1.00 0.00 O ATOM 774 OD2 ASP A 50 14.759 -11.177 -6.430 0.09 0.00 O ATOM 0 H ASP A 50 12.528 -10.044 -5.539 0.34 0.00 H new ATOM 0 HA ASP A 50 11.490 -12.716 -5.967 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.711 -11.656 -4.169 0.07 0.00 H new ATOM 0 HB3 ASP A 50 13.395 -13.348 -4.502 0.07 0.00 H new ATOM 779 N GLY A 51 11.155 -11.150 -3.079 0.17 0.00 N ATOM 780 CA GLY A 51 10.414 -11.173 -1.832 1.00 0.00 C ATOM 781 C GLY A 51 8.959 -10.791 -2.009 0.61 0.00 C ATOM 782 O GLY A 51 8.551 -10.349 -3.083 0.06 0.00 O ATOM 0 H GLY A 51 11.748 -10.330 -3.210 0.17 0.00 H new ATOM 0 HA2 GLY A 51 10.473 -12.171 -1.398 1.00 0.00 H new ATOM 0 HA3 GLY A 51 10.881 -10.489 -1.124 1.00 0.00 H new ATOM 786 N THR A 52 8.176 -10.965 -0.949 0.28 0.00 N ATOM 787 CA THR A 52 6.755 -10.634 -0.981 0.90 0.00 C ATOM 788 C THR A 52 6.399 -9.671 0.146 0.95 0.00 C ATOM 789 O THR A 52 7.047 -9.662 1.192 0.83 0.00 O ATOM 790 CB THR A 52 5.878 -11.894 -0.855 0.73 0.00 C ATOM 791 OG1 THR A 52 6.071 -12.500 0.429 0.66 0.00 O ATOM 792 CG2 THR A 52 6.210 -12.899 -1.949 0.14 0.00 C ATOM 0 H THR A 52 8.502 -11.334 -0.056 0.28 0.00 H new ATOM 0 HA THR A 52 6.560 -10.162 -1.944 0.90 0.00 H new ATOM 0 HB THR A 52 4.836 -11.594 -0.963 0.73 0.00 H new ATOM 0 HG1 THR A 52 5.846 -13.453 0.378 0.66 0.00 H new ATOM 0 HG21 THR A 52 5.577 -13.780 -1.838 0.14 0.00 H new ATOM 0 HG22 THR A 52 6.034 -12.446 -2.925 0.14 0.00 H new ATOM 0 HG23 THR A 52 7.257 -13.192 -1.869 0.14 0.00 H new ATOM 800 N PHE A 53 5.366 -8.863 -0.071 0.08 0.00 N ATOM 801 CA PHE A 53 4.931 -7.899 0.931 0.29 0.00 C ATOM 802 C PHE A 53 3.413 -7.874 1.051 0.05 0.00 C ATOM 803 O PHE A 53 2.700 -7.914 0.051 0.09 0.00 O ATOM 804 CB PHE A 53 5.448 -6.502 0.587 0.31 0.00 C ATOM 805 CG PHE A 53 6.919 -6.334 0.829 0.27 0.00 C ATOM 806 CD1 PHE A 53 7.842 -6.637 -0.160 0.08 0.00 C ATOM 807 CD2 PHE A 53 7.381 -5.875 2.052 0.09 0.00 C ATOM 808 CE1 PHE A 53 9.196 -6.482 0.065 0.10 0.00 C ATOM 809 CE2 PHE A 53 8.734 -5.719 2.283 0.07 0.00 C ATOM 810 CZ PHE A 53 9.642 -6.023 1.289 1.00 0.00 C ATOM 0 H PHE A 53 4.816 -8.857 -0.930 0.08 0.00 H new ATOM 0 HA PHE A 53 5.345 -8.208 1.891 0.29 0.00 H new ATOM 0 HB2 PHE A 53 5.233 -6.291 -0.461 0.31 0.00 H new ATOM 0 HB3 PHE A 53 4.904 -5.766 1.178 0.31 0.00 H new ATOM 0 HD1 PHE A 53 7.498 -6.999 -1.118 0.08 0.00 H new ATOM 0 HD2 PHE A 53 6.675 -5.636 2.834 0.09 0.00 H new ATOM 0 HE1 PHE A 53 9.905 -6.719 -0.715 0.10 0.00 H new ATOM 0 HE2 PHE A 53 9.081 -5.360 3.240 0.07 0.00 H new ATOM 0 HZ PHE A 53 10.700 -5.902 1.468 1.00 0.00 H new ATOM 820 N LYS A 54 2.931 -7.809 2.287 0.43 0.00 N ATOM 821 CA LYS A 54 1.499 -7.771 2.556 1.00 0.00 C ATOM 822 C LYS A 54 1.142 -6.517 3.350 0.31 0.00 C ATOM 823 O LYS A 54 1.752 -6.233 4.380 0.06 0.00 O ATOM 824 CB LYS A 54 1.075 -9.014 3.341 0.11 0.00 C ATOM 825 CG LYS A 54 1.269 -10.316 2.581 0.73 0.00 C ATOM 826 CD LYS A 54 0.695 -11.496 3.349 1.00 0.00 C ATOM 827 CE LYS A 54 0.852 -12.795 2.577 1.00 0.00 C ATOM 828 NZ LYS A 54 0.181 -12.734 1.248 0.38 0.00 N ATOM 0 H LYS A 54 3.515 -7.781 3.123 0.43 0.00 H new ATOM 0 HA LYS A 54 0.970 -7.752 1.603 1.00 0.00 H new ATOM 0 HB2 LYS A 54 1.645 -9.058 4.269 0.11 0.00 H new ATOM 0 HB3 LYS A 54 0.025 -8.918 3.616 0.11 0.00 H new ATOM 0 HG2 LYS A 54 0.787 -10.245 1.606 0.73 0.00 H new ATOM 0 HG3 LYS A 54 2.332 -10.479 2.401 0.73 0.00 H new ATOM 0 HD2 LYS A 54 1.196 -11.582 4.313 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -0.361 -11.319 3.554 1.00 0.00 H new ATOM 0 HE2 LYS A 54 1.912 -13.010 2.440 1.00 0.00 H new ATOM 0 HE3 LYS A 54 0.433 -13.616 3.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -0.399 -13.587 1.112 0.38 0.00 H new ATOM 0 HZ2 LYS A 54 -0.427 -11.891 1.204 0.38 0.00 H new ATOM 0 HZ3 LYS A 54 0.900 -12.682 0.498 0.38 0.00 H new ATOM 842 N LEU A 55 0.158 -5.769 2.866 0.29 0.00 N ATOM 843 CA LEU A 55 -0.270 -4.545 3.538 1.00 0.00 C ATOM 844 C LEU A 55 -1.771 -4.573 3.819 0.11 0.00 C ATOM 845 O LEU A 55 -2.504 -5.379 3.249 1.00 0.00 O ATOM 846 CB LEU A 55 0.112 -3.302 2.711 0.31 0.00 C ATOM 847 CG LEU A 55 -0.695 -3.033 1.427 0.08 0.00 C ATOM 848 CD1 LEU A 55 -0.934 -4.312 0.634 0.06 0.00 C ATOM 849 CD2 LEU A 55 -2.015 -2.345 1.748 0.38 0.00 C ATOM 0 H LEU A 55 -0.358 -5.986 2.013 0.29 0.00 H new ATOM 0 HA LEU A 55 0.250 -4.486 4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.022 -2.427 3.355 0.31 0.00 H new ATOM 0 HB3 LEU A 55 1.163 -3.389 2.437 0.31 0.00 H new ATOM 0 HG LEU A 55 -0.101 -2.365 0.804 0.08 0.00 H new ATOM 0 HD11 LEU A 55 -1.506 -4.081 -0.265 0.06 0.00 H new ATOM 0 HD12 LEU A 55 0.024 -4.750 0.352 0.06 0.00 H new ATOM 0 HD13 LEU A 55 -1.491 -5.021 1.247 0.06 0.00 H new ATOM 0 HD21 LEU A 55 -2.566 -2.166 0.825 0.38 0.00 H new ATOM 0 HD22 LEU A 55 -2.606 -2.982 2.406 0.38 0.00 H new ATOM 0 HD23 LEU A 55 -1.819 -1.394 2.243 0.38 0.00 H new ATOM 861 N VAL A 56 -2.220 -3.685 4.701 0.21 0.00 N ATOM 862 CA VAL A 56 -3.631 -3.616 5.065 0.08 0.00 C ATOM 863 C VAL A 56 -4.215 -2.232 4.793 0.20 0.00 C ATOM 864 O VAL A 56 -3.542 -1.215 4.969 0.23 0.00 O ATOM 865 CB VAL A 56 -3.836 -3.959 6.553 0.15 0.00 C ATOM 866 CG1 VAL A 56 -3.019 -3.026 7.433 1.00 0.00 C ATOM 867 CG2 VAL A 56 -5.310 -3.897 6.924 0.26 0.00 C ATOM 0 H VAL A 56 -1.628 -3.004 5.176 0.21 0.00 H new ATOM 0 HA VAL A 56 -4.150 -4.348 4.446 0.08 0.00 H new ATOM 0 HB VAL A 56 -3.489 -4.979 6.720 0.15 0.00 H new ATOM 0 HG11 VAL A 56 -3.176 -3.283 8.480 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -1.962 -3.129 7.189 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -3.333 -1.996 7.261 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -5.430 -4.143 7.979 0.26 0.00 H new ATOM 0 HG22 VAL A 56 -5.690 -2.892 6.740 0.26 0.00 H new ATOM 0 HG23 VAL A 56 -5.868 -4.612 6.319 0.26 0.00 H new ATOM 877 N ILE A 57 -5.473 -2.205 4.362 0.62 0.00 N ATOM 878 CA ILE A 57 -6.160 -0.951 4.082 0.14 0.00 C ATOM 879 C ILE A 57 -7.341 -0.767 5.027 0.22 0.00 C ATOM 880 O ILE A 57 -8.344 -1.472 4.924 0.22 0.00 O ATOM 881 CB ILE A 57 -6.676 -0.889 2.629 0.47 0.00 C ATOM 882 CG1 ILE A 57 -5.544 -1.172 1.640 0.79 0.00 C ATOM 883 CG2 ILE A 57 -7.302 0.467 2.345 0.09 0.00 C ATOM 884 CD1 ILE A 57 -5.345 -2.643 1.360 0.73 0.00 C ATOM 0 H ILE A 57 -6.037 -3.039 4.199 0.62 0.00 H new ATOM 0 HA ILE A 57 -5.432 -0.153 4.229 0.14 0.00 H new ATOM 0 HB ILE A 57 -7.439 -1.657 2.504 0.47 0.00 H new ATOM 0 HG12 ILE A 57 -5.753 -0.656 0.703 0.79 0.00 H new ATOM 0 HG13 ILE A 57 -4.616 -0.756 2.032 0.79 0.00 H new ATOM 0 HG21 ILE A 57 -7.661 0.494 1.316 0.09 0.00 H new ATOM 0 HG22 ILE A 57 -8.138 0.632 3.025 0.09 0.00 H new ATOM 0 HG23 ILE A 57 -6.557 1.249 2.490 0.09 0.00 H new ATOM 0 HD11 ILE A 57 -4.527 -2.771 0.651 0.73 0.00 H new ATOM 0 HD12 ILE A 57 -5.105 -3.161 2.289 0.73 0.00 H new ATOM 0 HD13 ILE A 57 -6.259 -3.060 0.938 0.73 0.00 H new ATOM 896 N GLU A 58 -7.213 0.179 5.947 0.24 0.00 N ATOM 897 CA GLU A 58 -8.272 0.451 6.912 1.00 0.00 C ATOM 898 C GLU A 58 -9.259 1.478 6.363 0.80 0.00 C ATOM 899 O GLU A 58 -8.872 2.585 5.984 0.59 0.00 O ATOM 900 CB GLU A 58 -7.677 0.951 8.231 0.18 0.00 C ATOM 901 CG GLU A 58 -8.712 1.165 9.325 0.89 0.00 C ATOM 902 CD GLU A 58 -8.093 1.624 10.631 0.80 0.00 C ATOM 903 OE1 GLU A 58 -7.921 2.849 10.806 0.24 0.00 O ATOM 904 OE2 GLU A 58 -7.784 0.761 11.478 1.00 0.00 O ATOM 0 H GLU A 58 -6.388 0.771 6.046 0.24 0.00 H new ATOM 0 HA GLU A 58 -8.808 -0.480 7.095 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.935 0.233 8.580 0.18 0.00 H new ATOM 0 HB3 GLU A 58 -7.152 1.889 8.050 0.18 0.00 H new ATOM 0 HG2 GLU A 58 -9.440 1.905 8.992 0.89 0.00 H new ATOM 0 HG3 GLU A 58 -9.256 0.236 9.492 0.89 0.00 H new ATOM 911 N PHE A 59 -10.533 1.101 6.320 0.05 0.00 N ATOM 912 CA PHE A 59 -11.579 1.987 5.822 0.10 0.00 C ATOM 913 C PHE A 59 -12.389 2.566 6.974 0.11 0.00 C ATOM 914 O PHE A 59 -12.530 1.935 8.023 0.40 0.00 O ATOM 915 CB PHE A 59 -12.505 1.237 4.864 1.00 0.00 C ATOM 916 CG PHE A 59 -11.845 0.830 3.578 1.00 0.00 C ATOM 917 CD1 PHE A 59 -11.768 1.717 2.515 0.22 0.00 C ATOM 918 CD2 PHE A 59 -11.306 -0.436 3.432 1.00 0.00 C ATOM 919 CE1 PHE A 59 -11.166 1.344 1.330 1.00 0.00 C ATOM 920 CE2 PHE A 59 -10.701 -0.814 2.248 0.41 0.00 C ATOM 921 CZ PHE A 59 -10.630 0.078 1.194 1.00 0.00 C ATOM 0 H PHE A 59 -10.866 0.186 6.625 0.05 0.00 H new ATOM 0 HA PHE A 59 -11.100 2.805 5.285 0.10 0.00 H new ATOM 0 HB2 PHE A 59 -12.886 0.346 5.364 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -13.365 1.867 4.637 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.183 2.709 2.615 0.22 0.00 H new ATOM 0 HD2 PHE A 59 -11.359 -1.137 4.252 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -11.114 2.043 0.508 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -10.284 -1.805 2.146 0.41 0.00 H new ATOM 0 HZ PHE A 59 -10.157 -0.214 0.268 1.00 0.00 H new ATOM 931 N SER A 60 -12.920 3.768 6.776 0.52 0.00 N ATOM 932 CA SER A 60 -13.720 4.428 7.800 0.09 0.00 C ATOM 933 C SER A 60 -15.171 4.557 7.352 0.36 0.00 C ATOM 934 O SER A 60 -15.474 4.467 6.163 0.20 0.00 O ATOM 935 CB SER A 60 -13.143 5.809 8.112 0.10 0.00 C ATOM 936 OG SER A 60 -11.805 5.712 8.570 0.08 0.00 O ATOM 0 H SER A 60 -12.810 4.305 5.915 0.52 0.00 H new ATOM 0 HA SER A 60 -13.691 3.818 8.703 0.09 0.00 H new ATOM 0 HB2 SER A 60 -13.180 6.432 7.219 0.10 0.00 H new ATOM 0 HB3 SER A 60 -13.755 6.300 8.869 0.10 0.00 H new ATOM 0 HG SER A 60 -11.459 6.609 8.761 0.08 0.00 H new ATOM 942 N GLU A 61 -16.068 4.768 8.312 0.58 0.00 N ATOM 943 CA GLU A 61 -17.489 4.906 8.012 0.75 0.00 C ATOM 944 C GLU A 61 -17.871 6.370 7.822 0.35 0.00 C ATOM 945 O GLU A 61 -19.052 6.708 7.756 1.00 0.00 O ATOM 946 CB GLU A 61 -18.333 4.278 9.124 1.00 0.00 C ATOM 947 CG GLU A 61 -18.046 4.835 10.510 0.09 0.00 C ATOM 948 CD GLU A 61 -18.688 6.188 10.745 0.08 0.00 C ATOM 949 OE1 GLU A 61 -19.907 6.229 11.015 0.77 0.00 O ATOM 950 OE2 GLU A 61 -17.971 7.208 10.662 0.88 0.00 O ATOM 0 H GLU A 61 -15.836 4.847 9.302 0.58 0.00 H new ATOM 0 HA GLU A 61 -17.688 4.380 7.078 0.75 0.00 H new ATOM 0 HB2 GLU A 61 -19.388 4.429 8.894 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.160 3.202 9.133 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -18.407 4.132 11.261 0.09 0.00 H new ATOM 0 HG3 GLU A 61 -16.968 4.921 10.646 0.09 0.00 H new ATOM 957 N GLU A 62 -16.863 7.235 7.732 0.69 0.00 N ATOM 958 CA GLU A 62 -17.096 8.661 7.544 0.10 0.00 C ATOM 959 C GLU A 62 -17.859 8.921 6.248 0.23 0.00 C ATOM 960 O GLU A 62 -19.077 9.101 6.261 0.29 0.00 O ATOM 961 CB GLU A 62 -15.773 9.430 7.533 1.00 0.00 C ATOM 962 CG GLU A 62 -15.239 9.749 8.920 0.54 0.00 C ATOM 963 CD GLU A 62 -14.616 8.545 9.599 0.67 0.00 C ATOM 964 OE1 GLU A 62 -15.372 7.703 10.124 1.00 0.00 O ATOM 965 OE2 GLU A 62 -13.371 8.449 9.607 0.78 0.00 O ATOM 0 H GLU A 62 -15.879 6.972 7.786 0.69 0.00 H new ATOM 0 HA GLU A 62 -17.699 9.013 8.381 0.10 0.00 H new ATOM 0 HB2 GLU A 62 -15.028 8.846 6.992 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -15.909 10.361 6.983 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -14.496 10.543 8.845 0.54 0.00 H new ATOM 0 HG3 GLU A 62 -16.051 10.130 9.539 0.54 0.00 H new ATOM 972 N TYR A 63 -17.136 8.935 5.131 0.21 0.00 N ATOM 973 CA TYR A 63 -17.746 9.175 3.828 0.06 0.00 C ATOM 974 C TYR A 63 -17.065 8.335 2.745 0.08 0.00 C ATOM 975 O TYR A 63 -15.884 8.003 2.862 0.48 0.00 O ATOM 976 CB TYR A 63 -17.660 10.662 3.467 0.48 0.00 C ATOM 977 CG TYR A 63 -18.453 11.564 4.388 0.53 0.00 C ATOM 978 CD1 TYR A 63 -19.789 11.847 4.133 0.33 0.00 C ATOM 979 CD2 TYR A 63 -17.865 12.135 5.510 0.09 0.00 C ATOM 980 CE1 TYR A 63 -20.517 12.672 4.970 0.12 0.00 C ATOM 981 CE2 TYR A 63 -18.587 12.961 6.352 0.66 0.00 C ATOM 982 CZ TYR A 63 -19.911 13.225 6.077 1.00 0.00 C ATOM 983 OH TYR A 63 -20.633 14.048 6.911 1.00 0.00 O ATOM 0 H TYR A 63 -16.128 8.783 5.103 0.21 0.00 H new ATOM 0 HA TYR A 63 -18.794 8.882 3.885 0.06 0.00 H new ATOM 0 HB2 TYR A 63 -16.615 10.970 3.485 0.48 0.00 H new ATOM 0 HB3 TYR A 63 -18.016 10.799 2.446 0.48 0.00 H new ATOM 0 HD1 TYR A 63 -20.267 11.415 3.266 0.33 0.00 H new ATOM 0 HD2 TYR A 63 -16.827 11.930 5.728 0.09 0.00 H new ATOM 0 HE1 TYR A 63 -21.555 12.882 4.757 0.12 0.00 H new ATOM 0 HE2 TYR A 63 -18.116 13.397 7.220 0.66 0.00 H new ATOM 0 HH TYR A 63 -20.060 14.354 7.645 1.00 0.00 H new ATOM 993 N PRO A 64 -17.801 7.977 1.675 0.26 0.00 N ATOM 994 CA PRO A 64 -17.254 7.173 0.573 0.54 0.00 C ATOM 995 C PRO A 64 -16.070 7.852 -0.106 0.12 0.00 C ATOM 996 O PRO A 64 -15.216 7.190 -0.695 1.00 0.00 O ATOM 997 CB PRO A 64 -18.427 7.052 -0.409 0.31 0.00 C ATOM 998 CG PRO A 64 -19.644 7.335 0.403 0.29 0.00 C ATOM 999 CD PRO A 64 -19.219 8.316 1.455 1.00 0.00 C ATOM 0 HA PRO A 64 -16.876 6.213 0.925 0.54 0.00 H new ATOM 0 HB2 PRO A 64 -18.328 7.761 -1.231 0.31 0.00 H new ATOM 0 HB3 PRO A 64 -18.470 6.056 -0.851 0.31 0.00 H new ATOM 0 HG2 PRO A 64 -20.440 7.748 -0.217 0.29 0.00 H new ATOM 0 HG3 PRO A 64 -20.033 6.422 0.855 0.29 0.00 H new ATOM 0 HD2 PRO A 64 -19.340 9.346 1.118 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -19.806 8.208 2.367 1.00 0.00 H new ATOM 1007 N ASN A 65 -16.025 9.179 -0.020 1.00 0.00 N ATOM 1008 CA ASN A 65 -14.947 9.950 -0.628 1.00 0.00 C ATOM 1009 C ASN A 65 -13.888 10.319 0.405 0.22 0.00 C ATOM 1010 O ASN A 65 -12.795 10.764 0.055 0.12 0.00 O ATOM 1011 CB ASN A 65 -15.503 11.223 -1.269 0.21 0.00 C ATOM 1012 CG ASN A 65 -16.026 12.203 -0.239 0.35 0.00 C ATOM 1013 OD1 ASN A 65 -16.501 11.808 0.825 0.12 0.00 O ATOM 1014 ND2 ASN A 65 -15.940 13.491 -0.548 1.00 0.00 N ATOM 0 H ASN A 65 -16.724 9.742 0.465 1.00 0.00 H new ATOM 0 HA ASN A 65 -14.483 9.330 -1.396 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -14.721 11.702 -1.859 0.21 0.00 H new ATOM 0 HB3 ASN A 65 -16.306 10.960 -1.958 0.21 0.00 H new ATOM 0 HD21 ASN A 65 -16.275 14.196 0.108 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -15.539 13.775 -1.442 1.00 0.00 H new ATOM 1021 N LYS A 66 -14.223 10.135 1.678 1.00 0.00 N ATOM 1022 CA LYS A 66 -13.303 10.448 2.766 1.00 0.00 C ATOM 1023 C LYS A 66 -11.975 9.710 2.582 0.29 0.00 C ATOM 1024 O LYS A 66 -11.968 8.503 2.340 0.07 0.00 O ATOM 1025 CB LYS A 66 -13.933 10.068 4.110 0.08 0.00 C ATOM 1026 CG LYS A 66 -13.188 10.611 5.319 0.66 0.00 C ATOM 1027 CD LYS A 66 -13.825 11.891 5.845 0.10 0.00 C ATOM 1028 CE LYS A 66 -13.599 13.065 4.903 0.16 0.00 C ATOM 1029 NZ LYS A 66 -14.280 14.298 5.381 0.62 0.00 N ATOM 0 H LYS A 66 -15.126 9.770 1.982 1.00 0.00 H new ATOM 0 HA LYS A 66 -13.106 11.520 2.753 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -14.960 10.434 4.135 0.08 0.00 H new ATOM 0 HB3 LYS A 66 -13.980 8.981 4.183 0.08 0.00 H new ATOM 0 HG2 LYS A 66 -13.177 9.859 6.108 0.66 0.00 H new ATOM 0 HG3 LYS A 66 -12.150 10.805 5.050 0.66 0.00 H new ATOM 0 HD2 LYS A 66 -14.895 11.735 5.981 0.10 0.00 H new ATOM 0 HD3 LYS A 66 -13.411 12.127 6.825 0.10 0.00 H new ATOM 0 HE2 LYS A 66 -12.530 13.254 4.809 0.16 0.00 H new ATOM 0 HE3 LYS A 66 -13.966 12.809 3.909 0.16 0.00 H new ATOM 0 HZ1 LYS A 66 -14.102 15.074 4.712 0.62 0.00 H new ATOM 0 HZ2 LYS A 66 -15.304 14.126 5.447 0.62 0.00 H new ATOM 0 HZ3 LYS A 66 -13.911 14.557 6.318 0.62 0.00 H new ATOM 1043 N PRO A 67 -10.832 10.419 2.694 1.00 0.00 N ATOM 1044 CA PRO A 67 -9.506 9.811 2.534 0.12 0.00 C ATOM 1045 C PRO A 67 -9.299 8.619 3.467 0.18 0.00 C ATOM 1046 O PRO A 67 -9.172 8.792 4.679 0.23 0.00 O ATOM 1047 CB PRO A 67 -8.531 10.943 2.894 1.00 0.00 C ATOM 1048 CG PRO A 67 -9.358 11.978 3.576 0.88 0.00 C ATOM 1049 CD PRO A 67 -10.734 11.857 2.992 0.16 0.00 C ATOM 0 HA PRO A 67 -9.365 9.420 1.527 0.12 0.00 H new ATOM 0 HB2 PRO A 67 -7.736 10.583 3.547 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -8.053 11.348 2.002 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -9.376 11.816 4.654 0.88 0.00 H new ATOM 0 HG3 PRO A 67 -8.950 12.975 3.410 0.88 0.00 H new ATOM 0 HD2 PRO A 67 -11.502 12.178 3.695 0.16 0.00 H new ATOM 0 HD3 PRO A 67 -10.848 12.465 2.095 0.16 0.00 H new ATOM 1057 N PRO A 68 -9.267 7.388 2.918 0.80 0.00 N ATOM 1058 CA PRO A 68 -9.073 6.177 3.721 0.41 0.00 C ATOM 1059 C PRO A 68 -7.697 6.129 4.373 0.53 0.00 C ATOM 1060 O PRO A 68 -6.927 7.086 4.295 1.00 0.00 O ATOM 1061 CB PRO A 68 -9.222 5.038 2.706 0.99 0.00 C ATOM 1062 CG PRO A 68 -8.932 5.660 1.386 1.00 0.00 C ATOM 1063 CD PRO A 68 -9.419 7.078 1.483 0.74 0.00 C ATOM 0 HA PRO A 68 -9.784 6.123 4.546 0.41 0.00 H new ATOM 0 HB2 PRO A 68 -8.528 4.225 2.920 0.99 0.00 H new ATOM 0 HB3 PRO A 68 -10.226 4.615 2.731 0.99 0.00 H new ATOM 0 HG2 PRO A 68 -7.865 5.628 1.165 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -9.440 5.127 0.583 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -8.828 7.750 0.861 0.74 0.00 H new ATOM 0 HD3 PRO A 68 -10.455 7.171 1.158 0.74 0.00 H new ATOM 1071 N THR A 69 -7.395 5.005 5.012 0.08 0.00 N ATOM 1072 CA THR A 69 -6.115 4.822 5.682 0.07 0.00 C ATOM 1073 C THR A 69 -5.475 3.505 5.265 0.09 0.00 C ATOM 1074 O THR A 69 -6.149 2.481 5.169 1.00 0.00 O ATOM 1075 CB THR A 69 -6.274 4.842 7.214 1.00 0.00 C ATOM 1076 OG1 THR A 69 -6.851 6.084 7.630 0.17 0.00 O ATOM 1077 CG2 THR A 69 -4.932 4.645 7.903 0.12 0.00 C ATOM 0 H THR A 69 -8.023 4.204 5.080 0.08 0.00 H new ATOM 0 HA THR A 69 -5.473 5.651 5.384 0.07 0.00 H new ATOM 0 HB THR A 69 -6.933 4.021 7.498 1.00 0.00 H new ATOM 0 HG1 THR A 69 -6.950 6.088 8.605 0.17 0.00 H new ATOM 0 HG21 THR A 69 -5.072 4.663 8.984 0.12 0.00 H new ATOM 0 HG22 THR A 69 -4.509 3.685 7.608 0.12 0.00 H new ATOM 0 HG23 THR A 69 -4.252 5.446 7.612 0.12 0.00 H new ATOM 1085 N VAL A 70 -4.173 3.539 5.016 0.06 0.00 N ATOM 1086 CA VAL A 70 -3.442 2.344 4.613 0.98 0.00 C ATOM 1087 C VAL A 70 -2.071 2.288 5.282 0.43 0.00 C ATOM 1088 O VAL A 70 -1.468 3.323 5.572 0.51 0.00 O ATOM 1089 CB VAL A 70 -3.271 2.282 3.082 0.17 0.00 C ATOM 1090 CG1 VAL A 70 -2.347 3.388 2.594 0.38 0.00 C ATOM 1091 CG2 VAL A 70 -2.752 0.916 2.662 0.42 0.00 C ATOM 0 H VAL A 70 -3.601 4.381 5.086 0.06 0.00 H new ATOM 0 HA VAL A 70 -4.029 1.484 4.935 0.98 0.00 H new ATOM 0 HB VAL A 70 -4.247 2.435 2.621 0.17 0.00 H new ATOM 0 HG11 VAL A 70 -2.242 3.323 1.511 0.38 0.00 H new ATOM 0 HG12 VAL A 70 -2.768 4.358 2.860 0.38 0.00 H new ATOM 0 HG13 VAL A 70 -1.368 3.277 3.061 0.38 0.00 H new ATOM 0 HG21 VAL A 70 -2.637 0.888 1.578 0.42 0.00 H new ATOM 0 HG22 VAL A 70 -1.787 0.732 3.135 0.42 0.00 H new ATOM 0 HG23 VAL A 70 -3.460 0.147 2.971 0.42 0.00 H new ATOM 1101 N ARG A 71 -1.586 1.074 5.528 1.00 0.00 N ATOM 1102 CA ARG A 71 -0.288 0.884 6.165 1.00 0.00 C ATOM 1103 C ARG A 71 0.191 -0.557 6.018 0.77 0.00 C ATOM 1104 O ARG A 71 -0.615 -1.483 5.933 0.07 0.00 O ATOM 1105 CB ARG A 71 -0.367 1.259 7.647 1.00 0.00 C ATOM 1106 CG ARG A 71 -1.462 0.523 8.403 0.68 0.00 C ATOM 1107 CD ARG A 71 -1.494 0.926 9.868 0.09 0.00 C ATOM 1108 NE ARG A 71 -1.715 2.361 10.038 0.22 0.00 N ATOM 1109 CZ ARG A 71 -1.704 2.973 11.220 0.79 0.00 C ATOM 1110 NH1 ARG A 71 -1.500 2.277 12.329 0.13 0.00 N ATOM 1111 NH2 ARG A 71 -1.904 4.283 11.291 0.08 0.00 N ATOM 0 H ARG A 71 -2.073 0.208 5.296 1.00 0.00 H new ATOM 0 HA ARG A 71 0.430 1.535 5.667 1.00 0.00 H new ATOM 0 HB2 ARG A 71 0.593 1.048 8.118 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -0.536 2.332 7.733 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -2.428 0.735 7.945 0.68 0.00 H new ATOM 0 HG3 ARG A 71 -1.301 -0.552 8.324 0.68 0.00 H new ATOM 0 HD2 ARG A 71 -2.284 0.375 10.378 0.09 0.00 H new ATOM 0 HD3 ARG A 71 -0.553 0.646 10.341 0.09 0.00 H new ATOM 0 HE ARG A 71 -1.887 2.924 9.205 0.22 0.00 H new ATOM 0 HH11 ARG A 71 -1.351 1.269 12.278 0.13 0.00 H new ATOM 0 HH12 ARG A 71 -1.492 2.749 13.233 0.13 0.00 H new ATOM 0 HH21 ARG A 71 -2.066 4.821 10.440 0.08 0.00 H new ATOM 0 HH22 ARG A 71 -1.896 4.752 12.197 0.08 0.00 H new ATOM 1125 N PHE A 72 1.509 -0.736 5.985 0.17 0.00 N ATOM 1126 CA PHE A 72 2.101 -2.064 5.851 0.13 0.00 C ATOM 1127 C PHE A 72 2.069 -2.819 7.175 1.00 0.00 C ATOM 1128 O PHE A 72 2.367 -2.258 8.230 0.45 0.00 O ATOM 1129 CB PHE A 72 3.546 -1.957 5.357 0.12 0.00 C ATOM 1130 CG PHE A 72 3.667 -1.808 3.868 0.21 0.00 C ATOM 1131 CD1 PHE A 72 3.499 -0.574 3.263 0.60 0.00 C ATOM 1132 CD2 PHE A 72 3.954 -2.906 3.074 0.05 0.00 C ATOM 1133 CE1 PHE A 72 3.615 -0.437 1.893 0.12 0.00 C ATOM 1134 CE2 PHE A 72 4.071 -2.777 1.702 0.79 0.00 C ATOM 1135 CZ PHE A 72 3.901 -1.539 1.111 0.41 0.00 C ATOM 0 H PHE A 72 2.188 0.023 6.049 0.17 0.00 H new ATOM 0 HA PHE A 72 1.509 -2.618 5.122 0.13 0.00 H new ATOM 0 HB2 PHE A 72 4.023 -1.103 5.838 0.12 0.00 H new ATOM 0 HB3 PHE A 72 4.094 -2.846 5.670 0.12 0.00 H new ATOM 0 HD1 PHE A 72 3.275 0.291 3.869 0.60 0.00 H new ATOM 0 HD2 PHE A 72 4.088 -3.875 3.532 0.05 0.00 H new ATOM 0 HE1 PHE A 72 3.482 0.531 1.434 0.12 0.00 H new ATOM 0 HE2 PHE A 72 4.295 -3.641 1.094 0.79 0.00 H new ATOM 0 HZ PHE A 72 3.992 -1.434 0.040 0.41 0.00 H new ATOM 1145 N LEU A 73 1.705 -4.095 7.110 0.13 0.00 N ATOM 1146 CA LEU A 73 1.641 -4.933 8.299 0.60 0.00 C ATOM 1147 C LEU A 73 3.041 -5.286 8.790 0.51 0.00 C ATOM 1148 O LEU A 73 3.375 -5.068 9.955 0.28 0.00 O ATOM 1149 CB LEU A 73 0.860 -6.215 8.004 0.25 0.00 C ATOM 1150 CG LEU A 73 -0.636 -6.023 7.749 0.08 0.00 C ATOM 1151 CD1 LEU A 73 -1.266 -7.323 7.275 0.05 0.00 C ATOM 1152 CD2 LEU A 73 -1.330 -5.525 9.007 0.12 0.00 C ATOM 0 H LEU A 73 1.450 -4.571 6.245 0.13 0.00 H new ATOM 0 HA LEU A 73 1.128 -4.372 9.080 0.60 0.00 H new ATOM 0 HB2 LEU A 73 1.302 -6.698 7.132 0.25 0.00 H new ATOM 0 HB3 LEU A 73 0.984 -6.898 8.844 0.25 0.00 H new ATOM 0 HG LEU A 73 -0.759 -5.274 6.967 0.08 0.00 H new ATOM 0 HD11 LEU A 73 -2.330 -7.168 7.098 0.05 0.00 H new ATOM 0 HD12 LEU A 73 -0.787 -7.643 6.349 0.05 0.00 H new ATOM 0 HD13 LEU A 73 -1.133 -8.091 8.037 0.05 0.00 H new ATOM 0 HD21 LEU A 73 -2.394 -5.394 8.808 0.12 0.00 H new ATOM 0 HD22 LEU A 73 -1.198 -6.253 9.808 0.12 0.00 H new ATOM 0 HD23 LEU A 73 -0.897 -4.571 9.308 0.12 0.00 H new ATOM 1164 N SER A 74 3.854 -5.831 7.892 0.26 0.00 N ATOM 1165 CA SER A 74 5.219 -6.219 8.230 0.13 0.00 C ATOM 1166 C SER A 74 6.106 -4.994 8.437 0.24 0.00 C ATOM 1167 O SER A 74 7.211 -5.104 8.970 0.10 0.00 O ATOM 1168 CB SER A 74 5.807 -7.108 7.133 0.35 0.00 C ATOM 1169 OG SER A 74 5.067 -8.309 6.999 0.43 0.00 O ATOM 0 H SER A 74 3.592 -6.014 6.924 0.26 0.00 H new ATOM 0 HA SER A 74 5.185 -6.779 9.165 0.13 0.00 H new ATOM 0 HB2 SER A 74 5.807 -6.570 6.185 0.35 0.00 H new ATOM 0 HB3 SER A 74 6.846 -7.341 7.367 0.35 0.00 H new ATOM 0 HG SER A 74 5.112 -8.619 6.070 0.43 0.00 H new ATOM 1175 N LYS A 75 5.614 -3.830 8.017 0.07 0.00 N ATOM 1176 CA LYS A 75 6.361 -2.581 8.155 1.00 0.00 C ATOM 1177 C LYS A 75 7.725 -2.684 7.482 0.09 0.00 C ATOM 1178 O LYS A 75 8.684 -3.190 8.069 0.08 0.00 O ATOM 1179 CB LYS A 75 6.532 -2.224 9.634 0.76 0.00 C ATOM 1180 CG LYS A 75 5.213 -2.048 10.371 0.34 0.00 C ATOM 1181 CD LYS A 75 5.427 -1.582 11.802 0.11 0.00 C ATOM 1182 CE LYS A 75 6.004 -0.175 11.854 0.05 0.00 C ATOM 1183 NZ LYS A 75 6.165 0.305 13.254 0.07 0.00 N ATOM 0 H LYS A 75 4.699 -3.726 7.577 0.07 0.00 H new ATOM 0 HA LYS A 75 5.793 -1.792 7.662 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.112 -3.006 10.124 0.76 0.00 H new ATOM 0 HB3 LYS A 75 7.109 -1.303 9.713 0.76 0.00 H new ATOM 0 HG2 LYS A 75 4.594 -1.324 9.841 0.34 0.00 H new ATOM 0 HG3 LYS A 75 4.668 -2.992 10.373 0.34 0.00 H new ATOM 0 HD2 LYS A 75 4.479 -1.607 12.339 0.11 0.00 H new ATOM 0 HD3 LYS A 75 6.100 -2.271 12.312 0.11 0.00 H new ATOM 0 HE2 LYS A 75 6.971 -0.160 11.351 0.05 0.00 H new ATOM 0 HE3 LYS A 75 5.351 0.506 11.309 0.05 0.00 H new ATOM 0 HZ1 LYS A 75 6.561 1.267 13.248 0.07 0.00 H new ATOM 0 HZ2 LYS A 75 5.239 0.315 13.726 0.07 0.00 H new ATOM 0 HZ3 LYS A 75 6.809 -0.331 13.767 0.07 0.00 H new ATOM 1197 N MET A 76 7.809 -2.204 6.246 0.47 0.00 N ATOM 1198 CA MET A 76 9.056 -2.248 5.492 0.48 0.00 C ATOM 1199 C MET A 76 9.738 -0.885 5.475 0.12 0.00 C ATOM 1200 O MET A 76 9.121 0.135 5.780 1.00 0.00 O ATOM 1201 CB MET A 76 8.796 -2.725 4.062 1.00 0.00 C ATOM 1202 CG MET A 76 7.752 -1.903 3.322 1.00 0.00 C ATOM 1203 SD MET A 76 7.491 -2.474 1.631 0.17 0.00 S ATOM 1204 CE MET A 76 9.143 -2.315 0.957 0.22 0.00 C ATOM 0 H MET A 76 7.028 -1.780 5.745 0.47 0.00 H new ATOM 0 HA MET A 76 9.723 -2.955 5.987 0.48 0.00 H new ATOM 0 HB2 MET A 76 9.731 -2.695 3.503 1.00 0.00 H new ATOM 0 HB3 MET A 76 8.473 -3.766 4.089 1.00 0.00 H new ATOM 0 HG2 MET A 76 6.808 -1.946 3.866 1.00 0.00 H new ATOM 0 HG3 MET A 76 8.063 -0.858 3.305 1.00 0.00 H new ATOM 0 HE1 MET A 76 9.093 -2.317 -0.132 0.22 0.00 H new ATOM 0 HE2 MET A 76 9.587 -1.380 1.298 0.22 0.00 H new ATOM 0 HE3 MET A 76 9.756 -3.151 1.294 0.22 0.00 H new ATOM 1214 N PHE A 77 11.017 -0.880 5.110 0.20 0.00 N ATOM 1215 CA PHE A 77 11.797 0.350 5.054 0.93 0.00 C ATOM 1216 C PHE A 77 11.660 1.030 3.695 0.06 0.00 C ATOM 1217 O PHE A 77 11.983 0.447 2.660 0.17 0.00 O ATOM 1218 CB PHE A 77 13.269 0.043 5.341 1.00 0.00 C ATOM 1219 CG PHE A 77 14.128 1.267 5.486 0.08 0.00 C ATOM 1220 CD1 PHE A 77 14.749 1.831 4.383 1.00 0.00 C ATOM 1221 CD2 PHE A 77 14.318 1.850 6.729 0.16 0.00 C ATOM 1222 CE1 PHE A 77 15.543 2.954 4.517 1.00 0.00 C ATOM 1223 CE2 PHE A 77 15.112 2.973 6.868 0.40 0.00 C ATOM 1224 CZ PHE A 77 15.724 3.525 5.762 0.35 0.00 C ATOM 0 H PHE A 77 11.536 -1.718 4.848 0.20 0.00 H new ATOM 0 HA PHE A 77 11.413 1.033 5.812 0.93 0.00 H new ATOM 0 HB2 PHE A 77 13.336 -0.546 6.256 1.00 0.00 H new ATOM 0 HB3 PHE A 77 13.665 -0.574 4.535 1.00 0.00 H new ATOM 0 HD1 PHE A 77 14.611 1.388 3.408 1.00 0.00 H new ATOM 0 HD2 PHE A 77 13.841 1.422 7.598 0.16 0.00 H new ATOM 0 HE1 PHE A 77 16.021 3.385 3.650 1.00 0.00 H new ATOM 0 HE2 PHE A 77 15.253 3.418 7.842 0.40 0.00 H new ATOM 0 HZ PHE A 77 16.344 4.403 5.869 0.35 0.00 H new ATOM 1234 N HIS A 78 11.179 2.271 3.710 0.19 0.00 N ATOM 1235 CA HIS A 78 11.004 3.045 2.485 0.22 0.00 C ATOM 1236 C HIS A 78 11.782 4.359 2.559 0.10 0.00 C ATOM 1237 O HIS A 78 12.071 4.850 3.649 0.08 0.00 O ATOM 1238 CB HIS A 78 9.521 3.337 2.244 1.00 0.00 C ATOM 1239 CG HIS A 78 8.794 2.230 1.545 0.15 0.00 C ATOM 1240 ND1 HIS A 78 8.968 1.921 0.214 0.24 0.00 N ATOM 1241 CD2 HIS A 78 7.872 1.354 2.016 0.11 0.00 C ATOM 1242 CE1 HIS A 78 8.161 0.890 -0.075 1.00 0.00 C ATOM 1243 NE2 HIS A 78 7.475 0.508 0.984 0.09 0.00 N ATOM 0 H HIS A 78 10.903 2.763 4.560 0.19 0.00 H new ATOM 0 HA HIS A 78 11.391 2.454 1.655 0.22 0.00 H new ATOM 0 HB2 HIS A 78 9.038 3.529 3.202 1.00 0.00 H new ATOM 0 HB3 HIS A 78 9.431 4.249 1.653 1.00 0.00 H new ATOM 0 HD2 HIS A 78 7.504 1.318 3.031 0.11 0.00 H new ATOM 0 HE1 HIS A 78 8.083 0.432 -1.050 1.00 0.00 H new ATOM 0 HE2 HIS A 78 6.795 -0.250 1.036 0.09 0.00 H new ATOM 1251 N PRO A 79 12.132 4.946 1.397 0.57 0.00 N ATOM 1252 CA PRO A 79 12.873 6.212 1.344 0.26 0.00 C ATOM 1253 C PRO A 79 12.041 7.379 1.863 1.00 0.00 C ATOM 1254 O PRO A 79 12.574 8.326 2.440 0.52 0.00 O ATOM 1255 CB PRO A 79 13.173 6.392 -0.146 1.00 0.00 C ATOM 1256 CG PRO A 79 12.118 5.606 -0.841 0.69 0.00 C ATOM 1257 CD PRO A 79 11.836 4.427 0.047 0.29 0.00 C ATOM 0 HA PRO A 79 13.766 6.190 1.968 0.26 0.00 H new ATOM 0 HB2 PRO A 79 13.138 7.443 -0.433 1.00 0.00 H new ATOM 0 HB3 PRO A 79 14.169 6.027 -0.396 1.00 0.00 H new ATOM 0 HG2 PRO A 79 11.220 6.205 -0.993 0.69 0.00 H new ATOM 0 HG3 PRO A 79 12.456 5.282 -1.826 0.69 0.00 H new ATOM 0 HD2 PRO A 79 10.801 4.096 -0.039 0.29 0.00 H new ATOM 0 HD3 PRO A 79 12.466 3.574 -0.204 0.29 0.00 H new ATOM 1265 N ASN A 80 10.730 7.298 1.656 1.00 0.00 N ATOM 1266 CA ASN A 80 9.818 8.343 2.105 0.82 0.00 C ATOM 1267 C ASN A 80 8.579 7.733 2.753 0.30 0.00 C ATOM 1268 O ASN A 80 7.832 6.994 2.113 0.47 0.00 O ATOM 1269 CB ASN A 80 9.404 9.226 0.925 0.86 0.00 C ATOM 1270 CG ASN A 80 10.587 9.899 0.256 1.00 0.00 C ATOM 1271 OD1 ASN A 80 11.578 10.230 0.906 1.00 0.00 O ATOM 1272 ND2 ASN A 80 10.490 10.102 -1.053 1.00 0.00 N ATOM 0 H ASN A 80 10.276 6.519 1.180 1.00 0.00 H new ATOM 0 HA ASN A 80 10.335 8.954 2.845 0.82 0.00 H new ATOM 0 HB2 ASN A 80 8.873 8.620 0.191 0.86 0.00 H new ATOM 0 HB3 ASN A 80 8.707 9.988 1.273 0.86 0.00 H new ATOM 0 HD21 ASN A 80 11.256 10.548 -1.558 1.00 0.00 H new ATOM 0 HD22 ASN A 80 9.650 9.812 -1.553 1.00 0.00 H new ATOM 1279 N VAL A 81 8.369 8.048 4.027 0.55 0.00 N ATOM 1280 CA VAL A 81 7.218 7.536 4.763 0.11 0.00 C ATOM 1281 C VAL A 81 6.831 8.476 5.901 0.68 0.00 C ATOM 1282 O VAL A 81 7.677 9.190 6.444 0.61 0.00 O ATOM 1283 CB VAL A 81 7.492 6.128 5.334 0.39 0.00 C ATOM 1284 CG1 VAL A 81 8.500 6.190 6.474 0.10 0.00 C ATOM 1285 CG2 VAL A 81 6.196 5.476 5.793 0.66 0.00 C ATOM 0 H VAL A 81 8.981 8.656 4.572 0.55 0.00 H new ATOM 0 HA VAL A 81 6.392 7.472 4.055 0.11 0.00 H new ATOM 0 HB VAL A 81 7.921 5.516 4.540 0.39 0.00 H new ATOM 0 HG11 VAL A 81 8.676 5.186 6.859 0.10 0.00 H new ATOM 0 HG12 VAL A 81 9.438 6.608 6.108 0.10 0.00 H new ATOM 0 HG13 VAL A 81 8.109 6.821 7.272 0.10 0.00 H new ATOM 0 HG21 VAL A 81 6.409 4.484 6.192 0.66 0.00 H new ATOM 0 HG22 VAL A 81 5.735 6.088 6.568 0.66 0.00 H new ATOM 0 HG23 VAL A 81 5.514 5.388 4.947 0.66 0.00 H new ATOM 1295 N TYR A 82 5.551 8.472 6.256 0.45 0.00 N ATOM 1296 CA TYR A 82 5.053 9.321 7.333 1.00 0.00 C ATOM 1297 C TYR A 82 5.193 8.621 8.681 0.20 0.00 C ATOM 1298 O TYR A 82 5.385 7.406 8.740 0.85 0.00 O ATOM 1299 CB TYR A 82 3.589 9.691 7.087 0.21 0.00 C ATOM 1300 CG TYR A 82 3.367 10.483 5.816 0.09 0.00 C ATOM 1301 CD1 TYR A 82 3.588 11.854 5.781 1.00 0.00 C ATOM 1302 CD2 TYR A 82 2.935 9.858 4.652 0.14 0.00 C ATOM 1303 CE1 TYR A 82 3.383 12.581 4.622 1.00 0.00 C ATOM 1304 CE2 TYR A 82 2.730 10.578 3.490 0.31 0.00 C ATOM 1305 CZ TYR A 82 2.956 11.938 3.480 1.00 0.00 C ATOM 1306 OH TYR A 82 2.751 12.657 2.325 1.00 0.00 O ATOM 0 H TYR A 82 4.839 7.890 5.814 0.45 0.00 H new ATOM 0 HA TYR A 82 5.651 10.232 7.350 1.00 0.00 H new ATOM 0 HB2 TYR A 82 2.995 8.778 7.044 0.21 0.00 H new ATOM 0 HB3 TYR A 82 3.222 10.270 7.934 0.21 0.00 H new ATOM 0 HD1 TYR A 82 3.925 12.361 6.673 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.757 8.793 4.656 0.14 0.00 H new ATOM 0 HE1 TYR A 82 3.557 13.647 4.612 1.00 0.00 H new ATOM 0 HE2 TYR A 82 2.394 10.077 2.594 0.31 0.00 H new ATOM 0 HH TYR A 82 2.452 12.054 1.613 1.00 0.00 H new ATOM 1316 N ALA A 83 5.095 9.393 9.759 0.17 0.00 N ATOM 1317 CA ALA A 83 5.209 8.841 11.105 0.37 0.00 C ATOM 1318 C ALA A 83 4.061 7.882 11.402 0.66 0.00 C ATOM 1319 O ALA A 83 4.191 6.979 12.228 0.13 0.00 O ATOM 1320 CB ALA A 83 5.244 9.961 12.135 0.07 0.00 C ATOM 0 H ALA A 83 4.937 10.400 9.727 0.17 0.00 H new ATOM 0 HA ALA A 83 6.142 8.281 11.164 0.37 0.00 H new ATOM 0 HB1 ALA A 83 5.329 9.534 13.134 0.07 0.00 H new ATOM 0 HB2 ALA A 83 6.101 10.606 11.942 0.07 0.00 H new ATOM 0 HB3 ALA A 83 4.327 10.546 12.068 0.07 0.00 H new ATOM 1326 N ASP A 84 2.937 8.087 10.723 1.00 0.00 N ATOM 1327 CA ASP A 84 1.764 7.240 10.908 0.26 0.00 C ATOM 1328 C ASP A 84 1.955 5.896 10.211 0.12 0.00 C ATOM 1329 O ASP A 84 1.204 4.949 10.445 0.08 0.00 O ATOM 1330 CB ASP A 84 0.515 7.940 10.370 0.83 0.00 C ATOM 1331 CG ASP A 84 -0.735 7.092 10.508 0.06 0.00 C ATOM 1332 OD1 ASP A 84 -1.404 7.186 11.558 1.00 0.00 O ATOM 1333 OD2 ASP A 84 -1.045 6.334 9.563 1.00 0.00 O ATOM 0 H ASP A 84 2.814 8.833 10.039 1.00 0.00 H new ATOM 0 HA ASP A 84 1.635 7.060 11.975 0.26 0.00 H new ATOM 0 HB2 ASP A 84 0.372 8.880 10.903 0.83 0.00 H new ATOM 0 HB3 ASP A 84 0.667 8.189 9.320 0.83 0.00 H new ATOM 1338 N GLY A 85 2.969 5.825 9.354 0.23 0.00 N ATOM 1339 CA GLY A 85 3.251 4.596 8.632 0.93 0.00 C ATOM 1340 C GLY A 85 2.518 4.518 7.306 1.00 0.00 C ATOM 1341 O GLY A 85 2.612 3.516 6.597 0.41 0.00 O ATOM 0 H GLY A 85 3.602 6.598 9.146 0.23 0.00 H new ATOM 0 HA2 GLY A 85 4.324 4.521 8.455 0.93 0.00 H new ATOM 0 HA3 GLY A 85 2.969 3.743 9.250 0.93 0.00 H new ATOM 1345 N SER A 86 1.785 5.576 6.973 0.42 0.00 N ATOM 1346 CA SER A 86 1.038 5.623 5.721 0.36 0.00 C ATOM 1347 C SER A 86 1.985 5.746 4.532 0.34 0.00 C ATOM 1348 O SER A 86 3.076 6.303 4.650 0.53 0.00 O ATOM 1349 CB SER A 86 0.056 6.795 5.730 1.00 0.00 C ATOM 1350 OG SER A 86 -0.877 6.671 6.791 0.29 0.00 O ATOM 0 H SER A 86 1.692 6.411 7.552 0.42 0.00 H new ATOM 0 HA SER A 86 0.478 4.693 5.625 0.36 0.00 H new ATOM 0 HB2 SER A 86 0.604 7.732 5.831 1.00 0.00 H new ATOM 0 HB3 SER A 86 -0.474 6.837 4.778 1.00 0.00 H new ATOM 0 HG SER A 86 -0.399 6.643 7.646 0.29 0.00 H new ATOM 1356 N ILE A 87 1.563 5.220 3.387 0.09 0.00 N ATOM 1357 CA ILE A 87 2.376 5.270 2.178 0.21 0.00 C ATOM 1358 C ILE A 87 2.229 6.615 1.479 0.34 0.00 C ATOM 1359 O ILE A 87 1.121 7.129 1.324 0.14 0.00 O ATOM 1360 CB ILE A 87 2.001 4.141 1.193 0.28 0.00 C ATOM 1361 CG1 ILE A 87 2.262 2.771 1.820 0.29 0.00 C ATOM 1362 CG2 ILE A 87 2.780 4.285 -0.105 0.07 0.00 C ATOM 1363 CD1 ILE A 87 1.170 2.311 2.760 0.11 0.00 C ATOM 0 H ILE A 87 0.663 4.754 3.271 0.09 0.00 H new ATOM 0 HA ILE A 87 3.412 5.134 2.487 0.21 0.00 H new ATOM 0 HB ILE A 87 0.937 4.222 0.970 0.28 0.00 H new ATOM 0 HG12 ILE A 87 2.378 2.034 1.025 0.29 0.00 H new ATOM 0 HG13 ILE A 87 3.206 2.805 2.364 0.29 0.00 H new ATOM 0 HG21 ILE A 87 2.503 3.481 -0.787 0.07 0.00 H new ATOM 0 HG22 ILE A 87 2.548 5.246 -0.564 0.07 0.00 H new ATOM 0 HG23 ILE A 87 3.848 4.231 0.104 0.07 0.00 H new ATOM 0 HD11 ILE A 87 1.427 1.332 3.165 0.11 0.00 H new ATOM 0 HD12 ILE A 87 1.068 3.026 3.577 0.11 0.00 H new ATOM 0 HD13 ILE A 87 0.227 2.243 2.217 0.11 0.00 H new ATOM 1375 N CYS A 88 3.355 7.181 1.054 0.66 0.00 N ATOM 1376 CA CYS A 88 3.353 8.467 0.371 0.17 0.00 C ATOM 1377 C CYS A 88 2.754 8.339 -1.027 0.64 0.00 C ATOM 1378 O CYS A 88 3.384 7.801 -1.939 0.67 0.00 O ATOM 1379 CB CYS A 88 4.774 9.027 0.287 0.68 0.00 C ATOM 1380 SG CYS A 88 5.970 7.902 -0.472 1.00 0.00 S ATOM 0 H CYS A 88 4.280 6.768 1.172 0.66 0.00 H new ATOM 0 HA CYS A 88 2.736 9.157 0.947 0.17 0.00 H new ATOM 0 HB2 CYS A 88 4.753 9.956 -0.283 0.68 0.00 H new ATOM 0 HB3 CYS A 88 5.114 9.277 1.292 0.68 0.00 H new ATOM 0 HG CYS A 88 6.785 7.457 0.438 1.00 0.00 H new ATOM 1386 N LEU A 89 1.531 8.833 -1.187 0.18 0.00 N ATOM 1387 CA LEU A 89 0.843 8.775 -2.472 0.42 0.00 C ATOM 1388 C LEU A 89 -0.153 9.925 -2.598 0.83 0.00 C ATOM 1389 O LEU A 89 -0.858 10.254 -1.643 0.33 0.00 O ATOM 1390 CB LEU A 89 0.121 7.433 -2.628 0.07 0.00 C ATOM 1391 CG LEU A 89 0.216 6.786 -4.016 0.25 0.00 C ATOM 1392 CD1 LEU A 89 -0.395 7.688 -5.077 1.00 0.00 C ATOM 1393 CD2 LEU A 89 1.663 6.465 -4.359 0.11 0.00 C ATOM 0 H LEU A 89 0.995 9.279 -0.442 0.18 0.00 H new ATOM 0 HA LEU A 89 1.585 8.869 -3.265 0.42 0.00 H new ATOM 0 HB2 LEU A 89 0.525 6.736 -1.894 0.07 0.00 H new ATOM 0 HB3 LEU A 89 -0.932 7.577 -2.385 0.07 0.00 H new ATOM 0 HG LEU A 89 -0.349 5.854 -3.995 0.25 0.00 H new ATOM 0 HD11 LEU A 89 -0.316 7.208 -6.052 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.445 7.865 -4.844 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.137 8.639 -5.096 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.710 6.007 -5.347 0.11 0.00 H new ATOM 0 HD22 LEU A 89 2.250 7.384 -4.357 0.11 0.00 H new ATOM 0 HD23 LEU A 89 2.068 5.774 -3.619 0.11 0.00 H new ATOM 1405 N ASP A 90 -0.207 10.529 -3.781 0.32 0.00 N ATOM 1406 CA ASP A 90 -1.111 11.646 -4.034 1.00 0.00 C ATOM 1407 C ASP A 90 -2.571 11.209 -3.951 0.85 0.00 C ATOM 1408 O ASP A 90 -3.467 12.037 -3.787 1.00 0.00 O ATOM 1409 CB ASP A 90 -0.830 12.253 -5.409 0.93 0.00 C ATOM 1410 CG ASP A 90 0.560 12.853 -5.504 1.00 0.00 C ATOM 1411 OD1 ASP A 90 1.536 12.079 -5.591 0.10 0.00 O ATOM 1412 OD2 ASP A 90 0.672 14.097 -5.493 0.28 0.00 O ATOM 0 H ASP A 90 0.366 10.263 -4.582 0.32 0.00 H new ATOM 0 HA ASP A 90 -0.935 12.397 -3.264 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -0.943 11.484 -6.173 0.93 0.00 H new ATOM 0 HB3 ASP A 90 -1.571 13.024 -5.621 0.93 0.00 H new ATOM 1417 N ILE A 91 -2.806 9.904 -4.065 0.99 0.00 N ATOM 1418 CA ILE A 91 -4.161 9.366 -4.009 0.05 0.00 C ATOM 1419 C ILE A 91 -4.714 9.403 -2.585 0.12 0.00 C ATOM 1420 O ILE A 91 -5.925 9.483 -2.382 0.19 0.00 O ATOM 1421 CB ILE A 91 -4.209 7.916 -4.537 1.00 0.00 C ATOM 1422 CG1 ILE A 91 -5.653 7.506 -4.837 1.00 0.00 C ATOM 1423 CG2 ILE A 91 -3.577 6.961 -3.534 1.00 0.00 C ATOM 1424 CD1 ILE A 91 -5.778 6.143 -5.486 0.78 0.00 C ATOM 0 H ILE A 91 -2.078 9.202 -4.196 0.99 0.00 H new ATOM 0 HA ILE A 91 -4.780 9.997 -4.646 0.05 0.00 H new ATOM 0 HB ILE A 91 -3.637 7.865 -5.463 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.223 7.509 -3.908 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.105 8.252 -5.490 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -3.620 5.944 -3.923 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -2.537 7.243 -3.369 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.121 7.012 -2.591 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.830 5.922 -5.668 0.78 0.00 H new ATOM 0 HD12 ILE A 91 -5.237 6.140 -6.432 0.78 0.00 H new ATOM 0 HD13 ILE A 91 -5.357 5.385 -4.825 0.78 0.00 H new ATOM 1436 N LEU A 92 -3.818 9.347 -1.603 0.07 0.00 N ATOM 1437 CA LEU A 92 -4.218 9.371 -0.200 0.13 0.00 C ATOM 1438 C LEU A 92 -4.810 10.726 0.176 0.09 0.00 C ATOM 1439 O LEU A 92 -5.621 10.825 1.097 0.08 0.00 O ATOM 1440 CB LEU A 92 -3.018 9.056 0.701 1.00 0.00 C ATOM 1441 CG LEU A 92 -3.320 9.042 2.204 0.36 0.00 C ATOM 1442 CD1 LEU A 92 -4.306 7.936 2.545 0.55 0.00 C ATOM 1443 CD2 LEU A 92 -2.034 8.879 3.002 0.09 0.00 C ATOM 0 H LEU A 92 -2.811 9.285 -1.753 0.07 0.00 H new ATOM 0 HA LEU A 92 -4.983 8.609 -0.054 0.13 0.00 H new ATOM 0 HB2 LEU A 92 -2.616 8.083 0.418 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -2.237 9.792 0.510 1.00 0.00 H new ATOM 0 HG LEU A 92 -3.775 9.996 2.472 0.36 0.00 H new ATOM 0 HD11 LEU A 92 -4.506 7.944 3.616 0.55 0.00 H new ATOM 0 HD12 LEU A 92 -5.237 8.098 2.001 0.55 0.00 H new ATOM 0 HD13 LEU A 92 -3.883 6.972 2.262 0.55 0.00 H new ATOM 0 HD21 LEU A 92 -2.265 8.871 4.067 0.09 0.00 H new ATOM 0 HD22 LEU A 92 -1.552 7.940 2.728 0.09 0.00 H new ATOM 0 HD23 LEU A 92 -1.362 9.709 2.783 0.09 0.00 H new ATOM 1455 N GLN A 93 -4.401 11.765 -0.543 0.10 0.00 N ATOM 1456 CA GLN A 93 -4.890 13.115 -0.283 0.12 0.00 C ATOM 1457 C GLN A 93 -6.327 13.281 -0.772 0.15 0.00 C ATOM 1458 O GLN A 93 -7.002 12.303 -1.092 0.52 0.00 O ATOM 1459 CB GLN A 93 -3.982 14.147 -0.956 0.82 0.00 C ATOM 1460 CG GLN A 93 -2.662 14.364 -0.231 1.00 0.00 C ATOM 1461 CD GLN A 93 -1.804 13.115 -0.190 0.20 0.00 C ATOM 1462 OE1 GLN A 93 -0.988 12.879 -1.079 0.26 0.00 O ATOM 1463 NE2 GLN A 93 -1.982 12.308 0.850 1.00 0.00 N ATOM 0 H GLN A 93 -3.732 11.699 -1.310 0.10 0.00 H new ATOM 0 HA GLN A 93 -4.875 13.278 0.795 0.12 0.00 H new ATOM 0 HB2 GLN A 93 -3.777 13.827 -1.978 0.82 0.00 H new ATOM 0 HB3 GLN A 93 -4.512 15.097 -1.020 0.82 0.00 H new ATOM 0 HG2 GLN A 93 -2.109 15.164 -0.724 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -2.862 14.696 0.788 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -2.670 12.542 1.565 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -1.430 11.454 0.933 1.00 0.00 H new ATOM 1472 N ASN A 94 -6.786 14.528 -0.825 0.49 0.00 N ATOM 1473 CA ASN A 94 -8.143 14.829 -1.271 1.00 0.00 C ATOM 1474 C ASN A 94 -8.308 14.564 -2.764 0.06 0.00 C ATOM 1475 O ASN A 94 -9.389 14.754 -3.320 0.11 0.00 O ATOM 1476 CB ASN A 94 -8.493 16.287 -0.962 1.00 0.00 C ATOM 1477 CG ASN A 94 -7.584 17.266 -1.680 0.15 0.00 C ATOM 1478 OD1 ASN A 94 -6.427 16.963 -1.968 0.96 0.00 O ATOM 1479 ND2 ASN A 94 -8.108 18.451 -1.972 0.15 0.00 N ATOM 0 H ASN A 94 -6.237 15.347 -0.564 0.49 0.00 H new ATOM 0 HA ASN A 94 -8.824 14.172 -0.730 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.527 16.478 -1.249 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.425 16.454 0.113 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -7.546 19.152 -2.454 0.15 0.00 H new ATOM 0 HD22 ASN A 94 -9.073 18.660 -1.714 0.15 0.00 H new ATOM 1486 N ARG A 95 -7.231 14.125 -3.409 0.27 0.00 N ATOM 1487 CA ARG A 95 -7.266 13.839 -4.838 1.00 0.00 C ATOM 1488 C ARG A 95 -8.062 12.566 -5.112 0.08 0.00 C ATOM 1489 O ARG A 95 -8.400 12.267 -6.258 1.00 0.00 O ATOM 1490 CB ARG A 95 -5.844 13.700 -5.386 1.00 0.00 C ATOM 1491 CG ARG A 95 -5.780 13.596 -6.900 0.30 0.00 C ATOM 1492 CD ARG A 95 -4.343 13.569 -7.393 0.12 0.00 C ATOM 1493 NE ARG A 95 -4.261 13.457 -8.847 0.11 0.00 N ATOM 1494 CZ ARG A 95 -3.118 13.342 -9.516 1.00 0.00 C ATOM 1495 NH1 ARG A 95 -1.963 13.325 -8.863 0.27 0.00 N ATOM 1496 NH2 ARG A 95 -3.127 13.242 -10.838 0.08 0.00 N ATOM 0 H ARG A 95 -6.327 13.960 -2.966 0.27 0.00 H new ATOM 0 HA ARG A 95 -7.758 14.670 -5.343 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -5.255 14.559 -5.065 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -5.381 12.815 -4.950 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -6.295 12.693 -7.226 0.30 0.00 H new ATOM 0 HG3 ARG A 95 -6.304 14.441 -7.347 0.30 0.00 H new ATOM 0 HD2 ARG A 95 -3.833 14.477 -7.071 0.12 0.00 H new ATOM 0 HD3 ARG A 95 -3.819 12.730 -6.935 0.12 0.00 H new ATOM 0 HE ARG A 95 -5.131 13.468 -9.380 0.11 0.00 H new ATOM 0 HH11 ARG A 95 -1.951 13.400 -7.846 0.27 0.00 H new ATOM 0 HH12 ARG A 95 -1.087 13.237 -9.378 0.27 0.00 H new ATOM 0 HH21 ARG A 95 -4.012 13.253 -11.344 0.08 0.00 H new ATOM 0 HH22 ARG A 95 -2.249 13.154 -11.349 0.08 0.00 H new ATOM 1510 N TRP A 96 -8.360 11.820 -4.051 1.00 0.00 N ATOM 1511 CA TRP A 96 -9.123 10.585 -4.176 1.00 0.00 C ATOM 1512 C TRP A 96 -10.482 10.853 -4.817 0.10 0.00 C ATOM 1513 O TRP A 96 -11.090 11.899 -4.590 0.36 0.00 O ATOM 1514 CB TRP A 96 -9.307 9.932 -2.804 0.08 0.00 C ATOM 1515 CG TRP A 96 -10.299 8.808 -2.804 0.76 0.00 C ATOM 1516 CD1 TRP A 96 -11.535 8.806 -2.224 0.07 0.00 C ATOM 1517 CD2 TRP A 96 -10.143 7.525 -3.420 1.00 0.00 C ATOM 1518 NE1 TRP A 96 -12.154 7.599 -2.435 0.42 0.00 N ATOM 1519 CE2 TRP A 96 -11.320 6.795 -3.168 1.00 0.00 C ATOM 1520 CE3 TRP A 96 -9.122 6.922 -4.158 0.45 0.00 C ATOM 1521 CZ2 TRP A 96 -11.501 5.494 -3.629 0.17 0.00 C ATOM 1522 CZ3 TRP A 96 -9.303 5.631 -4.616 1.00 0.00 C ATOM 1523 CH2 TRP A 96 -10.484 4.928 -4.350 0.16 0.00 C ATOM 0 H TRP A 96 -8.084 12.051 -3.096 1.00 0.00 H new ATOM 0 HA TRP A 96 -8.566 9.903 -4.819 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -8.344 9.556 -2.457 0.08 0.00 H new ATOM 0 HB3 TRP A 96 -9.629 10.690 -2.090 0.08 0.00 H new ATOM 0 HD1 TRP A 96 -11.963 9.634 -1.678 0.07 0.00 H new ATOM 0 HE1 TRP A 96 -13.083 7.342 -2.101 0.42 0.00 H new ATOM 0 HE3 TRP A 96 -8.207 7.456 -4.367 0.45 0.00 H new ATOM 0 HZ2 TRP A 96 -12.412 4.950 -3.425 0.17 0.00 H new ATOM 0 HZ3 TRP A 96 -8.520 5.156 -5.189 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -10.595 3.920 -4.721 0.16 0.00 H new ATOM 1534 N SER A 97 -10.950 9.901 -5.618 1.00 0.00 N ATOM 1535 CA SER A 97 -12.234 10.033 -6.294 0.35 0.00 C ATOM 1536 C SER A 97 -13.082 8.777 -6.107 0.14 0.00 C ATOM 1537 O SER A 97 -12.548 7.672 -6.000 0.09 0.00 O ATOM 1538 CB SER A 97 -12.020 10.302 -7.784 1.00 0.00 C ATOM 1539 OG SER A 97 -11.359 11.540 -7.990 0.06 0.00 O ATOM 0 H SER A 97 -10.458 9.029 -5.814 1.00 0.00 H new ATOM 0 HA SER A 97 -12.766 10.875 -5.851 0.35 0.00 H new ATOM 0 HB2 SER A 97 -11.432 9.495 -8.222 1.00 0.00 H new ATOM 0 HB3 SER A 97 -12.982 10.310 -8.297 1.00 0.00 H new ATOM 0 HG SER A 97 -11.233 11.688 -8.951 0.06 0.00 H new ATOM 1545 N PRO A 98 -14.422 8.926 -6.066 0.26 0.00 N ATOM 1546 CA PRO A 98 -15.334 7.792 -5.889 0.18 0.00 C ATOM 1547 C PRO A 98 -15.433 6.927 -7.141 0.35 0.00 C ATOM 1548 O PRO A 98 -16.040 5.857 -7.121 0.60 0.00 O ATOM 1549 CB PRO A 98 -16.675 8.462 -5.593 1.00 0.00 C ATOM 1550 CG PRO A 98 -16.594 9.789 -6.261 1.00 0.00 C ATOM 1551 CD PRO A 98 -15.148 10.206 -6.190 0.12 0.00 C ATOM 0 HA PRO A 98 -14.998 7.115 -5.104 0.18 0.00 H new ATOM 0 HB2 PRO A 98 -17.506 7.873 -5.983 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -16.835 8.569 -4.520 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -16.931 9.725 -7.296 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -17.234 10.516 -5.762 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -14.845 10.754 -7.082 0.12 0.00 H new ATOM 0 HD3 PRO A 98 -14.960 10.858 -5.337 0.12 0.00 H new ATOM 1559 N THR A 99 -14.832 7.399 -8.230 0.76 0.00 N ATOM 1560 CA THR A 99 -14.852 6.669 -9.491 0.08 0.00 C ATOM 1561 C THR A 99 -13.914 5.466 -9.449 0.41 0.00 C ATOM 1562 O THR A 99 -14.204 4.420 -10.030 0.62 0.00 O ATOM 1563 CB THR A 99 -14.456 7.573 -10.673 1.00 0.00 C ATOM 1564 OG1 THR A 99 -13.138 8.098 -10.471 0.07 0.00 O ATOM 1565 CG2 THR A 99 -15.443 8.719 -10.834 0.10 0.00 C ATOM 0 H THR A 99 -14.326 8.284 -8.263 0.76 0.00 H new ATOM 0 HA THR A 99 -15.875 6.323 -9.636 0.08 0.00 H new ATOM 0 HB THR A 99 -14.471 6.970 -11.581 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.894 8.670 -11.228 0.07 0.00 H new ATOM 0 HG21 THR A 99 -15.142 9.343 -11.675 0.10 0.00 H new ATOM 0 HG22 THR A 99 -16.440 8.318 -11.019 0.10 0.00 H new ATOM 0 HG23 THR A 99 -15.456 9.318 -9.924 0.10 0.00 H new ATOM 1573 N TYR A 100 -12.788 5.621 -8.757 1.00 0.00 N ATOM 1574 CA TYR A 100 -11.809 4.547 -8.641 0.28 0.00 C ATOM 1575 C TYR A 100 -12.299 3.459 -7.688 0.26 0.00 C ATOM 1576 O TYR A 100 -13.335 3.609 -7.040 0.76 0.00 O ATOM 1577 CB TYR A 100 -10.467 5.098 -8.152 0.31 0.00 C ATOM 1578 CG TYR A 100 -9.805 6.041 -9.132 1.00 0.00 C ATOM 1579 CD1 TYR A 100 -9.085 5.555 -10.216 0.75 0.00 C ATOM 1580 CD2 TYR A 100 -9.896 7.418 -8.970 1.00 0.00 C ATOM 1581 CE1 TYR A 100 -8.476 6.413 -11.112 1.00 0.00 C ATOM 1582 CE2 TYR A 100 -9.291 8.284 -9.863 0.08 0.00 C ATOM 1583 CZ TYR A 100 -8.582 7.776 -10.931 0.12 0.00 C ATOM 1584 OH TYR A 100 -7.977 8.634 -11.820 0.73 0.00 O ATOM 0 H TYR A 100 -12.532 6.479 -8.269 1.00 0.00 H new ATOM 0 HA TYR A 100 -11.676 4.107 -9.630 0.28 0.00 H new ATOM 0 HB2 TYR A 100 -10.621 5.619 -7.207 0.31 0.00 H new ATOM 0 HB3 TYR A 100 -9.793 4.265 -7.951 0.31 0.00 H new ATOM 0 HD1 TYR A 100 -9.000 4.488 -10.361 0.75 0.00 H new ATOM 0 HD2 TYR A 100 -10.448 7.819 -8.133 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -7.920 6.018 -11.950 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -9.373 9.352 -9.725 0.08 0.00 H new ATOM 0 HH TYR A 100 -8.149 9.560 -11.550 0.73 0.00 H new ATOM 1594 N ASP A 101 -11.548 2.365 -7.611 0.15 0.00 N ATOM 1595 CA ASP A 101 -11.906 1.250 -6.742 0.08 0.00 C ATOM 1596 C ASP A 101 -10.761 0.902 -5.796 0.16 0.00 C ATOM 1597 O ASP A 101 -9.750 1.602 -5.746 0.23 0.00 O ATOM 1598 CB ASP A 101 -12.282 0.025 -7.577 0.56 0.00 C ATOM 1599 CG ASP A 101 -13.480 0.282 -8.471 0.17 0.00 C ATOM 1600 OD1 ASP A 101 -14.621 0.058 -8.015 1.00 0.00 O ATOM 1601 OD2 ASP A 101 -13.278 0.705 -9.629 0.24 0.00 O ATOM 0 H ASP A 101 -10.687 2.227 -8.140 0.15 0.00 H new ATOM 0 HA ASP A 101 -12.766 1.553 -6.144 0.08 0.00 H new ATOM 0 HB2 ASP A 101 -11.430 -0.269 -8.191 0.56 0.00 H new ATOM 0 HB3 ASP A 101 -12.500 -0.811 -6.913 0.56 0.00 H new ATOM 1606 N VAL A 102 -10.929 -0.183 -5.045 0.84 0.00 N ATOM 1607 CA VAL A 102 -9.914 -0.628 -4.099 0.25 0.00 C ATOM 1608 C VAL A 102 -8.622 -1.005 -4.817 0.16 0.00 C ATOM 1609 O VAL A 102 -7.525 -0.794 -4.295 1.00 0.00 O ATOM 1610 CB VAL A 102 -10.406 -1.839 -3.279 1.00 0.00 C ATOM 1611 CG1 VAL A 102 -9.405 -2.198 -2.193 1.00 0.00 C ATOM 1612 CG2 VAL A 102 -11.776 -1.561 -2.683 0.55 0.00 C ATOM 0 H VAL A 102 -11.762 -0.771 -5.075 0.84 0.00 H new ATOM 0 HA VAL A 102 -9.721 0.206 -3.424 0.25 0.00 H new ATOM 0 HB VAL A 102 -10.495 -2.693 -3.951 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -9.773 -3.054 -1.628 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.447 -2.449 -2.649 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.276 -1.349 -1.522 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -12.105 -2.427 -2.109 0.55 0.00 H new ATOM 0 HG22 VAL A 102 -11.718 -0.692 -2.028 0.55 0.00 H new ATOM 0 HG23 VAL A 102 -12.488 -1.365 -3.484 0.55 0.00 H new ATOM 1622 N SER A 103 -8.758 -1.560 -6.017 0.06 0.00 N ATOM 1623 CA SER A 103 -7.602 -1.969 -6.810 0.05 0.00 C ATOM 1624 C SER A 103 -6.708 -0.775 -7.131 0.06 0.00 C ATOM 1625 O SER A 103 -5.488 -0.912 -7.238 0.91 0.00 O ATOM 1626 CB SER A 103 -8.061 -2.641 -8.107 1.00 0.00 C ATOM 1627 OG SER A 103 -8.832 -1.754 -8.896 0.12 0.00 O ATOM 0 H SER A 103 -9.658 -1.737 -6.463 0.06 0.00 H new ATOM 0 HA SER A 103 -7.024 -2.682 -6.222 0.05 0.00 H new ATOM 0 HB2 SER A 103 -7.192 -2.975 -8.674 1.00 0.00 H new ATOM 0 HB3 SER A 103 -8.649 -3.528 -7.872 1.00 0.00 H new ATOM 0 HG SER A 103 -9.111 -2.207 -9.719 0.12 0.00 H new ATOM 1633 N SER A 104 -7.322 0.394 -7.284 0.11 0.00 N ATOM 1634 CA SER A 104 -6.586 1.614 -7.599 0.10 0.00 C ATOM 1635 C SER A 104 -5.519 1.912 -6.548 0.63 0.00 C ATOM 1636 O SER A 104 -4.395 2.286 -6.883 1.00 0.00 O ATOM 1637 CB SER A 104 -7.546 2.800 -7.711 1.00 0.00 C ATOM 1638 OG SER A 104 -6.847 3.995 -8.012 0.46 0.00 O ATOM 0 H SER A 104 -8.330 0.523 -7.195 0.11 0.00 H new ATOM 0 HA SER A 104 -6.087 1.459 -8.556 0.10 0.00 H new ATOM 0 HB2 SER A 104 -8.285 2.602 -8.487 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.092 2.920 -6.775 1.00 0.00 H new ATOM 0 HG SER A 104 -7.376 4.535 -8.636 0.46 0.00 H new ATOM 1644 N ILE A 105 -5.875 1.742 -5.278 0.16 0.00 N ATOM 1645 CA ILE A 105 -4.946 2.003 -4.182 1.00 0.00 C ATOM 1646 C ILE A 105 -3.822 0.965 -4.160 0.21 0.00 C ATOM 1647 O ILE A 105 -2.700 1.257 -3.743 0.38 0.00 O ATOM 1648 CB ILE A 105 -5.681 2.025 -2.817 0.80 0.00 C ATOM 1649 CG1 ILE A 105 -5.145 3.160 -1.932 0.23 0.00 C ATOM 1650 CG2 ILE A 105 -5.567 0.686 -2.100 1.00 0.00 C ATOM 1651 CD1 ILE A 105 -3.676 3.037 -1.579 0.09 0.00 C ATOM 0 H ILE A 105 -6.798 1.425 -4.982 0.16 0.00 H new ATOM 0 HA ILE A 105 -4.508 2.987 -4.350 1.00 0.00 H new ATOM 0 HB ILE A 105 -6.738 2.207 -3.013 0.80 0.00 H new ATOM 0 HG12 ILE A 105 -5.305 4.109 -2.443 0.23 0.00 H new ATOM 0 HG13 ILE A 105 -5.726 3.192 -1.011 0.23 0.00 H new ATOM 0 HG21 ILE A 105 -6.094 0.738 -1.147 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -6.009 -0.096 -2.717 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -4.516 0.457 -1.922 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -3.381 3.879 -0.953 0.09 0.00 H new ATOM 0 HD12 ILE A 105 -3.509 2.106 -1.038 0.09 0.00 H new ATOM 0 HD13 ILE A 105 -3.081 3.038 -2.492 0.09 0.00 H new ATOM 1663 N LEU A 106 -4.129 -0.246 -4.617 0.97 0.00 N ATOM 1664 CA LEU A 106 -3.143 -1.323 -4.649 1.00 0.00 C ATOM 1665 C LEU A 106 -2.022 -1.001 -5.631 0.55 0.00 C ATOM 1666 O LEU A 106 -0.843 -1.025 -5.275 1.00 0.00 O ATOM 1667 CB LEU A 106 -3.805 -2.646 -5.043 1.00 0.00 C ATOM 1668 CG LEU A 106 -4.840 -3.183 -4.053 1.00 0.00 C ATOM 1669 CD1 LEU A 106 -5.494 -4.438 -4.608 0.21 0.00 C ATOM 1670 CD2 LEU A 106 -4.194 -3.470 -2.705 0.12 0.00 C ATOM 0 H LEU A 106 -5.050 -0.506 -4.969 0.97 0.00 H new ATOM 0 HA LEU A 106 -2.720 -1.419 -3.649 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.287 -2.517 -6.012 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.026 -3.398 -5.172 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.608 -2.424 -3.908 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -6.229 -4.811 -3.895 0.21 0.00 H new ATOM 0 HD12 LEU A 106 -5.989 -4.204 -5.550 0.21 0.00 H new ATOM 0 HD13 LEU A 106 -4.733 -5.200 -4.778 0.21 0.00 H new ATOM 0 HD21 LEU A 106 -4.947 -3.851 -2.015 0.12 0.00 H new ATOM 0 HD22 LEU A 106 -3.407 -4.213 -2.830 0.12 0.00 H new ATOM 0 HD23 LEU A 106 -3.766 -2.551 -2.304 0.12 0.00 H new ATOM 1682 N THR A 107 -2.401 -0.704 -6.870 0.08 0.00 N ATOM 1683 CA THR A 107 -1.435 -0.381 -7.912 0.10 0.00 C ATOM 1684 C THR A 107 -0.639 0.870 -7.560 0.28 0.00 C ATOM 1685 O THR A 107 0.509 1.025 -7.979 0.06 0.00 O ATOM 1686 CB THR A 107 -2.127 -0.172 -9.273 0.28 0.00 C ATOM 1687 OG1 THR A 107 -3.039 0.931 -9.196 0.06 0.00 O ATOM 1688 CG2 THR A 107 -2.876 -1.427 -9.697 0.06 0.00 C ATOM 0 H THR A 107 -3.374 -0.681 -7.177 0.08 0.00 H new ATOM 0 HA THR A 107 -0.754 -1.229 -7.985 0.10 0.00 H new ATOM 0 HB THR A 107 -1.360 0.043 -10.016 0.28 0.00 H new ATOM 0 HG1 THR A 107 -3.238 1.126 -8.256 0.06 0.00 H new ATOM 0 HG21 THR A 107 -3.356 -1.256 -10.660 0.06 0.00 H new ATOM 0 HG22 THR A 107 -2.175 -2.257 -9.783 0.06 0.00 H new ATOM 0 HG23 THR A 107 -3.634 -1.668 -8.951 0.06 0.00 H new ATOM 1696 N SER A 108 -1.253 1.762 -6.789 0.58 0.00 N ATOM 1697 CA SER A 108 -0.599 3.001 -6.382 1.00 0.00 C ATOM 1698 C SER A 108 0.615 2.710 -5.507 0.24 0.00 C ATOM 1699 O SER A 108 1.699 3.249 -5.733 1.00 0.00 O ATOM 1700 CB SER A 108 -1.584 3.899 -5.631 1.00 0.00 C ATOM 1701 OG SER A 108 -2.671 4.269 -6.461 0.06 0.00 O ATOM 0 H SER A 108 -2.202 1.650 -6.433 0.58 0.00 H new ATOM 0 HA SER A 108 -0.261 3.519 -7.280 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.957 3.378 -4.749 1.00 0.00 H new ATOM 0 HB3 SER A 108 -1.070 4.793 -5.279 1.00 0.00 H new ATOM 0 HG SER A 108 -3.331 3.545 -6.478 0.06 0.00 H new ATOM 1707 N ILE A 109 0.426 1.855 -4.507 0.09 0.00 N ATOM 1708 CA ILE A 109 1.505 1.491 -3.597 0.07 0.00 C ATOM 1709 C ILE A 109 2.557 0.643 -4.309 1.00 0.00 C ATOM 1710 O ILE A 109 3.754 0.778 -4.053 1.00 0.00 O ATOM 1711 CB ILE A 109 0.971 0.717 -2.376 0.10 0.00 C ATOM 1712 CG1 ILE A 109 -0.079 1.549 -1.635 0.95 0.00 C ATOM 1713 CG2 ILE A 109 2.115 0.340 -1.443 0.09 0.00 C ATOM 1714 CD1 ILE A 109 -0.779 0.795 -0.524 1.00 0.00 C ATOM 0 H ILE A 109 -0.465 1.401 -4.307 0.09 0.00 H new ATOM 0 HA ILE A 109 1.962 2.419 -3.254 0.07 0.00 H new ATOM 0 HB ILE A 109 0.498 -0.201 -2.726 0.10 0.00 H new ATOM 0 HG12 ILE A 109 0.401 2.434 -1.216 0.95 0.00 H new ATOM 0 HG13 ILE A 109 -0.824 1.899 -2.350 0.95 0.00 H new ATOM 0 HG21 ILE A 109 1.721 -0.206 -0.586 0.09 0.00 H new ATOM 0 HG22 ILE A 109 2.828 -0.288 -1.977 0.09 0.00 H new ATOM 0 HG23 ILE A 109 2.616 1.244 -1.098 0.09 0.00 H new ATOM 0 HD11 ILE A 109 -1.508 1.448 -0.045 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -1.288 -0.075 -0.939 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -0.045 0.468 0.213 1.00 0.00 H new ATOM 1726 N GLN A 110 2.103 -0.229 -5.206 0.06 0.00 N ATOM 1727 CA GLN A 110 3.007 -1.095 -5.955 0.81 0.00 C ATOM 1728 C GLN A 110 3.927 -0.269 -6.849 0.29 0.00 C ATOM 1729 O GLN A 110 5.074 -0.641 -7.090 0.14 0.00 O ATOM 1730 CB GLN A 110 2.213 -2.092 -6.803 1.00 0.00 C ATOM 1731 CG GLN A 110 3.083 -3.128 -7.500 1.00 0.00 C ATOM 1732 CD GLN A 110 2.296 -4.017 -8.441 0.55 0.00 C ATOM 1733 OE1 GLN A 110 1.290 -3.599 -9.015 0.46 0.00 O ATOM 1734 NE2 GLN A 110 2.752 -5.254 -8.606 0.40 0.00 N ATOM 0 H GLN A 110 1.116 -0.354 -5.431 0.06 0.00 H new ATOM 0 HA GLN A 110 3.618 -1.647 -5.240 0.81 0.00 H new ATOM 0 HB2 GLN A 110 1.492 -2.605 -6.166 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.643 -1.545 -7.553 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.868 -2.619 -8.059 1.00 0.00 H new ATOM 0 HG3 GLN A 110 3.575 -3.747 -6.750 1.00 0.00 H new ATOM 0 HE21 GLN A 110 3.590 -5.559 -8.111 0.40 0.00 H new ATOM 0 HE22 GLN A 110 2.264 -5.899 -9.228 0.40 0.00 H new ATOM 1743 N SER A 111 3.409 0.853 -7.337 0.06 0.00 N ATOM 1744 CA SER A 111 4.175 1.742 -8.203 0.20 0.00 C ATOM 1745 C SER A 111 5.345 2.361 -7.446 1.00 0.00 C ATOM 1746 O SER A 111 6.379 2.679 -8.034 0.09 0.00 O ATOM 1747 CB SER A 111 3.272 2.845 -8.760 0.16 0.00 C ATOM 1748 OG SER A 111 3.986 3.688 -9.649 0.85 0.00 O ATOM 0 H SER A 111 2.458 1.169 -7.147 0.06 0.00 H new ATOM 0 HA SER A 111 4.571 1.153 -9.030 0.20 0.00 H new ATOM 0 HB2 SER A 111 2.424 2.398 -9.280 0.16 0.00 H new ATOM 0 HB3 SER A 111 2.867 3.437 -7.939 0.16 0.00 H new ATOM 0 HG SER A 111 3.387 4.383 -9.992 0.85 0.00 H new ATOM 1754 N LEU A 112 5.170 2.532 -6.139 0.15 0.00 N ATOM 1755 CA LEU A 112 6.205 3.120 -5.297 0.21 0.00 C ATOM 1756 C LEU A 112 7.485 2.294 -5.352 0.53 0.00 C ATOM 1757 O LEU A 112 8.587 2.829 -5.246 0.16 0.00 O ATOM 1758 CB LEU A 112 5.716 3.221 -3.852 1.00 0.00 C ATOM 1759 CG LEU A 112 6.600 4.055 -2.924 0.40 0.00 C ATOM 1760 CD1 LEU A 112 6.471 5.533 -3.255 0.62 0.00 C ATOM 1761 CD2 LEU A 112 6.236 3.802 -1.468 1.00 0.00 C ATOM 0 H LEU A 112 4.320 2.271 -5.640 0.15 0.00 H new ATOM 0 HA LEU A 112 6.421 4.120 -5.674 0.21 0.00 H new ATOM 0 HB2 LEU A 112 4.713 3.648 -3.853 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.633 2.215 -3.442 1.00 0.00 H new ATOM 0 HG LEU A 112 7.637 3.755 -3.076 0.40 0.00 H new ATOM 0 HD11 LEU A 112 7.106 6.113 -2.585 0.62 0.00 H new ATOM 0 HD12 LEU A 112 6.780 5.703 -4.286 0.62 0.00 H new ATOM 0 HD13 LEU A 112 5.434 5.844 -3.131 0.62 0.00 H new ATOM 0 HD21 LEU A 112 6.876 4.404 -0.823 1.00 0.00 H new ATOM 0 HD22 LEU A 112 5.194 4.074 -1.301 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.377 2.746 -1.236 1.00 0.00 H new ATOM 1773 N LEU A 113 7.327 0.985 -5.521 0.09 0.00 N ATOM 1774 CA LEU A 113 8.470 0.082 -5.590 0.38 0.00 C ATOM 1775 C LEU A 113 9.213 0.261 -6.904 0.16 0.00 C ATOM 1776 O LEU A 113 10.442 0.332 -6.932 0.83 0.00 O ATOM 1777 CB LEU A 113 8.016 -1.372 -5.460 1.00 0.00 C ATOM 1778 CG LEU A 113 6.771 -1.598 -4.601 1.00 0.00 C ATOM 1779 CD1 LEU A 113 6.375 -3.065 -4.622 1.00 0.00 C ATOM 1780 CD2 LEU A 113 7.010 -1.127 -3.177 0.68 0.00 C ATOM 0 H LEU A 113 6.420 0.527 -5.613 0.09 0.00 H new ATOM 0 HA LEU A 113 9.138 0.324 -4.764 0.38 0.00 H new ATOM 0 HB2 LEU A 113 7.824 -1.765 -6.458 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.836 -1.955 -5.041 1.00 0.00 H new ATOM 0 HG LEU A 113 5.952 -1.013 -5.018 1.00 0.00 H new ATOM 0 HD11 LEU A 113 5.487 -3.211 -4.006 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.160 -3.369 -5.646 1.00 0.00 H new ATOM 0 HD13 LEU A 113 7.193 -3.668 -4.228 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.112 -1.296 -2.582 0.68 0.00 H new ATOM 0 HD22 LEU A 113 7.842 -1.683 -2.745 0.68 0.00 H new ATOM 0 HD23 LEU A 113 7.247 -0.063 -3.181 0.68 0.00 H new ATOM 1792 N ASP A 114 8.456 0.333 -7.992 0.61 0.00 N ATOM 1793 CA ASP A 114 9.036 0.492 -9.316 0.53 0.00 C ATOM 1794 C ASP A 114 9.802 1.807 -9.425 0.32 0.00 C ATOM 1795 O ASP A 114 11.022 1.814 -9.597 0.07 0.00 O ATOM 1796 CB ASP A 114 7.943 0.430 -10.385 0.13 0.00 C ATOM 1797 CG ASP A 114 8.507 0.494 -11.792 0.92 0.00 C ATOM 1798 OD1 ASP A 114 8.903 -0.567 -12.320 0.38 0.00 O ATOM 1799 OD2 ASP A 114 8.550 1.601 -12.364 1.00 0.00 O ATOM 0 H ASP A 114 7.437 0.283 -7.981 0.61 0.00 H new ATOM 0 HA ASP A 114 9.738 -0.326 -9.477 0.53 0.00 H new ATOM 0 HB2 ASP A 114 7.374 -0.492 -10.266 0.13 0.00 H new ATOM 0 HB3 ASP A 114 7.247 1.256 -10.237 0.13 0.00 H new ATOM 1804 N GLU A 115 9.078 2.919 -9.322 0.76 0.00 N ATOM 1805 CA GLU A 115 9.692 4.240 -9.410 0.14 0.00 C ATOM 1806 C GLU A 115 8.938 5.255 -8.543 0.07 0.00 C ATOM 1807 O GLU A 115 7.823 5.658 -8.877 0.39 0.00 O ATOM 1808 CB GLU A 115 9.725 4.711 -10.868 0.14 0.00 C ATOM 1809 CG GLU A 115 8.382 4.623 -11.573 0.70 0.00 C ATOM 1810 CD GLU A 115 8.473 4.986 -13.042 0.11 0.00 C ATOM 1811 OE1 GLU A 115 8.407 6.191 -13.362 1.00 0.00 O ATOM 1812 OE2 GLU A 115 8.613 4.065 -13.875 0.53 0.00 O ATOM 0 H GLU A 115 8.068 2.931 -9.178 0.76 0.00 H new ATOM 0 HA GLU A 115 10.713 4.166 -9.037 0.14 0.00 H new ATOM 0 HB2 GLU A 115 10.073 5.743 -10.898 0.14 0.00 H new ATOM 0 HB3 GLU A 115 10.452 4.113 -11.417 0.14 0.00 H new ATOM 0 HG2 GLU A 115 7.990 3.611 -11.476 0.70 0.00 H new ATOM 0 HG3 GLU A 115 7.673 5.288 -11.081 0.70 0.00 H new ATOM 1819 N PRO A 116 9.535 5.681 -7.411 0.72 0.00 N ATOM 1820 CA PRO A 116 8.907 6.649 -6.505 0.12 0.00 C ATOM 1821 C PRO A 116 8.924 8.071 -7.065 1.00 0.00 C ATOM 1822 O PRO A 116 9.120 8.275 -8.264 0.21 0.00 O ATOM 1823 CB PRO A 116 9.766 6.564 -5.246 0.25 0.00 C ATOM 1824 CG PRO A 116 11.110 6.147 -5.736 0.67 0.00 C ATOM 1825 CD PRO A 116 10.861 5.252 -6.920 0.32 0.00 C ATOM 0 HA PRO A 116 7.854 6.423 -6.338 0.12 0.00 H new ATOM 0 HB2 PRO A 116 9.812 7.524 -4.732 0.25 0.00 H new ATOM 0 HB3 PRO A 116 9.361 5.842 -4.537 0.25 0.00 H new ATOM 0 HG2 PRO A 116 11.707 7.013 -6.021 0.67 0.00 H new ATOM 0 HG3 PRO A 116 11.663 5.620 -4.958 0.67 0.00 H new ATOM 0 HD2 PRO A 116 11.629 5.375 -7.683 0.32 0.00 H new ATOM 0 HD3 PRO A 116 10.861 4.200 -6.634 0.32 0.00 H new ATOM 1833 N ASN A 117 8.717 9.047 -6.186 0.45 0.00 N ATOM 1834 CA ASN A 117 8.704 10.449 -6.584 0.75 0.00 C ATOM 1835 C ASN A 117 9.656 11.273 -5.713 1.00 0.00 C ATOM 1836 O ASN A 117 9.365 11.530 -4.545 1.00 0.00 O ATOM 1837 CB ASN A 117 7.287 11.013 -6.478 1.00 0.00 C ATOM 1838 CG ASN A 117 6.315 10.319 -7.414 1.00 0.00 C ATOM 1839 OD1 ASN A 117 5.686 9.326 -7.050 0.55 0.00 O ATOM 1840 ND2 ASN A 117 6.188 10.842 -8.629 0.16 0.00 N ATOM 0 H ASN A 117 8.556 8.891 -5.191 0.45 0.00 H new ATOM 0 HA ASN A 117 9.040 10.511 -7.619 0.75 0.00 H new ATOM 0 HB2 ASN A 117 6.934 10.911 -5.452 1.00 0.00 H new ATOM 0 HB3 ASN A 117 7.306 12.079 -6.704 1.00 0.00 H new ATOM 0 HD21 ASN A 117 5.549 10.419 -9.302 0.16 0.00 H new ATOM 0 HD22 ASN A 117 6.729 11.667 -8.888 0.16 0.00 H new ATOM 1847 N PRO A 118 10.811 11.697 -6.267 0.61 0.00 N ATOM 1848 CA PRO A 118 11.796 12.489 -5.525 0.85 0.00 C ATOM 1849 C PRO A 118 11.449 13.974 -5.485 0.60 0.00 C ATOM 1850 O PRO A 118 12.294 14.807 -5.158 0.57 0.00 O ATOM 1851 CB PRO A 118 13.077 12.260 -6.323 1.00 0.00 C ATOM 1852 CG PRO A 118 12.611 12.091 -7.728 0.12 0.00 C ATOM 1853 CD PRO A 118 11.255 11.434 -7.651 0.68 0.00 C ATOM 0 HA PRO A 118 11.859 12.193 -4.478 0.85 0.00 H new ATOM 0 HB2 PRO A 118 13.760 13.104 -6.229 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.611 11.377 -5.972 1.00 0.00 H new ATOM 0 HG2 PRO A 118 12.548 13.054 -8.235 0.12 0.00 H new ATOM 0 HG3 PRO A 118 13.308 11.477 -8.297 0.12 0.00 H new ATOM 0 HD2 PRO A 118 10.564 11.858 -8.380 0.68 0.00 H new ATOM 0 HD3 PRO A 118 11.317 10.365 -7.854 0.68 0.00 H new ATOM 1861 N ASN A 119 10.203 14.301 -5.817 1.00 0.00 N ATOM 1862 CA ASN A 119 9.755 15.690 -5.815 0.17 0.00 C ATOM 1863 C ASN A 119 9.663 16.227 -4.389 0.07 0.00 C ATOM 1864 O ASN A 119 9.851 17.419 -4.151 0.10 0.00 O ATOM 1865 CB ASN A 119 8.397 15.818 -6.508 0.72 0.00 C ATOM 1866 CG ASN A 119 7.267 15.226 -5.689 0.69 0.00 C ATOM 1867 OD1 ASN A 119 6.939 14.046 -5.823 1.00 0.00 O ATOM 1868 ND2 ASN A 119 6.663 16.043 -4.832 1.00 0.00 N ATOM 0 H ASN A 119 9.488 13.626 -6.090 1.00 0.00 H new ATOM 0 HA ASN A 119 10.488 16.281 -6.364 0.17 0.00 H new ATOM 0 HB2 ASN A 119 8.189 16.871 -6.700 0.72 0.00 H new ATOM 0 HB3 ASN A 119 8.439 15.319 -7.476 0.72 0.00 H new ATOM 0 HD21 ASN A 119 5.896 15.699 -4.254 1.00 0.00 H new ATOM 0 HD22 ASN A 119 6.966 17.014 -4.753 1.00 0.00 H new ATOM 1875 N SER A 120 9.374 15.336 -3.444 0.88 0.00 N ATOM 1876 CA SER A 120 9.255 15.719 -2.043 0.38 0.00 C ATOM 1877 C SER A 120 9.566 14.534 -1.127 0.23 0.00 C ATOM 1878 O SER A 120 8.821 13.555 -1.099 0.61 0.00 O ATOM 1879 CB SER A 120 7.846 16.239 -1.758 0.09 0.00 C ATOM 1880 OG SER A 120 7.562 17.394 -2.528 0.46 0.00 O ATOM 0 H SER A 120 9.218 14.344 -3.625 0.88 0.00 H new ATOM 0 HA SER A 120 9.978 16.510 -1.843 0.38 0.00 H new ATOM 0 HB2 SER A 120 7.116 15.461 -1.981 0.09 0.00 H new ATOM 0 HB3 SER A 120 7.749 16.472 -0.698 0.09 0.00 H new ATOM 0 HG SER A 120 6.655 17.705 -2.328 0.46 0.00 H new ATOM 1886 N PRO A 121 10.675 14.601 -0.360 0.37 0.00 N ATOM 1887 CA PRO A 121 11.070 13.526 0.550 0.05 0.00 C ATOM 1888 C PRO A 121 10.342 13.595 1.888 1.00 0.00 C ATOM 1889 O PRO A 121 10.184 14.670 2.465 1.00 0.00 O ATOM 1890 CB PRO A 121 12.562 13.780 0.743 0.10 0.00 C ATOM 1891 CG PRO A 121 12.701 15.260 0.640 0.09 0.00 C ATOM 1892 CD PRO A 121 11.635 15.724 -0.323 0.21 0.00 C ATOM 0 HA PRO A 121 10.830 12.540 0.152 0.05 0.00 H new ATOM 0 HB2 PRO A 121 12.906 13.415 1.711 0.10 0.00 H new ATOM 0 HB3 PRO A 121 13.154 13.271 -0.018 0.10 0.00 H new ATOM 0 HG2 PRO A 121 12.574 15.730 1.615 0.09 0.00 H new ATOM 0 HG3 PRO A 121 13.693 15.533 0.281 0.09 0.00 H new ATOM 0 HD2 PRO A 121 11.161 16.644 0.019 0.21 0.00 H new ATOM 0 HD3 PRO A 121 12.050 15.927 -1.310 0.21 0.00 H new ATOM 1900 N ALA A 122 9.902 12.439 2.375 0.49 0.00 N ATOM 1901 CA ALA A 122 9.196 12.367 3.648 0.06 0.00 C ATOM 1902 C ALA A 122 10.124 11.887 4.757 1.00 0.00 C ATOM 1903 O ALA A 122 10.110 12.420 5.866 0.29 0.00 O ATOM 1904 CB ALA A 122 7.986 11.450 3.530 0.26 0.00 C ATOM 0 H ALA A 122 10.022 11.540 1.907 0.49 0.00 H new ATOM 0 HA ALA A 122 8.851 13.368 3.905 0.06 0.00 H new ATOM 0 HB1 ALA A 122 7.468 11.406 4.488 0.26 0.00 H new ATOM 0 HB2 ALA A 122 7.309 11.838 2.769 0.26 0.00 H new ATOM 0 HB3 ALA A 122 8.314 10.449 3.248 0.26 0.00 H new ATOM 1910 N ASN A 123 10.931 10.874 4.450 1.00 0.00 N ATOM 1911 CA ASN A 123 11.870 10.322 5.420 0.20 0.00 C ATOM 1912 C ASN A 123 13.300 10.725 5.073 0.07 0.00 C ATOM 1913 O ASN A 123 13.918 10.150 4.176 0.22 0.00 O ATOM 1914 CB ASN A 123 11.745 8.798 5.470 1.00 0.00 C ATOM 1915 CG ASN A 123 12.173 8.227 6.808 0.06 0.00 C ATOM 1916 OD1 ASN A 123 11.369 8.114 7.732 1.00 0.00 O ATOM 1917 ND2 ASN A 123 13.445 7.861 6.918 1.00 0.00 N ATOM 0 H ASN A 123 10.953 10.420 3.537 1.00 0.00 H new ATOM 0 HA ASN A 123 11.628 10.726 6.403 0.20 0.00 H new ATOM 0 HB2 ASN A 123 10.712 8.514 5.271 1.00 0.00 H new ATOM 0 HB3 ASN A 123 12.354 8.360 4.679 1.00 0.00 H new ATOM 0 HD21 ASN A 123 13.789 7.469 7.794 1.00 0.00 H new ATOM 0 HD22 ASN A 123 14.078 7.972 6.126 1.00 0.00 H new ATOM 1924 N SER A 124 13.818 11.718 5.788 0.08 0.00 N ATOM 1925 CA SER A 124 15.171 12.216 5.554 0.28 0.00 C ATOM 1926 C SER A 124 16.230 11.207 5.994 0.27 0.00 C ATOM 1927 O SER A 124 17.314 11.139 5.412 0.98 0.00 O ATOM 1928 CB SER A 124 15.378 13.539 6.293 0.53 0.00 C ATOM 1929 OG SER A 124 15.192 13.377 7.689 0.61 0.00 O ATOM 0 H SER A 124 13.319 12.197 6.538 0.08 0.00 H new ATOM 0 HA SER A 124 15.284 12.373 4.481 0.28 0.00 H new ATOM 0 HB2 SER A 124 16.382 13.915 6.098 0.53 0.00 H new ATOM 0 HB3 SER A 124 14.679 14.284 5.914 0.53 0.00 H new ATOM 0 HG SER A 124 15.331 14.236 8.139 0.61 0.00 H new ATOM 1935 N GLN A 125 15.913 10.424 7.021 0.20 0.00 N ATOM 1936 CA GLN A 125 16.845 9.428 7.544 0.46 0.00 C ATOM 1937 C GLN A 125 17.167 8.365 6.496 1.00 0.00 C ATOM 1938 O GLN A 125 18.298 7.888 6.410 0.09 0.00 O ATOM 1939 CB GLN A 125 16.264 8.769 8.799 0.12 0.00 C ATOM 1940 CG GLN A 125 17.309 8.140 9.708 0.10 0.00 C ATOM 1941 CD GLN A 125 17.884 6.853 9.149 0.19 0.00 C ATOM 1942 OE1 GLN A 125 19.053 6.535 9.372 0.46 0.00 O ATOM 1943 NE2 GLN A 125 17.063 6.097 8.426 1.00 0.00 N ATOM 0 H GLN A 125 15.018 10.459 7.508 0.20 0.00 H new ATOM 0 HA GLN A 125 17.772 9.939 7.803 0.46 0.00 H new ATOM 0 HB2 GLN A 125 15.708 9.516 9.365 0.12 0.00 H new ATOM 0 HB3 GLN A 125 15.551 8.002 8.497 0.12 0.00 H new ATOM 0 HG2 GLN A 125 18.118 8.853 9.870 0.10 0.00 H new ATOM 0 HG3 GLN A 125 16.862 7.939 10.682 0.10 0.00 H new ATOM 0 HE21 GLN A 125 16.102 6.398 8.265 1.00 0.00 H new ATOM 0 HE22 GLN A 125 17.395 5.216 8.032 1.00 0.00 H new ATOM 1952 N ALA A 126 16.168 8.001 5.697 0.06 0.00 N ATOM 1953 CA ALA A 126 16.346 6.987 4.664 0.99 0.00 C ATOM 1954 C ALA A 126 17.138 7.526 3.477 0.24 0.00 C ATOM 1955 O ALA A 126 18.156 6.953 3.086 1.00 0.00 O ATOM 1956 CB ALA A 126 14.991 6.474 4.201 0.52 0.00 C ATOM 0 H ALA A 126 15.228 8.393 5.745 0.06 0.00 H new ATOM 0 HA ALA A 126 16.916 6.165 5.096 0.99 0.00 H new ATOM 0 HB1 ALA A 126 15.133 5.717 3.430 0.52 0.00 H new ATOM 0 HB2 ALA A 126 14.460 6.036 5.046 0.52 0.00 H new ATOM 0 HB3 ALA A 126 14.408 7.301 3.795 0.52 0.00 H new ATOM 1962 N ALA A 127 16.664 8.630 2.908 0.92 0.00 N ATOM 1963 CA ALA A 127 17.321 9.248 1.761 0.52 0.00 C ATOM 1964 C ALA A 127 18.781 9.590 2.059 1.00 0.00 C ATOM 1965 O ALA A 127 19.645 9.462 1.191 0.43 0.00 O ATOM 1966 CB ALA A 127 16.567 10.500 1.337 1.00 0.00 C ATOM 0 H ALA A 127 15.825 9.116 3.224 0.92 0.00 H new ATOM 0 HA ALA A 127 17.310 8.525 0.946 0.52 0.00 H new ATOM 0 HB1 ALA A 127 17.066 10.953 0.480 1.00 0.00 H new ATOM 0 HB2 ALA A 127 15.546 10.235 1.063 1.00 0.00 H new ATOM 0 HB3 ALA A 127 16.548 11.211 2.163 1.00 0.00 H new ATOM 1972 N GLN A 128 19.050 10.021 3.287 0.09 0.00 N ATOM 1973 CA GLN A 128 20.405 10.388 3.690 1.00 0.00 C ATOM 1974 C GLN A 128 21.333 9.175 3.694 1.00 0.00 C ATOM 1975 O GLN A 128 22.483 9.262 3.264 1.00 0.00 O ATOM 1976 CB GLN A 128 20.388 11.034 5.076 0.10 0.00 C ATOM 1977 CG GLN A 128 21.742 11.564 5.518 1.00 0.00 C ATOM 1978 CD GLN A 128 21.686 12.251 6.867 0.08 0.00 C ATOM 1979 OE1 GLN A 128 21.874 11.619 7.907 0.07 0.00 O ATOM 1980 NE2 GLN A 128 21.426 13.554 6.858 0.16 0.00 N ATOM 0 H GLN A 128 18.349 10.125 4.021 0.09 0.00 H new ATOM 0 HA GLN A 128 20.786 11.104 2.962 1.00 0.00 H new ATOM 0 HB2 GLN A 128 19.669 11.853 5.077 0.10 0.00 H new ATOM 0 HB3 GLN A 128 20.038 10.302 5.804 0.10 0.00 H new ATOM 0 HG2 GLN A 128 22.454 10.740 5.563 1.00 0.00 H new ATOM 0 HG3 GLN A 128 22.115 12.266 4.772 1.00 0.00 H new ATOM 0 HE21 GLN A 128 21.277 14.038 5.973 0.16 0.00 H new ATOM 0 HE22 GLN A 128 21.376 14.070 7.736 0.16 0.00 H new ATOM 1989 N LEU A 129 20.828 8.046 4.182 1.00 0.00 N ATOM 1990 CA LEU A 129 21.615 6.817 4.241 1.00 0.00 C ATOM 1991 C LEU A 129 22.081 6.394 2.851 0.34 0.00 C ATOM 1992 O LEU A 129 23.108 5.729 2.706 0.89 0.00 O ATOM 1993 CB LEU A 129 20.795 5.692 4.876 0.16 0.00 C ATOM 1994 CG LEU A 129 20.585 5.814 6.387 0.11 0.00 C ATOM 1995 CD1 LEU A 129 19.554 4.800 6.861 1.00 0.00 C ATOM 1996 CD2 LEU A 129 21.901 5.621 7.127 0.09 0.00 C ATOM 0 H LEU A 129 19.878 7.956 4.542 1.00 0.00 H new ATOM 0 HA LEU A 129 22.495 7.013 4.854 1.00 0.00 H new ATOM 0 HB2 LEU A 129 19.819 5.656 4.391 0.16 0.00 H new ATOM 0 HB3 LEU A 129 21.289 4.742 4.669 0.16 0.00 H new ATOM 0 HG LEU A 129 20.213 6.815 6.605 0.11 0.00 H new ATOM 0 HD11 LEU A 129 19.415 4.899 7.938 1.00 0.00 H new ATOM 0 HD12 LEU A 129 18.606 4.981 6.355 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.902 3.793 6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 129 21.732 5.711 8.200 0.09 0.00 H new ATOM 0 HD22 LEU A 129 22.302 4.632 6.905 0.09 0.00 H new ATOM 0 HD23 LEU A 129 22.613 6.381 6.807 0.09 0.00 H new ATOM 2008 N TYR A 130 21.320 6.780 1.835 0.05 0.00 N ATOM 2009 CA TYR A 130 21.649 6.438 0.456 0.24 0.00 C ATOM 2010 C TYR A 130 22.984 7.051 0.038 0.78 0.00 C ATOM 2011 O TYR A 130 23.762 6.431 -0.688 1.00 0.00 O ATOM 2012 CB TYR A 130 20.539 6.913 -0.484 0.06 0.00 C ATOM 2013 CG TYR A 130 20.772 6.558 -1.935 0.06 0.00 C ATOM 2014 CD1 TYR A 130 20.402 5.315 -2.433 1.00 0.00 C ATOM 2015 CD2 TYR A 130 21.361 7.466 -2.805 0.53 0.00 C ATOM 2016 CE1 TYR A 130 20.613 4.988 -3.759 0.30 0.00 C ATOM 2017 CE2 TYR A 130 21.574 7.147 -4.133 0.06 0.00 C ATOM 2018 CZ TYR A 130 21.198 5.907 -4.604 1.00 0.00 C ATOM 2019 OH TYR A 130 21.408 5.585 -5.926 1.00 0.00 O ATOM 0 H TYR A 130 20.468 7.332 1.940 0.05 0.00 H new ATOM 0 HA TYR A 130 21.737 5.354 0.390 0.24 0.00 H new ATOM 0 HB2 TYR A 130 19.593 6.479 -0.161 0.06 0.00 H new ATOM 0 HB3 TYR A 130 20.440 7.995 -0.396 0.06 0.00 H new ATOM 0 HD1 TYR A 130 19.943 4.593 -1.774 1.00 0.00 H new ATOM 0 HD2 TYR A 130 21.658 8.437 -2.438 0.53 0.00 H new ATOM 0 HE1 TYR A 130 20.321 4.017 -4.132 0.30 0.00 H new ATOM 0 HE2 TYR A 130 22.032 7.865 -4.797 0.06 0.00 H new ATOM 0 HH TYR A 130 21.828 6.343 -6.384 1.00 0.00 H new ATOM 2029 N GLN A 131 23.245 8.270 0.501 1.00 0.00 N ATOM 2030 CA GLN A 131 24.484 8.968 0.167 0.23 0.00 C ATOM 2031 C GLN A 131 25.549 8.760 1.241 0.98 0.00 C ATOM 2032 O GLN A 131 26.735 8.985 0.998 0.13 0.00 O ATOM 2033 CB GLN A 131 24.218 10.464 -0.020 0.12 0.00 C ATOM 2034 CG GLN A 131 23.698 11.152 1.232 1.00 0.00 C ATOM 2035 CD GLN A 131 23.463 12.637 1.030 0.98 0.00 C ATOM 2036 OE1 GLN A 131 23.617 13.433 1.957 0.20 0.00 O ATOM 2037 NE2 GLN A 131 23.078 13.018 -0.183 0.13 0.00 N ATOM 0 H GLN A 131 22.616 8.795 1.108 1.00 0.00 H new ATOM 0 HA GLN A 131 24.858 8.549 -0.767 0.23 0.00 H new ATOM 0 HB2 GLN A 131 25.140 10.952 -0.336 0.12 0.00 H new ATOM 0 HB3 GLN A 131 23.495 10.598 -0.825 0.12 0.00 H new ATOM 0 HG2 GLN A 131 22.765 10.680 1.540 1.00 0.00 H new ATOM 0 HG3 GLN A 131 24.412 11.008 2.043 1.00 0.00 H new ATOM 0 HE21 GLN A 131 22.963 12.325 -0.923 0.13 0.00 H new ATOM 0 HE22 GLN A 131 22.898 14.003 -0.375 0.13 0.00 H new ATOM 2046 N GLU A 132 25.124 8.333 2.425 1.00 0.00 N ATOM 2047 CA GLU A 132 26.048 8.105 3.530 1.00 0.00 C ATOM 2048 C GLU A 132 26.508 6.652 3.574 0.12 0.00 C ATOM 2049 O GLU A 132 27.606 6.325 3.124 0.10 0.00 O ATOM 2050 CB GLU A 132 25.394 8.484 4.859 0.11 0.00 C ATOM 2051 CG GLU A 132 25.054 9.962 4.971 1.00 0.00 C ATOM 2052 CD GLU A 132 26.273 10.853 4.827 1.00 0.00 C ATOM 2053 OE1 GLU A 132 26.954 11.098 5.845 0.37 0.00 O ATOM 2054 OE2 GLU A 132 26.546 11.305 3.694 0.26 0.00 O ATOM 0 H GLU A 132 24.147 8.138 2.644 1.00 0.00 H new ATOM 0 HA GLU A 132 26.922 8.736 3.369 1.00 0.00 H new ATOM 0 HB2 GLU A 132 24.483 7.900 4.985 0.11 0.00 H new ATOM 0 HB3 GLU A 132 26.064 8.211 5.675 0.11 0.00 H new ATOM 0 HG2 GLU A 132 24.325 10.223 4.203 1.00 0.00 H new ATOM 0 HG3 GLU A 132 24.582 10.151 5.935 1.00 0.00 H new ATOM 2061 N ASN A 133 25.661 5.784 4.120 0.19 0.00 N ATOM 2062 CA ASN A 133 25.984 4.366 4.226 0.87 0.00 C ATOM 2063 C ASN A 133 25.088 3.533 3.317 0.41 0.00 C ATOM 2064 O ASN A 133 23.942 3.238 3.656 1.00 0.00 O ATOM 2065 CB ASN A 133 25.837 3.901 5.676 0.21 0.00 C ATOM 2066 CG ASN A 133 26.875 4.523 6.591 0.65 0.00 C ATOM 2067 OD1 ASN A 133 27.989 4.829 6.169 0.13 0.00 O ATOM 2068 ND2 ASN A 133 26.511 4.714 7.855 0.31 0.00 N ATOM 0 H ASN A 133 24.747 6.038 4.495 0.19 0.00 H new ATOM 0 HA ASN A 133 27.017 4.227 3.908 0.87 0.00 H new ATOM 0 HB2 ASN A 133 24.840 4.155 6.037 0.21 0.00 H new ATOM 0 HB3 ASN A 133 25.924 2.815 5.717 0.21 0.00 H new ATOM 0 HD21 ASN A 133 27.166 5.129 8.517 0.31 0.00 H new ATOM 0 HD22 ASN A 133 25.576 4.445 8.163 0.31 0.00 H new ATOM 2075 N LYS A 134 25.621 3.161 2.159 0.05 0.00 N ATOM 2076 CA LYS A 134 24.875 2.361 1.194 1.00 0.00 C ATOM 2077 C LYS A 134 24.733 0.923 1.678 0.14 0.00 C ATOM 2078 O LYS A 134 23.814 0.209 1.276 1.00 0.00 O ATOM 2079 CB LYS A 134 25.576 2.389 -0.164 1.00 0.00 C ATOM 2080 CG LYS A 134 25.636 3.775 -0.788 0.06 0.00 C ATOM 2081 CD LYS A 134 26.462 3.780 -2.065 1.00 0.00 C ATOM 2082 CE LYS A 134 27.938 3.566 -1.775 0.20 0.00 C ATOM 2083 NZ LYS A 134 28.484 4.615 -0.868 0.28 0.00 N ATOM 0 H LYS A 134 26.568 3.401 1.865 0.05 0.00 H new ATOM 0 HA LYS A 134 23.878 2.789 1.091 1.00 0.00 H new ATOM 0 HB2 LYS A 134 26.590 2.007 -0.048 1.00 0.00 H new ATOM 0 HB3 LYS A 134 25.057 1.715 -0.846 1.00 0.00 H new ATOM 0 HG2 LYS A 134 24.625 4.120 -1.007 0.06 0.00 H new ATOM 0 HG3 LYS A 134 26.065 4.478 -0.074 0.06 0.00 H new ATOM 0 HD2 LYS A 134 26.104 2.997 -2.734 1.00 0.00 H new ATOM 0 HD3 LYS A 134 26.326 4.729 -2.584 1.00 0.00 H new ATOM 0 HE2 LYS A 134 28.080 2.585 -1.322 0.20 0.00 H new ATOM 0 HE3 LYS A 134 28.496 3.569 -2.711 0.20 0.00 H new ATOM 0 HZ1 LYS A 134 29.521 4.636 -0.946 0.28 0.00 H new ATOM 0 HZ2 LYS A 134 28.098 5.542 -1.138 0.28 0.00 H new ATOM 0 HZ3 LYS A 134 28.215 4.400 0.113 0.28 0.00 H new ATOM 2097 N ARG A 135 25.651 0.502 2.543 1.00 0.00 N ATOM 2098 CA ARG A 135 25.629 -0.852 3.085 1.00 0.00 C ATOM 2099 C ARG A 135 24.469 -1.029 4.060 0.38 0.00 C ATOM 2100 O ARG A 135 23.928 -2.125 4.204 0.05 0.00 O ATOM 2101 CB ARG A 135 26.953 -1.165 3.786 1.00 0.00 C ATOM 2102 CG ARG A 135 28.165 -1.040 2.881 0.17 0.00 C ATOM 2103 CD ARG A 135 29.446 -1.395 3.615 1.00 0.00 C ATOM 2104 NE ARG A 135 29.440 -2.778 4.082 0.14 0.00 N ATOM 2105 CZ ARG A 135 30.082 -3.190 5.172 0.17 0.00 C ATOM 2106 NH1 ARG A 135 30.766 -2.326 5.910 0.53 0.00 N ATOM 2107 NH2 ARG A 135 30.036 -4.467 5.527 0.13 0.00 N ATOM 0 H ARG A 135 26.420 1.080 2.884 1.00 0.00 H new ATOM 0 HA ARG A 135 25.492 -1.546 2.256 1.00 0.00 H new ATOM 0 HB2 ARG A 135 27.073 -0.492 4.635 1.00 0.00 H new ATOM 0 HB3 ARG A 135 26.912 -2.178 4.186 1.00 0.00 H new ATOM 0 HG2 ARG A 135 28.045 -1.695 2.018 0.17 0.00 H new ATOM 0 HG3 ARG A 135 28.233 -0.021 2.500 0.17 0.00 H new ATOM 0 HD2 ARG A 135 30.298 -1.239 2.954 1.00 0.00 H new ATOM 0 HD3 ARG A 135 29.575 -0.725 4.465 1.00 0.00 H new ATOM 0 HE ARG A 135 28.915 -3.466 3.543 0.14 0.00 H new ATOM 0 HH11 ARG A 135 30.801 -1.342 5.643 0.53 0.00 H new ATOM 0 HH12 ARG A 135 31.257 -2.645 6.745 0.53 0.00 H new ATOM 0 HH21 ARG A 135 29.508 -5.134 4.964 0.13 0.00 H new ATOM 0 HH22 ARG A 135 30.529 -4.782 6.363 0.13 0.00 H new ATOM 2121 N GLU A 136 24.094 0.059 4.728 0.66 0.00 N ATOM 2122 CA GLU A 136 22.997 0.027 5.689 0.52 0.00 C ATOM 2123 C GLU A 136 21.654 -0.058 4.972 0.09 0.00 C ATOM 2124 O GLU A 136 20.680 -0.583 5.512 1.00 0.00 O ATOM 2125 CB GLU A 136 23.036 1.271 6.579 0.45 0.00 C ATOM 2126 CG GLU A 136 21.932 1.310 7.626 0.17 0.00 C ATOM 2127 CD GLU A 136 22.039 0.179 8.630 0.26 0.00 C ATOM 2128 OE1 GLU A 136 21.514 -0.919 8.346 1.00 0.00 O ATOM 2129 OE2 GLU A 136 22.647 0.392 9.700 0.07 0.00 O ATOM 0 H GLU A 136 24.534 0.973 4.621 0.66 0.00 H new ATOM 0 HA GLU A 136 23.115 -0.860 6.312 0.52 0.00 H new ATOM 0 HB2 GLU A 136 24.002 1.317 7.081 0.45 0.00 H new ATOM 0 HB3 GLU A 136 22.960 2.159 5.951 0.45 0.00 H new ATOM 0 HG2 GLU A 136 21.970 2.263 8.153 0.17 0.00 H new ATOM 0 HG3 GLU A 136 20.963 1.259 7.129 0.17 0.00 H new ATOM 2136 N TYR A 137 21.612 0.465 3.751 0.12 0.00 N ATOM 2137 CA TYR A 137 20.390 0.455 2.955 1.00 0.00 C ATOM 2138 C TYR A 137 20.123 -0.931 2.376 1.00 0.00 C ATOM 2139 O TYR A 137 19.015 -1.455 2.486 1.00 0.00 O ATOM 2140 CB TYR A 137 20.493 1.483 1.826 0.88 0.00 C ATOM 2141 CG TYR A 137 19.227 1.625 1.009 1.00 0.00 C ATOM 2142 CD1 TYR A 137 19.002 0.823 -0.103 1.00 0.00 C ATOM 2143 CD2 TYR A 137 18.259 2.562 1.348 0.14 0.00 C ATOM 2144 CE1 TYR A 137 17.849 0.949 -0.853 0.07 0.00 C ATOM 2145 CE2 TYR A 137 17.101 2.694 0.603 0.39 0.00 C ATOM 2146 CZ TYR A 137 16.902 1.885 -0.496 1.00 0.00 C ATOM 2147 OH TYR A 137 15.753 2.015 -1.240 0.71 0.00 O ATOM 0 H TYR A 137 22.411 0.901 3.291 0.12 0.00 H new ATOM 0 HA TYR A 137 19.557 0.717 3.607 1.00 0.00 H new ATOM 0 HB2 TYR A 137 20.749 2.453 2.253 0.88 0.00 H new ATOM 0 HB3 TYR A 137 21.311 1.200 1.164 0.88 0.00 H new ATOM 0 HD1 TYR A 137 19.741 0.088 -0.386 1.00 0.00 H new ATOM 0 HD2 TYR A 137 18.413 3.198 2.207 0.14 0.00 H new ATOM 0 HE1 TYR A 137 17.690 0.318 -1.715 0.07 0.00 H new ATOM 0 HE2 TYR A 137 16.357 3.426 0.880 0.39 0.00 H new ATOM 0 HH TYR A 137 15.191 2.718 -0.853 0.71 0.00 H new ATOM 2157 N GLU A 138 21.147 -1.521 1.765 0.16 0.00 N ATOM 2158 CA GLU A 138 21.019 -2.843 1.155 0.10 0.00 C ATOM 2159 C GLU A 138 20.662 -3.907 2.189 0.33 0.00 C ATOM 2160 O GLU A 138 19.734 -4.691 1.987 0.07 0.00 O ATOM 2161 CB GLU A 138 22.316 -3.225 0.433 0.99 0.00 C ATOM 2162 CG GLU A 138 23.551 -3.170 1.319 0.76 0.00 C ATOM 2163 CD GLU A 138 24.822 -3.514 0.567 0.07 0.00 C ATOM 2164 OE1 GLU A 138 25.456 -2.587 0.018 0.07 0.00 O ATOM 2165 OE2 GLU A 138 25.185 -4.707 0.528 0.41 0.00 O ATOM 0 H GLU A 138 22.075 -1.105 1.679 0.16 0.00 H new ATOM 0 HA GLU A 138 20.206 -2.794 0.430 0.10 0.00 H new ATOM 0 HB2 GLU A 138 22.214 -4.233 0.031 0.99 0.00 H new ATOM 0 HB3 GLU A 138 22.459 -2.556 -0.416 0.99 0.00 H new ATOM 0 HG2 GLU A 138 23.644 -2.171 1.745 0.76 0.00 H new ATOM 0 HG3 GLU A 138 23.427 -3.862 2.152 0.76 0.00 H new ATOM 2172 N LYS A 139 21.399 -3.932 3.297 0.98 0.00 N ATOM 2173 CA LYS A 139 21.155 -4.907 4.354 0.08 0.00 C ATOM 2174 C LYS A 139 19.753 -4.746 4.935 0.42 0.00 C ATOM 2175 O LYS A 139 19.141 -5.718 5.378 0.10 0.00 O ATOM 2176 CB LYS A 139 22.201 -4.767 5.461 0.75 0.00 C ATOM 2177 CG LYS A 139 23.602 -5.176 5.033 0.33 0.00 C ATOM 2178 CD LYS A 139 23.685 -6.667 4.740 1.00 0.00 C ATOM 2179 CE LYS A 139 25.067 -7.061 4.247 0.06 0.00 C ATOM 2180 NZ LYS A 139 25.166 -8.523 3.974 0.11 0.00 N ATOM 0 H LYS A 139 22.168 -3.289 3.485 0.98 0.00 H new ATOM 0 HA LYS A 139 21.233 -5.903 3.917 0.08 0.00 H new ATOM 0 HB2 LYS A 139 22.222 -3.731 5.800 0.75 0.00 H new ATOM 0 HB3 LYS A 139 21.899 -5.375 6.313 0.75 0.00 H new ATOM 0 HG2 LYS A 139 23.891 -4.613 4.145 0.33 0.00 H new ATOM 0 HG3 LYS A 139 24.313 -4.919 5.818 0.33 0.00 H new ATOM 0 HD2 LYS A 139 23.445 -7.230 5.642 1.00 0.00 H new ATOM 0 HD3 LYS A 139 22.940 -6.934 3.990 1.00 0.00 H new ATOM 0 HE2 LYS A 139 25.300 -6.506 3.338 0.06 0.00 H new ATOM 0 HE3 LYS A 139 25.812 -6.780 4.992 0.06 0.00 H new ATOM 0 HZ1 LYS A 139 26.124 -8.750 3.640 0.11 0.00 H new ATOM 0 HZ2 LYS A 139 24.969 -9.053 4.847 0.11 0.00 H new ATOM 0 HZ3 LYS A 139 24.473 -8.788 3.245 0.11 0.00 H new ATOM 2194 N ARG A 140 19.250 -3.516 4.926 0.06 0.00 N ATOM 2195 CA ARG A 140 17.919 -3.232 5.453 0.68 0.00 C ATOM 2196 C ARG A 140 16.840 -3.840 4.560 0.13 0.00 C ATOM 2197 O ARG A 140 15.786 -4.255 5.041 1.00 0.00 O ATOM 2198 CB ARG A 140 17.708 -1.721 5.576 1.00 0.00 C ATOM 2199 CG ARG A 140 16.400 -1.342 6.254 0.12 0.00 C ATOM 2200 CD ARG A 140 16.392 -1.748 7.719 0.98 0.00 C ATOM 2201 NE ARG A 140 15.166 -1.328 8.394 0.13 0.00 N ATOM 2202 CZ ARG A 140 14.898 -1.586 9.673 0.07 0.00 C ATOM 2203 NH1 ARG A 140 15.769 -2.258 10.414 0.60 0.00 N ATOM 2204 NH2 ARG A 140 13.760 -1.172 10.210 0.08 0.00 N ATOM 0 H ARG A 140 19.742 -2.701 4.560 0.06 0.00 H new ATOM 0 HA ARG A 140 17.842 -3.683 6.442 0.68 0.00 H new ATOM 0 HB2 ARG A 140 18.537 -1.291 6.139 1.00 0.00 H new ATOM 0 HB3 ARG A 140 17.734 -1.277 4.581 1.00 0.00 H new ATOM 0 HG2 ARG A 140 16.246 -0.266 6.173 0.12 0.00 H new ATOM 0 HG3 ARG A 140 15.569 -1.823 5.738 0.12 0.00 H new ATOM 0 HD2 ARG A 140 16.497 -2.830 7.796 0.98 0.00 H new ATOM 0 HD3 ARG A 140 17.253 -1.308 8.222 0.98 0.00 H new ATOM 0 HE ARG A 140 14.475 -0.807 7.854 0.13 0.00 H new ATOM 0 HH11 ARG A 140 16.647 -2.579 10.005 0.60 0.00 H new ATOM 0 HH12 ARG A 140 15.561 -2.454 11.393 0.60 0.00 H new ATOM 0 HH21 ARG A 140 13.087 -0.655 9.644 0.08 0.00 H new ATOM 0 HH22 ARG A 140 13.556 -1.370 11.190 0.08 0.00 H new ATOM 2218 N VAL A 141 17.112 -3.888 3.259 0.46 0.00 N ATOM 2219 CA VAL A 141 16.165 -4.445 2.299 0.06 0.00 C ATOM 2220 C VAL A 141 15.989 -5.947 2.510 1.00 0.00 C ATOM 2221 O VAL A 141 14.869 -6.457 2.505 0.08 0.00 O ATOM 2222 CB VAL A 141 16.618 -4.189 0.847 0.12 0.00 C ATOM 2223 CG1 VAL A 141 15.656 -4.832 -0.140 0.08 0.00 C ATOM 2224 CG2 VAL A 141 16.741 -2.696 0.584 1.00 0.00 C ATOM 0 H VAL A 141 17.980 -3.548 2.846 0.46 0.00 H new ATOM 0 HA VAL A 141 15.212 -3.943 2.466 0.06 0.00 H new ATOM 0 HB VAL A 141 17.598 -4.645 0.708 0.12 0.00 H new ATOM 0 HG11 VAL A 141 15.995 -4.638 -1.158 0.08 0.00 H new ATOM 0 HG12 VAL A 141 15.622 -5.908 0.033 0.08 0.00 H new ATOM 0 HG13 VAL A 141 14.660 -4.411 -0.004 0.08 0.00 H new ATOM 0 HG21 VAL A 141 17.062 -2.533 -0.445 1.00 0.00 H new ATOM 0 HG22 VAL A 141 15.775 -2.218 0.743 1.00 0.00 H new ATOM 0 HG23 VAL A 141 17.475 -2.266 1.265 1.00 0.00 H new ATOM 2234 N SER A 142 17.100 -6.650 2.691 0.36 0.00 N ATOM 2235 CA SER A 142 17.065 -8.093 2.902 1.00 0.00 C ATOM 2236 C SER A 142 16.446 -8.429 4.256 1.00 0.00 C ATOM 2237 O SER A 142 15.827 -9.481 4.423 0.15 0.00 O ATOM 2238 CB SER A 142 18.475 -8.678 2.814 1.00 0.00 C ATOM 2239 OG SER A 142 19.324 -8.117 3.801 0.69 0.00 O ATOM 0 H SER A 142 18.036 -6.245 2.696 0.36 0.00 H new ATOM 0 HA SER A 142 16.448 -8.534 2.120 1.00 0.00 H new ATOM 0 HB2 SER A 142 18.431 -9.760 2.940 1.00 0.00 H new ATOM 0 HB3 SER A 142 18.889 -8.489 1.824 1.00 0.00 H new ATOM 0 HG SER A 142 18.914 -7.303 4.161 0.69 0.00 H new ATOM 2245 N ALA A 143 16.618 -7.528 5.217 0.93 0.00 N ATOM 2246 CA ALA A 143 16.083 -7.726 6.559 0.36 0.00 C ATOM 2247 C ALA A 143 14.560 -7.661 6.571 0.36 0.00 C ATOM 2248 O ALA A 143 13.896 -8.571 7.070 1.00 0.00 O ATOM 2249 CB ALA A 143 16.664 -6.694 7.515 0.71 0.00 C ATOM 0 H ALA A 143 17.125 -6.652 5.091 0.93 0.00 H new ATOM 0 HA ALA A 143 16.374 -8.723 6.890 0.36 0.00 H new ATOM 0 HB1 ALA A 143 16.256 -6.853 8.513 0.71 0.00 H new ATOM 0 HB2 ALA A 143 17.749 -6.796 7.545 0.71 0.00 H new ATOM 0 HB3 ALA A 143 16.403 -5.693 7.172 0.71 0.00 H new ATOM 2255 N ILE A 144 14.007 -6.583 6.021 0.24 0.00 N ATOM 2256 CA ILE A 144 12.560 -6.402 5.979 0.28 0.00 C ATOM 2257 C ILE A 144 11.880 -7.518 5.190 1.00 0.00 C ATOM 2258 O ILE A 144 10.805 -7.987 5.564 0.31 0.00 O ATOM 2259 CB ILE A 144 12.174 -5.039 5.368 0.24 0.00 C ATOM 2260 CG1 ILE A 144 12.780 -4.885 3.970 0.37 0.00 C ATOM 2261 CG2 ILE A 144 12.628 -3.907 6.280 0.06 0.00 C ATOM 2262 CD1 ILE A 144 12.362 -3.615 3.261 0.43 0.00 C ATOM 0 H ILE A 144 14.539 -5.822 5.599 0.24 0.00 H new ATOM 0 HA ILE A 144 12.214 -6.435 7.012 0.28 0.00 H new ATOM 0 HB ILE A 144 11.089 -4.993 5.274 0.24 0.00 H new ATOM 0 HG12 ILE A 144 13.867 -4.904 4.051 0.37 0.00 H new ATOM 0 HG13 ILE A 144 12.490 -5.742 3.362 0.37 0.00 H new ATOM 0 HG21 ILE A 144 12.350 -2.950 5.838 0.06 0.00 H new ATOM 0 HG22 ILE A 144 12.149 -4.010 7.254 0.06 0.00 H new ATOM 0 HG23 ILE A 144 13.710 -3.950 6.402 0.06 0.00 H new ATOM 0 HD11 ILE A 144 12.831 -3.576 2.278 0.43 0.00 H new ATOM 0 HD12 ILE A 144 11.278 -3.602 3.147 0.43 0.00 H new ATOM 0 HD13 ILE A 144 12.676 -2.751 3.847 0.43 0.00 H new ATOM 2274 N VAL A 145 12.514 -7.944 4.101 0.83 0.00 N ATOM 2275 CA VAL A 145 11.968 -9.008 3.266 1.00 0.00 C ATOM 2276 C VAL A 145 12.030 -10.349 3.989 1.00 0.00 C ATOM 2277 O VAL A 145 11.134 -11.182 3.856 0.09 0.00 O ATOM 2278 CB VAL A 145 12.722 -9.117 1.925 0.39 0.00 C ATOM 2279 CG1 VAL A 145 12.229 -10.311 1.121 0.42 0.00 C ATOM 2280 CG2 VAL A 145 12.573 -7.834 1.121 0.14 0.00 C ATOM 0 H VAL A 145 13.405 -7.569 3.777 0.83 0.00 H new ATOM 0 HA VAL A 145 10.928 -8.754 3.062 1.00 0.00 H new ATOM 0 HB VAL A 145 13.779 -9.267 2.143 0.39 0.00 H new ATOM 0 HG11 VAL A 145 12.776 -10.367 0.180 0.42 0.00 H new ATOM 0 HG12 VAL A 145 12.393 -11.226 1.690 0.42 0.00 H new ATOM 0 HG13 VAL A 145 11.165 -10.197 0.916 0.42 0.00 H new ATOM 0 HG21 VAL A 145 13.112 -7.931 0.178 0.14 0.00 H new ATOM 0 HG22 VAL A 145 11.518 -7.652 0.919 0.14 0.00 H new ATOM 0 HG23 VAL A 145 12.983 -6.999 1.689 0.14 0.00 H new ATOM 2290 N GLU A 146 13.097 -10.548 4.759 1.00 0.00 N ATOM 2291 CA GLU A 146 13.285 -11.787 5.505 0.11 0.00 C ATOM 2292 C GLU A 146 12.185 -11.971 6.548 0.09 0.00 C ATOM 2293 O GLU A 146 11.835 -13.099 6.898 0.29 0.00 O ATOM 2294 CB GLU A 146 14.657 -11.792 6.184 1.00 0.00 C ATOM 2295 CG GLU A 146 14.963 -13.075 6.940 1.00 0.00 C ATOM 2296 CD GLU A 146 16.328 -13.051 7.600 1.00 0.00 C ATOM 2297 OE1 GLU A 146 17.310 -13.467 6.948 0.28 0.00 O ATOM 2298 OE2 GLU A 146 16.415 -12.615 8.766 0.10 0.00 O ATOM 0 H GLU A 146 13.845 -9.865 4.882 1.00 0.00 H new ATOM 0 HA GLU A 146 13.231 -12.618 4.801 0.11 0.00 H new ATOM 0 HB2 GLU A 146 15.427 -11.634 5.428 1.00 0.00 H new ATOM 0 HB3 GLU A 146 14.713 -10.952 6.876 1.00 0.00 H new ATOM 0 HG2 GLU A 146 14.199 -13.236 7.700 1.00 0.00 H new ATOM 0 HG3 GLU A 146 14.911 -13.919 6.252 1.00 0.00 H new ATOM 2305 N GLN A 147 11.644 -10.859 7.038 0.08 0.00 N ATOM 2306 CA GLN A 147 10.586 -10.904 8.044 0.10 0.00 C ATOM 2307 C GLN A 147 9.379 -11.688 7.541 1.00 0.00 C ATOM 2308 O GLN A 147 8.889 -12.590 8.220 1.00 0.00 O ATOM 2309 CB GLN A 147 10.155 -9.488 8.433 0.08 0.00 C ATOM 2310 CG GLN A 147 11.284 -8.634 8.981 0.13 0.00 C ATOM 2311 CD GLN A 147 10.788 -7.349 9.613 1.00 0.00 C ATOM 2312 OE1 GLN A 147 10.530 -7.292 10.815 0.16 0.00 O ATOM 2313 NE2 GLN A 147 10.645 -6.307 8.800 0.10 0.00 N ATOM 0 H GLN A 147 11.919 -9.918 6.756 0.08 0.00 H new ATOM 0 HA GLN A 147 10.987 -11.411 8.922 0.10 0.00 H new ATOM 0 HB2 GLN A 147 9.730 -8.995 7.559 0.08 0.00 H new ATOM 0 HB3 GLN A 147 9.364 -9.551 9.180 0.08 0.00 H new ATOM 0 HG2 GLN A 147 11.842 -9.207 9.722 0.13 0.00 H new ATOM 0 HG3 GLN A 147 11.978 -8.394 8.175 0.13 0.00 H new ATOM 0 HE21 GLN A 147 10.871 -6.398 7.809 0.10 0.00 H new ATOM 0 HE22 GLN A 147 10.310 -5.416 9.167 0.10 0.00 H new ATOM 2322 N SER A 148 8.904 -11.341 6.348 0.79 0.00 N ATOM 2323 CA SER A 148 7.749 -12.015 5.765 0.73 0.00 C ATOM 2324 C SER A 148 8.182 -13.078 4.761 1.00 0.00 C ATOM 2325 O SER A 148 8.217 -14.267 5.083 0.25 0.00 O ATOM 2326 CB SER A 148 6.826 -10.997 5.093 0.26 0.00 C ATOM 2327 OG SER A 148 5.675 -11.628 4.558 0.59 0.00 O ATOM 0 H SER A 148 9.299 -10.600 5.769 0.79 0.00 H new ATOM 0 HA SER A 148 7.205 -12.511 6.569 0.73 0.00 H new ATOM 0 HB2 SER A 148 6.526 -10.240 5.817 0.26 0.00 H new ATOM 0 HB3 SER A 148 7.365 -10.482 4.298 0.26 0.00 H new ATOM 0 HG SER A 148 5.100 -10.956 4.135 0.59 0.00 H new ATOM 2333 N TRP A 149 8.516 -12.648 3.545 0.44 0.00 N ATOM 2334 CA TRP A 149 8.946 -13.570 2.496 0.18 0.00 C ATOM 2335 C TRP A 149 7.904 -14.673 2.288 0.06 0.00 C ATOM 2336 O TRP A 149 6.782 -14.573 2.784 0.06 0.00 O ATOM 2337 CB TRP A 149 10.308 -14.175 2.858 0.08 0.00 C ATOM 2338 CG TRP A 149 11.098 -14.639 1.671 0.06 0.00 C ATOM 2339 CD1 TRP A 149 11.460 -13.895 0.583 0.10 0.00 C ATOM 2340 CD2 TRP A 149 11.626 -15.953 1.451 0.10 0.00 C ATOM 2341 NE1 TRP A 149 12.178 -14.666 -0.299 0.93 0.00 N ATOM 2342 CE2 TRP A 149 12.293 -15.933 0.212 1.00 0.00 C ATOM 2343 CE3 TRP A 149 11.598 -17.144 2.183 0.08 0.00 C ATOM 2344 CZ2 TRP A 149 12.926 -17.059 -0.310 0.15 0.00 C ATOM 2345 CZ3 TRP A 149 12.227 -18.260 1.664 0.24 0.00 C ATOM 2346 CH2 TRP A 149 12.884 -18.210 0.429 0.56 0.00 C ATOM 0 H TRP A 149 8.497 -11.668 3.263 0.44 0.00 H new ATOM 0 HA TRP A 149 9.045 -13.018 1.562 0.18 0.00 H new ATOM 0 HB2 TRP A 149 10.891 -13.433 3.404 0.08 0.00 H new ATOM 0 HB3 TRP A 149 10.153 -15.018 3.532 0.08 0.00 H new ATOM 0 HD1 TRP A 149 11.217 -12.853 0.438 0.10 0.00 H new ATOM 0 HE1 TRP A 149 12.563 -14.348 -1.189 0.93 0.00 H new ATOM 0 HE3 TRP A 149 11.094 -17.191 3.137 0.08 0.00 H new ATOM 0 HZ2 TRP A 149 13.432 -17.025 -1.264 0.15 0.00 H new ATOM 0 HZ3 TRP A 149 12.211 -19.186 2.220 0.24 0.00 H new ATOM 0 HH2 TRP A 149 13.368 -19.099 0.051 0.56 0.00 H new ATOM 2357 N ASN A 150 8.280 -15.716 1.545 0.16 0.00 N ATOM 2358 CA ASN A 150 7.384 -16.839 1.268 0.27 0.00 C ATOM 2359 C ASN A 150 6.200 -16.405 0.409 1.00 0.00 C ATOM 2360 O ASN A 150 5.498 -15.449 0.735 1.00 0.00 O ATOM 2361 CB ASN A 150 6.885 -17.465 2.573 0.55 0.00 C ATOM 2362 CG ASN A 150 5.912 -18.603 2.333 1.00 0.00 C ATOM 2363 OD1 ASN A 150 4.701 -18.397 2.268 0.66 0.00 O ATOM 2364 ND2 ASN A 150 6.440 -19.814 2.199 0.21 0.00 N ATOM 0 H ASN A 150 9.204 -15.806 1.123 0.16 0.00 H new ATOM 0 HA ASN A 150 7.952 -17.585 0.712 0.27 0.00 H new ATOM 0 HB2 ASN A 150 7.737 -17.833 3.145 0.55 0.00 H new ATOM 0 HB3 ASN A 150 6.401 -16.699 3.179 0.55 0.00 H new ATOM 0 HD21 ASN A 150 5.835 -20.619 2.035 0.21 0.00 H new ATOM 0 HD22 ASN A 150 7.450 -19.939 2.260 0.21 0.00 H new ATOM 2371 N ASP A 151 5.983 -17.123 -0.689 0.06 0.00 N ATOM 2372 CA ASP A 151 4.886 -16.816 -1.600 0.98 0.00 C ATOM 2373 C ASP A 151 3.838 -17.925 -1.586 1.00 0.00 C ATOM 2374 O ASP A 151 2.637 -17.658 -1.616 0.40 0.00 O ATOM 2375 CB ASP A 151 5.419 -16.623 -3.021 1.00 0.00 C ATOM 2376 CG ASP A 151 4.326 -16.252 -4.003 0.32 0.00 C ATOM 2377 OD1 ASP A 151 3.714 -17.173 -4.584 0.09 0.00 O ATOM 2378 OD2 ASP A 151 4.082 -15.042 -4.192 0.93 0.00 O ATOM 0 H ASP A 151 6.553 -17.921 -0.969 0.06 0.00 H new ATOM 0 HA ASP A 151 4.415 -15.892 -1.264 0.98 0.00 H new ATOM 0 HB2 ASP A 151 6.181 -15.843 -3.018 1.00 0.00 H new ATOM 0 HB3 ASP A 151 5.904 -17.541 -3.352 1.00 0.00 H new ATOM 2383 N SER A 152 4.303 -19.171 -1.539 0.11 0.00 N ATOM 2384 CA SER A 152 3.407 -20.323 -1.522 1.00 0.00 C ATOM 2385 C SER A 152 2.624 -20.385 -0.215 0.79 0.00 C ATOM 2386 O SER A 152 1.485 -19.872 -0.183 0.20 0.00 O ATOM 2387 CB SER A 152 4.200 -21.615 -1.720 1.00 0.00 C ATOM 2388 OG SER A 152 4.891 -21.607 -2.958 0.11 0.00 O ATOM 2389 OXT SER A 152 3.156 -20.947 0.766 0.20 0.00 O ATOM 0 H SER A 152 5.295 -19.408 -1.512 0.11 0.00 H new ATOM 0 HA SER A 152 2.698 -20.212 -2.342 1.00 0.00 H new ATOM 0 HB2 SER A 152 4.912 -21.737 -0.904 1.00 0.00 H new ATOM 0 HB3 SER A 152 3.524 -22.469 -1.683 1.00 0.00 H new ATOM 0 HG SER A 152 5.391 -22.444 -3.059 0.11 0.00 H new TER 2395 SER A 152