USER MOD reduce.3.24.130724 H: found=0, std=0, add=1271, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1271 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 125 GLN : amide:sc= -0.0201 K(o=-0.21,f=-1.3) USER MOD Set 1.2: A 141 MET CE :methyl 175:sc= -0.187 (180deg=-0.275) USER MOD Set 2.1: A 100 HIS : no HD1:sc= 0.359 K(o=0.4,f=-2.1) USER MOD Set 2.2: A 101 SER OG : rot 47:sc= 0.038 USER MOD Set 3.1: A 28 GLN : amide:sc= -0.231 K(o=0.89,f=-2.3) USER MOD Set 3.2: A 34 LYS NZ :NH3+ -121:sc= 1.12 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot -100:sc= -0.128 USER MOD Single : A 4 GLN :FLIP amide:sc= -0.0992 F(o=-0.94,f=-0.099) USER MOD Single : A 7 MET CE :methyl 169:sc= -0.0691 (180deg=-0.336) USER MOD Single : A 12 LYS NZ :NH3+ -111:sc= 0.849 (180deg=0.000211) USER MOD Single : A 19 LYS NZ :NH3+ 166:sc= -0.0307 (180deg=-0.263) USER MOD Single : A 23 THR OG1 : rot -171:sc= -0.065 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= 1.26 K(o=1.3,f=-8.9!) USER MOD Single : A 35 MET CE :methyl -118:sc= -5.35! (180deg=-9.72!) USER MOD Single : A 39 GLN : amide:sc= -1.62 K(o=-1.6,f=-3.4!) USER MOD Single : A 42 SER OG : rot 180:sc= 0.00368 USER MOD Single : A 43 GLN : amide:sc= -0.0706 X(o=-0.071,f=-0.19) USER MOD Single : A 44 ASN : amide:sc=-0.000325 K(o=-0.00032,f=-0.78) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.323 X(o=-0.32,f=-0.49!) USER MOD Single : A 49 LYS NZ :NH3+ 179:sc= 2 (180deg=1.93) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.626 X(o=-0.63,f=-0.31) USER MOD Single : A 62 GLN :FLIP amide:sc= -1.09 F(o=-6.1!,f=-1.1) USER MOD Single : A 64 CYS SG : rot 70:sc= -3.86! USER MOD Single : A 66 MET CE :methyl -110:sc= -2.8! (180deg=-7.62!) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.91 K(o=-0.91,f=-5.5!) USER MOD Single : A 83 ASN : amide:sc= -0.359 K(o=-0.36,f=-3.4!) USER MOD Single : A 85 TYR OH : rot -109:sc= 1.27 USER MOD Single : A 87 SER OG : rot -38:sc= 0.265 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 MET CE :methyl -142:sc= 0 (180deg=-0.53) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 174:sc=-0.00827 (180deg=-0.0698) USER MOD Single : A 117 GLN : amide:sc= -0.0688 K(o=-0.069,f=-0.79) USER MOD Single : A 118 ASN : amide:sc= -0.0096 X(o=-0.0096,f=0) USER MOD Single : A 127 LYS NZ :NH3+ -176:sc= 0.867 (180deg=0.663) USER MOD Single : A 128 GLN :FLIP amide:sc= -0.0122 F(o=-0.58,f=-0.012) USER MOD Single : A 132 THR OG1 : rot -32:sc= 0.199 USER MOD Single : A 136 LYS NZ :NH3+ -169:sc= 0.955 (180deg=0.619) USER MOD Single : A 139 HIS : no HE2:sc= -5.39! C(o=-5.4!,f=-11!) USER MOD Single : A 147 CYS SG : rot 61:sc= -4.34! USER MOD Single : A 149 HIS : no HD1:sc=-0.00786 X(o=-0.0079,f=0) USER MOD Single : A 155 ASN : amide:sc= -0.123 K(o=-0.12,f=-2.7!) USER MOD Single : A 159 GLN : amide:sc= -0.196 K(o=-0.2,f=-0.93) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.119 -11.399 -11.203 1.00 0.00 N ATOM 2 CA GLY A 1 -17.238 -10.230 -10.969 1.00 0.00 C ATOM 3 C GLY A 1 -17.292 -9.756 -9.534 1.00 0.00 C ATOM 4 O GLY A 1 -18.283 -9.166 -9.105 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.051 -11.691 -12.199 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.822 -12.186 -10.591 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.103 -11.142 -10.984 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.212 -10.493 -11.225 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.533 -9.416 -11.631 1.00 0.00 H new ATOM 10 N THR A 2 -16.229 -10.017 -8.789 1.00 0.00 N ATOM 11 CA THR A 2 -16.164 -9.621 -7.397 1.00 0.00 C ATOM 12 C THR A 2 -15.752 -8.160 -7.265 1.00 0.00 C ATOM 13 O THR A 2 -14.566 -7.828 -7.255 1.00 0.00 O ATOM 14 CB THR A 2 -15.185 -10.522 -6.623 1.00 0.00 C ATOM 15 OG1 THR A 2 -15.507 -11.899 -6.880 1.00 0.00 O ATOM 16 CG2 THR A 2 -15.257 -10.254 -5.124 1.00 0.00 C ATOM 0 H THR A 2 -15.399 -10.503 -9.129 1.00 0.00 H new ATOM 0 HA THR A 2 -17.159 -9.737 -6.968 1.00 0.00 H new ATOM 0 HB THR A 2 -14.172 -10.302 -6.960 1.00 0.00 H new ATOM 0 HG1 THR A 2 -16.023 -12.260 -6.129 1.00 0.00 H new ATOM 0 HG21 THR A 2 -14.554 -10.905 -4.604 1.00 0.00 H new ATOM 0 HG22 THR A 2 -15.000 -9.213 -4.928 1.00 0.00 H new ATOM 0 HG23 THR A 2 -16.268 -10.452 -4.767 1.00 0.00 H new ATOM 24 N VAL A 3 -16.747 -7.288 -7.195 1.00 0.00 N ATOM 25 CA VAL A 3 -16.510 -5.870 -6.995 1.00 0.00 C ATOM 26 C VAL A 3 -17.305 -5.376 -5.786 1.00 0.00 C ATOM 27 O VAL A 3 -18.525 -5.541 -5.711 1.00 0.00 O ATOM 28 CB VAL A 3 -16.846 -5.050 -8.266 1.00 0.00 C ATOM 29 CG1 VAL A 3 -18.332 -5.082 -8.595 1.00 0.00 C ATOM 30 CG2 VAL A 3 -16.347 -3.623 -8.122 1.00 0.00 C ATOM 0 H VAL A 3 -17.732 -7.542 -7.275 1.00 0.00 H new ATOM 0 HA VAL A 3 -15.448 -5.723 -6.798 1.00 0.00 H new ATOM 0 HB VAL A 3 -16.329 -5.517 -9.104 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -18.519 -4.494 -9.493 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -18.645 -6.112 -8.765 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -18.898 -4.663 -7.763 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -16.591 -3.060 -9.023 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -16.825 -3.155 -7.261 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -15.267 -3.628 -7.978 1.00 0.00 H new ATOM 40 N GLN A 4 -16.596 -4.824 -4.816 1.00 0.00 N ATOM 41 CA GLN A 4 -17.224 -4.340 -3.596 1.00 0.00 C ATOM 42 C GLN A 4 -17.176 -2.818 -3.561 1.00 0.00 C ATOM 43 O GLN A 4 -16.269 -2.215 -4.136 1.00 0.00 O ATOM 44 CB GLN A 4 -16.524 -4.936 -2.370 1.00 0.00 C ATOM 45 CG GLN A 4 -17.191 -4.587 -1.046 1.00 0.00 C ATOM 46 CD GLN A 4 -18.620 -5.095 -0.951 1.00 0.00 C ATOM 47 OE1 GLN A 4 -18.895 -6.233 -1.574 1.00 0.00 O flip ATOM 48 NE2 GLN A 4 -19.468 -4.477 -0.303 1.00 0.00 N flip ATOM 0 H GLN A 4 -15.584 -4.699 -4.849 1.00 0.00 H new ATOM 0 HA GLN A 4 -18.267 -4.655 -3.578 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -16.492 -6.021 -2.474 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -15.492 -4.587 -2.348 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -16.606 -5.008 -0.228 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -17.186 -3.505 -0.917 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -19.218 -3.605 0.163 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -20.419 -4.838 -0.233 1.00 0.00 H new ATOM 57 N GLU A 5 -18.158 -2.205 -2.904 1.00 0.00 N ATOM 58 CA GLU A 5 -18.264 -0.752 -2.857 1.00 0.00 C ATOM 59 C GLU A 5 -18.103 -0.214 -1.439 1.00 0.00 C ATOM 60 O GLU A 5 -18.819 -0.607 -0.518 1.00 0.00 O ATOM 61 CB GLU A 5 -19.595 -0.304 -3.456 1.00 0.00 C ATOM 62 CG GLU A 5 -19.653 -0.499 -4.959 1.00 0.00 C ATOM 63 CD GLU A 5 -21.026 -0.247 -5.540 1.00 0.00 C ATOM 64 OE1 GLU A 5 -21.314 0.909 -5.911 1.00 0.00 O ATOM 65 OE2 GLU A 5 -21.816 -1.206 -5.646 1.00 0.00 O ATOM 0 H GLU A 5 -18.893 -2.696 -2.396 1.00 0.00 H new ATOM 0 HA GLU A 5 -17.448 -0.340 -3.451 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -20.406 -0.863 -2.989 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -19.758 0.748 -3.223 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -18.936 0.171 -5.434 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -19.345 -1.517 -5.199 1.00 0.00 H new ATOM 72 N ILE A 6 -17.134 0.677 -1.281 1.00 0.00 N ATOM 73 CA ILE A 6 -16.878 1.346 -0.011 1.00 0.00 C ATOM 74 C ILE A 6 -17.176 2.835 -0.165 1.00 0.00 C ATOM 75 O ILE A 6 -16.951 3.405 -1.231 1.00 0.00 O ATOM 76 CB ILE A 6 -15.406 1.151 0.459 1.00 0.00 C ATOM 77 CG1 ILE A 6 -15.077 -0.335 0.677 1.00 0.00 C ATOM 78 CG2 ILE A 6 -15.137 1.929 1.739 1.00 0.00 C ATOM 79 CD1 ILE A 6 -14.763 -1.100 -0.592 1.00 0.00 C ATOM 0 H ILE A 6 -16.502 0.957 -2.031 1.00 0.00 H new ATOM 0 HA ILE A 6 -17.526 0.904 0.746 1.00 0.00 H new ATOM 0 HB ILE A 6 -14.762 1.534 -0.332 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -14.225 -0.410 1.352 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -15.921 -0.812 1.175 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -14.103 1.777 2.047 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -15.311 2.991 1.563 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -15.805 1.578 2.525 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -14.543 -2.139 -0.346 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -15.621 -1.060 -1.263 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -13.898 -0.652 -1.082 1.00 0.00 H new ATOM 91 N MET A 7 -17.700 3.456 0.879 1.00 0.00 N ATOM 92 CA MET A 7 -18.081 4.857 0.807 1.00 0.00 C ATOM 93 C MET A 7 -16.912 5.774 1.159 1.00 0.00 C ATOM 94 O MET A 7 -16.315 5.657 2.230 1.00 0.00 O ATOM 95 CB MET A 7 -19.265 5.124 1.732 1.00 0.00 C ATOM 96 CG MET A 7 -19.675 6.585 1.787 1.00 0.00 C ATOM 97 SD MET A 7 -19.924 7.304 0.152 1.00 0.00 S ATOM 98 CE MET A 7 -21.172 6.213 -0.520 1.00 0.00 C ATOM 0 H MET A 7 -17.871 3.015 1.783 1.00 0.00 H new ATOM 0 HA MET A 7 -18.373 5.075 -0.220 1.00 0.00 H new ATOM 0 HB2 MET A 7 -20.116 4.529 1.401 1.00 0.00 H new ATOM 0 HB3 MET A 7 -19.013 4.788 2.738 1.00 0.00 H new ATOM 0 HG2 MET A 7 -20.595 6.678 2.363 1.00 0.00 H new ATOM 0 HG3 MET A 7 -18.909 7.153 2.316 1.00 0.00 H new ATOM 0 HE1 MET A 7 -21.569 6.639 -1.442 1.00 0.00 H new ATOM 0 HE2 MET A 7 -20.729 5.240 -0.731 1.00 0.00 H new ATOM 0 HE3 MET A 7 -21.979 6.095 0.203 1.00 0.00 H new ATOM 108 N ILE A 8 -16.593 6.682 0.241 1.00 0.00 N ATOM 109 CA ILE A 8 -15.510 7.640 0.427 1.00 0.00 C ATOM 110 C ILE A 8 -16.062 9.030 0.755 1.00 0.00 C ATOM 111 O ILE A 8 -16.676 9.689 -0.088 1.00 0.00 O ATOM 112 CB ILE A 8 -14.587 7.702 -0.827 1.00 0.00 C ATOM 113 CG1 ILE A 8 -13.515 6.609 -0.764 1.00 0.00 C ATOM 114 CG2 ILE A 8 -13.921 9.065 -0.975 1.00 0.00 C ATOM 115 CD1 ILE A 8 -14.057 5.202 -0.649 1.00 0.00 C ATOM 0 H ILE A 8 -17.078 6.774 -0.652 1.00 0.00 H new ATOM 0 HA ILE A 8 -14.910 7.299 1.270 1.00 0.00 H new ATOM 0 HB ILE A 8 -15.221 7.538 -1.699 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -12.896 6.674 -1.659 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -12.865 6.805 0.089 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.286 9.066 -1.861 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -14.686 9.835 -1.076 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -13.314 9.271 -0.094 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.228 4.495 -0.611 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -14.651 5.114 0.260 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.683 4.981 -1.514 1.00 0.00 H new ATOM 127 N PRO A 9 -15.880 9.460 2.012 1.00 0.00 N ATOM 128 CA PRO A 9 -16.260 10.804 2.476 1.00 0.00 C ATOM 129 C PRO A 9 -15.523 11.918 1.740 1.00 0.00 C ATOM 130 O PRO A 9 -14.363 11.754 1.345 1.00 0.00 O ATOM 131 CB PRO A 9 -15.817 10.799 3.946 1.00 0.00 C ATOM 132 CG PRO A 9 -15.789 9.365 4.329 1.00 0.00 C ATOM 133 CD PRO A 9 -15.323 8.642 3.104 1.00 0.00 C ATOM 0 HA PRO A 9 -17.320 10.995 2.312 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -14.836 11.259 4.065 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -16.511 11.362 4.570 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -15.114 9.194 5.168 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -16.776 9.020 4.638 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -14.235 8.588 3.055 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -15.695 7.618 3.073 1.00 0.00 H new ATOM 141 N ALA A 10 -16.189 13.053 1.560 1.00 0.00 N ATOM 142 CA ALA A 10 -15.526 14.247 1.058 1.00 0.00 C ATOM 143 C ALA A 10 -14.561 14.758 2.119 1.00 0.00 C ATOM 144 O ALA A 10 -14.949 14.994 3.264 1.00 0.00 O ATOM 145 CB ALA A 10 -16.529 15.326 0.682 1.00 0.00 C ATOM 0 H ALA A 10 -17.184 13.170 1.754 1.00 0.00 H new ATOM 0 HA ALA A 10 -14.977 13.991 0.152 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -15.998 16.203 0.311 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -17.195 14.949 -0.095 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -17.114 15.600 1.560 1.00 0.00 H new ATOM 151 N GLY A 11 -13.308 14.914 1.743 1.00 0.00 N ATOM 152 CA GLY A 11 -12.270 15.179 2.713 1.00 0.00 C ATOM 153 C GLY A 11 -11.412 13.952 2.906 1.00 0.00 C ATOM 154 O GLY A 11 -10.191 14.042 3.030 1.00 0.00 O ATOM 0 H GLY A 11 -12.987 14.862 0.776 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -11.654 16.014 2.378 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -12.716 15.473 3.663 1.00 0.00 H new ATOM 158 N LYS A 12 -12.060 12.793 2.913 1.00 0.00 N ATOM 159 CA LYS A 12 -11.349 11.527 2.941 1.00 0.00 C ATOM 160 C LYS A 12 -10.859 11.193 1.544 1.00 0.00 C ATOM 161 O LYS A 12 -9.817 10.574 1.374 1.00 0.00 O ATOM 162 CB LYS A 12 -12.236 10.392 3.454 1.00 0.00 C ATOM 163 CG LYS A 12 -11.790 9.799 4.783 1.00 0.00 C ATOM 164 CD LYS A 12 -12.242 10.634 5.974 1.00 0.00 C ATOM 165 CE LYS A 12 -11.433 11.917 6.113 1.00 0.00 C ATOM 166 NZ LYS A 12 -11.964 12.796 7.185 1.00 0.00 N ATOM 0 H LYS A 12 -13.076 12.707 2.900 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.505 11.629 3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -13.256 10.763 3.559 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -12.260 9.600 2.706 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -12.189 8.789 4.879 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.703 9.715 4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.298 10.882 5.863 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -12.147 10.045 6.886 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -10.394 11.669 6.329 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -11.441 12.455 5.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -12.383 13.647 6.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -12.691 12.285 7.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -11.190 13.073 7.822 1.00 0.00 H new ATOM 180 N ALA A 13 -11.623 11.622 0.544 1.00 0.00 N ATOM 181 CA ALA A 13 -11.262 11.412 -0.852 1.00 0.00 C ATOM 182 C ALA A 13 -9.861 11.933 -1.134 1.00 0.00 C ATOM 183 O ALA A 13 -9.128 11.353 -1.927 1.00 0.00 O ATOM 184 CB ALA A 13 -12.274 12.083 -1.768 1.00 0.00 C ATOM 0 H ALA A 13 -12.503 12.121 0.678 1.00 0.00 H new ATOM 0 HA ALA A 13 -11.271 10.340 -1.049 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -11.990 11.917 -2.807 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -13.263 11.660 -1.590 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -12.295 13.154 -1.564 1.00 0.00 H new ATOM 190 N GLY A 14 -9.491 13.015 -0.461 1.00 0.00 N ATOM 191 CA GLY A 14 -8.158 13.561 -0.602 1.00 0.00 C ATOM 192 C GLY A 14 -7.078 12.559 -0.246 1.00 0.00 C ATOM 193 O GLY A 14 -6.049 12.491 -0.910 1.00 0.00 O ATOM 0 H GLY A 14 -10.095 13.526 0.183 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.013 13.896 -1.629 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -8.059 14.439 0.037 1.00 0.00 H new ATOM 197 N LEU A 15 -7.312 11.766 0.790 1.00 0.00 N ATOM 198 CA LEU A 15 -6.344 10.762 1.201 1.00 0.00 C ATOM 199 C LEU A 15 -6.591 9.434 0.484 1.00 0.00 C ATOM 200 O LEU A 15 -5.681 8.616 0.359 1.00 0.00 O ATOM 201 CB LEU A 15 -6.349 10.591 2.732 1.00 0.00 C ATOM 202 CG LEU A 15 -7.701 10.264 3.377 1.00 0.00 C ATOM 203 CD1 LEU A 15 -7.959 8.766 3.385 1.00 0.00 C ATOM 204 CD2 LEU A 15 -7.767 10.820 4.791 1.00 0.00 C ATOM 0 H LEU A 15 -8.159 11.798 1.358 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.351 11.107 0.911 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -5.647 9.798 2.989 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -5.970 11.510 3.180 1.00 0.00 H new ATOM 0 HG LEU A 15 -8.479 10.737 2.778 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -8.925 8.566 3.849 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -7.963 8.392 2.361 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -7.174 8.265 3.951 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.734 10.578 5.232 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -6.973 10.379 5.393 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -7.642 11.902 4.763 1.00 0.00 H new ATOM 216 N VAL A 16 -7.823 9.228 0.014 1.00 0.00 N ATOM 217 CA VAL A 16 -8.179 8.008 -0.715 1.00 0.00 C ATOM 218 C VAL A 16 -7.700 8.048 -2.166 1.00 0.00 C ATOM 219 O VAL A 16 -7.135 7.083 -2.662 1.00 0.00 O ATOM 220 CB VAL A 16 -9.702 7.744 -0.694 1.00 0.00 C ATOM 221 CG1 VAL A 16 -10.052 6.517 -1.526 1.00 0.00 C ATOM 222 CG2 VAL A 16 -10.188 7.566 0.734 1.00 0.00 C ATOM 0 H VAL A 16 -8.591 9.890 0.125 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.672 7.194 -0.197 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.202 8.608 -1.131 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -11.129 6.352 -1.496 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.738 6.675 -2.558 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.540 5.644 -1.121 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -11.262 7.381 0.732 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -9.675 6.720 1.190 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -9.976 8.470 1.306 1.00 0.00 H new ATOM 232 N ILE A 17 -7.937 9.149 -2.860 1.00 0.00 N ATOM 233 CA ILE A 17 -7.478 9.257 -4.238 1.00 0.00 C ATOM 234 C ILE A 17 -6.089 9.876 -4.279 1.00 0.00 C ATOM 235 O ILE A 17 -5.346 9.699 -5.240 1.00 0.00 O ATOM 236 CB ILE A 17 -8.447 10.070 -5.134 1.00 0.00 C ATOM 237 CG1 ILE A 17 -8.430 11.559 -4.773 1.00 0.00 C ATOM 238 CG2 ILE A 17 -9.855 9.510 -5.017 1.00 0.00 C ATOM 239 CD1 ILE A 17 -9.319 12.414 -5.654 1.00 0.00 C ATOM 0 H ILE A 17 -8.434 9.965 -2.503 1.00 0.00 H new ATOM 0 HA ILE A 17 -7.446 8.245 -4.641 1.00 0.00 H new ATOM 0 HB ILE A 17 -8.110 9.979 -6.167 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -8.744 11.675 -3.736 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -7.406 11.927 -4.840 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -10.530 10.087 -5.650 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -9.860 8.468 -5.337 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -10.187 9.573 -3.981 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -9.253 13.455 -5.336 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -8.993 12.330 -6.691 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.351 12.073 -5.569 1.00 0.00 H new ATOM 251 N GLY A 18 -5.734 10.582 -3.214 1.00 0.00 N ATOM 252 CA GLY A 18 -4.439 11.229 -3.147 1.00 0.00 C ATOM 253 C GLY A 18 -4.522 12.686 -3.525 1.00 0.00 C ATOM 254 O GLY A 18 -3.518 13.394 -3.514 1.00 0.00 O ATOM 0 H GLY A 18 -6.323 10.718 -2.392 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.039 11.137 -2.137 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.743 10.719 -3.813 1.00 0.00 H new ATOM 258 N LYS A 19 -5.739 13.112 -3.862 1.00 0.00 N ATOM 259 CA LYS A 19 -6.036 14.477 -4.298 1.00 0.00 C ATOM 260 C LYS A 19 -5.444 14.739 -5.685 1.00 0.00 C ATOM 261 O LYS A 19 -6.147 15.165 -6.598 1.00 0.00 O ATOM 262 CB LYS A 19 -5.537 15.505 -3.277 1.00 0.00 C ATOM 263 CG LYS A 19 -6.391 16.759 -3.225 1.00 0.00 C ATOM 264 CD LYS A 19 -7.821 16.436 -2.813 1.00 0.00 C ATOM 265 CE LYS A 19 -8.699 17.679 -2.790 1.00 0.00 C ATOM 266 NZ LYS A 19 -8.743 18.354 -4.115 1.00 0.00 N ATOM 0 H LYS A 19 -6.561 12.508 -3.839 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.119 14.584 -4.367 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.517 15.046 -2.289 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.511 15.782 -3.521 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -5.958 17.468 -2.519 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -6.392 17.242 -4.202 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -8.242 15.707 -3.505 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -7.819 15.975 -1.826 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -9.710 17.403 -2.490 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -8.322 18.375 -2.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -9.521 19.044 -4.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -7.842 18.846 -4.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -8.896 17.645 -4.861 1.00 0.00 H new ATOM 280 N GLY A 20 -4.156 14.463 -5.835 1.00 0.00 N ATOM 281 CA GLY A 20 -3.517 14.530 -7.133 1.00 0.00 C ATOM 282 C GLY A 20 -3.510 13.175 -7.817 1.00 0.00 C ATOM 283 O GLY A 20 -2.859 12.988 -8.844 1.00 0.00 O ATOM 0 H GLY A 20 -3.537 14.191 -5.071 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.038 15.253 -7.760 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -2.493 14.887 -7.018 1.00 0.00 H new ATOM 287 N GLY A 21 -4.225 12.220 -7.226 1.00 0.00 N ATOM 288 CA GLY A 21 -4.355 10.901 -7.820 1.00 0.00 C ATOM 289 C GLY A 21 -3.247 9.951 -7.407 1.00 0.00 C ATOM 290 O GLY A 21 -3.185 8.821 -7.884 1.00 0.00 O ATOM 0 H GLY A 21 -4.719 12.338 -6.341 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -5.317 10.474 -7.535 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -4.358 10.997 -8.906 1.00 0.00 H new ATOM 294 N GLU A 22 -2.388 10.390 -6.496 1.00 0.00 N ATOM 295 CA GLU A 22 -1.206 9.617 -6.129 1.00 0.00 C ATOM 296 C GLU A 22 -1.544 8.391 -5.275 1.00 0.00 C ATOM 297 O GLU A 22 -0.824 7.391 -5.312 1.00 0.00 O ATOM 298 CB GLU A 22 -0.185 10.510 -5.421 1.00 0.00 C ATOM 299 CG GLU A 22 -0.722 11.216 -4.188 1.00 0.00 C ATOM 300 CD GLU A 22 0.224 12.289 -3.694 1.00 0.00 C ATOM 301 OE1 GLU A 22 1.194 11.955 -2.983 1.00 0.00 O ATOM 302 OE2 GLU A 22 0.015 13.469 -4.041 1.00 0.00 O ATOM 0 H GLU A 22 -2.486 11.275 -5.998 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.769 9.240 -7.054 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.673 9.903 -5.133 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.176 11.259 -6.126 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.689 11.663 -4.418 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.889 10.486 -3.396 1.00 0.00 H new ATOM 309 N THR A 23 -2.637 8.454 -4.524 1.00 0.00 N ATOM 310 CA THR A 23 -3.031 7.333 -3.684 1.00 0.00 C ATOM 311 C THR A 23 -3.681 6.233 -4.515 1.00 0.00 C ATOM 312 O THR A 23 -3.364 5.057 -4.351 1.00 0.00 O ATOM 313 CB THR A 23 -3.998 7.765 -2.561 1.00 0.00 C ATOM 314 OG1 THR A 23 -3.393 8.783 -1.754 1.00 0.00 O ATOM 315 CG2 THR A 23 -4.377 6.582 -1.681 1.00 0.00 C ATOM 0 H THR A 23 -3.259 9.261 -4.480 1.00 0.00 H new ATOM 0 HA THR A 23 -2.120 6.950 -3.224 1.00 0.00 H new ATOM 0 HB THR A 23 -4.901 8.157 -3.028 1.00 0.00 H new ATOM 0 HG1 THR A 23 -3.947 8.945 -0.962 1.00 0.00 H new ATOM 0 HG21 THR A 23 -5.059 6.914 -0.898 1.00 0.00 H new ATOM 0 HG22 THR A 23 -4.865 5.819 -2.287 1.00 0.00 H new ATOM 0 HG23 THR A 23 -3.479 6.164 -1.226 1.00 0.00 H new ATOM 323 N ILE A 24 -4.565 6.617 -5.438 1.00 0.00 N ATOM 324 CA ILE A 24 -5.307 5.631 -6.220 1.00 0.00 C ATOM 325 C ILE A 24 -4.354 4.793 -7.067 1.00 0.00 C ATOM 326 O ILE A 24 -4.668 3.668 -7.439 1.00 0.00 O ATOM 327 CB ILE A 24 -6.391 6.277 -7.124 1.00 0.00 C ATOM 328 CG1 ILE A 24 -7.530 5.288 -7.373 1.00 0.00 C ATOM 329 CG2 ILE A 24 -5.812 6.736 -8.458 1.00 0.00 C ATOM 330 CD1 ILE A 24 -8.286 4.904 -6.121 1.00 0.00 C ATOM 0 H ILE A 24 -4.781 7.589 -5.659 1.00 0.00 H new ATOM 0 HA ILE A 24 -5.822 4.988 -5.506 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.774 7.153 -6.601 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -8.227 5.723 -8.089 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.123 4.387 -7.832 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.601 7.183 -9.063 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -5.029 7.474 -8.280 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -5.391 5.880 -8.986 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -9.078 4.200 -6.376 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.602 4.439 -5.411 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -8.723 5.796 -5.672 1.00 0.00 H new ATOM 342 N LYS A 25 -3.187 5.353 -7.362 1.00 0.00 N ATOM 343 CA LYS A 25 -2.148 4.637 -8.086 1.00 0.00 C ATOM 344 C LYS A 25 -1.716 3.413 -7.304 1.00 0.00 C ATOM 345 O LYS A 25 -1.694 2.306 -7.825 1.00 0.00 O ATOM 346 CB LYS A 25 -0.942 5.542 -8.300 1.00 0.00 C ATOM 347 CG LYS A 25 -1.229 6.751 -9.159 1.00 0.00 C ATOM 348 CD LYS A 25 -0.207 7.834 -8.910 1.00 0.00 C ATOM 349 CE LYS A 25 -0.355 8.980 -9.898 1.00 0.00 C ATOM 350 NZ LYS A 25 0.605 10.082 -9.621 1.00 0.00 N ATOM 0 H LYS A 25 -2.937 6.309 -7.108 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.549 4.329 -9.052 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.575 5.877 -7.330 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.142 4.962 -8.761 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.217 6.467 -10.211 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -2.228 7.129 -8.942 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -0.317 8.212 -7.894 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.796 7.414 -8.987 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -0.198 8.608 -10.911 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -1.373 9.367 -9.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.471 10.843 -10.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 0.439 10.455 -8.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.578 9.720 -9.687 1.00 0.00 H new ATOM 364 N GLN A 26 -1.405 3.624 -6.038 1.00 0.00 N ATOM 365 CA GLN A 26 -0.922 2.569 -5.177 1.00 0.00 C ATOM 366 C GLN A 26 -2.055 1.602 -4.846 1.00 0.00 C ATOM 367 O GLN A 26 -1.841 0.408 -4.704 1.00 0.00 O ATOM 368 CB GLN A 26 -0.319 3.189 -3.918 1.00 0.00 C ATOM 369 CG GLN A 26 0.867 4.097 -4.224 1.00 0.00 C ATOM 370 CD GLN A 26 1.227 5.023 -3.075 1.00 0.00 C ATOM 371 OE1 GLN A 26 2.013 4.675 -2.192 1.00 0.00 O ATOM 372 NE2 GLN A 26 0.670 6.221 -3.094 1.00 0.00 N ATOM 0 H GLN A 26 -1.481 4.533 -5.581 1.00 0.00 H new ATOM 0 HA GLN A 26 -0.145 1.997 -5.684 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -1.086 3.762 -3.396 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.000 2.395 -3.243 1.00 0.00 H new ATOM 0 HG2 GLN A 26 1.732 3.482 -4.471 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.639 4.695 -5.106 1.00 0.00 H new ATOM 0 HE21 GLN A 26 0.024 6.471 -3.843 1.00 0.00 H new ATOM 0 HE22 GLN A 26 0.886 6.896 -2.360 1.00 0.00 H new ATOM 381 N LEU A 27 -3.270 2.120 -4.777 1.00 0.00 N ATOM 382 CA LEU A 27 -4.439 1.284 -4.552 1.00 0.00 C ATOM 383 C LEU A 27 -4.704 0.395 -5.762 1.00 0.00 C ATOM 384 O LEU A 27 -5.269 -0.687 -5.638 1.00 0.00 O ATOM 385 CB LEU A 27 -5.648 2.167 -4.261 1.00 0.00 C ATOM 386 CG LEU A 27 -5.464 3.114 -3.079 1.00 0.00 C ATOM 387 CD1 LEU A 27 -6.588 4.127 -3.025 1.00 0.00 C ATOM 388 CD2 LEU A 27 -5.392 2.344 -1.773 1.00 0.00 C ATOM 0 H LEU A 27 -3.473 3.115 -4.873 1.00 0.00 H new ATOM 0 HA LEU A 27 -4.254 0.638 -3.694 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -5.876 2.755 -5.150 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -6.511 1.529 -4.070 1.00 0.00 H new ATOM 0 HG LEU A 27 -4.522 3.644 -3.219 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -6.438 4.792 -2.175 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -6.596 4.711 -3.946 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -7.540 3.608 -2.916 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -5.261 3.042 -0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.315 1.782 -1.631 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -4.548 1.654 -1.803 1.00 0.00 H new ATOM 400 N GLN A 28 -4.293 0.857 -6.931 1.00 0.00 N ATOM 401 CA GLN A 28 -4.395 0.055 -8.139 1.00 0.00 C ATOM 402 C GLN A 28 -3.194 -0.871 -8.269 1.00 0.00 C ATOM 403 O GLN A 28 -3.333 -2.064 -8.528 1.00 0.00 O ATOM 404 CB GLN A 28 -4.475 0.949 -9.375 1.00 0.00 C ATOM 405 CG GLN A 28 -5.748 1.766 -9.476 1.00 0.00 C ATOM 406 CD GLN A 28 -5.699 2.743 -10.634 1.00 0.00 C ATOM 407 OE1 GLN A 28 -6.107 2.423 -11.748 1.00 0.00 O ATOM 408 NE2 GLN A 28 -5.186 3.935 -10.379 1.00 0.00 N ATOM 0 H GLN A 28 -3.886 1.782 -7.069 1.00 0.00 H new ATOM 0 HA GLN A 28 -5.305 -0.541 -8.067 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -3.622 1.627 -9.374 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.386 0.326 -10.265 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.600 1.098 -9.600 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -5.904 2.312 -8.546 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -4.859 4.159 -9.439 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -5.117 4.630 -11.122 1.00 0.00 H new ATOM 417 N GLU A 29 -2.012 -0.314 -8.080 1.00 0.00 N ATOM 418 CA GLU A 29 -0.779 -1.036 -8.347 1.00 0.00 C ATOM 419 C GLU A 29 -0.358 -1.910 -7.173 1.00 0.00 C ATOM 420 O GLU A 29 -0.142 -3.111 -7.344 1.00 0.00 O ATOM 421 CB GLU A 29 0.331 -0.052 -8.700 1.00 0.00 C ATOM 422 CG GLU A 29 0.080 0.700 -9.998 1.00 0.00 C ATOM 423 CD GLU A 29 -0.039 -0.226 -11.191 1.00 0.00 C ATOM 424 OE1 GLU A 29 1.003 -0.599 -11.764 1.00 0.00 O ATOM 425 OE2 GLU A 29 -1.173 -0.590 -11.561 1.00 0.00 O ATOM 0 H GLU A 29 -1.878 0.639 -7.742 1.00 0.00 H new ATOM 0 HA GLU A 29 -0.961 -1.700 -9.192 1.00 0.00 H new ATOM 0 HB2 GLU A 29 0.442 0.667 -7.888 1.00 0.00 H new ATOM 0 HB3 GLU A 29 1.274 -0.592 -8.778 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -0.835 1.286 -9.904 1.00 0.00 H new ATOM 0 HG3 GLU A 29 0.894 1.405 -10.169 1.00 0.00 H new ATOM 432 N ARG A 30 -0.258 -1.318 -5.987 1.00 0.00 N ATOM 433 CA ARG A 30 0.192 -2.055 -4.813 1.00 0.00 C ATOM 434 C ARG A 30 -0.820 -3.131 -4.456 1.00 0.00 C ATOM 435 O ARG A 30 -0.452 -4.266 -4.166 1.00 0.00 O ATOM 436 CB ARG A 30 0.402 -1.143 -3.603 1.00 0.00 C ATOM 437 CG ARG A 30 1.333 -1.762 -2.572 1.00 0.00 C ATOM 438 CD ARG A 30 1.796 -0.744 -1.548 1.00 0.00 C ATOM 439 NE ARG A 30 2.687 0.257 -2.128 1.00 0.00 N ATOM 440 CZ ARG A 30 2.638 1.550 -1.831 1.00 0.00 C ATOM 441 NH1 ARG A 30 1.738 2.004 -0.969 1.00 0.00 N ATOM 442 NH2 ARG A 30 3.487 2.395 -2.397 1.00 0.00 N ATOM 0 H ARG A 30 -0.481 -0.338 -5.815 1.00 0.00 H new ATOM 0 HA ARG A 30 1.152 -2.506 -5.066 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.813 -0.190 -3.936 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -0.561 -0.930 -3.139 1.00 0.00 H new ATOM 0 HG2 ARG A 30 0.821 -2.580 -2.065 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.199 -2.191 -3.076 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.928 -0.247 -1.114 1.00 0.00 H new ATOM 0 HD3 ARG A 30 2.309 -1.257 -0.735 1.00 0.00 H new ATOM 0 HE ARG A 30 3.388 -0.055 -2.800 1.00 0.00 H new ATOM 0 HH11 ARG A 30 1.080 1.359 -0.531 1.00 0.00 H new ATOM 0 HH12 ARG A 30 1.704 2.998 -0.744 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.180 2.053 -3.062 1.00 0.00 H new ATOM 0 HH22 ARG A 30 3.448 3.388 -2.167 1.00 0.00 H new ATOM 456 N ALA A 31 -2.098 -2.760 -4.483 1.00 0.00 N ATOM 457 CA ALA A 31 -3.170 -3.691 -4.154 1.00 0.00 C ATOM 458 C ALA A 31 -3.523 -4.604 -5.323 1.00 0.00 C ATOM 459 O ALA A 31 -4.339 -5.509 -5.174 1.00 0.00 O ATOM 460 CB ALA A 31 -4.402 -2.938 -3.700 1.00 0.00 C ATOM 0 H ALA A 31 -2.414 -1.822 -4.729 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.807 -4.321 -3.342 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.193 -3.647 -3.458 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.162 -2.347 -2.816 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.739 -2.277 -4.498 1.00 0.00 H new ATOM 466 N GLY A 32 -2.940 -4.342 -6.485 1.00 0.00 N ATOM 467 CA GLY A 32 -3.145 -5.199 -7.643 1.00 0.00 C ATOM 468 C GLY A 32 -4.580 -5.212 -8.150 1.00 0.00 C ATOM 469 O GLY A 32 -4.930 -6.017 -9.015 1.00 0.00 O ATOM 0 H GLY A 32 -2.324 -3.546 -6.650 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.488 -4.870 -8.448 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.850 -6.217 -7.387 1.00 0.00 H new ATOM 473 N VAL A 33 -5.412 -4.323 -7.623 1.00 0.00 N ATOM 474 CA VAL A 33 -6.810 -4.255 -8.032 1.00 0.00 C ATOM 475 C VAL A 33 -7.061 -3.000 -8.849 1.00 0.00 C ATOM 476 O VAL A 33 -6.184 -2.148 -8.980 1.00 0.00 O ATOM 477 CB VAL A 33 -7.771 -4.257 -6.819 1.00 0.00 C ATOM 478 CG1 VAL A 33 -7.646 -5.550 -6.038 1.00 0.00 C ATOM 479 CG2 VAL A 33 -7.507 -3.064 -5.915 1.00 0.00 C ATOM 0 H VAL A 33 -5.145 -3.641 -6.913 1.00 0.00 H new ATOM 0 HA VAL A 33 -7.007 -5.143 -8.632 1.00 0.00 H new ATOM 0 HB VAL A 33 -8.790 -4.179 -7.198 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -8.330 -5.530 -5.190 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -7.894 -6.391 -6.685 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -6.623 -5.660 -5.677 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -8.195 -3.088 -5.070 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -6.481 -3.105 -5.549 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -7.655 -2.142 -6.477 1.00 0.00 H new ATOM 489 N LYS A 34 -8.245 -2.893 -9.417 1.00 0.00 N ATOM 490 CA LYS A 34 -8.650 -1.666 -10.069 1.00 0.00 C ATOM 491 C LYS A 34 -9.790 -1.052 -9.291 1.00 0.00 C ATOM 492 O LYS A 34 -10.897 -1.590 -9.256 1.00 0.00 O ATOM 493 CB LYS A 34 -9.051 -1.910 -11.529 1.00 0.00 C ATOM 494 CG LYS A 34 -9.704 -0.708 -12.210 1.00 0.00 C ATOM 495 CD LYS A 34 -8.801 0.521 -12.243 1.00 0.00 C ATOM 496 CE LYS A 34 -9.470 1.668 -12.987 1.00 0.00 C ATOM 497 NZ LYS A 34 -8.599 2.870 -13.063 1.00 0.00 N ATOM 0 H LYS A 34 -8.941 -3.638 -9.440 1.00 0.00 H new ATOM 0 HA LYS A 34 -7.805 -0.977 -10.085 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.164 -2.196 -12.094 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -9.740 -2.754 -11.568 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -9.977 -0.979 -13.230 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.628 -0.459 -11.688 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.565 0.831 -11.225 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -7.857 0.270 -12.727 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -9.728 1.344 -13.995 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -10.403 1.928 -12.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -9.079 3.676 -12.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.703 2.681 -12.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.404 3.095 -14.059 1.00 0.00 H new ATOM 511 N MET A 35 -9.506 0.058 -8.641 1.00 0.00 N ATOM 512 CA MET A 35 -10.516 0.749 -7.873 1.00 0.00 C ATOM 513 C MET A 35 -11.119 1.836 -8.738 1.00 0.00 C ATOM 514 O MET A 35 -10.438 2.795 -9.103 1.00 0.00 O ATOM 515 CB MET A 35 -9.919 1.347 -6.590 1.00 0.00 C ATOM 516 CG MET A 35 -8.926 0.424 -5.902 1.00 0.00 C ATOM 517 SD MET A 35 -9.244 0.225 -4.136 1.00 0.00 S ATOM 518 CE MET A 35 -9.121 1.914 -3.561 1.00 0.00 C ATOM 0 H MET A 35 -8.586 0.498 -8.630 1.00 0.00 H new ATOM 0 HA MET A 35 -11.290 0.043 -7.573 1.00 0.00 H new ATOM 0 HB2 MET A 35 -9.423 2.287 -6.832 1.00 0.00 H new ATOM 0 HB3 MET A 35 -10.727 1.582 -5.897 1.00 0.00 H new ATOM 0 HG2 MET A 35 -8.956 -0.554 -6.382 1.00 0.00 H new ATOM 0 HG3 MET A 35 -7.919 0.816 -6.041 1.00 0.00 H new ATOM 0 HE1 MET A 35 -8.301 1.997 -2.847 1.00 0.00 H new ATOM 0 HE2 MET A 35 -8.932 2.574 -4.408 1.00 0.00 H new ATOM 0 HE3 MET A 35 -10.054 2.202 -3.077 1.00 0.00 H new ATOM 528 N ILE A 36 -12.382 1.679 -9.088 1.00 0.00 N ATOM 529 CA ILE A 36 -13.035 2.631 -9.962 1.00 0.00 C ATOM 530 C ILE A 36 -14.094 3.422 -9.201 1.00 0.00 C ATOM 531 O ILE A 36 -15.191 2.944 -8.908 1.00 0.00 O ATOM 532 CB ILE A 36 -13.635 1.955 -11.222 1.00 0.00 C ATOM 533 CG1 ILE A 36 -14.363 2.986 -12.089 1.00 0.00 C ATOM 534 CG2 ILE A 36 -14.557 0.804 -10.854 1.00 0.00 C ATOM 535 CD1 ILE A 36 -13.463 4.095 -12.595 1.00 0.00 C ATOM 0 H ILE A 36 -12.972 0.905 -8.782 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.272 3.326 -10.313 1.00 0.00 H new ATOM 0 HB ILE A 36 -12.811 1.538 -11.801 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -14.814 2.478 -12.941 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -15.177 3.425 -11.512 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -14.959 0.355 -11.762 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -13.997 0.054 -10.295 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -15.377 1.177 -10.240 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -14.046 4.788 -13.202 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -13.031 4.628 -11.748 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -12.663 3.667 -13.200 1.00 0.00 H new ATOM 547 N LEU A 37 -13.704 4.625 -8.839 1.00 0.00 N ATOM 548 CA LEU A 37 -14.560 5.559 -8.143 1.00 0.00 C ATOM 549 C LEU A 37 -14.423 6.923 -8.797 1.00 0.00 C ATOM 550 O LEU A 37 -13.348 7.268 -9.288 1.00 0.00 O ATOM 551 CB LEU A 37 -14.263 5.601 -6.615 1.00 0.00 C ATOM 552 CG LEU A 37 -12.795 5.694 -6.124 1.00 0.00 C ATOM 553 CD1 LEU A 37 -11.931 4.553 -6.636 1.00 0.00 C ATOM 554 CD2 LEU A 37 -12.170 7.023 -6.476 1.00 0.00 C ATOM 0 H LEU A 37 -12.768 4.987 -9.023 1.00 0.00 H new ATOM 0 HA LEU A 37 -15.595 5.228 -8.225 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -14.800 6.454 -6.201 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -14.699 4.705 -6.173 1.00 0.00 H new ATOM 0 HG LEU A 37 -12.839 5.609 -5.038 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.914 4.670 -6.261 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -12.339 3.604 -6.289 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -11.919 4.566 -7.726 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -11.142 7.049 -6.115 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -12.178 7.154 -7.558 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -12.739 7.827 -6.009 1.00 0.00 H new ATOM 566 N ILE A 38 -15.518 7.665 -8.863 1.00 0.00 N ATOM 567 CA ILE A 38 -15.507 8.972 -9.503 1.00 0.00 C ATOM 568 C ILE A 38 -14.563 9.912 -8.765 1.00 0.00 C ATOM 569 O ILE A 38 -14.905 10.455 -7.721 1.00 0.00 O ATOM 570 CB ILE A 38 -16.915 9.624 -9.563 1.00 0.00 C ATOM 571 CG1 ILE A 38 -17.918 8.744 -10.320 1.00 0.00 C ATOM 572 CG2 ILE A 38 -16.837 10.993 -10.223 1.00 0.00 C ATOM 573 CD1 ILE A 38 -18.463 7.581 -9.515 1.00 0.00 C ATOM 0 H ILE A 38 -16.422 7.386 -8.483 1.00 0.00 H new ATOM 0 HA ILE A 38 -15.167 8.811 -10.526 1.00 0.00 H new ATOM 0 HB ILE A 38 -17.266 9.732 -8.537 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -18.751 9.365 -10.649 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -17.437 8.355 -11.217 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -17.832 11.437 -10.258 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -16.172 11.637 -9.648 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -16.452 10.887 -11.237 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -19.164 7.012 -10.126 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -17.641 6.934 -9.208 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -18.976 7.959 -8.631 1.00 0.00 H new ATOM 585 N GLN A 39 -13.370 10.081 -9.312 1.00 0.00 N ATOM 586 CA GLN A 39 -12.395 11.000 -8.751 1.00 0.00 C ATOM 587 C GLN A 39 -12.624 12.386 -9.325 1.00 0.00 C ATOM 588 O GLN A 39 -13.208 13.253 -8.679 1.00 0.00 O ATOM 589 CB GLN A 39 -10.975 10.525 -9.068 1.00 0.00 C ATOM 590 CG GLN A 39 -10.691 9.109 -8.600 1.00 0.00 C ATOM 591 CD GLN A 39 -9.337 8.588 -9.050 1.00 0.00 C ATOM 592 OE1 GLN A 39 -9.164 7.388 -9.256 1.00 0.00 O ATOM 593 NE2 GLN A 39 -8.370 9.481 -9.217 1.00 0.00 N ATOM 0 H GLN A 39 -13.053 9.591 -10.148 1.00 0.00 H new ATOM 0 HA GLN A 39 -12.513 11.033 -7.668 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -10.813 10.583 -10.144 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.261 11.203 -8.601 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.742 9.076 -7.512 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.471 8.446 -8.975 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -8.551 10.468 -9.036 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -7.446 9.180 -9.526 1.00 0.00 H new ATOM 602 N ASP A 40 -12.183 12.576 -10.557 1.00 0.00 N ATOM 603 CA ASP A 40 -12.429 13.813 -11.271 1.00 0.00 C ATOM 604 C ASP A 40 -13.512 13.583 -12.312 1.00 0.00 C ATOM 605 O ASP A 40 -13.229 13.244 -13.464 1.00 0.00 O ATOM 606 CB ASP A 40 -11.144 14.320 -11.929 1.00 0.00 C ATOM 607 CG ASP A 40 -11.337 15.659 -12.606 1.00 0.00 C ATOM 608 OD1 ASP A 40 -11.363 16.689 -11.899 1.00 0.00 O ATOM 609 OD2 ASP A 40 -11.469 15.694 -13.845 1.00 0.00 O ATOM 0 H ASP A 40 -11.650 11.884 -11.084 1.00 0.00 H new ATOM 0 HA ASP A 40 -12.765 14.575 -10.567 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.361 14.406 -11.175 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -10.801 13.590 -12.663 1.00 0.00 H new ATOM 614 N GLY A 41 -14.755 13.726 -11.887 1.00 0.00 N ATOM 615 CA GLY A 41 -15.873 13.481 -12.770 1.00 0.00 C ATOM 616 C GLY A 41 -17.020 14.427 -12.507 1.00 0.00 C ATOM 617 O GLY A 41 -17.082 15.049 -11.447 1.00 0.00 O ATOM 0 H GLY A 41 -15.011 14.009 -10.941 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -15.547 13.585 -13.805 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -16.215 12.453 -12.646 1.00 0.00 H new ATOM 621 N SER A 42 -17.929 14.518 -13.463 1.00 0.00 N ATOM 622 CA SER A 42 -19.056 15.440 -13.380 1.00 0.00 C ATOM 623 C SER A 42 -19.973 15.121 -12.197 1.00 0.00 C ATOM 624 O SER A 42 -20.622 16.012 -11.645 1.00 0.00 O ATOM 625 CB SER A 42 -19.856 15.376 -14.679 1.00 0.00 C ATOM 626 OG SER A 42 -18.997 15.435 -15.805 1.00 0.00 O ATOM 0 H SER A 42 -17.910 13.959 -14.316 1.00 0.00 H new ATOM 0 HA SER A 42 -18.658 16.443 -13.227 1.00 0.00 H new ATOM 0 HB2 SER A 42 -20.437 14.454 -14.708 1.00 0.00 H new ATOM 0 HB3 SER A 42 -20.566 16.202 -14.715 1.00 0.00 H new ATOM 0 HG SER A 42 -19.530 15.391 -16.626 1.00 0.00 H new ATOM 632 N GLN A 43 -20.021 13.854 -11.810 1.00 0.00 N ATOM 633 CA GLN A 43 -20.940 13.410 -10.772 1.00 0.00 C ATOM 634 C GLN A 43 -20.388 13.679 -9.374 1.00 0.00 C ATOM 635 O GLN A 43 -20.763 14.653 -8.723 1.00 0.00 O ATOM 636 CB GLN A 43 -21.248 11.918 -10.932 1.00 0.00 C ATOM 637 CG GLN A 43 -21.815 11.553 -12.293 1.00 0.00 C ATOM 638 CD GLN A 43 -23.032 12.378 -12.655 1.00 0.00 C ATOM 639 OE1 GLN A 43 -22.918 13.439 -13.269 1.00 0.00 O ATOM 640 NE2 GLN A 43 -24.203 11.904 -12.270 1.00 0.00 N ATOM 0 H GLN A 43 -19.434 13.116 -12.199 1.00 0.00 H new ATOM 0 HA GLN A 43 -21.860 13.983 -10.886 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -20.334 11.348 -10.764 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -21.957 11.618 -10.161 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -21.046 11.693 -13.053 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -22.081 10.496 -12.300 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -24.254 11.020 -11.763 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -25.057 12.422 -12.480 1.00 0.00 H new ATOM 649 N ASN A 44 -19.475 12.828 -8.927 1.00 0.00 N ATOM 650 CA ASN A 44 -19.009 12.878 -7.547 1.00 0.00 C ATOM 651 C ASN A 44 -17.570 13.361 -7.452 1.00 0.00 C ATOM 652 O ASN A 44 -16.720 12.680 -6.888 1.00 0.00 O ATOM 653 CB ASN A 44 -19.125 11.501 -6.888 1.00 0.00 C ATOM 654 CG ASN A 44 -20.546 10.970 -6.858 1.00 0.00 C ATOM 655 OD1 ASN A 44 -21.512 11.732 -6.849 1.00 0.00 O ATOM 656 ND2 ASN A 44 -20.681 9.654 -6.831 1.00 0.00 N ATOM 0 H ASN A 44 -19.044 12.099 -9.495 1.00 0.00 H new ATOM 0 HA ASN A 44 -19.646 13.590 -7.022 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -18.491 10.794 -7.424 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -18.745 11.560 -5.868 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -21.612 9.237 -6.802 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -19.855 9.056 -6.840 1.00 0.00 H new ATOM 663 N THR A 45 -17.293 14.534 -7.992 1.00 0.00 N ATOM 664 CA THR A 45 -15.968 15.111 -7.861 1.00 0.00 C ATOM 665 C THR A 45 -15.834 15.765 -6.482 1.00 0.00 C ATOM 666 O THR A 45 -14.850 15.551 -5.769 1.00 0.00 O ATOM 667 CB THR A 45 -15.657 16.116 -9.006 1.00 0.00 C ATOM 668 OG1 THR A 45 -14.328 16.634 -8.884 1.00 0.00 O ATOM 669 CG2 THR A 45 -16.651 17.267 -9.040 1.00 0.00 C ATOM 0 H THR A 45 -17.958 15.100 -8.519 1.00 0.00 H new ATOM 0 HA THR A 45 -15.230 14.314 -7.948 1.00 0.00 H new ATOM 0 HB THR A 45 -15.745 15.563 -9.941 1.00 0.00 H new ATOM 0 HG1 THR A 45 -14.154 17.263 -9.615 1.00 0.00 H new ATOM 0 HG21 THR A 45 -16.396 17.944 -9.855 1.00 0.00 H new ATOM 0 HG22 THR A 45 -17.656 16.875 -9.195 1.00 0.00 H new ATOM 0 HG23 THR A 45 -16.614 17.807 -8.094 1.00 0.00 H new ATOM 677 N ASN A 46 -16.855 16.521 -6.090 1.00 0.00 N ATOM 678 CA ASN A 46 -16.911 17.123 -4.763 1.00 0.00 C ATOM 679 C ASN A 46 -17.693 16.200 -3.830 1.00 0.00 C ATOM 680 O ASN A 46 -17.467 16.156 -2.624 1.00 0.00 O ATOM 681 CB ASN A 46 -17.578 18.506 -4.855 1.00 0.00 C ATOM 682 CG ASN A 46 -17.464 19.338 -3.584 1.00 0.00 C ATOM 683 OD1 ASN A 46 -17.478 18.821 -2.470 1.00 0.00 O ATOM 684 ND2 ASN A 46 -17.348 20.645 -3.745 1.00 0.00 N ATOM 0 H ASN A 46 -17.661 16.732 -6.678 1.00 0.00 H new ATOM 0 HA ASN A 46 -15.905 17.254 -4.365 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -17.130 19.059 -5.680 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -18.633 18.373 -5.096 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -17.267 21.254 -2.931 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -17.340 21.044 -4.683 1.00 0.00 H new ATOM 691 N VAL A 47 -18.578 15.422 -4.430 1.00 0.00 N ATOM 692 CA VAL A 47 -19.488 14.554 -3.700 1.00 0.00 C ATOM 693 C VAL A 47 -18.777 13.276 -3.238 1.00 0.00 C ATOM 694 O VAL A 47 -17.718 12.924 -3.767 1.00 0.00 O ATOM 695 CB VAL A 47 -20.693 14.195 -4.602 1.00 0.00 C ATOM 696 CG1 VAL A 47 -21.686 13.298 -3.888 1.00 0.00 C ATOM 697 CG2 VAL A 47 -21.378 15.458 -5.106 1.00 0.00 C ATOM 0 H VAL A 47 -18.686 15.374 -5.443 1.00 0.00 H new ATOM 0 HA VAL A 47 -19.839 15.083 -2.814 1.00 0.00 H new ATOM 0 HB VAL A 47 -20.308 13.639 -5.457 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -22.516 13.070 -4.556 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -21.193 12.372 -3.593 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -22.063 13.807 -3.001 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -22.223 15.186 -5.739 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -21.733 16.042 -4.257 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -20.669 16.051 -5.683 1.00 0.00 H new ATOM 707 N ASP A 48 -19.353 12.612 -2.233 1.00 0.00 N ATOM 708 CA ASP A 48 -18.857 11.324 -1.751 1.00 0.00 C ATOM 709 C ASP A 48 -18.790 10.309 -2.885 1.00 0.00 C ATOM 710 O ASP A 48 -19.563 10.375 -3.843 1.00 0.00 O ATOM 711 CB ASP A 48 -19.739 10.799 -0.611 1.00 0.00 C ATOM 712 CG ASP A 48 -21.222 10.875 -0.923 1.00 0.00 C ATOM 713 OD1 ASP A 48 -21.801 11.978 -0.793 1.00 0.00 O ATOM 714 OD2 ASP A 48 -21.827 9.840 -1.267 1.00 0.00 O ATOM 0 H ASP A 48 -20.174 12.952 -1.733 1.00 0.00 H new ATOM 0 HA ASP A 48 -17.848 11.472 -1.367 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -19.471 9.764 -0.399 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -19.534 11.373 0.293 1.00 0.00 H new ATOM 719 N LYS A 49 -17.870 9.365 -2.771 1.00 0.00 N ATOM 720 CA LYS A 49 -17.509 8.521 -3.897 1.00 0.00 C ATOM 721 C LYS A 49 -17.611 7.045 -3.543 1.00 0.00 C ATOM 722 O LYS A 49 -17.092 6.605 -2.520 1.00 0.00 O ATOM 723 CB LYS A 49 -16.087 8.864 -4.344 1.00 0.00 C ATOM 724 CG LYS A 49 -15.910 10.338 -4.659 1.00 0.00 C ATOM 725 CD LYS A 49 -14.452 10.755 -4.630 1.00 0.00 C ATOM 726 CE LYS A 49 -14.288 12.205 -5.056 1.00 0.00 C ATOM 727 NZ LYS A 49 -15.024 13.150 -4.174 1.00 0.00 N ATOM 0 H LYS A 49 -17.360 9.164 -1.911 1.00 0.00 H new ATOM 0 HA LYS A 49 -18.208 8.709 -4.712 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.386 8.578 -3.560 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.836 8.276 -5.227 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -16.328 10.551 -5.643 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -16.471 10.933 -3.938 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -14.052 10.621 -3.625 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -13.873 10.111 -5.292 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -13.229 12.462 -5.054 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -14.642 12.320 -6.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -14.864 14.125 -4.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -16.041 12.936 -4.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -14.682 13.051 -3.197 1.00 0.00 H new ATOM 741 N PRO A 50 -18.301 6.265 -4.384 1.00 0.00 N ATOM 742 CA PRO A 50 -18.425 4.824 -4.204 1.00 0.00 C ATOM 743 C PRO A 50 -17.219 4.069 -4.761 1.00 0.00 C ATOM 744 O PRO A 50 -16.981 4.046 -5.970 1.00 0.00 O ATOM 745 CB PRO A 50 -19.696 4.501 -4.984 1.00 0.00 C ATOM 746 CG PRO A 50 -19.731 5.504 -6.088 1.00 0.00 C ATOM 747 CD PRO A 50 -19.034 6.739 -5.571 1.00 0.00 C ATOM 0 HA PRO A 50 -18.468 4.527 -3.156 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -19.673 3.484 -5.374 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -20.580 4.579 -4.350 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -19.230 5.120 -6.977 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -20.758 5.730 -6.374 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -18.358 7.157 -6.317 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -19.748 7.522 -5.313 1.00 0.00 H new ATOM 755 N LEU A 51 -16.459 3.461 -3.866 1.00 0.00 N ATOM 756 CA LEU A 51 -15.238 2.765 -4.234 1.00 0.00 C ATOM 757 C LEU A 51 -15.569 1.377 -4.756 1.00 0.00 C ATOM 758 O LEU A 51 -15.989 0.520 -3.993 1.00 0.00 O ATOM 759 CB LEU A 51 -14.326 2.630 -3.005 1.00 0.00 C ATOM 760 CG LEU A 51 -12.816 2.530 -3.269 1.00 0.00 C ATOM 761 CD1 LEU A 51 -12.511 1.715 -4.513 1.00 0.00 C ATOM 762 CD2 LEU A 51 -12.198 3.913 -3.356 1.00 0.00 C ATOM 0 H LEU A 51 -16.670 3.436 -2.868 1.00 0.00 H new ATOM 0 HA LEU A 51 -14.730 3.337 -5.011 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -14.501 3.488 -2.356 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -14.633 1.743 -2.450 1.00 0.00 H new ATOM 0 HG LEU A 51 -12.368 2.004 -2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -11.432 1.670 -4.663 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -12.903 0.705 -4.392 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -12.978 2.184 -5.379 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -11.128 3.822 -3.543 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -12.663 4.469 -4.170 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -12.358 4.443 -2.417 1.00 0.00 H new ATOM 774 N ARG A 52 -15.377 1.158 -6.044 1.00 0.00 N ATOM 775 CA ARG A 52 -15.542 -0.172 -6.608 1.00 0.00 C ATOM 776 C ARG A 52 -14.193 -0.854 -6.761 1.00 0.00 C ATOM 777 O ARG A 52 -13.396 -0.486 -7.623 1.00 0.00 O ATOM 778 CB ARG A 52 -16.252 -0.139 -7.961 1.00 0.00 C ATOM 779 CG ARG A 52 -17.754 0.037 -7.865 1.00 0.00 C ATOM 780 CD ARG A 52 -18.159 1.491 -8.053 1.00 0.00 C ATOM 781 NE ARG A 52 -19.590 1.702 -7.826 1.00 0.00 N ATOM 782 CZ ARG A 52 -20.369 2.460 -8.595 1.00 0.00 C ATOM 783 NH1 ARG A 52 -19.886 3.005 -9.705 1.00 0.00 N ATOM 784 NH2 ARG A 52 -21.642 2.638 -8.262 1.00 0.00 N ATOM 0 H ARG A 52 -15.109 1.877 -6.716 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.165 -0.737 -5.914 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -15.839 0.675 -8.557 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -16.038 -1.065 -8.494 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.242 -0.578 -8.621 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.101 -0.316 -6.894 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -17.588 2.117 -7.367 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -17.903 1.810 -9.063 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.019 1.237 -7.025 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.915 2.844 -9.972 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -20.486 3.585 -10.291 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -22.016 2.196 -7.423 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -22.246 3.217 -8.846 1.00 0.00 H new ATOM 798 N ILE A 53 -13.938 -1.832 -5.911 1.00 0.00 N ATOM 799 CA ILE A 53 -12.713 -2.610 -5.989 1.00 0.00 C ATOM 800 C ILE A 53 -12.929 -3.838 -6.864 1.00 0.00 C ATOM 801 O ILE A 53 -13.703 -4.728 -6.512 1.00 0.00 O ATOM 802 CB ILE A 53 -12.239 -3.053 -4.589 1.00 0.00 C ATOM 803 CG1 ILE A 53 -12.035 -1.827 -3.698 1.00 0.00 C ATOM 804 CG2 ILE A 53 -10.952 -3.861 -4.691 1.00 0.00 C ATOM 805 CD1 ILE A 53 -11.614 -2.160 -2.285 1.00 0.00 C ATOM 0 H ILE A 53 -14.565 -2.108 -5.155 1.00 0.00 H new ATOM 0 HA ILE A 53 -11.943 -1.976 -6.428 1.00 0.00 H new ATOM 0 HB ILE A 53 -13.004 -3.689 -4.143 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -11.280 -1.184 -4.150 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -12.963 -1.255 -3.665 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -10.633 -4.165 -3.694 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -11.126 -4.747 -5.302 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -10.175 -3.251 -5.150 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -11.490 -1.239 -1.716 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -12.379 -2.777 -1.813 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -10.670 -2.704 -2.305 1.00 0.00 H new ATOM 817 N ILE A 54 -12.256 -3.872 -8.007 1.00 0.00 N ATOM 818 CA ILE A 54 -12.421 -4.962 -8.961 1.00 0.00 C ATOM 819 C ILE A 54 -11.236 -5.919 -8.900 1.00 0.00 C ATOM 820 O ILE A 54 -10.085 -5.505 -9.061 1.00 0.00 O ATOM 821 CB ILE A 54 -12.558 -4.426 -10.405 1.00 0.00 C ATOM 822 CG1 ILE A 54 -13.645 -3.351 -10.481 1.00 0.00 C ATOM 823 CG2 ILE A 54 -12.873 -5.565 -11.366 1.00 0.00 C ATOM 824 CD1 ILE A 54 -13.737 -2.678 -11.832 1.00 0.00 C ATOM 0 H ILE A 54 -11.590 -3.156 -8.297 1.00 0.00 H new ATOM 0 HA ILE A 54 -13.333 -5.493 -8.689 1.00 0.00 H new ATOM 0 HB ILE A 54 -11.608 -3.977 -10.695 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -14.608 -3.802 -10.243 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -13.451 -2.595 -9.720 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -12.966 -5.172 -12.378 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -12.069 -6.300 -11.335 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -13.810 -6.040 -11.073 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -14.528 -1.928 -11.812 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.787 -2.197 -12.064 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -13.962 -3.423 -12.595 1.00 0.00 H new ATOM 836 N GLY A 55 -11.521 -7.191 -8.646 1.00 0.00 N ATOM 837 CA GLY A 55 -10.482 -8.201 -8.637 1.00 0.00 C ATOM 838 C GLY A 55 -10.990 -9.544 -8.147 1.00 0.00 C ATOM 839 O GLY A 55 -12.197 -9.736 -7.989 1.00 0.00 O ATOM 0 H GLY A 55 -12.458 -7.541 -8.445 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -10.078 -8.313 -9.643 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -9.662 -7.870 -7.999 1.00 0.00 H new ATOM 843 N ASP A 56 -10.076 -10.478 -7.939 1.00 0.00 N ATOM 844 CA ASP A 56 -10.408 -11.771 -7.350 1.00 0.00 C ATOM 845 C ASP A 56 -10.733 -11.600 -5.867 1.00 0.00 C ATOM 846 O ASP A 56 -10.071 -10.823 -5.184 1.00 0.00 O ATOM 847 CB ASP A 56 -9.229 -12.735 -7.517 1.00 0.00 C ATOM 848 CG ASP A 56 -9.613 -14.189 -7.313 1.00 0.00 C ATOM 849 OD1 ASP A 56 -9.761 -14.625 -6.152 1.00 0.00 O ATOM 850 OD2 ASP A 56 -9.754 -14.913 -8.322 1.00 0.00 O ATOM 0 H ASP A 56 -9.089 -10.366 -8.171 1.00 0.00 H new ATOM 0 HA ASP A 56 -11.280 -12.181 -7.859 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.807 -12.614 -8.515 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -8.447 -12.469 -6.806 1.00 0.00 H new ATOM 855 N PRO A 57 -11.764 -12.302 -5.364 1.00 0.00 N ATOM 856 CA PRO A 57 -12.221 -12.209 -3.972 1.00 0.00 C ATOM 857 C PRO A 57 -11.110 -11.985 -2.939 1.00 0.00 C ATOM 858 O PRO A 57 -11.236 -11.107 -2.084 1.00 0.00 O ATOM 859 CB PRO A 57 -12.880 -13.564 -3.761 1.00 0.00 C ATOM 860 CG PRO A 57 -13.490 -13.879 -5.083 1.00 0.00 C ATOM 861 CD PRO A 57 -12.607 -13.240 -6.130 1.00 0.00 C ATOM 0 HA PRO A 57 -12.867 -11.343 -3.826 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -12.152 -14.320 -3.467 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -13.633 -13.523 -2.974 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -13.552 -14.957 -5.234 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -14.506 -13.490 -5.143 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -12.004 -13.984 -6.651 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -13.196 -12.721 -6.886 1.00 0.00 H new ATOM 869 N TYR A 58 -10.021 -12.754 -3.026 1.00 0.00 N ATOM 870 CA TYR A 58 -8.947 -12.659 -2.033 1.00 0.00 C ATOM 871 C TYR A 58 -8.317 -11.262 -2.027 1.00 0.00 C ATOM 872 O TYR A 58 -8.035 -10.702 -0.968 1.00 0.00 O ATOM 873 CB TYR A 58 -7.861 -13.729 -2.261 1.00 0.00 C ATOM 874 CG TYR A 58 -6.938 -13.467 -3.441 1.00 0.00 C ATOM 875 CD1 TYR A 58 -5.794 -12.685 -3.297 1.00 0.00 C ATOM 876 CD2 TYR A 58 -7.215 -13.991 -4.692 1.00 0.00 C ATOM 877 CE1 TYR A 58 -4.960 -12.438 -4.372 1.00 0.00 C ATOM 878 CE2 TYR A 58 -6.384 -13.753 -5.769 1.00 0.00 C ATOM 879 CZ TYR A 58 -5.261 -12.972 -5.606 1.00 0.00 C ATOM 880 OH TYR A 58 -4.445 -12.724 -6.686 1.00 0.00 O ATOM 0 H TYR A 58 -9.860 -13.440 -3.763 1.00 0.00 H new ATOM 0 HA TYR A 58 -9.401 -12.840 -1.059 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -7.257 -13.810 -1.357 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -8.347 -14.693 -2.407 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -5.555 -12.265 -2.331 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -8.098 -14.598 -4.828 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -4.077 -11.829 -4.245 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -6.614 -14.177 -6.735 1.00 0.00 H new ATOM 0 HH TYR A 58 -4.803 -13.177 -7.478 1.00 0.00 H new ATOM 890 N LYS A 59 -8.122 -10.686 -3.210 1.00 0.00 N ATOM 891 CA LYS A 59 -7.438 -9.406 -3.309 1.00 0.00 C ATOM 892 C LYS A 59 -8.410 -8.277 -3.028 1.00 0.00 C ATOM 893 O LYS A 59 -8.029 -7.245 -2.480 1.00 0.00 O ATOM 894 CB LYS A 59 -6.766 -9.225 -4.677 1.00 0.00 C ATOM 895 CG LYS A 59 -7.717 -9.132 -5.855 1.00 0.00 C ATOM 896 CD LYS A 59 -6.973 -8.825 -7.148 1.00 0.00 C ATOM 897 CE LYS A 59 -6.017 -9.943 -7.529 1.00 0.00 C ATOM 898 NZ LYS A 59 -5.213 -9.601 -8.731 1.00 0.00 N ATOM 0 H LYS A 59 -8.424 -11.081 -4.101 1.00 0.00 H new ATOM 0 HA LYS A 59 -6.647 -9.386 -2.560 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -6.158 -8.321 -4.649 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -6.087 -10.061 -4.844 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -8.261 -10.071 -5.961 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -8.457 -8.355 -5.666 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -7.692 -8.671 -7.953 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -6.417 -7.894 -7.035 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -5.349 -10.150 -6.693 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.583 -10.855 -7.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.574 -10.390 -8.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -5.848 -9.428 -9.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.653 -8.745 -8.542 1.00 0.00 H new ATOM 912 N VAL A 60 -9.673 -8.496 -3.376 1.00 0.00 N ATOM 913 CA VAL A 60 -10.725 -7.544 -3.057 1.00 0.00 C ATOM 914 C VAL A 60 -10.892 -7.457 -1.548 1.00 0.00 C ATOM 915 O VAL A 60 -11.211 -6.404 -1.005 1.00 0.00 O ATOM 916 CB VAL A 60 -12.077 -7.948 -3.697 1.00 0.00 C ATOM 917 CG1 VAL A 60 -13.172 -6.951 -3.347 1.00 0.00 C ATOM 918 CG2 VAL A 60 -11.946 -8.076 -5.204 1.00 0.00 C ATOM 0 H VAL A 60 -9.991 -9.325 -3.879 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.433 -6.576 -3.463 1.00 0.00 H new ATOM 0 HB VAL A 60 -12.356 -8.919 -3.289 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -14.108 -7.261 -3.810 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -13.298 -6.913 -2.265 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.895 -5.963 -3.715 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.908 -8.360 -5.630 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -11.631 -7.121 -5.624 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.204 -8.839 -5.441 1.00 0.00 H new ATOM 928 N GLN A 61 -10.619 -8.565 -0.873 1.00 0.00 N ATOM 929 CA GLN A 61 -10.819 -8.651 0.565 1.00 0.00 C ATOM 930 C GLN A 61 -9.738 -7.851 1.269 1.00 0.00 C ATOM 931 O GLN A 61 -10.030 -6.972 2.079 1.00 0.00 O ATOM 932 CB GLN A 61 -10.801 -10.121 1.011 1.00 0.00 C ATOM 933 CG GLN A 61 -11.313 -10.384 2.428 1.00 0.00 C ATOM 934 CD GLN A 61 -10.286 -10.102 3.512 1.00 0.00 C ATOM 935 OE1 GLN A 61 -9.459 -10.955 3.829 1.00 0.00 O ATOM 936 NE2 GLN A 61 -10.357 -8.928 4.121 1.00 0.00 N ATOM 0 H GLN A 61 -10.258 -9.418 -1.300 1.00 0.00 H new ATOM 0 HA GLN A 61 -11.790 -8.233 0.830 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -11.402 -10.702 0.312 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -9.779 -10.493 0.938 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -12.194 -9.768 2.606 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -11.630 -11.424 2.503 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -11.056 -8.245 3.831 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -9.712 -8.707 4.880 1.00 0.00 H new ATOM 945 N GLN A 62 -8.488 -8.132 0.921 1.00 0.00 N ATOM 946 CA GLN A 62 -7.360 -7.446 1.526 1.00 0.00 C ATOM 947 C GLN A 62 -7.366 -5.965 1.154 1.00 0.00 C ATOM 948 O GLN A 62 -6.797 -5.138 1.863 1.00 0.00 O ATOM 949 CB GLN A 62 -6.046 -8.096 1.086 1.00 0.00 C ATOM 950 CG GLN A 62 -5.965 -9.594 1.350 1.00 0.00 C ATOM 951 CD GLN A 62 -5.847 -9.960 2.826 1.00 0.00 C ATOM 952 OE1 GLN A 62 -6.437 -9.167 3.708 1.00 0.00 O flip ATOM 953 NE2 GLN A 62 -5.232 -10.967 3.168 1.00 0.00 N flip ATOM 0 H GLN A 62 -8.233 -8.831 0.223 1.00 0.00 H new ATOM 0 HA GLN A 62 -7.449 -7.529 2.609 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -5.907 -7.919 0.019 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -5.221 -7.604 1.601 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -6.853 -10.073 0.938 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -5.106 -10.000 0.816 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -4.788 -11.557 2.464 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.165 -11.213 4.156 1.00 0.00 H new ATOM 962 N ALA A 63 -8.010 -5.635 0.037 1.00 0.00 N ATOM 963 CA ALA A 63 -8.116 -4.248 -0.390 1.00 0.00 C ATOM 964 C ALA A 63 -9.238 -3.532 0.353 1.00 0.00 C ATOM 965 O ALA A 63 -9.021 -2.467 0.911 1.00 0.00 O ATOM 966 CB ALA A 63 -8.335 -4.146 -1.888 1.00 0.00 C ATOM 0 H ALA A 63 -8.463 -6.306 -0.583 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.171 -3.761 -0.149 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.410 -3.097 -2.174 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.496 -4.606 -2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.257 -4.662 -2.157 1.00 0.00 H new ATOM 972 N CYS A 64 -10.438 -4.116 0.362 1.00 0.00 N ATOM 973 CA CYS A 64 -11.566 -3.532 1.094 1.00 0.00 C ATOM 974 C CYS A 64 -11.177 -3.294 2.543 1.00 0.00 C ATOM 975 O CYS A 64 -11.503 -2.263 3.131 1.00 0.00 O ATOM 976 CB CYS A 64 -12.793 -4.445 1.027 1.00 0.00 C ATOM 977 SG CYS A 64 -13.474 -4.644 -0.634 1.00 0.00 S ATOM 0 H CYS A 64 -10.654 -4.986 -0.125 1.00 0.00 H new ATOM 0 HA CYS A 64 -11.820 -2.580 0.627 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -12.524 -5.426 1.418 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -13.568 -4.043 1.680 1.00 0.00 H new ATOM 0 HG CYS A 64 -12.657 -5.352 -1.356 1.00 0.00 H new ATOM 983 N GLU A 65 -10.458 -4.259 3.093 1.00 0.00 N ATOM 984 CA GLU A 65 -9.909 -4.155 4.430 1.00 0.00 C ATOM 985 C GLU A 65 -8.991 -2.944 4.546 1.00 0.00 C ATOM 986 O GLU A 65 -9.176 -2.094 5.417 1.00 0.00 O ATOM 987 CB GLU A 65 -9.151 -5.440 4.757 1.00 0.00 C ATOM 988 CG GLU A 65 -8.262 -5.356 5.980 1.00 0.00 C ATOM 989 CD GLU A 65 -7.929 -6.729 6.523 1.00 0.00 C ATOM 990 OE1 GLU A 65 -8.734 -7.273 7.306 1.00 0.00 O ATOM 991 OE2 GLU A 65 -6.872 -7.282 6.149 1.00 0.00 O ATOM 0 H GLU A 65 -10.240 -5.137 2.622 1.00 0.00 H new ATOM 0 HA GLU A 65 -10.722 -4.021 5.144 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -9.872 -6.244 4.903 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -8.539 -5.713 3.898 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -7.341 -4.832 5.725 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -8.760 -4.770 6.752 1.00 0.00 H new ATOM 998 N MET A 66 -8.023 -2.858 3.646 1.00 0.00 N ATOM 999 CA MET A 66 -7.041 -1.789 3.694 1.00 0.00 C ATOM 1000 C MET A 66 -7.700 -0.437 3.471 1.00 0.00 C ATOM 1001 O MET A 66 -7.365 0.527 4.145 1.00 0.00 O ATOM 1002 CB MET A 66 -5.930 -2.019 2.665 1.00 0.00 C ATOM 1003 CG MET A 66 -6.249 -1.493 1.278 1.00 0.00 C ATOM 1004 SD MET A 66 -5.214 -2.199 -0.008 1.00 0.00 S ATOM 1005 CE MET A 66 -5.448 -0.969 -1.281 1.00 0.00 C ATOM 0 H MET A 66 -7.898 -3.515 2.876 1.00 0.00 H new ATOM 0 HA MET A 66 -6.593 -1.792 4.688 1.00 0.00 H new ATOM 0 HB2 MET A 66 -5.016 -1.543 3.021 1.00 0.00 H new ATOM 0 HB3 MET A 66 -5.727 -3.088 2.598 1.00 0.00 H new ATOM 0 HG2 MET A 66 -7.294 -1.703 1.049 1.00 0.00 H new ATOM 0 HG3 MET A 66 -6.133 -0.409 1.273 1.00 0.00 H new ATOM 0 HE1 MET A 66 -6.040 -1.393 -2.092 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.969 -0.108 -0.863 1.00 0.00 H new ATOM 0 HE3 MET A 66 -4.478 -0.655 -1.666 1.00 0.00 H new ATOM 1015 N VAL A 67 -8.647 -0.370 2.537 1.00 0.00 N ATOM 1016 CA VAL A 67 -9.334 0.876 2.247 1.00 0.00 C ATOM 1017 C VAL A 67 -9.985 1.440 3.503 1.00 0.00 C ATOM 1018 O VAL A 67 -9.809 2.610 3.824 1.00 0.00 O ATOM 1019 CB VAL A 67 -10.392 0.703 1.138 1.00 0.00 C ATOM 1020 CG1 VAL A 67 -11.177 1.989 0.940 1.00 0.00 C ATOM 1021 CG2 VAL A 67 -9.731 0.284 -0.166 1.00 0.00 C ATOM 0 H VAL A 67 -8.951 -1.163 1.973 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.583 1.580 1.889 1.00 0.00 H new ATOM 0 HB VAL A 67 -11.085 -0.080 1.446 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -11.918 1.846 0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.681 2.254 1.869 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -10.496 2.791 0.655 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -10.491 0.166 -0.938 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.017 1.048 -0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.210 -0.663 -0.022 1.00 0.00 H new ATOM 1031 N MET A 68 -10.697 0.597 4.236 1.00 0.00 N ATOM 1032 CA MET A 68 -11.379 1.039 5.446 1.00 0.00 C ATOM 1033 C MET A 68 -10.375 1.366 6.548 1.00 0.00 C ATOM 1034 O MET A 68 -10.642 2.188 7.424 1.00 0.00 O ATOM 1035 CB MET A 68 -12.362 -0.029 5.934 1.00 0.00 C ATOM 1036 CG MET A 68 -13.428 -0.386 4.911 1.00 0.00 C ATOM 1037 SD MET A 68 -14.675 -1.512 5.563 1.00 0.00 S ATOM 1038 CE MET A 68 -15.747 -1.684 4.137 1.00 0.00 C ATOM 0 H MET A 68 -10.818 -0.392 4.017 1.00 0.00 H new ATOM 0 HA MET A 68 -11.936 1.944 5.204 1.00 0.00 H new ATOM 0 HB2 MET A 68 -11.807 -0.929 6.197 1.00 0.00 H new ATOM 0 HB3 MET A 68 -12.847 0.324 6.844 1.00 0.00 H new ATOM 0 HG2 MET A 68 -13.914 0.527 4.567 1.00 0.00 H new ATOM 0 HG3 MET A 68 -12.953 -0.842 4.042 1.00 0.00 H new ATOM 0 HE1 MET A 68 -16.572 -2.354 4.381 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.143 -0.707 3.859 1.00 0.00 H new ATOM 0 HE3 MET A 68 -15.179 -2.096 3.303 1.00 0.00 H new ATOM 1048 N ASP A 69 -9.218 0.725 6.492 1.00 0.00 N ATOM 1049 CA ASP A 69 -8.193 0.910 7.508 1.00 0.00 C ATOM 1050 C ASP A 69 -7.299 2.114 7.226 1.00 0.00 C ATOM 1051 O ASP A 69 -6.717 2.679 8.143 1.00 0.00 O ATOM 1052 CB ASP A 69 -7.342 -0.348 7.644 1.00 0.00 C ATOM 1053 CG ASP A 69 -7.756 -1.187 8.837 1.00 0.00 C ATOM 1054 OD1 ASP A 69 -8.861 -1.773 8.807 1.00 0.00 O ATOM 1055 OD2 ASP A 69 -6.981 -1.260 9.812 1.00 0.00 O ATOM 0 H ASP A 69 -8.965 0.070 5.752 1.00 0.00 H new ATOM 0 HA ASP A 69 -8.713 1.103 8.447 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -7.427 -0.943 6.735 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -6.294 -0.067 7.744 1.00 0.00 H new ATOM 1060 N ILE A 70 -7.132 2.480 5.967 1.00 0.00 N ATOM 1061 CA ILE A 70 -6.372 3.679 5.649 1.00 0.00 C ATOM 1062 C ILE A 70 -7.268 4.921 5.588 1.00 0.00 C ATOM 1063 O ILE A 70 -6.852 6.020 5.953 1.00 0.00 O ATOM 1064 CB ILE A 70 -5.511 3.501 4.372 1.00 0.00 C ATOM 1065 CG1 ILE A 70 -6.329 3.164 3.122 1.00 0.00 C ATOM 1066 CG2 ILE A 70 -4.479 2.416 4.615 1.00 0.00 C ATOM 1067 CD1 ILE A 70 -6.926 4.366 2.432 1.00 0.00 C ATOM 0 H ILE A 70 -7.504 1.977 5.161 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.671 3.842 6.468 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.032 4.461 4.176 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.691 2.633 2.416 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -7.133 2.482 3.400 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.870 2.286 3.720 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.840 2.702 5.450 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -4.984 1.479 4.849 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -7.489 4.041 1.557 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -7.592 4.887 3.120 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -6.128 5.040 2.120 1.00 0.00 H new ATOM 1079 N LEU A 71 -8.511 4.728 5.158 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.486 5.816 5.064 1.00 0.00 C ATOM 1081 C LEU A 71 -9.961 6.270 6.450 1.00 0.00 C ATOM 1082 O LEU A 71 -10.568 7.331 6.591 1.00 0.00 O ATOM 1083 CB LEU A 71 -10.654 5.372 4.155 1.00 0.00 C ATOM 1084 CG LEU A 71 -11.912 6.250 4.133 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -12.629 6.073 2.809 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -12.861 5.881 5.265 1.00 0.00 C ATOM 0 H LEU A 71 -8.872 3.820 4.866 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.012 6.688 4.613 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.277 5.300 3.135 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.951 4.367 4.457 1.00 0.00 H new ATOM 0 HG LEU A 71 -11.604 7.288 4.262 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -13.523 6.697 2.793 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.967 6.367 1.995 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -12.914 5.028 2.686 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.743 6.520 5.223 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -13.163 4.839 5.162 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -12.357 6.020 6.222 1.00 0.00 H new ATOM 1098 N ARG A 72 -9.651 5.487 7.480 1.00 0.00 N ATOM 1099 CA ARG A 72 -10.018 5.850 8.849 1.00 0.00 C ATOM 1100 C ARG A 72 -9.247 7.082 9.320 1.00 0.00 C ATOM 1101 O ARG A 72 -9.539 7.639 10.379 1.00 0.00 O ATOM 1102 CB ARG A 72 -9.788 4.674 9.811 1.00 0.00 C ATOM 1103 CG ARG A 72 -8.350 4.161 9.866 1.00 0.00 C ATOM 1104 CD ARG A 72 -7.438 5.028 10.724 1.00 0.00 C ATOM 1105 NE ARG A 72 -7.830 5.020 12.130 1.00 0.00 N ATOM 1106 CZ ARG A 72 -7.642 6.046 12.957 1.00 0.00 C ATOM 1107 NH1 ARG A 72 -7.069 7.160 12.513 1.00 0.00 N ATOM 1108 NH2 ARG A 72 -8.021 5.957 14.224 1.00 0.00 N ATOM 0 H ARG A 72 -9.150 4.603 7.396 1.00 0.00 H new ATOM 0 HA ARG A 72 -11.081 6.093 8.851 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -10.088 4.979 10.813 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -10.441 3.852 9.519 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -8.348 3.144 10.258 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -7.949 4.113 8.854 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -6.411 4.673 10.633 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -7.456 6.052 10.350 1.00 0.00 H new ATOM 0 HE ARG A 72 -8.274 4.180 12.500 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -6.774 7.228 11.539 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -6.925 7.947 13.146 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -8.458 5.101 14.567 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -7.876 6.744 14.856 1.00 0.00 H new ATOM 1122 N GLU A 73 -8.249 7.482 8.539 1.00 0.00 N ATOM 1123 CA GLU A 73 -7.454 8.658 8.848 1.00 0.00 C ATOM 1124 C GLU A 73 -8.356 9.887 8.988 1.00 0.00 C ATOM 1125 O GLU A 73 -9.211 10.150 8.140 1.00 0.00 O ATOM 1126 CB GLU A 73 -6.406 8.886 7.759 1.00 0.00 C ATOM 1127 CG GLU A 73 -5.499 10.073 8.035 1.00 0.00 C ATOM 1128 CD GLU A 73 -4.770 9.960 9.360 1.00 0.00 C ATOM 1129 OE1 GLU A 73 -5.358 10.333 10.397 1.00 0.00 O ATOM 1130 OE2 GLU A 73 -3.613 9.508 9.372 1.00 0.00 O ATOM 0 H GLU A 73 -7.973 7.003 7.682 1.00 0.00 H new ATOM 0 HA GLU A 73 -6.941 8.496 9.796 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -5.796 7.988 7.658 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -6.911 9.038 6.805 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.769 10.162 7.230 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -6.093 10.987 8.029 1.00 0.00 H new ATOM 1137 N ARG A 74 -8.151 10.621 10.076 1.00 0.00 N ATOM 1138 CA ARG A 74 -8.967 11.785 10.397 1.00 0.00 C ATOM 1139 C ARG A 74 -8.750 12.899 9.378 1.00 0.00 C ATOM 1140 O ARG A 74 -9.711 13.516 8.913 1.00 0.00 O ATOM 1141 CB ARG A 74 -8.638 12.290 11.809 1.00 0.00 C ATOM 1142 CG ARG A 74 -7.160 12.578 12.017 1.00 0.00 C ATOM 1143 CD ARG A 74 -6.867 13.150 13.392 1.00 0.00 C ATOM 1144 NE ARG A 74 -5.438 13.427 13.549 1.00 0.00 N ATOM 1145 CZ ARG A 74 -4.916 14.220 14.481 1.00 0.00 C ATOM 1146 NH1 ARG A 74 -5.695 14.811 15.379 1.00 0.00 N ATOM 1147 NH2 ARG A 74 -3.603 14.412 14.522 1.00 0.00 N ATOM 0 H ARG A 74 -7.417 10.427 10.758 1.00 0.00 H new ATOM 0 HA ARG A 74 -10.015 11.487 10.361 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -9.209 13.198 12.004 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.962 11.547 12.538 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.591 11.658 11.881 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.819 13.279 11.255 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.437 14.067 13.538 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.192 12.447 14.159 1.00 0.00 H new ATOM 0 HE ARG A 74 -4.795 12.979 12.896 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -6.703 14.659 15.358 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -5.285 15.417 16.090 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -2.999 13.952 13.841 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -3.198 15.019 15.235 1.00 0.00 H new ATOM 1161 N ASP A 75 -7.484 13.137 9.044 1.00 0.00 N ATOM 1162 CA ASP A 75 -7.083 14.165 8.088 1.00 0.00 C ATOM 1163 C ASP A 75 -5.566 14.284 8.075 1.00 0.00 C ATOM 1164 O ASP A 75 -4.983 15.013 8.881 1.00 0.00 O ATOM 1165 CB ASP A 75 -7.704 15.525 8.431 1.00 0.00 C ATOM 1166 CG ASP A 75 -7.357 16.594 7.416 1.00 0.00 C ATOM 1167 OD1 ASP A 75 -7.182 16.260 6.228 1.00 0.00 O ATOM 1168 OD2 ASP A 75 -7.278 17.784 7.799 1.00 0.00 O ATOM 0 H ASP A 75 -6.699 12.615 9.434 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.443 13.870 7.102 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.788 15.422 8.489 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -7.361 15.839 9.417 1.00 0.00 H new ATOM 1173 N GLN A 76 -4.935 13.546 7.171 1.00 0.00 N ATOM 1174 CA GLN A 76 -3.481 13.496 7.082 1.00 0.00 C ATOM 1175 C GLN A 76 -3.062 12.640 5.890 1.00 0.00 C ATOM 1176 O GLN A 76 -2.397 13.115 4.970 1.00 0.00 O ATOM 1177 CB GLN A 76 -2.881 12.924 8.375 1.00 0.00 C ATOM 1178 CG GLN A 76 -1.358 12.888 8.404 1.00 0.00 C ATOM 1179 CD GLN A 76 -0.723 14.265 8.493 1.00 0.00 C ATOM 1180 OE1 GLN A 76 -1.270 15.257 8.007 1.00 0.00 O ATOM 1181 NE2 GLN A 76 0.443 14.333 9.117 1.00 0.00 N ATOM 0 H GLN A 76 -5.414 12.967 6.481 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.106 14.510 6.945 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.234 13.518 9.218 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.258 11.912 8.519 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -1.032 12.290 9.255 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.997 12.387 7.506 1.00 0.00 H new ATOM 0 HE21 GLN A 76 0.863 13.489 9.506 1.00 0.00 H new ATOM 0 HE22 GLN A 76 0.921 15.229 9.209 1.00 0.00 H new ATOM 1190 N GLY A 77 -3.465 11.378 5.911 1.00 0.00 N ATOM 1191 CA GLY A 77 -3.159 10.484 4.815 1.00 0.00 C ATOM 1192 C GLY A 77 -3.281 9.028 5.214 1.00 0.00 C ATOM 1193 O GLY A 77 -2.749 8.617 6.243 1.00 0.00 O ATOM 0 H GLY A 77 -4.000 10.957 6.670 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -3.832 10.689 3.983 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.146 10.679 4.461 1.00 0.00 H new ATOM 1197 N GLY A 78 -3.981 8.248 4.405 1.00 0.00 N ATOM 1198 CA GLY A 78 -4.150 6.835 4.692 1.00 0.00 C ATOM 1199 C GLY A 78 -3.024 5.996 4.118 1.00 0.00 C ATOM 1200 O GLY A 78 -3.259 5.122 3.286 1.00 0.00 O ATOM 0 H GLY A 78 -4.438 8.568 3.551 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -4.197 6.688 5.771 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -5.101 6.494 4.282 1.00 0.00 H new ATOM 1204 N PHE A 79 -1.794 6.299 4.533 1.00 0.00 N ATOM 1205 CA PHE A 79 -0.595 5.568 4.099 1.00 0.00 C ATOM 1206 C PHE A 79 -0.423 5.579 2.575 1.00 0.00 C ATOM 1207 O PHE A 79 0.431 4.875 2.037 1.00 0.00 O ATOM 1208 CB PHE A 79 -0.618 4.121 4.614 1.00 0.00 C ATOM 1209 CG PHE A 79 -0.761 4.013 6.108 1.00 0.00 C ATOM 1210 CD1 PHE A 79 0.350 4.100 6.935 1.00 0.00 C ATOM 1211 CD2 PHE A 79 -2.006 3.822 6.685 1.00 0.00 C ATOM 1212 CE1 PHE A 79 0.216 4.004 8.308 1.00 0.00 C ATOM 1213 CE2 PHE A 79 -2.145 3.727 8.055 1.00 0.00 C ATOM 1214 CZ PHE A 79 -1.033 3.815 8.869 1.00 0.00 C ATOM 0 H PHE A 79 -1.596 7.061 5.182 1.00 0.00 H new ATOM 0 HA PHE A 79 0.260 6.088 4.531 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -1.443 3.589 4.140 1.00 0.00 H new ATOM 0 HB3 PHE A 79 0.301 3.621 4.309 1.00 0.00 H new ATOM 0 HD1 PHE A 79 1.329 4.244 6.502 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.880 3.746 6.054 1.00 0.00 H new ATOM 0 HE1 PHE A 79 1.087 4.077 8.942 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.123 3.584 8.490 1.00 0.00 H new ATOM 0 HZ PHE A 79 -1.139 3.736 9.941 1.00 0.00 H new ATOM 1224 N GLY A 80 -1.242 6.374 1.887 1.00 0.00 N ATOM 1225 CA GLY A 80 -1.161 6.481 0.440 1.00 0.00 C ATOM 1226 C GLY A 80 -1.625 5.225 -0.277 1.00 0.00 C ATOM 1227 O GLY A 80 -1.522 5.139 -1.499 1.00 0.00 O ATOM 0 H GLY A 80 -1.967 6.951 2.313 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.766 7.325 0.110 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -0.131 6.696 0.155 1.00 0.00 H new ATOM 1231 N ASP A 81 -2.173 4.280 0.481 1.00 0.00 N ATOM 1232 CA ASP A 81 -2.520 2.951 -0.031 1.00 0.00 C ATOM 1233 C ASP A 81 -2.908 2.041 1.122 1.00 0.00 C ATOM 1234 O ASP A 81 -4.051 1.596 1.224 1.00 0.00 O ATOM 1235 CB ASP A 81 -1.331 2.351 -0.799 1.00 0.00 C ATOM 1236 CG ASP A 81 -1.250 0.838 -0.736 1.00 0.00 C ATOM 1237 OD1 ASP A 81 -1.964 0.164 -1.496 1.00 0.00 O ATOM 1238 OD2 ASP A 81 -0.431 0.325 0.067 1.00 0.00 O ATOM 0 H ASP A 81 -2.391 4.411 1.469 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.365 3.044 -0.713 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -1.396 2.657 -1.843 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -0.407 2.770 -0.401 1.00 0.00 H new ATOM 1243 N ARG A 82 -1.939 1.818 2.002 1.00 0.00 N ATOM 1244 CA ARG A 82 -2.051 0.880 3.109 1.00 0.00 C ATOM 1245 C ARG A 82 -0.663 0.594 3.636 1.00 0.00 C ATOM 1246 O ARG A 82 -0.439 0.601 4.846 1.00 0.00 O ATOM 1247 CB ARG A 82 -2.699 -0.435 2.664 1.00 0.00 C ATOM 1248 CG ARG A 82 -2.542 -1.568 3.661 1.00 0.00 C ATOM 1249 CD ARG A 82 -2.647 -2.919 2.972 1.00 0.00 C ATOM 1250 NE ARG A 82 -2.838 -2.792 1.521 1.00 0.00 N ATOM 1251 CZ ARG A 82 -1.867 -2.546 0.632 1.00 0.00 C ATOM 1252 NH1 ARG A 82 -0.610 -2.409 1.025 1.00 0.00 N ATOM 1253 NH2 ARG A 82 -2.173 -2.409 -0.646 1.00 0.00 N ATOM 0 H ARG A 82 -1.037 2.294 1.964 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.680 1.323 3.881 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.761 -0.264 2.488 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.263 -0.739 1.712 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.577 -1.485 4.162 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.309 -1.488 4.431 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -1.743 -3.495 3.168 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -3.480 -3.478 3.398 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.786 -2.900 1.162 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -0.373 -2.491 2.014 1.00 0.00 H new ATOM 0 HH12 ARG A 82 0.121 -2.222 0.339 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -3.143 -2.491 -0.950 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -1.439 -2.222 -1.329 1.00 0.00 H new ATOM 1267 N ASN A 83 0.266 0.359 2.711 1.00 0.00 N ATOM 1268 CA ASN A 83 1.647 0.041 3.060 1.00 0.00 C ATOM 1269 C ASN A 83 1.672 -1.198 3.951 1.00 0.00 C ATOM 1270 O ASN A 83 1.918 -1.109 5.154 1.00 0.00 O ATOM 1271 CB ASN A 83 2.308 1.235 3.766 1.00 0.00 C ATOM 1272 CG ASN A 83 3.809 1.068 3.964 1.00 0.00 C ATOM 1273 OD1 ASN A 83 4.323 -0.043 4.070 1.00 0.00 O ATOM 1274 ND2 ASN A 83 4.522 2.182 4.022 1.00 0.00 N ATOM 0 H ASN A 83 0.084 0.383 1.708 1.00 0.00 H new ATOM 0 HA ASN A 83 2.212 -0.166 2.151 1.00 0.00 H new ATOM 0 HB2 ASN A 83 2.124 2.138 3.184 1.00 0.00 H new ATOM 0 HB3 ASN A 83 1.835 1.380 4.737 1.00 0.00 H new ATOM 0 HD21 ASN A 83 5.532 2.135 4.159 1.00 0.00 H new ATOM 0 HD22 ASN A 83 4.062 3.088 3.930 1.00 0.00 H new ATOM 1281 N GLU A 84 1.401 -2.353 3.349 1.00 0.00 N ATOM 1282 CA GLU A 84 1.327 -3.599 4.096 1.00 0.00 C ATOM 1283 C GLU A 84 1.216 -4.793 3.134 1.00 0.00 C ATOM 1284 O GLU A 84 2.149 -5.560 3.004 1.00 0.00 O ATOM 1285 CB GLU A 84 0.161 -3.549 5.098 1.00 0.00 C ATOM 1286 CG GLU A 84 0.343 -4.468 6.299 1.00 0.00 C ATOM 1287 CD GLU A 84 -0.766 -4.346 7.326 1.00 0.00 C ATOM 1288 OE1 GLU A 84 -1.245 -3.222 7.562 1.00 0.00 O ATOM 1289 OE2 GLU A 84 -1.166 -5.384 7.902 1.00 0.00 O ATOM 0 H GLU A 84 1.230 -2.449 2.348 1.00 0.00 H new ATOM 0 HA GLU A 84 2.244 -3.731 4.670 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.041 -2.525 5.451 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.761 -3.818 4.582 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.395 -5.500 5.952 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.297 -4.244 6.777 1.00 0.00 H new ATOM 1296 N TYR A 85 0.098 -4.935 2.433 1.00 0.00 N ATOM 1297 CA TYR A 85 -0.052 -6.032 1.464 1.00 0.00 C ATOM 1298 C TYR A 85 -0.683 -5.555 0.154 1.00 0.00 C ATOM 1299 O TYR A 85 0.005 -5.029 -0.713 1.00 0.00 O ATOM 1300 CB TYR A 85 -0.858 -7.201 2.047 1.00 0.00 C ATOM 1301 CG TYR A 85 -1.913 -6.812 3.063 1.00 0.00 C ATOM 1302 CD1 TYR A 85 -1.587 -6.670 4.402 1.00 0.00 C ATOM 1303 CD2 TYR A 85 -3.235 -6.595 2.686 1.00 0.00 C ATOM 1304 CE1 TYR A 85 -2.540 -6.324 5.335 1.00 0.00 C ATOM 1305 CE2 TYR A 85 -4.195 -6.245 3.618 1.00 0.00 C ATOM 1306 CZ TYR A 85 -3.838 -6.109 4.941 1.00 0.00 C ATOM 1307 OH TYR A 85 -4.782 -5.759 5.877 1.00 0.00 O ATOM 0 H TYR A 85 -0.711 -4.319 2.509 1.00 0.00 H new ATOM 0 HA TYR A 85 0.954 -6.388 1.244 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -1.343 -7.732 1.228 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -0.166 -7.901 2.515 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -0.568 -6.833 4.720 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -3.516 -6.702 1.649 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -2.267 -6.222 6.375 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -5.217 -6.080 3.310 1.00 0.00 H new ATOM 0 HH TYR A 85 -5.395 -6.510 6.020 1.00 0.00 H new ATOM 1317 N GLY A 86 -1.996 -5.713 0.032 1.00 0.00 N ATOM 1318 CA GLY A 86 -2.679 -5.365 -1.201 1.00 0.00 C ATOM 1319 C GLY A 86 -2.625 -6.511 -2.198 1.00 0.00 C ATOM 1320 O GLY A 86 -1.658 -6.636 -2.945 1.00 0.00 O ATOM 0 H GLY A 86 -2.602 -6.077 0.767 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.718 -5.114 -0.987 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -2.220 -4.478 -1.637 1.00 0.00 H new ATOM 1324 N SER A 87 -3.650 -7.374 -2.174 1.00 0.00 N ATOM 1325 CA SER A 87 -3.695 -8.581 -3.019 1.00 0.00 C ATOM 1326 C SER A 87 -2.588 -9.567 -2.624 1.00 0.00 C ATOM 1327 O SER A 87 -2.381 -10.585 -3.286 1.00 0.00 O ATOM 1328 CB SER A 87 -3.549 -8.217 -4.509 1.00 0.00 C ATOM 1329 OG SER A 87 -3.635 -9.365 -5.342 1.00 0.00 O ATOM 0 H SER A 87 -4.467 -7.259 -1.574 1.00 0.00 H new ATOM 0 HA SER A 87 -4.665 -9.053 -2.863 1.00 0.00 H new ATOM 0 HB2 SER A 87 -4.327 -7.506 -4.788 1.00 0.00 H new ATOM 0 HB3 SER A 87 -2.592 -7.721 -4.670 1.00 0.00 H new ATOM 0 HG SER A 87 -3.186 -10.119 -4.907 1.00 0.00 H new ATOM 1335 N ARG A 88 -1.882 -9.260 -1.550 1.00 0.00 N ATOM 1336 CA ARG A 88 -0.724 -10.031 -1.139 1.00 0.00 C ATOM 1337 C ARG A 88 -0.777 -10.346 0.331 1.00 0.00 C ATOM 1338 O ARG A 88 -1.642 -9.845 1.044 1.00 0.00 O ATOM 1339 CB ARG A 88 0.561 -9.260 -1.416 1.00 0.00 C ATOM 1340 CG ARG A 88 0.831 -9.015 -2.890 1.00 0.00 C ATOM 1341 CD ARG A 88 1.320 -10.280 -3.575 1.00 0.00 C ATOM 1342 NE ARG A 88 0.280 -11.304 -3.692 1.00 0.00 N ATOM 1343 CZ ARG A 88 0.415 -12.437 -4.389 1.00 0.00 C ATOM 1344 NH1 ARG A 88 1.514 -12.661 -5.102 1.00 0.00 N ATOM 1345 NH2 ARG A 88 -0.552 -13.346 -4.377 1.00 0.00 N ATOM 0 H ARG A 88 -2.095 -8.471 -0.940 1.00 0.00 H new ATOM 0 HA ARG A 88 -0.735 -10.958 -1.712 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.514 -8.300 -0.902 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.401 -9.809 -0.990 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -0.079 -8.663 -3.376 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.576 -8.227 -3.000 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.689 -10.029 -4.569 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.162 -10.687 -3.016 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.605 -11.143 -3.211 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.261 -11.966 -5.120 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.611 -13.527 -5.631 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -1.400 -13.181 -3.835 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.447 -14.210 -4.910 1.00 0.00 H new ATOM 1359 N ILE A 89 0.158 -11.193 0.730 1.00 0.00 N ATOM 1360 CA ILE A 89 0.484 -11.509 2.115 1.00 0.00 C ATOM 1361 C ILE A 89 -0.680 -11.382 3.103 1.00 0.00 C ATOM 1362 O ILE A 89 -1.331 -12.373 3.437 1.00 0.00 O ATOM 1363 CB ILE A 89 1.667 -10.658 2.602 1.00 0.00 C ATOM 1364 CG1 ILE A 89 2.799 -10.686 1.570 1.00 0.00 C ATOM 1365 CG2 ILE A 89 2.162 -11.186 3.941 1.00 0.00 C ATOM 1366 CD1 ILE A 89 3.373 -12.068 1.337 1.00 0.00 C ATOM 0 H ILE A 89 0.739 -11.705 0.066 1.00 0.00 H new ATOM 0 HA ILE A 89 0.748 -12.566 2.101 1.00 0.00 H new ATOM 0 HB ILE A 89 1.337 -9.627 2.726 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.427 -10.292 0.624 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.597 -10.021 1.900 1.00 0.00 H new ATOM 0 HG21 ILE A 89 3.001 -10.580 4.283 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.356 -11.136 4.673 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.484 -12.221 3.827 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.169 -12.011 0.595 1.00 0.00 H new ATOM 0 HD12 ILE A 89 3.776 -12.457 2.272 1.00 0.00 H new ATOM 0 HD13 ILE A 89 2.588 -12.732 0.976 1.00 0.00 H new ATOM 1378 N GLY A 90 -0.925 -10.165 3.574 1.00 0.00 N ATOM 1379 CA GLY A 90 -1.891 -9.959 4.633 1.00 0.00 C ATOM 1380 C GLY A 90 -1.242 -10.136 5.994 1.00 0.00 C ATOM 1381 O GLY A 90 -1.851 -10.645 6.935 1.00 0.00 O ATOM 0 H GLY A 90 -0.470 -9.316 3.239 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -2.316 -8.958 4.555 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -2.715 -10.664 4.523 1.00 0.00 H new ATOM 1385 N GLY A 91 0.011 -9.700 6.081 1.00 0.00 N ATOM 1386 CA GLY A 91 0.793 -9.827 7.298 1.00 0.00 C ATOM 1387 C GLY A 91 2.198 -9.287 7.100 1.00 0.00 C ATOM 1388 O GLY A 91 3.068 -9.968 6.552 1.00 0.00 O ATOM 0 H GLY A 91 0.508 -9.251 5.311 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.303 -9.287 8.108 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.841 -10.874 7.596 1.00 0.00 H new ATOM 1392 N GLY A 92 2.419 -8.058 7.525 1.00 0.00 N ATOM 1393 CA GLY A 92 3.678 -7.401 7.273 1.00 0.00 C ATOM 1394 C GLY A 92 3.494 -6.256 6.310 1.00 0.00 C ATOM 1395 O GLY A 92 2.504 -6.225 5.592 1.00 0.00 O ATOM 0 H GLY A 92 1.742 -7.499 8.045 1.00 0.00 H new ATOM 0 HA2 GLY A 92 4.096 -7.032 8.210 1.00 0.00 H new ATOM 0 HA3 GLY A 92 4.392 -8.116 6.865 1.00 0.00 H new ATOM 1399 N ILE A 93 4.449 -5.342 6.266 1.00 0.00 N ATOM 1400 CA ILE A 93 4.306 -4.117 5.494 1.00 0.00 C ATOM 1401 C ILE A 93 4.900 -4.237 4.090 1.00 0.00 C ATOM 1402 O ILE A 93 5.759 -5.085 3.829 1.00 0.00 O ATOM 1403 CB ILE A 93 4.964 -2.931 6.213 1.00 0.00 C ATOM 1404 CG1 ILE A 93 6.447 -3.202 6.426 1.00 0.00 C ATOM 1405 CG2 ILE A 93 4.246 -2.650 7.526 1.00 0.00 C ATOM 1406 CD1 ILE A 93 7.183 -2.035 7.034 1.00 0.00 C ATOM 0 H ILE A 93 5.338 -5.426 6.759 1.00 0.00 H new ATOM 0 HA ILE A 93 3.234 -3.944 5.399 1.00 0.00 H new ATOM 0 HB ILE A 93 4.878 -2.040 5.592 1.00 0.00 H new ATOM 0 HG12 ILE A 93 6.561 -4.072 7.073 1.00 0.00 H new ATOM 0 HG13 ILE A 93 6.905 -3.453 5.469 1.00 0.00 H new ATOM 0 HG21 ILE A 93 4.721 -1.807 8.027 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.202 -2.411 7.326 1.00 0.00 H new ATOM 0 HG23 ILE A 93 4.301 -3.530 8.166 1.00 0.00 H new ATOM 0 HD11 ILE A 93 8.234 -2.293 7.159 1.00 0.00 H new ATOM 0 HD12 ILE A 93 7.098 -1.169 6.377 1.00 0.00 H new ATOM 0 HD13 ILE A 93 6.749 -1.798 8.005 1.00 0.00 H new ATOM 1418 N ASP A 94 4.440 -3.365 3.196 1.00 0.00 N ATOM 1419 CA ASP A 94 4.912 -3.339 1.816 1.00 0.00 C ATOM 1420 C ASP A 94 5.894 -2.193 1.623 1.00 0.00 C ATOM 1421 O ASP A 94 5.500 -1.029 1.598 1.00 0.00 O ATOM 1422 CB ASP A 94 3.748 -3.179 0.833 1.00 0.00 C ATOM 1423 CG ASP A 94 3.464 -4.441 0.041 1.00 0.00 C ATOM 1424 OD1 ASP A 94 3.708 -5.554 0.560 1.00 0.00 O ATOM 1425 OD2 ASP A 94 3.001 -4.319 -1.111 1.00 0.00 O ATOM 0 H ASP A 94 3.733 -2.660 3.407 1.00 0.00 H new ATOM 0 HA ASP A 94 5.407 -4.289 1.615 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.852 -2.892 1.383 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.972 -2.366 0.143 1.00 0.00 H new ATOM 1430 N VAL A 95 7.164 -2.529 1.474 1.00 0.00 N ATOM 1431 CA VAL A 95 8.223 -1.529 1.398 1.00 0.00 C ATOM 1432 C VAL A 95 8.679 -1.280 -0.041 1.00 0.00 C ATOM 1433 O VAL A 95 9.390 -2.091 -0.623 1.00 0.00 O ATOM 1434 CB VAL A 95 9.433 -1.969 2.244 1.00 0.00 C ATOM 1435 CG1 VAL A 95 10.667 -1.156 1.891 1.00 0.00 C ATOM 1436 CG2 VAL A 95 9.112 -1.856 3.724 1.00 0.00 C ATOM 0 H VAL A 95 7.491 -3.492 1.403 1.00 0.00 H new ATOM 0 HA VAL A 95 7.812 -0.598 1.789 1.00 0.00 H new ATOM 0 HB VAL A 95 9.648 -3.013 2.019 1.00 0.00 H new ATOM 0 HG11 VAL A 95 11.507 -1.486 2.502 1.00 0.00 H new ATOM 0 HG12 VAL A 95 10.907 -1.298 0.837 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.473 -0.100 2.080 1.00 0.00 H new ATOM 0 HG21 VAL A 95 9.976 -2.170 4.309 1.00 0.00 H new ATOM 0 HG22 VAL A 95 8.867 -0.822 3.965 1.00 0.00 H new ATOM 0 HG23 VAL A 95 8.261 -2.495 3.962 1.00 0.00 H new ATOM 1446 N PRO A 96 8.284 -0.146 -0.634 1.00 0.00 N ATOM 1447 CA PRO A 96 8.719 0.217 -1.983 1.00 0.00 C ATOM 1448 C PRO A 96 10.167 0.702 -2.003 1.00 0.00 C ATOM 1449 O PRO A 96 10.475 1.799 -1.529 1.00 0.00 O ATOM 1450 CB PRO A 96 7.769 1.354 -2.363 1.00 0.00 C ATOM 1451 CG PRO A 96 7.348 1.962 -1.066 1.00 0.00 C ATOM 1452 CD PRO A 96 7.386 0.861 -0.041 1.00 0.00 C ATOM 0 HA PRO A 96 8.688 -0.629 -2.670 1.00 0.00 H new ATOM 0 HB2 PRO A 96 8.266 2.087 -2.998 1.00 0.00 H new ATOM 0 HB3 PRO A 96 6.910 0.980 -2.920 1.00 0.00 H new ATOM 0 HG2 PRO A 96 8.016 2.776 -0.785 1.00 0.00 H new ATOM 0 HG3 PRO A 96 6.346 2.384 -1.143 1.00 0.00 H new ATOM 0 HD2 PRO A 96 7.765 1.219 0.916 1.00 0.00 H new ATOM 0 HD3 PRO A 96 6.393 0.452 0.142 1.00 0.00 H new ATOM 1460 N VAL A 97 11.054 -0.116 -2.546 1.00 0.00 N ATOM 1461 CA VAL A 97 12.464 0.229 -2.617 1.00 0.00 C ATOM 1462 C VAL A 97 12.839 0.705 -4.012 1.00 0.00 C ATOM 1463 O VAL A 97 12.535 0.042 -5.005 1.00 0.00 O ATOM 1464 CB VAL A 97 13.371 -0.963 -2.257 1.00 0.00 C ATOM 1465 CG1 VAL A 97 14.829 -0.534 -2.270 1.00 0.00 C ATOM 1466 CG2 VAL A 97 13.003 -1.543 -0.905 1.00 0.00 C ATOM 0 H VAL A 97 10.821 -1.026 -2.945 1.00 0.00 H new ATOM 0 HA VAL A 97 12.618 1.027 -1.891 1.00 0.00 H new ATOM 0 HB VAL A 97 13.223 -1.741 -3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 97 15.461 -1.385 -2.014 1.00 0.00 H new ATOM 0 HG12 VAL A 97 15.093 -0.172 -3.264 1.00 0.00 H new ATOM 0 HG13 VAL A 97 14.980 0.263 -1.542 1.00 0.00 H new ATOM 0 HG21 VAL A 97 13.660 -2.383 -0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 97 13.115 -0.777 -0.138 1.00 0.00 H new ATOM 0 HG23 VAL A 97 11.969 -1.887 -0.926 1.00 0.00 H new ATOM 1476 N PRO A 98 13.476 1.886 -4.085 1.00 0.00 N ATOM 1477 CA PRO A 98 14.076 2.414 -5.313 1.00 0.00 C ATOM 1478 C PRO A 98 14.812 1.345 -6.117 1.00 0.00 C ATOM 1479 O PRO A 98 15.598 0.565 -5.572 1.00 0.00 O ATOM 1480 CB PRO A 98 15.064 3.443 -4.771 1.00 0.00 C ATOM 1481 CG PRO A 98 14.431 3.960 -3.530 1.00 0.00 C ATOM 1482 CD PRO A 98 13.630 2.824 -2.957 1.00 0.00 C ATOM 0 HA PRO A 98 13.332 2.813 -6.002 1.00 0.00 H new ATOM 0 HB2 PRO A 98 16.033 2.989 -4.562 1.00 0.00 H new ATOM 0 HB3 PRO A 98 15.236 4.244 -5.490 1.00 0.00 H new ATOM 0 HG2 PRO A 98 15.186 4.299 -2.821 1.00 0.00 H new ATOM 0 HG3 PRO A 98 13.791 4.815 -3.748 1.00 0.00 H new ATOM 0 HD2 PRO A 98 14.145 2.357 -2.118 1.00 0.00 H new ATOM 0 HD3 PRO A 98 12.663 3.165 -2.587 1.00 0.00 H new ATOM 1490 N ARG A 99 14.542 1.329 -7.422 1.00 0.00 N ATOM 1491 CA ARG A 99 15.117 0.348 -8.349 1.00 0.00 C ATOM 1492 C ARG A 99 16.637 0.257 -8.237 1.00 0.00 C ATOM 1493 O ARG A 99 17.214 -0.816 -8.395 1.00 0.00 O ATOM 1494 CB ARG A 99 14.745 0.698 -9.792 1.00 0.00 C ATOM 1495 CG ARG A 99 15.161 2.102 -10.212 1.00 0.00 C ATOM 1496 CD ARG A 99 14.991 2.311 -11.705 1.00 0.00 C ATOM 1497 NE ARG A 99 15.217 3.700 -12.099 1.00 0.00 N ATOM 1498 CZ ARG A 99 15.095 4.149 -13.350 1.00 0.00 C ATOM 1499 NH1 ARG A 99 14.802 3.314 -14.337 1.00 0.00 N ATOM 1500 NH2 ARG A 99 15.274 5.435 -13.614 1.00 0.00 N ATOM 0 H ARG A 99 13.916 1.998 -7.870 1.00 0.00 H new ATOM 0 HA ARG A 99 14.700 -0.621 -8.074 1.00 0.00 H new ATOM 0 HB2 ARG A 99 15.210 -0.024 -10.463 1.00 0.00 H new ATOM 0 HB3 ARG A 99 13.667 0.597 -9.914 1.00 0.00 H new ATOM 0 HG2 ARG A 99 14.564 2.836 -9.671 1.00 0.00 H new ATOM 0 HG3 ARG A 99 16.202 2.272 -9.936 1.00 0.00 H new ATOM 0 HD2 ARG A 99 15.686 1.666 -12.242 1.00 0.00 H new ATOM 0 HD3 ARG A 99 13.985 2.011 -12.000 1.00 0.00 H new ATOM 0 HE ARG A 99 15.484 4.366 -11.374 1.00 0.00 H new ATOM 0 HH11 ARG A 99 14.668 2.322 -14.143 1.00 0.00 H new ATOM 0 HH12 ARG A 99 14.710 3.664 -15.291 1.00 0.00 H new ATOM 0 HH21 ARG A 99 15.505 6.083 -12.861 1.00 0.00 H new ATOM 0 HH22 ARG A 99 15.181 5.777 -14.570 1.00 0.00 H new ATOM 1514 N HIS A 100 17.277 1.385 -7.971 1.00 0.00 N ATOM 1515 CA HIS A 100 18.734 1.447 -7.895 1.00 0.00 C ATOM 1516 C HIS A 100 19.225 1.238 -6.466 1.00 0.00 C ATOM 1517 O HIS A 100 20.418 1.352 -6.191 1.00 0.00 O ATOM 1518 CB HIS A 100 19.245 2.794 -8.432 1.00 0.00 C ATOM 1519 CG HIS A 100 18.534 3.986 -7.862 1.00 0.00 C ATOM 1520 ND1 HIS A 100 18.609 4.343 -6.536 1.00 0.00 N ATOM 1521 CD2 HIS A 100 17.693 4.877 -8.440 1.00 0.00 C ATOM 1522 CE1 HIS A 100 17.842 5.390 -6.319 1.00 0.00 C ATOM 1523 NE2 HIS A 100 17.276 5.741 -7.458 1.00 0.00 N ATOM 0 H HIS A 100 16.810 2.276 -7.803 1.00 0.00 H new ATOM 0 HA HIS A 100 19.131 0.642 -8.514 1.00 0.00 H new ATOM 0 HB2 HIS A 100 20.310 2.880 -8.214 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.139 2.805 -9.517 1.00 0.00 H new ATOM 0 HD2 HIS A 100 17.404 4.903 -9.480 1.00 0.00 H new ATOM 0 HE1 HIS A 100 17.700 5.880 -5.367 1.00 0.00 H new ATOM 0 HE2 HIS A 100 16.635 6.524 -7.587 1.00 0.00 H new ATOM 1532 N SER A 101 18.307 0.944 -5.557 1.00 0.00 N ATOM 1533 CA SER A 101 18.657 0.813 -4.151 1.00 0.00 C ATOM 1534 C SER A 101 18.283 -0.559 -3.593 1.00 0.00 C ATOM 1535 O SER A 101 18.795 -0.966 -2.552 1.00 0.00 O ATOM 1536 CB SER A 101 17.966 1.908 -3.345 1.00 0.00 C ATOM 1537 OG SER A 101 18.251 3.189 -3.882 1.00 0.00 O ATOM 0 H SER A 101 17.320 0.793 -5.766 1.00 0.00 H new ATOM 0 HA SER A 101 19.739 0.917 -4.067 1.00 0.00 H new ATOM 0 HB2 SER A 101 16.889 1.741 -3.346 1.00 0.00 H new ATOM 0 HB3 SER A 101 18.295 1.863 -2.307 1.00 0.00 H new ATOM 0 HG SER A 101 18.130 3.170 -4.854 1.00 0.00 H new ATOM 1543 N VAL A 102 17.393 -1.270 -4.279 1.00 0.00 N ATOM 1544 CA VAL A 102 16.969 -2.595 -3.833 1.00 0.00 C ATOM 1545 C VAL A 102 18.160 -3.551 -3.733 1.00 0.00 C ATOM 1546 O VAL A 102 18.210 -4.400 -2.842 1.00 0.00 O ATOM 1547 CB VAL A 102 15.872 -3.183 -4.758 1.00 0.00 C ATOM 1548 CG1 VAL A 102 16.391 -3.394 -6.170 1.00 0.00 C ATOM 1549 CG2 VAL A 102 15.315 -4.477 -4.186 1.00 0.00 C ATOM 0 H VAL A 102 16.952 -0.953 -5.143 1.00 0.00 H new ATOM 0 HA VAL A 102 16.539 -2.480 -2.838 1.00 0.00 H new ATOM 0 HB VAL A 102 15.061 -2.457 -4.809 1.00 0.00 H new ATOM 0 HG11 VAL A 102 15.597 -3.807 -6.792 1.00 0.00 H new ATOM 0 HG12 VAL A 102 16.717 -2.440 -6.584 1.00 0.00 H new ATOM 0 HG13 VAL A 102 17.232 -4.087 -6.149 1.00 0.00 H new ATOM 0 HG21 VAL A 102 14.547 -4.869 -4.853 1.00 0.00 H new ATOM 0 HG22 VAL A 102 16.118 -5.207 -4.088 1.00 0.00 H new ATOM 0 HG23 VAL A 102 14.879 -4.284 -3.206 1.00 0.00 H new ATOM 1559 N GLY A 103 19.132 -3.388 -4.624 1.00 0.00 N ATOM 1560 CA GLY A 103 20.335 -4.194 -4.564 1.00 0.00 C ATOM 1561 C GLY A 103 21.154 -3.891 -3.326 1.00 0.00 C ATOM 1562 O GLY A 103 21.836 -4.762 -2.793 1.00 0.00 O ATOM 0 H GLY A 103 19.107 -2.711 -5.387 1.00 0.00 H new ATOM 0 HA2 GLY A 103 20.066 -5.250 -4.572 1.00 0.00 H new ATOM 0 HA3 GLY A 103 20.939 -4.012 -5.453 1.00 0.00 H new ATOM 1566 N VAL A 104 21.067 -2.654 -2.858 1.00 0.00 N ATOM 1567 CA VAL A 104 21.772 -2.233 -1.656 1.00 0.00 C ATOM 1568 C VAL A 104 21.090 -2.817 -0.424 1.00 0.00 C ATOM 1569 O VAL A 104 21.743 -3.153 0.564 1.00 0.00 O ATOM 1570 CB VAL A 104 21.818 -0.694 -1.545 1.00 0.00 C ATOM 1571 CG1 VAL A 104 22.628 -0.258 -0.332 1.00 0.00 C ATOM 1572 CG2 VAL A 104 22.387 -0.084 -2.819 1.00 0.00 C ATOM 0 H VAL A 104 20.511 -1.920 -3.296 1.00 0.00 H new ATOM 0 HA VAL A 104 22.796 -2.602 -1.718 1.00 0.00 H new ATOM 0 HB VAL A 104 20.798 -0.333 -1.415 1.00 0.00 H new ATOM 0 HG11 VAL A 104 22.644 0.831 -0.278 1.00 0.00 H new ATOM 0 HG12 VAL A 104 22.173 -0.660 0.573 1.00 0.00 H new ATOM 0 HG13 VAL A 104 23.648 -0.632 -0.422 1.00 0.00 H new ATOM 0 HG21 VAL A 104 22.412 1.001 -2.723 1.00 0.00 H new ATOM 0 HG22 VAL A 104 23.398 -0.457 -2.981 1.00 0.00 H new ATOM 0 HG23 VAL A 104 21.759 -0.359 -3.666 1.00 0.00 H new ATOM 1582 N VAL A 105 19.767 -2.943 -0.502 1.00 0.00 N ATOM 1583 CA VAL A 105 18.986 -3.562 0.564 1.00 0.00 C ATOM 1584 C VAL A 105 19.366 -5.032 0.703 1.00 0.00 C ATOM 1585 O VAL A 105 19.410 -5.576 1.802 1.00 0.00 O ATOM 1586 CB VAL A 105 17.469 -3.446 0.289 1.00 0.00 C ATOM 1587 CG1 VAL A 105 16.659 -4.059 1.423 1.00 0.00 C ATOM 1588 CG2 VAL A 105 17.077 -1.992 0.084 1.00 0.00 C ATOM 0 H VAL A 105 19.213 -2.623 -1.296 1.00 0.00 H new ATOM 0 HA VAL A 105 19.209 -3.034 1.491 1.00 0.00 H new ATOM 0 HB VAL A 105 17.248 -4.000 -0.623 1.00 0.00 H new ATOM 0 HG11 VAL A 105 15.596 -3.964 1.203 1.00 0.00 H new ATOM 0 HG12 VAL A 105 16.915 -5.114 1.525 1.00 0.00 H new ATOM 0 HG13 VAL A 105 16.885 -3.539 2.354 1.00 0.00 H new ATOM 0 HG21 VAL A 105 16.006 -1.928 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL A 105 17.320 -1.420 0.980 1.00 0.00 H new ATOM 0 HG23 VAL A 105 17.624 -1.584 -0.766 1.00 0.00 H new ATOM 1598 N ILE A 106 19.648 -5.662 -0.428 1.00 0.00 N ATOM 1599 CA ILE A 106 20.089 -7.049 -0.448 1.00 0.00 C ATOM 1600 C ILE A 106 21.544 -7.148 0.005 1.00 0.00 C ATOM 1601 O ILE A 106 21.901 -7.988 0.833 1.00 0.00 O ATOM 1602 CB ILE A 106 19.944 -7.650 -1.865 1.00 0.00 C ATOM 1603 CG1 ILE A 106 18.500 -7.527 -2.355 1.00 0.00 C ATOM 1604 CG2 ILE A 106 20.382 -9.108 -1.885 1.00 0.00 C ATOM 1605 CD1 ILE A 106 17.513 -8.347 -1.554 1.00 0.00 C ATOM 0 H ILE A 106 19.579 -5.231 -1.350 1.00 0.00 H new ATOM 0 HA ILE A 106 19.459 -7.615 0.239 1.00 0.00 H new ATOM 0 HB ILE A 106 20.592 -7.087 -2.537 1.00 0.00 H new ATOM 0 HG12 ILE A 106 18.202 -6.479 -2.319 1.00 0.00 H new ATOM 0 HG13 ILE A 106 18.453 -7.836 -3.399 1.00 0.00 H new ATOM 0 HG21 ILE A 106 20.270 -9.508 -2.893 1.00 0.00 H new ATOM 0 HG22 ILE A 106 21.426 -9.178 -1.580 1.00 0.00 H new ATOM 0 HG23 ILE A 106 19.763 -9.683 -1.196 1.00 0.00 H new ATOM 0 HD11 ILE A 106 16.511 -8.209 -1.960 1.00 0.00 H new ATOM 0 HD12 ILE A 106 17.785 -9.401 -1.610 1.00 0.00 H new ATOM 0 HD13 ILE A 106 17.530 -8.023 -0.513 1.00 0.00 H new ATOM 1617 N GLY A 107 22.372 -6.268 -0.537 1.00 0.00 N ATOM 1618 CA GLY A 107 23.784 -6.270 -0.225 1.00 0.00 C ATOM 1619 C GLY A 107 24.612 -6.596 -1.447 1.00 0.00 C ATOM 1620 O GLY A 107 24.458 -5.964 -2.491 1.00 0.00 O ATOM 0 H GLY A 107 22.085 -5.544 -1.196 1.00 0.00 H new ATOM 0 HA2 GLY A 107 24.075 -5.295 0.165 1.00 0.00 H new ATOM 0 HA3 GLY A 107 23.985 -7.000 0.559 1.00 0.00 H new ATOM 1624 N ARG A 108 25.483 -7.579 -1.326 1.00 0.00 N ATOM 1625 CA ARG A 108 26.242 -8.065 -2.464 1.00 0.00 C ATOM 1626 C ARG A 108 25.606 -9.342 -2.986 1.00 0.00 C ATOM 1627 O ARG A 108 25.079 -9.381 -4.101 1.00 0.00 O ATOM 1628 CB ARG A 108 27.699 -8.318 -2.075 1.00 0.00 C ATOM 1629 CG ARG A 108 28.487 -7.057 -1.746 1.00 0.00 C ATOM 1630 CD ARG A 108 28.728 -6.195 -2.980 1.00 0.00 C ATOM 1631 NE ARG A 108 27.529 -5.476 -3.415 1.00 0.00 N ATOM 1632 CZ ARG A 108 27.167 -5.334 -4.692 1.00 0.00 C ATOM 1633 NH1 ARG A 108 27.864 -5.929 -5.651 1.00 0.00 N ATOM 1634 NH2 ARG A 108 26.102 -4.611 -5.011 1.00 0.00 N ATOM 0 H ARG A 108 25.684 -8.059 -0.448 1.00 0.00 H new ATOM 0 HA ARG A 108 26.229 -7.308 -3.248 1.00 0.00 H new ATOM 0 HB2 ARG A 108 27.722 -8.983 -1.211 1.00 0.00 H new ATOM 0 HB3 ARG A 108 28.196 -8.840 -2.893 1.00 0.00 H new ATOM 0 HG2 ARG A 108 27.946 -6.477 -0.998 1.00 0.00 H new ATOM 0 HG3 ARG A 108 29.444 -7.333 -1.304 1.00 0.00 H new ATOM 0 HD2 ARG A 108 29.519 -5.476 -2.766 1.00 0.00 H new ATOM 0 HD3 ARG A 108 29.083 -6.826 -3.795 1.00 0.00 H new ATOM 0 HE ARG A 108 26.934 -5.058 -2.699 1.00 0.00 H new ATOM 0 HH11 ARG A 108 28.678 -6.496 -5.413 1.00 0.00 H new ATOM 0 HH12 ARG A 108 27.586 -5.820 -6.626 1.00 0.00 H new ATOM 0 HH21 ARG A 108 25.554 -4.159 -4.279 1.00 0.00 H new ATOM 0 HH22 ARG A 108 25.831 -4.506 -5.989 1.00 0.00 H new ATOM 1648 N SER A 109 25.640 -10.382 -2.167 1.00 0.00 N ATOM 1649 CA SER A 109 25.020 -11.645 -2.521 1.00 0.00 C ATOM 1650 C SER A 109 23.724 -11.844 -1.736 1.00 0.00 C ATOM 1651 O SER A 109 22.857 -12.621 -2.140 1.00 0.00 O ATOM 1652 CB SER A 109 25.990 -12.797 -2.261 1.00 0.00 C ATOM 1653 OG SER A 109 27.225 -12.572 -2.923 1.00 0.00 O ATOM 0 H SER A 109 26.091 -10.374 -1.252 1.00 0.00 H new ATOM 0 HA SER A 109 24.775 -11.630 -3.583 1.00 0.00 H new ATOM 0 HB2 SER A 109 26.160 -12.901 -1.189 1.00 0.00 H new ATOM 0 HB3 SER A 109 25.552 -13.733 -2.607 1.00 0.00 H new ATOM 0 HG SER A 109 27.833 -13.319 -2.743 1.00 0.00 H new ATOM 1659 N GLY A 110 23.598 -11.135 -0.620 1.00 0.00 N ATOM 1660 CA GLY A 110 22.395 -11.219 0.188 1.00 0.00 C ATOM 1661 C GLY A 110 22.697 -11.145 1.670 1.00 0.00 C ATOM 1662 O GLY A 110 22.248 -11.985 2.447 1.00 0.00 O ATOM 0 H GLY A 110 24.311 -10.501 -0.259 1.00 0.00 H new ATOM 0 HA2 GLY A 110 21.719 -10.409 -0.084 1.00 0.00 H new ATOM 0 HA3 GLY A 110 21.877 -12.153 -0.030 1.00 0.00 H new ATOM 1666 N GLU A 111 23.474 -10.145 2.061 1.00 0.00 N ATOM 1667 CA GLU A 111 23.879 -9.988 3.452 1.00 0.00 C ATOM 1668 C GLU A 111 22.925 -9.053 4.182 1.00 0.00 C ATOM 1669 O GLU A 111 22.304 -9.437 5.172 1.00 0.00 O ATOM 1670 CB GLU A 111 25.306 -9.434 3.557 1.00 0.00 C ATOM 1671 CG GLU A 111 26.357 -10.244 2.808 1.00 0.00 C ATOM 1672 CD GLU A 111 26.213 -10.136 1.306 1.00 0.00 C ATOM 1673 OE1 GLU A 111 25.991 -9.016 0.808 1.00 0.00 O ATOM 1674 OE2 GLU A 111 26.278 -11.175 0.621 1.00 0.00 O ATOM 0 H GLU A 111 23.838 -9.428 1.433 1.00 0.00 H new ATOM 0 HA GLU A 111 23.850 -10.975 3.914 1.00 0.00 H new ATOM 0 HB2 GLU A 111 25.314 -8.413 3.177 1.00 0.00 H new ATOM 0 HB3 GLU A 111 25.586 -9.384 4.609 1.00 0.00 H new ATOM 0 HG2 GLU A 111 27.350 -9.902 3.100 1.00 0.00 H new ATOM 0 HG3 GLU A 111 26.281 -11.291 3.102 1.00 0.00 H new ATOM 1681 N MET A 112 22.804 -7.834 3.663 1.00 0.00 N ATOM 1682 CA MET A 112 22.017 -6.780 4.304 1.00 0.00 C ATOM 1683 C MET A 112 20.557 -7.191 4.455 1.00 0.00 C ATOM 1684 O MET A 112 19.914 -6.879 5.455 1.00 0.00 O ATOM 1685 CB MET A 112 22.111 -5.485 3.491 1.00 0.00 C ATOM 1686 CG MET A 112 21.447 -4.286 4.157 1.00 0.00 C ATOM 1687 SD MET A 112 22.104 -3.959 5.805 1.00 0.00 S ATOM 1688 CE MET A 112 21.088 -2.568 6.301 1.00 0.00 C ATOM 0 H MET A 112 23.246 -7.548 2.790 1.00 0.00 H new ATOM 0 HA MET A 112 22.428 -6.614 5.300 1.00 0.00 H new ATOM 0 HB2 MET A 112 23.162 -5.254 3.315 1.00 0.00 H new ATOM 0 HB3 MET A 112 21.652 -5.646 2.516 1.00 0.00 H new ATOM 0 HG2 MET A 112 21.587 -3.404 3.532 1.00 0.00 H new ATOM 0 HG3 MET A 112 20.373 -4.461 4.226 1.00 0.00 H new ATOM 0 HE1 MET A 112 21.694 -1.858 6.864 1.00 0.00 H new ATOM 0 HE2 MET A 112 20.684 -2.078 5.415 1.00 0.00 H new ATOM 0 HE3 MET A 112 20.268 -2.921 6.926 1.00 0.00 H new ATOM 1698 N ILE A 113 20.050 -7.912 3.465 1.00 0.00 N ATOM 1699 CA ILE A 113 18.660 -8.342 3.470 1.00 0.00 C ATOM 1700 C ILE A 113 18.400 -9.329 4.610 1.00 0.00 C ATOM 1701 O ILE A 113 17.317 -9.356 5.195 1.00 0.00 O ATOM 1702 CB ILE A 113 18.268 -8.968 2.108 1.00 0.00 C ATOM 1703 CG1 ILE A 113 16.757 -9.188 2.025 1.00 0.00 C ATOM 1704 CG2 ILE A 113 19.012 -10.274 1.858 1.00 0.00 C ATOM 1705 CD1 ILE A 113 15.966 -7.901 1.974 1.00 0.00 C ATOM 0 H ILE A 113 20.581 -8.211 2.648 1.00 0.00 H new ATOM 0 HA ILE A 113 18.038 -7.462 3.631 1.00 0.00 H new ATOM 0 HB ILE A 113 18.559 -8.264 1.329 1.00 0.00 H new ATOM 0 HG12 ILE A 113 16.531 -9.780 1.138 1.00 0.00 H new ATOM 0 HG13 ILE A 113 16.434 -9.771 2.888 1.00 0.00 H new ATOM 0 HG21 ILE A 113 18.712 -10.685 0.894 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.086 -10.086 1.854 1.00 0.00 H new ATOM 0 HG23 ILE A 113 18.771 -10.987 2.647 1.00 0.00 H new ATOM 0 HD11 ILE A 113 14.902 -8.130 1.916 1.00 0.00 H new ATOM 0 HD12 ILE A 113 16.163 -7.317 2.873 1.00 0.00 H new ATOM 0 HD13 ILE A 113 16.262 -7.327 1.096 1.00 0.00 H new ATOM 1717 N LYS A 114 19.413 -10.122 4.942 1.00 0.00 N ATOM 1718 CA LYS A 114 19.307 -11.075 6.036 1.00 0.00 C ATOM 1719 C LYS A 114 19.662 -10.405 7.357 1.00 0.00 C ATOM 1720 O LYS A 114 19.298 -10.887 8.431 1.00 0.00 O ATOM 1721 CB LYS A 114 20.202 -12.290 5.776 1.00 0.00 C ATOM 1722 CG LYS A 114 19.782 -13.086 4.548 1.00 0.00 C ATOM 1723 CD LYS A 114 20.641 -14.324 4.344 1.00 0.00 C ATOM 1724 CE LYS A 114 20.114 -15.167 3.192 1.00 0.00 C ATOM 1725 NZ LYS A 114 20.891 -16.419 3.001 1.00 0.00 N ATOM 0 H LYS A 114 20.316 -10.122 4.468 1.00 0.00 H new ATOM 0 HA LYS A 114 18.276 -11.424 6.099 1.00 0.00 H new ATOM 0 HB2 LYS A 114 21.232 -11.956 5.651 1.00 0.00 H new ATOM 0 HB3 LYS A 114 20.183 -12.942 6.649 1.00 0.00 H new ATOM 0 HG2 LYS A 114 18.738 -13.383 4.649 1.00 0.00 H new ATOM 0 HG3 LYS A 114 19.848 -12.450 3.665 1.00 0.00 H new ATOM 0 HD2 LYS A 114 21.670 -14.028 4.142 1.00 0.00 H new ATOM 0 HD3 LYS A 114 20.654 -14.917 5.258 1.00 0.00 H new ATOM 0 HE2 LYS A 114 19.069 -15.416 3.377 1.00 0.00 H new ATOM 0 HE3 LYS A 114 20.144 -14.581 2.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 20.492 -16.957 2.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 21.883 -16.184 2.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 20.842 -16.994 3.866 1.00 0.00 H new ATOM 1739 N LYS A 115 20.368 -9.285 7.268 1.00 0.00 N ATOM 1740 CA LYS A 115 20.667 -8.479 8.440 1.00 0.00 C ATOM 1741 C LYS A 115 19.392 -7.871 9.001 1.00 0.00 C ATOM 1742 O LYS A 115 19.237 -7.753 10.211 1.00 0.00 O ATOM 1743 CB LYS A 115 21.676 -7.381 8.103 1.00 0.00 C ATOM 1744 CG LYS A 115 23.087 -7.904 7.895 1.00 0.00 C ATOM 1745 CD LYS A 115 24.040 -6.811 7.433 1.00 0.00 C ATOM 1746 CE LYS A 115 24.091 -5.641 8.405 1.00 0.00 C ATOM 1747 NZ LYS A 115 24.495 -6.061 9.774 1.00 0.00 N ATOM 0 H LYS A 115 20.744 -8.916 6.395 1.00 0.00 H new ATOM 0 HA LYS A 115 21.109 -9.127 9.196 1.00 0.00 H new ATOM 0 HB2 LYS A 115 21.351 -6.863 7.200 1.00 0.00 H new ATOM 0 HB3 LYS A 115 21.684 -6.645 8.907 1.00 0.00 H new ATOM 0 HG2 LYS A 115 23.454 -8.335 8.826 1.00 0.00 H new ATOM 0 HG3 LYS A 115 23.071 -8.706 7.157 1.00 0.00 H new ATOM 0 HD2 LYS A 115 25.040 -7.229 7.318 1.00 0.00 H new ATOM 0 HD3 LYS A 115 23.730 -6.452 6.452 1.00 0.00 H new ATOM 0 HE2 LYS A 115 24.793 -4.894 8.035 1.00 0.00 H new ATOM 0 HE3 LYS A 115 23.112 -5.164 8.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 24.614 -5.220 10.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 23.760 -6.675 10.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 25.394 -6.582 9.726 1.00 0.00 H new ATOM 1761 N ILE A 116 18.469 -7.505 8.118 1.00 0.00 N ATOM 1762 CA ILE A 116 17.171 -6.999 8.544 1.00 0.00 C ATOM 1763 C ILE A 116 16.425 -8.085 9.314 1.00 0.00 C ATOM 1764 O ILE A 116 15.767 -7.816 10.323 1.00 0.00 O ATOM 1765 CB ILE A 116 16.305 -6.539 7.349 1.00 0.00 C ATOM 1766 CG1 ILE A 116 17.105 -5.615 6.423 1.00 0.00 C ATOM 1767 CG2 ILE A 116 15.054 -5.827 7.843 1.00 0.00 C ATOM 1768 CD1 ILE A 116 17.592 -4.345 7.092 1.00 0.00 C ATOM 0 H ILE A 116 18.596 -7.549 7.107 1.00 0.00 H new ATOM 0 HA ILE A 116 17.351 -6.133 9.182 1.00 0.00 H new ATOM 0 HB ILE A 116 16.008 -7.423 6.784 1.00 0.00 H new ATOM 0 HG12 ILE A 116 17.964 -6.162 6.035 1.00 0.00 H new ATOM 0 HG13 ILE A 116 16.484 -5.348 5.568 1.00 0.00 H new ATOM 0 HG21 ILE A 116 14.455 -5.509 6.989 1.00 0.00 H new ATOM 0 HG22 ILE A 116 14.470 -6.506 8.464 1.00 0.00 H new ATOM 0 HG23 ILE A 116 15.340 -4.954 8.430 1.00 0.00 H new ATOM 0 HD11 ILE A 116 18.149 -3.745 6.372 1.00 0.00 H new ATOM 0 HD12 ILE A 116 16.737 -3.775 7.456 1.00 0.00 H new ATOM 0 HD13 ILE A 116 18.241 -4.601 7.930 1.00 0.00 H new ATOM 1780 N GLN A 117 16.566 -9.321 8.842 1.00 0.00 N ATOM 1781 CA GLN A 117 15.950 -10.476 9.487 1.00 0.00 C ATOM 1782 C GLN A 117 16.539 -10.694 10.879 1.00 0.00 C ATOM 1783 O GLN A 117 15.845 -11.127 11.796 1.00 0.00 O ATOM 1784 CB GLN A 117 16.161 -11.735 8.640 1.00 0.00 C ATOM 1785 CG GLN A 117 15.656 -11.609 7.211 1.00 0.00 C ATOM 1786 CD GLN A 117 15.904 -12.861 6.392 1.00 0.00 C ATOM 1787 OE1 GLN A 117 16.865 -13.593 6.628 1.00 0.00 O ATOM 1788 NE2 GLN A 117 15.039 -13.114 5.422 1.00 0.00 N ATOM 0 H GLN A 117 17.107 -9.549 8.008 1.00 0.00 H new ATOM 0 HA GLN A 117 14.882 -10.280 9.581 1.00 0.00 H new ATOM 0 HB2 GLN A 117 17.225 -11.973 8.619 1.00 0.00 H new ATOM 0 HB3 GLN A 117 15.656 -12.573 9.121 1.00 0.00 H new ATOM 0 HG2 GLN A 117 14.587 -11.394 7.225 1.00 0.00 H new ATOM 0 HG3 GLN A 117 16.145 -10.762 6.730 1.00 0.00 H new ATOM 0 HE21 GLN A 117 14.256 -12.481 5.259 1.00 0.00 H new ATOM 0 HE22 GLN A 117 15.156 -13.942 4.837 1.00 0.00 H new ATOM 1797 N ASN A 118 17.821 -10.391 11.024 1.00 0.00 N ATOM 1798 CA ASN A 118 18.517 -10.572 12.292 1.00 0.00 C ATOM 1799 C ASN A 118 18.270 -9.399 13.230 1.00 0.00 C ATOM 1800 O ASN A 118 18.097 -9.576 14.434 1.00 0.00 O ATOM 1801 CB ASN A 118 20.019 -10.732 12.044 1.00 0.00 C ATOM 1802 CG ASN A 118 20.817 -10.883 13.326 1.00 0.00 C ATOM 1803 OD1 ASN A 118 20.958 -11.986 13.851 1.00 0.00 O ATOM 1804 ND2 ASN A 118 21.364 -9.783 13.827 1.00 0.00 N ATOM 0 H ASN A 118 18.404 -10.017 10.275 1.00 0.00 H new ATOM 0 HA ASN A 118 18.128 -11.473 12.766 1.00 0.00 H new ATOM 0 HB2 ASN A 118 20.187 -11.605 11.413 1.00 0.00 H new ATOM 0 HB3 ASN A 118 20.386 -9.865 11.494 1.00 0.00 H new ATOM 0 HD21 ASN A 118 21.925 -9.834 14.677 1.00 0.00 H new ATOM 0 HD22 ASN A 118 21.224 -8.886 13.362 1.00 0.00 H new ATOM 1811 N ASP A 119 18.236 -8.202 12.668 1.00 0.00 N ATOM 1812 CA ASP A 119 18.141 -6.987 13.463 1.00 0.00 C ATOM 1813 C ASP A 119 16.712 -6.750 13.928 1.00 0.00 C ATOM 1814 O ASP A 119 16.451 -6.643 15.126 1.00 0.00 O ATOM 1815 CB ASP A 119 18.616 -5.785 12.645 1.00 0.00 C ATOM 1816 CG ASP A 119 18.977 -4.595 13.510 1.00 0.00 C ATOM 1817 OD1 ASP A 119 18.071 -3.990 14.120 1.00 0.00 O ATOM 1818 OD2 ASP A 119 20.178 -4.254 13.582 1.00 0.00 O ATOM 0 H ASP A 119 18.273 -8.045 11.661 1.00 0.00 H new ATOM 0 HA ASP A 119 18.778 -7.108 14.339 1.00 0.00 H new ATOM 0 HB2 ASP A 119 19.484 -6.074 12.052 1.00 0.00 H new ATOM 0 HB3 ASP A 119 17.833 -5.495 11.944 1.00 0.00 H new ATOM 1823 N ALA A 120 15.783 -6.696 12.981 1.00 0.00 N ATOM 1824 CA ALA A 120 14.395 -6.402 13.302 1.00 0.00 C ATOM 1825 C ALA A 120 13.614 -7.670 13.623 1.00 0.00 C ATOM 1826 O ALA A 120 12.626 -7.625 14.350 1.00 0.00 O ATOM 1827 CB ALA A 120 13.726 -5.649 12.162 1.00 0.00 C ATOM 0 H ALA A 120 15.966 -6.851 11.990 1.00 0.00 H new ATOM 0 HA ALA A 120 14.393 -5.771 14.191 1.00 0.00 H new ATOM 0 HB1 ALA A 120 12.689 -5.440 12.424 1.00 0.00 H new ATOM 0 HB2 ALA A 120 14.253 -4.711 11.987 1.00 0.00 H new ATOM 0 HB3 ALA A 120 13.757 -6.256 11.257 1.00 0.00 H new ATOM 1833 N GLY A 121 14.073 -8.797 13.089 1.00 0.00 N ATOM 1834 CA GLY A 121 13.389 -10.061 13.309 1.00 0.00 C ATOM 1835 C GLY A 121 12.260 -10.273 12.324 1.00 0.00 C ATOM 1836 O GLY A 121 11.244 -10.884 12.648 1.00 0.00 O ATOM 0 H GLY A 121 14.908 -8.859 12.506 1.00 0.00 H new ATOM 0 HA2 GLY A 121 14.104 -10.880 13.223 1.00 0.00 H new ATOM 0 HA3 GLY A 121 12.994 -10.088 14.325 1.00 0.00 H new ATOM 1840 N VAL A 122 12.443 -9.766 11.115 1.00 0.00 N ATOM 1841 CA VAL A 122 11.402 -9.804 10.099 1.00 0.00 C ATOM 1842 C VAL A 122 11.806 -10.680 8.920 1.00 0.00 C ATOM 1843 O VAL A 122 12.975 -11.018 8.752 1.00 0.00 O ATOM 1844 CB VAL A 122 11.088 -8.387 9.587 1.00 0.00 C ATOM 1845 CG1 VAL A 122 10.484 -7.539 10.694 1.00 0.00 C ATOM 1846 CG2 VAL A 122 12.344 -7.729 9.036 1.00 0.00 C ATOM 0 H VAL A 122 13.309 -9.320 10.812 1.00 0.00 H new ATOM 0 HA VAL A 122 10.514 -10.229 10.566 1.00 0.00 H new ATOM 0 HB VAL A 122 10.359 -8.468 8.781 1.00 0.00 H new ATOM 0 HG11 VAL A 122 10.269 -6.541 10.312 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.560 -8.000 11.043 1.00 0.00 H new ATOM 0 HG13 VAL A 122 11.189 -7.466 11.522 1.00 0.00 H new ATOM 0 HG21 VAL A 122 12.103 -6.728 8.678 1.00 0.00 H new ATOM 0 HG22 VAL A 122 13.095 -7.662 9.823 1.00 0.00 H new ATOM 0 HG23 VAL A 122 12.735 -8.325 8.211 1.00 0.00 H new ATOM 1856 N ARG A 123 10.829 -11.047 8.106 1.00 0.00 N ATOM 1857 CA ARG A 123 11.082 -11.824 6.907 1.00 0.00 C ATOM 1858 C ARG A 123 10.850 -10.943 5.686 1.00 0.00 C ATOM 1859 O ARG A 123 10.219 -9.896 5.795 1.00 0.00 O ATOM 1860 CB ARG A 123 10.159 -13.038 6.873 1.00 0.00 C ATOM 1861 CG ARG A 123 10.763 -14.244 6.178 1.00 0.00 C ATOM 1862 CD ARG A 123 11.963 -14.783 6.945 1.00 0.00 C ATOM 1863 NE ARG A 123 11.623 -15.121 8.327 1.00 0.00 N ATOM 1864 CZ ARG A 123 12.497 -15.564 9.230 1.00 0.00 C ATOM 1865 NH1 ARG A 123 13.745 -15.851 8.876 1.00 0.00 N ATOM 1866 NH2 ARG A 123 12.104 -15.763 10.480 1.00 0.00 N ATOM 0 H ARG A 123 9.847 -10.816 8.257 1.00 0.00 H new ATOM 0 HA ARG A 123 12.114 -12.176 6.904 1.00 0.00 H new ATOM 0 HB2 ARG A 123 9.896 -13.312 7.895 1.00 0.00 H new ATOM 0 HB3 ARG A 123 9.232 -12.765 6.368 1.00 0.00 H new ATOM 0 HG2 ARG A 123 10.010 -15.026 6.082 1.00 0.00 H new ATOM 0 HG3 ARG A 123 11.068 -13.969 5.168 1.00 0.00 H new ATOM 0 HD2 ARG A 123 12.348 -15.668 6.440 1.00 0.00 H new ATOM 0 HD3 ARG A 123 12.761 -14.040 6.939 1.00 0.00 H new ATOM 0 HE ARG A 123 10.652 -15.010 8.619 1.00 0.00 H new ATOM 0 HH11 ARG A 123 14.040 -15.733 7.907 1.00 0.00 H new ATOM 0 HH12 ARG A 123 14.408 -16.190 9.573 1.00 0.00 H new ATOM 0 HH21 ARG A 123 11.137 -15.577 10.746 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.768 -16.102 11.176 1.00 0.00 H new ATOM 1880 N ILE A 124 11.348 -11.351 4.528 1.00 0.00 N ATOM 1881 CA ILE A 124 11.250 -10.511 3.341 1.00 0.00 C ATOM 1882 C ILE A 124 10.553 -11.241 2.195 1.00 0.00 C ATOM 1883 O ILE A 124 10.966 -12.329 1.790 1.00 0.00 O ATOM 1884 CB ILE A 124 12.637 -10.023 2.867 1.00 0.00 C ATOM 1885 CG1 ILE A 124 13.361 -9.275 3.995 1.00 0.00 C ATOM 1886 CG2 ILE A 124 12.494 -9.127 1.646 1.00 0.00 C ATOM 1887 CD1 ILE A 124 12.661 -8.006 4.445 1.00 0.00 C ATOM 0 H ILE A 124 11.818 -12.245 4.384 1.00 0.00 H new ATOM 0 HA ILE A 124 10.653 -9.645 3.626 1.00 0.00 H new ATOM 0 HB ILE A 124 13.233 -10.894 2.593 1.00 0.00 H new ATOM 0 HG12 ILE A 124 13.466 -9.942 4.850 1.00 0.00 H new ATOM 0 HG13 ILE A 124 14.368 -9.023 3.662 1.00 0.00 H new ATOM 0 HG21 ILE A 124 13.480 -8.791 1.324 1.00 0.00 H new ATOM 0 HG22 ILE A 124 12.019 -9.685 0.839 1.00 0.00 H new ATOM 0 HG23 ILE A 124 11.881 -8.262 1.899 1.00 0.00 H new ATOM 0 HD11 ILE A 124 13.236 -7.537 5.244 1.00 0.00 H new ATOM 0 HD12 ILE A 124 12.580 -7.317 3.604 1.00 0.00 H new ATOM 0 HD13 ILE A 124 11.664 -8.251 4.811 1.00 0.00 H new ATOM 1899 N GLN A 125 9.492 -10.630 1.686 1.00 0.00 N ATOM 1900 CA GLN A 125 8.743 -11.164 0.555 1.00 0.00 C ATOM 1901 C GLN A 125 8.863 -10.229 -0.637 1.00 0.00 C ATOM 1902 O GLN A 125 8.371 -9.105 -0.602 1.00 0.00 O ATOM 1903 CB GLN A 125 7.264 -11.326 0.923 1.00 0.00 C ATOM 1904 CG GLN A 125 6.388 -11.813 -0.225 1.00 0.00 C ATOM 1905 CD GLN A 125 6.593 -13.285 -0.541 1.00 0.00 C ATOM 1906 OE1 GLN A 125 6.919 -14.082 0.340 1.00 0.00 O ATOM 1907 NE2 GLN A 125 6.401 -13.657 -1.797 1.00 0.00 N ATOM 0 H GLN A 125 9.125 -9.749 2.046 1.00 0.00 H new ATOM 0 HA GLN A 125 9.157 -12.139 0.297 1.00 0.00 H new ATOM 0 HB2 GLN A 125 7.182 -12.029 1.752 1.00 0.00 H new ATOM 0 HB3 GLN A 125 6.882 -10.369 1.277 1.00 0.00 H new ATOM 0 HG2 GLN A 125 5.341 -11.643 0.026 1.00 0.00 H new ATOM 0 HG3 GLN A 125 6.603 -11.222 -1.115 1.00 0.00 H new ATOM 0 HE21 GLN A 125 6.131 -12.967 -2.498 1.00 0.00 H new ATOM 0 HE22 GLN A 125 6.523 -14.634 -2.064 1.00 0.00 H new ATOM 1916 N PHE A 126 9.525 -10.674 -1.683 1.00 0.00 N ATOM 1917 CA PHE A 126 9.566 -9.898 -2.903 1.00 0.00 C ATOM 1918 C PHE A 126 8.368 -10.249 -3.770 1.00 0.00 C ATOM 1919 O PHE A 126 8.297 -11.329 -4.359 1.00 0.00 O ATOM 1920 CB PHE A 126 10.880 -10.117 -3.653 1.00 0.00 C ATOM 1921 CG PHE A 126 12.009 -9.295 -3.102 1.00 0.00 C ATOM 1922 CD1 PHE A 126 12.104 -7.949 -3.411 1.00 0.00 C ATOM 1923 CD2 PHE A 126 12.964 -9.860 -2.272 1.00 0.00 C ATOM 1924 CE1 PHE A 126 13.131 -7.180 -2.906 1.00 0.00 C ATOM 1925 CE2 PHE A 126 13.992 -9.094 -1.762 1.00 0.00 C ATOM 1926 CZ PHE A 126 14.075 -7.752 -2.078 1.00 0.00 C ATOM 0 H PHE A 126 10.036 -11.556 -1.714 1.00 0.00 H new ATOM 0 HA PHE A 126 9.516 -8.839 -2.650 1.00 0.00 H new ATOM 0 HB2 PHE A 126 11.148 -11.172 -3.606 1.00 0.00 H new ATOM 0 HB3 PHE A 126 10.738 -9.871 -4.705 1.00 0.00 H new ATOM 0 HD1 PHE A 126 11.365 -7.496 -4.055 1.00 0.00 H new ATOM 0 HD2 PHE A 126 12.903 -10.909 -2.022 1.00 0.00 H new ATOM 0 HE1 PHE A 126 13.196 -6.132 -3.158 1.00 0.00 H new ATOM 0 HE2 PHE A 126 14.732 -9.544 -1.116 1.00 0.00 H new ATOM 0 HZ PHE A 126 14.878 -7.151 -1.677 1.00 0.00 H new ATOM 1936 N LYS A 127 7.410 -9.336 -3.817 1.00 0.00 N ATOM 1937 CA LYS A 127 6.188 -9.551 -4.574 1.00 0.00 C ATOM 1938 C LYS A 127 6.174 -8.691 -5.833 1.00 0.00 C ATOM 1939 O LYS A 127 7.229 -8.267 -6.301 1.00 0.00 O ATOM 1940 CB LYS A 127 4.934 -9.303 -3.712 1.00 0.00 C ATOM 1941 CG LYS A 127 5.119 -8.344 -2.543 1.00 0.00 C ATOM 1942 CD LYS A 127 4.009 -7.306 -2.477 1.00 0.00 C ATOM 1943 CE LYS A 127 4.204 -6.210 -3.512 1.00 0.00 C ATOM 1944 NZ LYS A 127 3.078 -5.236 -3.522 1.00 0.00 N ATOM 0 H LYS A 127 7.456 -8.437 -3.338 1.00 0.00 H new ATOM 0 HA LYS A 127 6.166 -10.597 -4.879 1.00 0.00 H new ATOM 0 HB2 LYS A 127 4.144 -8.916 -4.355 1.00 0.00 H new ATOM 0 HB3 LYS A 127 4.588 -10.260 -3.322 1.00 0.00 H new ATOM 0 HG2 LYS A 127 5.143 -8.909 -1.611 1.00 0.00 H new ATOM 0 HG3 LYS A 127 6.081 -7.841 -2.636 1.00 0.00 H new ATOM 0 HD2 LYS A 127 3.046 -7.791 -2.638 1.00 0.00 H new ATOM 0 HD3 LYS A 127 3.981 -6.865 -1.481 1.00 0.00 H new ATOM 0 HE2 LYS A 127 5.136 -5.683 -3.308 1.00 0.00 H new ATOM 0 HE3 LYS A 127 4.301 -6.660 -4.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 3.222 -4.547 -4.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.182 -5.742 -3.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 3.042 -4.737 -2.610 1.00 0.00 H new ATOM 1958 N GLN A 128 4.987 -8.455 -6.387 1.00 0.00 N ATOM 1959 CA GLN A 128 4.843 -7.706 -7.639 1.00 0.00 C ATOM 1960 C GLN A 128 5.134 -6.205 -7.453 1.00 0.00 C ATOM 1961 O GLN A 128 4.256 -5.360 -7.612 1.00 0.00 O ATOM 1962 CB GLN A 128 3.437 -7.941 -8.224 1.00 0.00 C ATOM 1963 CG GLN A 128 3.116 -7.140 -9.486 1.00 0.00 C ATOM 1964 CD GLN A 128 4.127 -7.328 -10.608 1.00 0.00 C ATOM 1965 OE1 GLN A 128 4.686 -8.521 -10.724 1.00 0.00 O flip ATOM 1966 NE2 GLN A 128 4.386 -6.405 -11.385 1.00 0.00 N flip ATOM 0 H GLN A 128 4.104 -8.773 -5.988 1.00 0.00 H new ATOM 0 HA GLN A 128 5.586 -8.076 -8.346 1.00 0.00 H new ATOM 0 HB2 GLN A 128 3.327 -9.002 -8.448 1.00 0.00 H new ATOM 0 HB3 GLN A 128 2.698 -7.698 -7.461 1.00 0.00 H new ATOM 0 HG2 GLN A 128 2.129 -7.429 -9.847 1.00 0.00 H new ATOM 0 HG3 GLN A 128 3.064 -6.082 -9.230 1.00 0.00 H new ATOM 0 HE21 GLN A 128 3.936 -5.497 -11.266 1.00 0.00 H new ATOM 0 HE22 GLN A 128 5.050 -6.550 -12.146 1.00 0.00 H new ATOM 1975 N ASP A 129 6.382 -5.906 -7.089 1.00 0.00 N ATOM 1976 CA ASP A 129 6.920 -4.542 -7.064 1.00 0.00 C ATOM 1977 C ASP A 129 6.013 -3.543 -6.345 1.00 0.00 C ATOM 1978 O ASP A 129 5.130 -3.923 -5.574 1.00 0.00 O ATOM 1979 CB ASP A 129 7.184 -4.048 -8.489 1.00 0.00 C ATOM 1980 CG ASP A 129 8.296 -4.811 -9.197 1.00 0.00 C ATOM 1981 OD1 ASP A 129 8.290 -6.062 -9.171 1.00 0.00 O ATOM 1982 OD2 ASP A 129 9.187 -4.161 -9.785 1.00 0.00 O ATOM 0 H ASP A 129 7.058 -6.613 -6.799 1.00 0.00 H new ATOM 0 HA ASP A 129 7.851 -4.596 -6.500 1.00 0.00 H new ATOM 0 HB2 ASP A 129 6.267 -4.134 -9.071 1.00 0.00 H new ATOM 0 HB3 ASP A 129 7.443 -2.990 -8.457 1.00 0.00 H new ATOM 1987 N ASP A 130 6.268 -2.259 -6.572 1.00 0.00 N ATOM 1988 CA ASP A 130 5.434 -1.205 -6.011 1.00 0.00 C ATOM 1989 C ASP A 130 4.272 -0.895 -6.945 1.00 0.00 C ATOM 1990 O ASP A 130 3.109 -1.112 -6.598 1.00 0.00 O ATOM 1991 CB ASP A 130 6.245 0.066 -5.762 1.00 0.00 C ATOM 1992 CG ASP A 130 5.372 1.207 -5.282 1.00 0.00 C ATOM 1993 OD1 ASP A 130 5.135 1.302 -4.063 1.00 0.00 O ATOM 1994 OD2 ASP A 130 4.915 2.004 -6.125 1.00 0.00 O ATOM 0 H ASP A 130 7.046 -1.924 -7.141 1.00 0.00 H new ATOM 0 HA ASP A 130 5.045 -1.561 -5.057 1.00 0.00 H new ATOM 0 HB2 ASP A 130 7.019 -0.136 -5.021 1.00 0.00 H new ATOM 0 HB3 ASP A 130 6.753 0.359 -6.681 1.00 0.00 H new ATOM 1999 N GLY A 131 4.590 -0.372 -8.126 1.00 0.00 N ATOM 2000 CA GLY A 131 3.567 -0.129 -9.119 1.00 0.00 C ATOM 2001 C GLY A 131 3.638 1.253 -9.746 1.00 0.00 C ATOM 2002 O GLY A 131 3.602 1.375 -10.970 1.00 0.00 O ATOM 0 H GLY A 131 5.535 -0.114 -8.409 1.00 0.00 H new ATOM 0 HA2 GLY A 131 3.651 -0.879 -9.905 1.00 0.00 H new ATOM 0 HA3 GLY A 131 2.588 -0.259 -8.658 1.00 0.00 H new ATOM 2006 N THR A 132 3.759 2.295 -8.923 1.00 0.00 N ATOM 2007 CA THR A 132 3.700 3.668 -9.427 1.00 0.00 C ATOM 2008 C THR A 132 4.969 4.026 -10.198 1.00 0.00 C ATOM 2009 O THR A 132 5.020 5.043 -10.894 1.00 0.00 O ATOM 2010 CB THR A 132 3.469 4.699 -8.293 1.00 0.00 C ATOM 2011 OG1 THR A 132 3.185 5.992 -8.853 1.00 0.00 O ATOM 2012 CG2 THR A 132 4.685 4.806 -7.383 1.00 0.00 C ATOM 0 H THR A 132 3.897 2.217 -7.915 1.00 0.00 H new ATOM 0 HA THR A 132 2.846 3.713 -10.103 1.00 0.00 H new ATOM 0 HB THR A 132 2.621 4.355 -7.701 1.00 0.00 H new ATOM 0 HG1 THR A 132 3.672 6.097 -9.697 1.00 0.00 H new ATOM 0 HG21 THR A 132 4.489 5.537 -6.599 1.00 0.00 H new ATOM 0 HG22 THR A 132 4.888 3.835 -6.931 1.00 0.00 H new ATOM 0 HG23 THR A 132 5.550 5.122 -7.967 1.00 0.00 H new ATOM 2020 N GLY A 133 5.982 3.184 -10.078 1.00 0.00 N ATOM 2021 CA GLY A 133 7.220 3.407 -10.788 1.00 0.00 C ATOM 2022 C GLY A 133 8.077 2.163 -10.825 1.00 0.00 C ATOM 2023 O GLY A 133 7.563 1.052 -10.687 1.00 0.00 O ATOM 0 H GLY A 133 5.967 2.345 -9.498 1.00 0.00 H new ATOM 0 HA2 GLY A 133 7.002 3.729 -11.806 1.00 0.00 H new ATOM 0 HA3 GLY A 133 7.773 4.215 -10.310 1.00 0.00 H new ATOM 2027 N PRO A 134 9.396 2.319 -10.994 1.00 0.00 N ATOM 2028 CA PRO A 134 10.326 1.193 -11.047 1.00 0.00 C ATOM 2029 C PRO A 134 10.709 0.676 -9.660 1.00 0.00 C ATOM 2030 O PRO A 134 11.605 -0.156 -9.520 1.00 0.00 O ATOM 2031 CB PRO A 134 11.537 1.793 -11.755 1.00 0.00 C ATOM 2032 CG PRO A 134 11.532 3.228 -11.359 1.00 0.00 C ATOM 2033 CD PRO A 134 10.088 3.613 -11.160 1.00 0.00 C ATOM 0 HA PRO A 134 9.898 0.326 -11.550 1.00 0.00 H new ATOM 0 HB2 PRO A 134 12.460 1.300 -11.448 1.00 0.00 H new ATOM 0 HB3 PRO A 134 11.460 1.680 -12.836 1.00 0.00 H new ATOM 0 HG2 PRO A 134 12.103 3.380 -10.443 1.00 0.00 H new ATOM 0 HG3 PRO A 134 11.995 3.845 -12.129 1.00 0.00 H new ATOM 0 HD2 PRO A 134 9.961 4.249 -10.284 1.00 0.00 H new ATOM 0 HD3 PRO A 134 9.700 4.167 -12.015 1.00 0.00 H new ATOM 2041 N GLU A 135 10.018 1.167 -8.639 1.00 0.00 N ATOM 2042 CA GLU A 135 10.279 0.750 -7.272 1.00 0.00 C ATOM 2043 C GLU A 135 9.719 -0.639 -7.006 1.00 0.00 C ATOM 2044 O GLU A 135 8.708 -1.044 -7.590 1.00 0.00 O ATOM 2045 CB GLU A 135 9.698 1.751 -6.276 1.00 0.00 C ATOM 2046 CG GLU A 135 10.702 2.791 -5.804 1.00 0.00 C ATOM 2047 CD GLU A 135 11.257 3.652 -6.922 1.00 0.00 C ATOM 2048 OE1 GLU A 135 12.202 3.212 -7.613 1.00 0.00 O ATOM 2049 OE2 GLU A 135 10.778 4.793 -7.091 1.00 0.00 O ATOM 0 H GLU A 135 9.272 1.856 -8.735 1.00 0.00 H new ATOM 0 HA GLU A 135 11.360 0.716 -7.139 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.850 2.259 -6.736 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.314 1.210 -5.411 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.225 3.434 -5.064 1.00 0.00 H new ATOM 0 HG3 GLU A 135 11.527 2.285 -5.302 1.00 0.00 H new ATOM 2056 N LYS A 136 10.383 -1.358 -6.118 1.00 0.00 N ATOM 2057 CA LYS A 136 10.039 -2.737 -5.828 1.00 0.00 C ATOM 2058 C LYS A 136 9.785 -2.934 -4.343 1.00 0.00 C ATOM 2059 O LYS A 136 10.634 -2.617 -3.514 1.00 0.00 O ATOM 2060 CB LYS A 136 11.172 -3.652 -6.286 1.00 0.00 C ATOM 2061 CG LYS A 136 11.452 -3.552 -7.772 1.00 0.00 C ATOM 2062 CD LYS A 136 12.715 -4.294 -8.159 1.00 0.00 C ATOM 2063 CE LYS A 136 12.886 -4.321 -9.666 1.00 0.00 C ATOM 2064 NZ LYS A 136 11.755 -5.017 -10.339 1.00 0.00 N ATOM 0 H LYS A 136 11.173 -1.003 -5.580 1.00 0.00 H new ATOM 0 HA LYS A 136 9.124 -2.987 -6.366 1.00 0.00 H new ATOM 0 HB2 LYS A 136 12.078 -3.403 -5.734 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.921 -4.683 -6.038 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.607 -3.958 -8.329 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.546 -2.503 -8.054 1.00 0.00 H new ATOM 0 HD2 LYS A 136 13.579 -3.814 -7.699 1.00 0.00 H new ATOM 0 HD3 LYS A 136 12.675 -5.313 -7.775 1.00 0.00 H new ATOM 0 HE2 LYS A 136 12.960 -3.300 -10.042 1.00 0.00 H new ATOM 0 HE3 LYS A 136 13.821 -4.821 -9.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 11.993 -5.180 -11.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 11.581 -5.929 -9.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 10.900 -4.428 -10.278 1.00 0.00 H new ATOM 2078 N ILE A 137 8.601 -3.428 -4.014 1.00 0.00 N ATOM 2079 CA ILE A 137 8.266 -3.757 -2.640 1.00 0.00 C ATOM 2080 C ILE A 137 9.118 -4.904 -2.104 1.00 0.00 C ATOM 2081 O ILE A 137 8.984 -6.053 -2.536 1.00 0.00 O ATOM 2082 CB ILE A 137 6.794 -4.168 -2.476 1.00 0.00 C ATOM 2083 CG1 ILE A 137 5.830 -3.049 -2.890 1.00 0.00 C ATOM 2084 CG2 ILE A 137 6.528 -4.600 -1.045 1.00 0.00 C ATOM 2085 CD1 ILE A 137 5.893 -1.815 -2.022 1.00 0.00 C ATOM 0 H ILE A 137 7.854 -3.610 -4.684 1.00 0.00 H new ATOM 0 HA ILE A 137 8.460 -2.844 -2.077 1.00 0.00 H new ATOM 0 HB ILE A 137 6.612 -5.009 -3.145 1.00 0.00 H new ATOM 0 HG12 ILE A 137 6.045 -2.765 -3.920 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.812 -3.439 -2.872 1.00 0.00 H new ATOM 0 HG21 ILE A 137 5.482 -4.889 -0.941 1.00 0.00 H new ATOM 0 HG22 ILE A 137 7.165 -5.449 -0.797 1.00 0.00 H new ATOM 0 HG23 ILE A 137 6.745 -3.773 -0.369 1.00 0.00 H new ATOM 0 HD11 ILE A 137 5.179 -1.077 -2.387 1.00 0.00 H new ATOM 0 HD12 ILE A 137 5.647 -2.080 -0.994 1.00 0.00 H new ATOM 0 HD13 ILE A 137 6.899 -1.396 -2.058 1.00 0.00 H new ATOM 2097 N ALA A 138 9.987 -4.581 -1.167 1.00 0.00 N ATOM 2098 CA ALA A 138 10.624 -5.576 -0.337 1.00 0.00 C ATOM 2099 C ALA A 138 9.755 -5.761 0.896 1.00 0.00 C ATOM 2100 O ALA A 138 9.904 -5.049 1.886 1.00 0.00 O ATOM 2101 CB ALA A 138 12.036 -5.147 0.044 1.00 0.00 C ATOM 0 H ALA A 138 10.269 -3.622 -0.962 1.00 0.00 H new ATOM 0 HA ALA A 138 10.720 -6.518 -0.877 1.00 0.00 H new ATOM 0 HB1 ALA A 138 12.493 -5.914 0.669 1.00 0.00 H new ATOM 0 HB2 ALA A 138 12.631 -5.012 -0.859 1.00 0.00 H new ATOM 0 HB3 ALA A 138 11.995 -4.207 0.595 1.00 0.00 H new ATOM 2107 N HIS A 139 8.828 -6.701 0.819 1.00 0.00 N ATOM 2108 CA HIS A 139 7.790 -6.828 1.832 1.00 0.00 C ATOM 2109 C HIS A 139 8.361 -7.350 3.135 1.00 0.00 C ATOM 2110 O HIS A 139 8.847 -8.477 3.212 1.00 0.00 O ATOM 2111 CB HIS A 139 6.670 -7.757 1.340 1.00 0.00 C ATOM 2112 CG HIS A 139 5.606 -8.032 2.357 1.00 0.00 C ATOM 2113 ND1 HIS A 139 4.390 -7.395 2.363 1.00 0.00 N ATOM 2114 CD2 HIS A 139 5.574 -8.906 3.392 1.00 0.00 C ATOM 2115 CE1 HIS A 139 3.662 -7.856 3.358 1.00 0.00 C ATOM 2116 NE2 HIS A 139 4.355 -8.776 3.999 1.00 0.00 N ATOM 0 H HIS A 139 8.772 -7.388 0.067 1.00 0.00 H new ATOM 0 HA HIS A 139 7.375 -5.836 2.012 1.00 0.00 H new ATOM 0 HB2 HIS A 139 6.207 -7.314 0.458 1.00 0.00 H new ATOM 0 HB3 HIS A 139 7.110 -8.704 1.027 1.00 0.00 H new ATOM 0 HD1 HIS A 139 4.097 -6.677 1.700 1.00 0.00 H new ATOM 0 HD2 HIS A 139 6.365 -9.581 3.684 1.00 0.00 H new ATOM 0 HE1 HIS A 139 2.662 -7.534 3.608 1.00 0.00 H new ATOM 2125 N ILE A 140 8.287 -6.514 4.150 1.00 0.00 N ATOM 2126 CA ILE A 140 8.681 -6.888 5.490 1.00 0.00 C ATOM 2127 C ILE A 140 7.561 -7.690 6.136 1.00 0.00 C ATOM 2128 O ILE A 140 6.509 -7.158 6.461 1.00 0.00 O ATOM 2129 CB ILE A 140 9.000 -5.639 6.329 1.00 0.00 C ATOM 2130 CG1 ILE A 140 10.246 -4.952 5.774 1.00 0.00 C ATOM 2131 CG2 ILE A 140 9.185 -5.999 7.794 1.00 0.00 C ATOM 2132 CD1 ILE A 140 10.510 -3.595 6.379 1.00 0.00 C ATOM 0 H ILE A 140 7.951 -5.554 4.067 1.00 0.00 H new ATOM 0 HA ILE A 140 9.582 -7.499 5.441 1.00 0.00 H new ATOM 0 HB ILE A 140 8.159 -4.949 6.266 1.00 0.00 H new ATOM 0 HG12 ILE A 140 11.111 -5.592 5.948 1.00 0.00 H new ATOM 0 HG13 ILE A 140 10.141 -4.845 4.694 1.00 0.00 H new ATOM 0 HG21 ILE A 140 9.410 -5.098 8.365 1.00 0.00 H new ATOM 0 HG22 ILE A 140 8.270 -6.452 8.176 1.00 0.00 H new ATOM 0 HG23 ILE A 140 10.008 -6.706 7.894 1.00 0.00 H new ATOM 0 HD11 ILE A 140 11.410 -3.168 5.937 1.00 0.00 H new ATOM 0 HD12 ILE A 140 9.663 -2.938 6.183 1.00 0.00 H new ATOM 0 HD13 ILE A 140 10.648 -3.697 7.455 1.00 0.00 H new ATOM 2144 N MET A 141 7.786 -8.977 6.283 1.00 0.00 N ATOM 2145 CA MET A 141 6.753 -9.887 6.743 1.00 0.00 C ATOM 2146 C MET A 141 6.972 -10.275 8.197 1.00 0.00 C ATOM 2147 O MET A 141 8.065 -10.693 8.583 1.00 0.00 O ATOM 2148 CB MET A 141 6.719 -11.122 5.840 1.00 0.00 C ATOM 2149 CG MET A 141 5.713 -12.181 6.257 1.00 0.00 C ATOM 2150 SD MET A 141 5.210 -13.235 4.881 1.00 0.00 S ATOM 2151 CE MET A 141 6.798 -13.733 4.216 1.00 0.00 C ATOM 0 H MET A 141 8.683 -9.423 6.089 1.00 0.00 H new ATOM 0 HA MET A 141 5.788 -9.383 6.686 1.00 0.00 H new ATOM 0 HB2 MET A 141 6.493 -10.806 4.822 1.00 0.00 H new ATOM 0 HB3 MET A 141 7.712 -11.570 5.822 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.145 -12.798 7.044 1.00 0.00 H new ATOM 0 HG3 MET A 141 4.833 -11.696 6.679 1.00 0.00 H new ATOM 0 HE1 MET A 141 6.646 -14.458 3.416 1.00 0.00 H new ATOM 0 HE2 MET A 141 7.317 -12.860 3.821 1.00 0.00 H new ATOM 0 HE3 MET A 141 7.398 -14.185 5.006 1.00 0.00 H new ATOM 2161 N GLY A 142 5.928 -10.112 8.995 1.00 0.00 N ATOM 2162 CA GLY A 142 5.992 -10.428 10.402 1.00 0.00 C ATOM 2163 C GLY A 142 4.933 -9.670 11.175 1.00 0.00 C ATOM 2164 O GLY A 142 3.924 -9.270 10.598 1.00 0.00 O ATOM 0 H GLY A 142 5.023 -9.760 8.683 1.00 0.00 H new ATOM 0 HA2 GLY A 142 5.855 -11.500 10.545 1.00 0.00 H new ATOM 0 HA3 GLY A 142 6.980 -10.179 10.790 1.00 0.00 H new ATOM 2168 N PRO A 143 5.134 -9.457 12.483 1.00 0.00 N ATOM 2169 CA PRO A 143 4.200 -8.687 13.313 1.00 0.00 C ATOM 2170 C PRO A 143 4.178 -7.210 12.918 1.00 0.00 C ATOM 2171 O PRO A 143 5.231 -6.631 12.656 1.00 0.00 O ATOM 2172 CB PRO A 143 4.751 -8.850 14.739 1.00 0.00 C ATOM 2173 CG PRO A 143 5.734 -9.971 14.661 1.00 0.00 C ATOM 2174 CD PRO A 143 6.273 -9.955 13.261 1.00 0.00 C ATOM 0 HA PRO A 143 3.174 -9.038 13.204 1.00 0.00 H new ATOM 0 HB2 PRO A 143 5.229 -7.932 15.082 1.00 0.00 H new ATOM 0 HB3 PRO A 143 3.952 -9.077 15.445 1.00 0.00 H new ATOM 0 HG2 PRO A 143 6.535 -9.838 15.388 1.00 0.00 H new ATOM 0 HG3 PRO A 143 5.256 -10.925 14.884 1.00 0.00 H new ATOM 0 HD2 PRO A 143 7.142 -9.304 13.169 1.00 0.00 H new ATOM 0 HD3 PRO A 143 6.583 -10.948 12.935 1.00 0.00 H new ATOM 2182 N PRO A 144 2.985 -6.592 12.860 1.00 0.00 N ATOM 2183 CA PRO A 144 2.804 -5.215 12.365 1.00 0.00 C ATOM 2184 C PRO A 144 3.827 -4.217 12.914 1.00 0.00 C ATOM 2185 O PRO A 144 4.525 -3.551 12.143 1.00 0.00 O ATOM 2186 CB PRO A 144 1.398 -4.859 12.848 1.00 0.00 C ATOM 2187 CG PRO A 144 0.680 -6.161 12.894 1.00 0.00 C ATOM 2188 CD PRO A 144 1.705 -7.197 13.273 1.00 0.00 C ATOM 0 HA PRO A 144 2.942 -5.162 11.285 1.00 0.00 H new ATOM 0 HB2 PRO A 144 1.423 -4.385 13.829 1.00 0.00 H new ATOM 0 HB3 PRO A 144 0.910 -4.160 12.169 1.00 0.00 H new ATOM 0 HG2 PRO A 144 -0.131 -6.132 13.622 1.00 0.00 H new ATOM 0 HG3 PRO A 144 0.233 -6.392 11.927 1.00 0.00 H new ATOM 0 HD2 PRO A 144 1.687 -7.405 14.343 1.00 0.00 H new ATOM 0 HD3 PRO A 144 1.526 -8.143 12.762 1.00 0.00 H new ATOM 2196 N ASP A 145 3.932 -4.131 14.239 1.00 0.00 N ATOM 2197 CA ASP A 145 4.836 -3.170 14.878 1.00 0.00 C ATOM 2198 C ASP A 145 6.294 -3.485 14.547 1.00 0.00 C ATOM 2199 O ASP A 145 7.123 -2.581 14.425 1.00 0.00 O ATOM 2200 CB ASP A 145 4.638 -3.155 16.402 1.00 0.00 C ATOM 2201 CG ASP A 145 5.230 -4.371 17.092 1.00 0.00 C ATOM 2202 OD1 ASP A 145 4.543 -5.416 17.169 1.00 0.00 O ATOM 2203 OD2 ASP A 145 6.386 -4.290 17.556 1.00 0.00 O ATOM 0 H ASP A 145 3.405 -4.712 14.891 1.00 0.00 H new ATOM 0 HA ASP A 145 4.594 -2.183 14.485 1.00 0.00 H new ATOM 0 HB2 ASP A 145 5.094 -2.254 16.813 1.00 0.00 H new ATOM 0 HB3 ASP A 145 3.572 -3.102 16.623 1.00 0.00 H new ATOM 2208 N ARG A 146 6.593 -4.770 14.391 1.00 0.00 N ATOM 2209 CA ARG A 146 7.946 -5.218 14.077 1.00 0.00 C ATOM 2210 C ARG A 146 8.271 -4.864 12.629 1.00 0.00 C ATOM 2211 O ARG A 146 9.399 -4.502 12.295 1.00 0.00 O ATOM 2212 CB ARG A 146 8.055 -6.727 14.308 1.00 0.00 C ATOM 2213 CG ARG A 146 9.457 -7.215 14.626 1.00 0.00 C ATOM 2214 CD ARG A 146 9.438 -8.678 15.040 1.00 0.00 C ATOM 2215 NE ARG A 146 10.738 -9.134 15.528 1.00 0.00 N ATOM 2216 CZ ARG A 146 10.923 -10.253 16.231 1.00 0.00 C ATOM 2217 NH1 ARG A 146 9.891 -11.036 16.526 1.00 0.00 N ATOM 2218 NH2 ARG A 146 12.139 -10.584 16.643 1.00 0.00 N ATOM 0 H ARG A 146 5.912 -5.525 14.477 1.00 0.00 H new ATOM 0 HA ARG A 146 8.664 -4.719 14.728 1.00 0.00 H new ATOM 0 HB2 ARG A 146 7.392 -7.005 15.128 1.00 0.00 H new ATOM 0 HB3 ARG A 146 7.697 -7.245 13.418 1.00 0.00 H new ATOM 0 HG2 ARG A 146 10.098 -7.087 13.754 1.00 0.00 H new ATOM 0 HG3 ARG A 146 9.884 -6.611 15.427 1.00 0.00 H new ATOM 0 HD2 ARG A 146 8.689 -8.823 15.819 1.00 0.00 H new ATOM 0 HD3 ARG A 146 9.137 -9.290 14.190 1.00 0.00 H new ATOM 0 HE ARG A 146 11.555 -8.561 15.318 1.00 0.00 H new ATOM 0 HH11 ARG A 146 8.953 -10.783 16.215 1.00 0.00 H new ATOM 0 HH12 ARG A 146 10.036 -11.891 17.064 1.00 0.00 H new ATOM 0 HH21 ARG A 146 12.933 -9.983 16.423 1.00 0.00 H new ATOM 0 HH22 ARG A 146 12.280 -11.439 17.180 1.00 0.00 H new ATOM 2232 N CYS A 147 7.251 -4.965 11.787 1.00 0.00 N ATOM 2233 CA CYS A 147 7.329 -4.552 10.394 1.00 0.00 C ATOM 2234 C CYS A 147 7.646 -3.067 10.297 1.00 0.00 C ATOM 2235 O CYS A 147 8.623 -2.668 9.658 1.00 0.00 O ATOM 2236 CB CYS A 147 6.006 -4.868 9.707 1.00 0.00 C ATOM 2237 SG CYS A 147 5.606 -6.627 9.701 1.00 0.00 S ATOM 0 H CYS A 147 6.340 -5.339 12.054 1.00 0.00 H new ATOM 0 HA CYS A 147 8.131 -5.097 9.896 1.00 0.00 H new ATOM 0 HB2 CYS A 147 5.206 -4.322 10.207 1.00 0.00 H new ATOM 0 HB3 CYS A 147 6.043 -4.508 8.679 1.00 0.00 H new ATOM 0 HG CYS A 147 5.510 -7.054 10.925 1.00 0.00 H new ATOM 2243 N GLU A 148 6.830 -2.259 10.959 1.00 0.00 N ATOM 2244 CA GLU A 148 7.037 -0.819 11.006 1.00 0.00 C ATOM 2245 C GLU A 148 8.440 -0.490 11.518 1.00 0.00 C ATOM 2246 O GLU A 148 9.120 0.379 10.973 1.00 0.00 O ATOM 2247 CB GLU A 148 5.974 -0.181 11.896 1.00 0.00 C ATOM 2248 CG GLU A 148 4.597 -0.128 11.251 1.00 0.00 C ATOM 2249 CD GLU A 148 4.380 1.150 10.472 1.00 0.00 C ATOM 2250 OE1 GLU A 148 4.949 1.289 9.368 1.00 0.00 O ATOM 2251 OE2 GLU A 148 3.656 2.038 10.972 1.00 0.00 O ATOM 0 H GLU A 148 6.011 -2.580 11.475 1.00 0.00 H new ATOM 0 HA GLU A 148 6.947 -0.414 9.998 1.00 0.00 H new ATOM 0 HB2 GLU A 148 5.909 -0.741 12.829 1.00 0.00 H new ATOM 0 HB3 GLU A 148 6.286 0.831 12.153 1.00 0.00 H new ATOM 0 HG2 GLU A 148 4.476 -0.982 10.585 1.00 0.00 H new ATOM 0 HG3 GLU A 148 3.832 -0.215 12.023 1.00 0.00 H new ATOM 2258 N HIS A 149 8.871 -1.216 12.546 1.00 0.00 N ATOM 2259 CA HIS A 149 10.203 -1.044 13.131 1.00 0.00 C ATOM 2260 C HIS A 149 11.305 -1.295 12.096 1.00 0.00 C ATOM 2261 O HIS A 149 12.367 -0.676 12.142 1.00 0.00 O ATOM 2262 CB HIS A 149 10.365 -1.999 14.323 1.00 0.00 C ATOM 2263 CG HIS A 149 11.719 -1.973 14.977 1.00 0.00 C ATOM 2264 ND1 HIS A 149 12.026 -1.163 16.047 1.00 0.00 N ATOM 2265 CD2 HIS A 149 12.843 -2.680 14.710 1.00 0.00 C ATOM 2266 CE1 HIS A 149 13.277 -1.373 16.414 1.00 0.00 C ATOM 2267 NE2 HIS A 149 13.795 -2.290 15.618 1.00 0.00 N ATOM 0 H HIS A 149 8.311 -1.939 12.998 1.00 0.00 H new ATOM 0 HA HIS A 149 10.300 -0.013 13.472 1.00 0.00 H new ATOM 0 HB2 HIS A 149 9.612 -1.753 15.071 1.00 0.00 H new ATOM 0 HB3 HIS A 149 10.160 -3.015 13.986 1.00 0.00 H new ATOM 0 HD2 HIS A 149 12.967 -3.414 13.928 1.00 0.00 H new ATOM 0 HE1 HIS A 149 13.789 -0.879 17.227 1.00 0.00 H new ATOM 0 HE2 HIS A 149 14.748 -2.650 15.670 1.00 0.00 H new ATOM 2276 N ALA A 150 11.034 -2.186 11.154 1.00 0.00 N ATOM 2277 CA ALA A 150 12.027 -2.586 10.168 1.00 0.00 C ATOM 2278 C ALA A 150 12.155 -1.551 9.058 1.00 0.00 C ATOM 2279 O ALA A 150 13.247 -1.305 8.546 1.00 0.00 O ATOM 2280 CB ALA A 150 11.660 -3.940 9.585 1.00 0.00 C ATOM 0 H ALA A 150 10.130 -2.648 11.051 1.00 0.00 H new ATOM 0 HA ALA A 150 12.993 -2.659 10.668 1.00 0.00 H new ATOM 0 HB1 ALA A 150 12.407 -4.233 8.848 1.00 0.00 H new ATOM 0 HB2 ALA A 150 11.626 -4.682 10.382 1.00 0.00 H new ATOM 0 HB3 ALA A 150 10.683 -3.877 9.106 1.00 0.00 H new ATOM 2286 N ALA A 151 11.039 -0.929 8.701 1.00 0.00 N ATOM 2287 CA ALA A 151 11.023 0.042 7.614 1.00 0.00 C ATOM 2288 C ALA A 151 11.742 1.328 7.999 1.00 0.00 C ATOM 2289 O ALA A 151 12.155 2.095 7.136 1.00 0.00 O ATOM 2290 CB ALA A 151 9.603 0.343 7.184 1.00 0.00 C ATOM 0 H ALA A 151 10.134 -1.079 9.147 1.00 0.00 H new ATOM 0 HA ALA A 151 11.558 -0.401 6.774 1.00 0.00 H new ATOM 0 HB1 ALA A 151 9.615 1.070 6.372 1.00 0.00 H new ATOM 0 HB2 ALA A 151 9.124 -0.575 6.843 1.00 0.00 H new ATOM 0 HB3 ALA A 151 9.046 0.751 8.028 1.00 0.00 H new ATOM 2296 N ARG A 152 11.921 1.547 9.293 1.00 0.00 N ATOM 2297 CA ARG A 152 12.612 2.738 9.768 1.00 0.00 C ATOM 2298 C ARG A 152 14.117 2.571 9.594 1.00 0.00 C ATOM 2299 O ARG A 152 14.870 3.539 9.644 1.00 0.00 O ATOM 2300 CB ARG A 152 12.264 3.037 11.229 1.00 0.00 C ATOM 2301 CG ARG A 152 11.014 3.897 11.405 1.00 0.00 C ATOM 2302 CD ARG A 152 9.793 3.250 10.775 1.00 0.00 C ATOM 2303 NE ARG A 152 8.587 4.068 10.897 1.00 0.00 N ATOM 2304 CZ ARG A 152 7.388 3.682 10.456 1.00 0.00 C ATOM 2305 NH1 ARG A 152 7.240 2.480 9.918 1.00 0.00 N ATOM 2306 NH2 ARG A 152 6.343 4.493 10.564 1.00 0.00 N ATOM 0 H ARG A 152 11.600 0.920 10.030 1.00 0.00 H new ATOM 0 HA ARG A 152 12.280 3.588 9.171 1.00 0.00 H new ATOM 0 HB2 ARG A 152 12.122 2.095 11.758 1.00 0.00 H new ATOM 0 HB3 ARG A 152 13.109 3.542 11.697 1.00 0.00 H new ATOM 0 HG2 ARG A 152 10.832 4.061 12.467 1.00 0.00 H new ATOM 0 HG3 ARG A 152 11.180 4.876 10.955 1.00 0.00 H new ATOM 0 HD2 ARG A 152 9.992 3.061 9.720 1.00 0.00 H new ATOM 0 HD3 ARG A 152 9.618 2.282 11.245 1.00 0.00 H new ATOM 0 HE ARG A 152 8.666 4.982 11.343 1.00 0.00 H new ATOM 0 HH11 ARG A 152 8.041 1.853 9.842 1.00 0.00 H new ATOM 0 HH12 ARG A 152 6.325 2.182 9.580 1.00 0.00 H new ATOM 0 HH21 ARG A 152 6.455 5.415 10.985 1.00 0.00 H new ATOM 0 HH22 ARG A 152 5.428 4.194 10.226 1.00 0.00 H new ATOM 2320 N ILE A 153 14.544 1.330 9.410 1.00 0.00 N ATOM 2321 CA ILE A 153 15.932 1.039 9.088 1.00 0.00 C ATOM 2322 C ILE A 153 16.165 1.210 7.588 1.00 0.00 C ATOM 2323 O ILE A 153 17.075 1.925 7.160 1.00 0.00 O ATOM 2324 CB ILE A 153 16.312 -0.404 9.490 1.00 0.00 C ATOM 2325 CG1 ILE A 153 15.962 -0.663 10.957 1.00 0.00 C ATOM 2326 CG2 ILE A 153 17.797 -0.655 9.245 1.00 0.00 C ATOM 2327 CD1 ILE A 153 16.166 -2.101 11.381 1.00 0.00 C ATOM 0 H ILE A 153 13.946 0.506 9.479 1.00 0.00 H new ATOM 0 HA ILE A 153 16.555 1.736 9.649 1.00 0.00 H new ATOM 0 HB ILE A 153 15.738 -1.094 8.871 1.00 0.00 H new ATOM 0 HG12 ILE A 153 16.572 -0.016 11.588 1.00 0.00 H new ATOM 0 HG13 ILE A 153 14.922 -0.386 11.129 1.00 0.00 H new ATOM 0 HG21 ILE A 153 18.046 -1.676 9.534 1.00 0.00 H new ATOM 0 HG22 ILE A 153 18.021 -0.512 8.188 1.00 0.00 H new ATOM 0 HG23 ILE A 153 18.387 0.044 9.838 1.00 0.00 H new ATOM 0 HD11 ILE A 153 15.899 -2.212 12.432 1.00 0.00 H new ATOM 0 HD12 ILE A 153 15.535 -2.752 10.775 1.00 0.00 H new ATOM 0 HD13 ILE A 153 17.211 -2.377 11.242 1.00 0.00 H new ATOM 2339 N ILE A 154 15.304 0.569 6.798 1.00 0.00 N ATOM 2340 CA ILE A 154 15.462 0.518 5.346 1.00 0.00 C ATOM 2341 C ILE A 154 15.167 1.867 4.698 1.00 0.00 C ATOM 2342 O ILE A 154 16.011 2.423 4.002 1.00 0.00 O ATOM 2343 CB ILE A 154 14.523 -0.536 4.722 1.00 0.00 C ATOM 2344 CG1 ILE A 154 14.655 -1.869 5.457 1.00 0.00 C ATOM 2345 CG2 ILE A 154 14.831 -0.710 3.239 1.00 0.00 C ATOM 2346 CD1 ILE A 154 13.637 -2.897 5.024 1.00 0.00 C ATOM 0 H ILE A 154 14.482 0.074 7.144 1.00 0.00 H new ATOM 0 HA ILE A 154 16.501 0.248 5.158 1.00 0.00 H new ATOM 0 HB ILE A 154 13.495 -0.188 4.822 1.00 0.00 H new ATOM 0 HG12 ILE A 154 15.656 -2.268 5.293 1.00 0.00 H new ATOM 0 HG13 ILE A 154 14.553 -1.696 6.528 1.00 0.00 H new ATOM 0 HG21 ILE A 154 14.161 -1.457 2.813 1.00 0.00 H new ATOM 0 HG22 ILE A 154 14.690 0.240 2.724 1.00 0.00 H new ATOM 0 HG23 ILE A 154 15.863 -1.038 3.118 1.00 0.00 H new ATOM 0 HD11 ILE A 154 13.789 -3.818 5.586 1.00 0.00 H new ATOM 0 HD12 ILE A 154 12.633 -2.517 5.214 1.00 0.00 H new ATOM 0 HD13 ILE A 154 13.753 -3.098 3.959 1.00 0.00 H new ATOM 2358 N ASN A 155 13.970 2.385 4.930 1.00 0.00 N ATOM 2359 CA ASN A 155 13.536 3.643 4.319 1.00 0.00 C ATOM 2360 C ASN A 155 14.471 4.781 4.702 1.00 0.00 C ATOM 2361 O ASN A 155 14.647 5.735 3.946 1.00 0.00 O ATOM 2362 CB ASN A 155 12.096 3.983 4.731 1.00 0.00 C ATOM 2363 CG ASN A 155 11.075 2.992 4.190 1.00 0.00 C ATOM 2364 OD1 ASN A 155 11.384 1.826 3.951 1.00 0.00 O ATOM 2365 ND2 ASN A 155 9.843 3.444 4.013 1.00 0.00 N ATOM 0 H ASN A 155 13.275 1.954 5.540 1.00 0.00 H new ATOM 0 HA ASN A 155 13.567 3.516 3.237 1.00 0.00 H new ATOM 0 HB2 ASN A 155 12.031 4.007 5.819 1.00 0.00 H new ATOM 0 HB3 ASN A 155 11.848 4.983 4.375 1.00 0.00 H new ATOM 0 HD21 ASN A 155 9.115 2.818 3.668 1.00 0.00 H new ATOM 0 HD22 ASN A 155 9.622 4.418 4.222 1.00 0.00 H new ATOM 2372 N ASP A 156 15.081 4.660 5.876 1.00 0.00 N ATOM 2373 CA ASP A 156 16.051 5.640 6.351 1.00 0.00 C ATOM 2374 C ASP A 156 17.272 5.666 5.438 1.00 0.00 C ATOM 2375 O ASP A 156 17.719 6.730 5.007 1.00 0.00 O ATOM 2376 CB ASP A 156 16.473 5.306 7.783 1.00 0.00 C ATOM 2377 CG ASP A 156 17.443 6.313 8.365 1.00 0.00 C ATOM 2378 OD1 ASP A 156 16.985 7.328 8.930 1.00 0.00 O ATOM 2379 OD2 ASP A 156 18.664 6.083 8.278 1.00 0.00 O ATOM 0 H ASP A 156 14.919 3.886 6.521 1.00 0.00 H new ATOM 0 HA ASP A 156 15.586 6.626 6.338 1.00 0.00 H new ATOM 0 HB2 ASP A 156 15.586 5.257 8.415 1.00 0.00 H new ATOM 0 HB3 ASP A 156 16.931 4.317 7.799 1.00 0.00 H new ATOM 2384 N LEU A 157 17.791 4.486 5.118 1.00 0.00 N ATOM 2385 CA LEU A 157 18.962 4.384 4.254 1.00 0.00 C ATOM 2386 C LEU A 157 18.568 4.616 2.797 1.00 0.00 C ATOM 2387 O LEU A 157 19.404 4.959 1.962 1.00 0.00 O ATOM 2388 CB LEU A 157 19.666 3.026 4.439 1.00 0.00 C ATOM 2389 CG LEU A 157 18.869 1.788 4.035 1.00 0.00 C ATOM 2390 CD1 LEU A 157 19.028 1.487 2.551 1.00 0.00 C ATOM 2391 CD2 LEU A 157 19.289 0.589 4.870 1.00 0.00 C ATOM 0 H LEU A 157 17.422 3.592 5.441 1.00 0.00 H new ATOM 0 HA LEU A 157 19.673 5.160 4.539 1.00 0.00 H new ATOM 0 HB2 LEU A 157 20.591 3.040 3.863 1.00 0.00 H new ATOM 0 HB3 LEU A 157 19.945 2.926 5.488 1.00 0.00 H new ATOM 0 HG LEU A 157 17.815 1.993 4.223 1.00 0.00 H new ATOM 0 HD11 LEU A 157 18.448 0.600 2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 157 18.670 2.335 1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 157 20.080 1.310 2.326 1.00 0.00 H new ATOM 0 HD21 LEU A 157 18.711 -0.285 4.569 1.00 0.00 H new ATOM 0 HD22 LEU A 157 20.350 0.392 4.717 1.00 0.00 H new ATOM 0 HD23 LEU A 157 19.108 0.798 5.924 1.00 0.00 H new ATOM 2403 N LEU A 158 17.285 4.434 2.499 1.00 0.00 N ATOM 2404 CA LEU A 158 16.768 4.687 1.163 1.00 0.00 C ATOM 2405 C LEU A 158 16.806 6.168 0.831 1.00 0.00 C ATOM 2406 O LEU A 158 17.031 6.540 -0.315 1.00 0.00 O ATOM 2407 CB LEU A 158 15.343 4.154 1.013 1.00 0.00 C ATOM 2408 CG LEU A 158 15.242 2.642 0.826 1.00 0.00 C ATOM 2409 CD1 LEU A 158 13.786 2.214 0.725 1.00 0.00 C ATOM 2410 CD2 LEU A 158 16.013 2.219 -0.415 1.00 0.00 C ATOM 0 H LEU A 158 16.585 4.112 3.168 1.00 0.00 H new ATOM 0 HA LEU A 158 17.412 4.158 0.461 1.00 0.00 H new ATOM 0 HB2 LEU A 158 14.770 4.436 1.896 1.00 0.00 H new ATOM 0 HB3 LEU A 158 14.875 4.644 0.159 1.00 0.00 H new ATOM 0 HG LEU A 158 15.681 2.150 1.694 1.00 0.00 H new ATOM 0 HD11 LEU A 158 13.733 1.133 0.592 1.00 0.00 H new ATOM 0 HD12 LEU A 158 13.260 2.494 1.638 1.00 0.00 H new ATOM 0 HD13 LEU A 158 13.320 2.708 -0.128 1.00 0.00 H new ATOM 0 HD21 LEU A 158 15.936 1.139 -0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 158 15.596 2.717 -1.290 1.00 0.00 H new ATOM 0 HD23 LEU A 158 17.061 2.497 -0.305 1.00 0.00 H new ATOM 2422 N GLN A 159 16.603 7.013 1.833 1.00 0.00 N ATOM 2423 CA GLN A 159 16.659 8.456 1.627 1.00 0.00 C ATOM 2424 C GLN A 159 18.080 8.870 1.301 1.00 0.00 C ATOM 2425 O GLN A 159 18.313 9.822 0.558 1.00 0.00 O ATOM 2426 CB GLN A 159 16.164 9.203 2.861 1.00 0.00 C ATOM 2427 CG GLN A 159 14.816 8.713 3.351 1.00 0.00 C ATOM 2428 CD GLN A 159 13.769 8.663 2.252 1.00 0.00 C ATOM 2429 OE1 GLN A 159 13.774 9.473 1.322 1.00 0.00 O ATOM 2430 NE2 GLN A 159 12.878 7.687 2.339 1.00 0.00 N ATOM 0 H GLN A 159 16.399 6.728 2.791 1.00 0.00 H new ATOM 0 HA GLN A 159 16.007 8.713 0.792 1.00 0.00 H new ATOM 0 HB2 GLN A 159 16.896 9.096 3.661 1.00 0.00 H new ATOM 0 HB3 GLN A 159 16.096 10.266 2.632 1.00 0.00 H new ATOM 0 HG2 GLN A 159 14.931 7.718 3.781 1.00 0.00 H new ATOM 0 HG3 GLN A 159 14.466 9.367 4.150 1.00 0.00 H new ATOM 0 HE21 GLN A 159 12.908 7.037 3.125 1.00 0.00 H new ATOM 0 HE22 GLN A 159 12.162 7.585 1.620 1.00 0.00 H new ATOM 2439 N SER A 160 19.025 8.122 1.846 1.00 0.00 N ATOM 2440 CA SER A 160 20.432 8.323 1.569 1.00 0.00 C ATOM 2441 C SER A 160 20.734 8.052 0.095 1.00 0.00 C ATOM 2442 O SER A 160 21.718 8.547 -0.455 1.00 0.00 O ATOM 2443 CB SER A 160 21.247 7.385 2.449 1.00 0.00 C ATOM 2444 OG SER A 160 20.978 7.612 3.822 1.00 0.00 O ATOM 0 H SER A 160 18.835 7.358 2.494 1.00 0.00 H new ATOM 0 HA SER A 160 20.697 9.358 1.785 1.00 0.00 H new ATOM 0 HB2 SER A 160 21.015 6.350 2.196 1.00 0.00 H new ATOM 0 HB3 SER A 160 22.310 7.530 2.254 1.00 0.00 H new ATOM 0 HG SER A 160 21.512 6.996 4.366 1.00 0.00 H new ATOM 2450 N LEU A 161 19.875 7.265 -0.536 1.00 0.00 N ATOM 2451 CA LEU A 161 20.057 6.884 -1.927 1.00 0.00 C ATOM 2452 C LEU A 161 18.996 7.533 -2.814 1.00 0.00 C ATOM 2453 O LEU A 161 18.948 7.294 -4.021 1.00 0.00 O ATOM 2454 CB LEU A 161 19.999 5.362 -2.053 1.00 0.00 C ATOM 2455 CG LEU A 161 21.034 4.604 -1.216 1.00 0.00 C ATOM 2456 CD1 LEU A 161 20.799 3.107 -1.306 1.00 0.00 C ATOM 2457 CD2 LEU A 161 22.446 4.948 -1.672 1.00 0.00 C ATOM 0 H LEU A 161 19.038 6.876 -0.101 1.00 0.00 H new ATOM 0 HA LEU A 161 21.033 7.236 -2.261 1.00 0.00 H new ATOM 0 HB2 LEU A 161 19.003 5.026 -1.764 1.00 0.00 H new ATOM 0 HB3 LEU A 161 20.134 5.094 -3.101 1.00 0.00 H new ATOM 0 HG LEU A 161 20.923 4.909 -0.175 1.00 0.00 H new ATOM 0 HD11 LEU A 161 21.544 2.585 -0.705 1.00 0.00 H new ATOM 0 HD12 LEU A 161 19.802 2.872 -0.933 1.00 0.00 H new ATOM 0 HD13 LEU A 161 20.882 2.787 -2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 161 23.168 4.400 -1.066 1.00 0.00 H new ATOM 0 HD22 LEU A 161 22.568 4.672 -2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 161 22.615 6.019 -1.557 1.00 0.00 H new ATOM 2469 N ARG A 162 18.147 8.355 -2.209 1.00 0.00 N ATOM 2470 CA ARG A 162 17.097 9.054 -2.942 1.00 0.00 C ATOM 2471 C ARG A 162 17.377 10.546 -2.993 1.00 0.00 C ATOM 2472 O ARG A 162 16.577 11.360 -2.528 1.00 0.00 O ATOM 2473 CB ARG A 162 15.724 8.807 -2.310 1.00 0.00 C ATOM 2474 CG ARG A 162 15.136 7.446 -2.634 1.00 0.00 C ATOM 2475 CD ARG A 162 13.777 7.256 -1.978 1.00 0.00 C ATOM 2476 NE ARG A 162 12.828 8.306 -2.358 1.00 0.00 N ATOM 2477 CZ ARG A 162 11.691 8.084 -3.018 1.00 0.00 C ATOM 2478 NH1 ARG A 162 11.384 6.861 -3.431 1.00 0.00 N ATOM 2479 NH2 ARG A 162 10.869 9.091 -3.274 1.00 0.00 N ATOM 0 H ARG A 162 18.165 8.555 -1.209 1.00 0.00 H new ATOM 0 HA ARG A 162 17.088 8.660 -3.958 1.00 0.00 H new ATOM 0 HB2 ARG A 162 15.809 8.907 -1.228 1.00 0.00 H new ATOM 0 HB3 ARG A 162 15.034 9.580 -2.648 1.00 0.00 H new ATOM 0 HG2 ARG A 162 15.038 7.339 -3.714 1.00 0.00 H new ATOM 0 HG3 ARG A 162 15.817 6.665 -2.296 1.00 0.00 H new ATOM 0 HD2 ARG A 162 13.372 6.284 -2.259 1.00 0.00 H new ATOM 0 HD3 ARG A 162 13.896 7.251 -0.895 1.00 0.00 H new ATOM 0 HE ARG A 162 13.051 9.268 -2.101 1.00 0.00 H new ATOM 0 HH11 ARG A 162 12.019 6.085 -3.244 1.00 0.00 H new ATOM 0 HH12 ARG A 162 10.513 6.697 -3.935 1.00 0.00 H new ATOM 0 HH21 ARG A 162 11.106 10.034 -2.966 1.00 0.00 H new ATOM 0 HH22 ARG A 162 9.999 8.923 -3.779 1.00 0.00 H new ATOM 2493 N SER A 163 18.516 10.898 -3.566 1.00 0.00 N ATOM 2494 CA SER A 163 18.908 12.289 -3.699 1.00 0.00 C ATOM 2495 C SER A 163 18.268 12.905 -4.944 1.00 0.00 C ATOM 2496 O SER A 163 18.316 14.118 -5.150 1.00 0.00 O ATOM 2497 CB SER A 163 20.430 12.388 -3.769 1.00 0.00 C ATOM 2498 OG SER A 163 21.024 11.696 -2.681 1.00 0.00 O ATOM 0 H SER A 163 19.189 10.234 -3.949 1.00 0.00 H new ATOM 0 HA SER A 163 18.559 12.845 -2.829 1.00 0.00 H new ATOM 0 HB2 SER A 163 20.785 11.969 -4.711 1.00 0.00 H new ATOM 0 HB3 SER A 163 20.733 13.435 -3.751 1.00 0.00 H new ATOM 0 HG SER A 163 22.000 11.767 -2.741 1.00 0.00 H new ATOM 2504 N GLY A 164 17.677 12.056 -5.775 1.00 0.00 N ATOM 2505 CA GLY A 164 16.971 12.528 -6.949 1.00 0.00 C ATOM 2506 C GLY A 164 15.601 11.895 -7.080 1.00 0.00 C ATOM 2507 O GLY A 164 15.443 10.897 -7.783 1.00 0.00 O ATOM 0 H GLY A 164 17.675 11.043 -5.655 1.00 0.00 H new ATOM 0 HA2 GLY A 164 16.866 13.612 -6.898 1.00 0.00 H new ATOM 0 HA3 GLY A 164 17.559 12.306 -7.839 1.00 0.00 H new TER 2511 GLY A 164