USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1184 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 130 ASN : amide:sc= -3.77! C(o=-3.8!,f=-23!) USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 63 THR OG1 : rot -67:sc= -0.376 USER MOD Set 2.2: A 76 LYS NZ :NH3+ -121:sc= 0.262 (180deg=0) USER MOD Set 3.1: A 40 ASN : amide:sc= -2.74 K(o=-4,f=-6.3!) USER MOD Set 3.2: A 62 HIS : no HD1:sc= -1.29 K(o=-4,f=-8.8!) USER MOD Set 4.1: A 38 GLN :FLIP amide:sc= -6.55! C(o=-12!,f=-6.9!) USER MOD Set 4.2: A 44 SER OG : rot -137:sc= -0.342 USER MOD Set 5.1: A 4 LYS NZ :NH3+ 179:sc= -3.14! (180deg=0) USER MOD Set 5.2: A 49 ASN : amide:sc= -3.85! C(o=-7!,f=-20!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= -0.0749 (180deg=-0.131) USER MOD Single : A 2 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.2) USER MOD Single : A 6 GLN : amide:sc= -0.121 K(o=-0.12,f=-1.5) USER MOD Single : A 9 LYS NZ :NH3+ -152:sc= -1.59! (180deg=-2.31!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -58:sc= 0.171 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0401) USER MOD Single : A 30 TYR OH : rot 30:sc= -1.33 USER MOD Single : A 35 THR OG1 : rot 180:sc= -1.01 USER MOD Single : A 51 SER OG : rot 110:sc= -0.121 USER MOD Single : A 55 GLN :FLIP amide:sc= -1.59 F(o=-3.2!,f=-1.6) USER MOD Single : A 56 ASN : amide:sc= -2.07! C(o=-2.1!,f=-6!) USER MOD Single : A 58 SER OG : rot -75:sc= -0.231 USER MOD Single : A 69 ASN : amide:sc= -1.4! C(o=-1.4!,f=-5.9!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -5.85! C(o=-5.8!,f=-9.9!) USER MOD Single : A 73 THR OG1 : rot -160:sc= -2.27 USER MOD Single : A 74 ASN : amide:sc= 0.0869 K(o=0.087,f=-4!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot -160:sc= 0 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN :FLIP amide:sc= -0.588 F(o=-1.2,f=-0.59) USER MOD Single : A 92 THR OG1 : rot 21:sc= 0.138 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 144:sc= -1.48 (180deg=-7.37!) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 73:sc= 0.819 USER MOD Single : A 99 SER OG : rot 10:sc= 0.806 USER MOD Single : A 104 LYS NZ :NH3+ 148:sc= -0.0946 (180deg=-0.758) USER MOD Single : A 106 THR OG1 : rot -46:sc= 0.144! USER MOD Single : A 114 GLN :FLIP amide:sc= -5.44! C(o=-13!,f=-5.4!) USER MOD Single : A 115 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0451) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 177:sc= -0.139 (180deg=-0.146) USER MOD Single : A 120 GLN : amide:sc= -0.911 X(o=-0.91,f=-0.58) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.494 USER MOD Single : A 126 CYS SG : rot -99:sc= -0.271 USER MOD Single : A 129 TYR OH : rot 143:sc= -1.36 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 162:sc= -0.0018 (180deg=-0.273) USER MOD Single : A 140 LYS NZ :NH3+ -106:sc= -1.97! (180deg=-3.41!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -147:sc= -0.134 (180deg=-1.13) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.218 0.352 6.143 1.00 0.00 N ATOM 2 CA MET A 1 22.424 0.873 7.293 1.00 0.00 C ATOM 3 C MET A 1 21.720 2.167 6.881 1.00 0.00 C ATOM 4 O MET A 1 21.736 3.149 7.594 1.00 0.00 O ATOM 5 CB MET A 1 23.356 1.153 8.473 1.00 0.00 C ATOM 6 CG MET A 1 23.951 -0.163 8.978 1.00 0.00 C ATOM 7 SD MET A 1 24.766 0.114 10.570 1.00 0.00 S ATOM 8 CE MET A 1 26.339 0.728 9.920 1.00 0.00 C ATOM 0 H1 MET A 1 23.614 -0.578 6.388 1.00 0.00 H new ATOM 0 H2 MET A 1 22.602 0.258 5.310 1.00 0.00 H new ATOM 0 H3 MET A 1 23.992 1.012 5.928 1.00 0.00 H new ATOM 0 HA MET A 1 21.681 0.132 7.586 1.00 0.00 H new ATOM 0 HB2 MET A 1 24.153 1.831 8.168 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.807 1.647 9.274 1.00 0.00 H new ATOM 0 HG2 MET A 1 23.166 -0.912 9.085 1.00 0.00 H new ATOM 0 HG3 MET A 1 24.667 -0.552 8.254 1.00 0.00 H new ATOM 0 HE1 MET A 1 27.007 0.965 10.748 1.00 0.00 H new ATOM 0 HE2 MET A 1 26.797 -0.037 9.292 1.00 0.00 H new ATOM 0 HE3 MET A 1 26.162 1.626 9.328 1.00 0.00 H new ATOM 20 N GLN A 2 21.100 2.174 5.731 1.00 0.00 N ATOM 21 CA GLN A 2 20.396 3.403 5.272 1.00 0.00 C ATOM 22 C GLN A 2 19.104 3.580 6.070 1.00 0.00 C ATOM 23 O GLN A 2 18.177 2.802 5.952 1.00 0.00 O ATOM 24 CB GLN A 2 20.061 3.272 3.783 1.00 0.00 C ATOM 25 CG GLN A 2 21.349 3.343 2.960 1.00 0.00 C ATOM 26 CD GLN A 2 21.911 4.764 3.011 1.00 0.00 C ATOM 27 OE1 GLN A 2 21.246 5.708 2.631 1.00 0.00 O ATOM 28 NE2 GLN A 2 23.118 4.958 3.469 1.00 0.00 N ATOM 0 H GLN A 2 21.052 1.381 5.091 1.00 0.00 H new ATOM 0 HA GLN A 2 21.040 4.269 5.426 1.00 0.00 H new ATOM 0 HB2 GLN A 2 19.550 2.328 3.596 1.00 0.00 H new ATOM 0 HB3 GLN A 2 19.380 4.068 3.481 1.00 0.00 H new ATOM 0 HG2 GLN A 2 22.082 2.637 3.351 1.00 0.00 H new ATOM 0 HG3 GLN A 2 21.149 3.057 1.927 1.00 0.00 H new ATOM 0 HE21 GLN A 2 23.676 4.166 3.788 1.00 0.00 H new ATOM 0 HE22 GLN A 2 23.503 5.902 3.508 1.00 0.00 H new ATOM 37 N ALA A 3 19.031 4.599 6.881 1.00 0.00 N ATOM 38 CA ALA A 3 17.797 4.826 7.684 1.00 0.00 C ATOM 39 C ALA A 3 16.679 5.316 6.761 1.00 0.00 C ATOM 40 O ALA A 3 16.841 5.384 5.560 1.00 0.00 O ATOM 41 CB ALA A 3 18.073 5.880 8.759 1.00 0.00 C ATOM 0 H ALA A 3 19.773 5.285 7.022 1.00 0.00 H new ATOM 0 HA ALA A 3 17.494 3.894 8.162 1.00 0.00 H new ATOM 0 HB1 ALA A 3 17.170 6.046 9.346 1.00 0.00 H new ATOM 0 HB2 ALA A 3 18.872 5.532 9.413 1.00 0.00 H new ATOM 0 HB3 ALA A 3 18.374 6.814 8.284 1.00 0.00 H new ATOM 47 N LYS A 4 15.546 5.658 7.315 1.00 0.00 N ATOM 48 CA LYS A 4 14.410 6.144 6.476 1.00 0.00 C ATOM 49 C LYS A 4 14.925 7.166 5.443 1.00 0.00 C ATOM 50 O LYS A 4 15.260 8.276 5.802 1.00 0.00 O ATOM 51 CB LYS A 4 13.385 6.831 7.382 1.00 0.00 C ATOM 52 CG LYS A 4 12.956 5.866 8.488 1.00 0.00 C ATOM 53 CD LYS A 4 11.847 6.506 9.325 1.00 0.00 C ATOM 54 CE LYS A 4 11.474 5.571 10.477 1.00 0.00 C ATOM 55 NZ LYS A 4 10.475 6.240 11.357 1.00 0.00 N ATOM 0 H LYS A 4 15.357 5.622 8.317 1.00 0.00 H new ATOM 0 HA LYS A 4 13.954 5.301 5.957 1.00 0.00 H new ATOM 0 HB2 LYS A 4 13.815 7.733 7.818 1.00 0.00 H new ATOM 0 HB3 LYS A 4 12.518 7.141 6.799 1.00 0.00 H new ATOM 0 HG2 LYS A 4 12.603 4.931 8.052 1.00 0.00 H new ATOM 0 HG3 LYS A 4 13.808 5.621 9.122 1.00 0.00 H new ATOM 0 HD2 LYS A 4 12.180 7.467 9.716 1.00 0.00 H new ATOM 0 HD3 LYS A 4 10.973 6.701 8.703 1.00 0.00 H new ATOM 0 HE2 LYS A 4 11.064 4.640 10.086 1.00 0.00 H new ATOM 0 HE3 LYS A 4 12.363 5.311 11.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 10.209 5.598 12.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 10.888 7.108 11.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 9.630 6.482 10.801 1.00 0.00 H new ATOM 69 N PRO A 5 14.996 6.814 4.169 1.00 0.00 N ATOM 70 CA PRO A 5 15.481 7.756 3.110 1.00 0.00 C ATOM 71 C PRO A 5 14.787 9.125 3.172 1.00 0.00 C ATOM 72 O PRO A 5 14.135 9.464 4.140 1.00 0.00 O ATOM 73 CB PRO A 5 15.140 7.036 1.797 1.00 0.00 C ATOM 74 CG PRO A 5 15.143 5.585 2.148 1.00 0.00 C ATOM 75 CD PRO A 5 14.637 5.500 3.590 1.00 0.00 C ATOM 0 HA PRO A 5 16.542 7.976 3.225 1.00 0.00 H new ATOM 0 HB2 PRO A 5 14.168 7.349 1.415 1.00 0.00 H new ATOM 0 HB3 PRO A 5 15.874 7.257 1.022 1.00 0.00 H new ATOM 0 HG2 PRO A 5 14.499 5.019 1.474 1.00 0.00 H new ATOM 0 HG3 PRO A 5 16.145 5.164 2.060 1.00 0.00 H new ATOM 0 HD2 PRO A 5 13.561 5.327 3.627 1.00 0.00 H new ATOM 0 HD3 PRO A 5 15.110 4.681 4.132 1.00 0.00 H new ATOM 83 N GLN A 6 14.929 9.917 2.145 1.00 0.00 N ATOM 84 CA GLN A 6 14.290 11.263 2.143 1.00 0.00 C ATOM 85 C GLN A 6 12.811 11.142 1.762 1.00 0.00 C ATOM 86 O GLN A 6 12.472 10.943 0.613 1.00 0.00 O ATOM 87 CB GLN A 6 15.002 12.162 1.130 1.00 0.00 C ATOM 88 CG GLN A 6 16.511 12.121 1.377 1.00 0.00 C ATOM 89 CD GLN A 6 16.818 12.690 2.764 1.00 0.00 C ATOM 90 OE1 GLN A 6 16.083 13.515 3.270 1.00 0.00 O ATOM 91 NE2 GLN A 6 17.880 12.282 3.403 1.00 0.00 N ATOM 0 H GLN A 6 15.461 9.689 1.305 1.00 0.00 H new ATOM 0 HA GLN A 6 14.368 11.696 3.140 1.00 0.00 H new ATOM 0 HB2 GLN A 6 14.780 11.830 0.116 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.637 13.185 1.217 1.00 0.00 H new ATOM 0 HG2 GLN A 6 16.874 11.096 1.305 1.00 0.00 H new ATOM 0 HG3 GLN A 6 17.031 12.698 0.612 1.00 0.00 H new ATOM 0 HE21 GLN A 6 18.496 11.590 2.978 1.00 0.00 H new ATOM 0 HE22 GLN A 6 18.094 12.656 4.328 1.00 0.00 H new ATOM 100 N ILE A 7 11.931 11.275 2.719 1.00 0.00 N ATOM 101 CA ILE A 7 10.472 11.186 2.417 1.00 0.00 C ATOM 102 C ILE A 7 9.982 12.577 1.959 1.00 0.00 C ATOM 103 O ILE A 7 10.002 13.513 2.733 1.00 0.00 O ATOM 104 CB ILE A 7 9.711 10.782 3.691 1.00 0.00 C ATOM 105 CG1 ILE A 7 10.434 9.634 4.421 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.291 10.346 3.323 1.00 0.00 C ATOM 107 CD1 ILE A 7 10.447 8.358 3.567 1.00 0.00 C ATOM 0 H ILE A 7 12.160 11.442 3.699 1.00 0.00 H new ATOM 0 HA ILE A 7 10.296 10.445 1.637 1.00 0.00 H new ATOM 0 HB ILE A 7 9.670 11.643 4.358 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.457 9.932 4.651 1.00 0.00 H new ATOM 0 HG13 ILE A 7 9.939 9.434 5.371 1.00 0.00 H new ATOM 0 HG21 ILE A 7 7.753 10.060 4.227 1.00 0.00 H new ATOM 0 HG22 ILE A 7 7.771 11.172 2.837 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.336 9.495 2.643 1.00 0.00 H new ATOM 0 HD11 ILE A 7 10.964 7.564 4.107 1.00 0.00 H new ATOM 0 HD12 ILE A 7 9.423 8.049 3.359 1.00 0.00 H new ATOM 0 HD13 ILE A 7 10.964 8.554 2.628 1.00 0.00 H new ATOM 119 N PRO A 8 9.551 12.737 0.721 1.00 0.00 N ATOM 120 CA PRO A 8 9.073 14.061 0.221 1.00 0.00 C ATOM 121 C PRO A 8 8.186 14.783 1.242 1.00 0.00 C ATOM 122 O PRO A 8 7.163 14.277 1.660 1.00 0.00 O ATOM 123 CB PRO A 8 8.283 13.703 -1.041 1.00 0.00 C ATOM 124 CG PRO A 8 8.943 12.465 -1.561 1.00 0.00 C ATOM 125 CD PRO A 8 9.465 11.704 -0.333 1.00 0.00 C ATOM 0 HA PRO A 8 9.896 14.751 0.033 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.232 13.526 -0.814 1.00 0.00 H new ATOM 0 HB3 PRO A 8 8.320 14.509 -1.774 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.236 11.855 -2.124 1.00 0.00 H new ATOM 0 HG3 PRO A 8 9.759 12.715 -2.239 1.00 0.00 H new ATOM 0 HD2 PRO A 8 8.790 10.898 -0.047 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.437 11.251 -0.528 1.00 0.00 H new ATOM 133 N LYS A 9 8.572 15.961 1.647 1.00 0.00 N ATOM 134 CA LYS A 9 7.755 16.714 2.640 1.00 0.00 C ATOM 135 C LYS A 9 6.413 17.094 2.015 1.00 0.00 C ATOM 136 O LYS A 9 5.402 17.163 2.686 1.00 0.00 O ATOM 137 CB LYS A 9 8.500 17.983 3.057 1.00 0.00 C ATOM 138 CG LYS A 9 9.957 17.641 3.373 1.00 0.00 C ATOM 139 CD LYS A 9 10.614 18.818 4.096 1.00 0.00 C ATOM 140 CE LYS A 9 10.466 20.087 3.253 1.00 0.00 C ATOM 141 NZ LYS A 9 10.684 19.758 1.816 1.00 0.00 N ATOM 0 H LYS A 9 9.419 16.435 1.333 1.00 0.00 H new ATOM 0 HA LYS A 9 7.583 16.089 3.516 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.454 18.723 2.258 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.022 18.427 3.930 1.00 0.00 H new ATOM 0 HG2 LYS A 9 10.005 16.747 3.994 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.497 17.419 2.453 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.151 18.962 5.072 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.669 18.607 4.271 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.473 20.515 3.392 1.00 0.00 H new ATOM 0 HE3 LYS A 9 11.186 20.838 3.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.051 20.595 1.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.371 18.981 1.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 9.783 19.468 1.386 1.00 0.00 H new ATOM 155 N ASP A 10 6.394 17.342 0.736 1.00 0.00 N ATOM 156 CA ASP A 10 5.116 17.720 0.070 1.00 0.00 C ATOM 157 C ASP A 10 4.254 16.471 -0.131 1.00 0.00 C ATOM 158 O ASP A 10 4.573 15.604 -0.919 1.00 0.00 O ATOM 159 CB ASP A 10 5.419 18.354 -1.289 1.00 0.00 C ATOM 160 CG ASP A 10 6.419 19.497 -1.108 1.00 0.00 C ATOM 161 OD1 ASP A 10 6.743 19.800 0.028 1.00 0.00 O ATOM 162 OD2 ASP A 10 6.843 20.052 -2.108 1.00 0.00 O ATOM 0 H ASP A 10 7.208 17.300 0.122 1.00 0.00 H new ATOM 0 HA ASP A 10 4.579 18.434 0.694 1.00 0.00 H new ATOM 0 HB2 ASP A 10 5.826 17.605 -1.969 1.00 0.00 H new ATOM 0 HB3 ASP A 10 4.500 18.729 -1.740 1.00 0.00 H new ATOM 167 N LYS A 11 3.160 16.378 0.575 1.00 0.00 N ATOM 168 CA LYS A 11 2.270 15.194 0.424 1.00 0.00 C ATOM 169 C LYS A 11 1.770 15.127 -1.023 1.00 0.00 C ATOM 170 O LYS A 11 1.037 14.233 -1.394 1.00 0.00 O ATOM 171 CB LYS A 11 1.067 15.329 1.379 1.00 0.00 C ATOM 172 CG LYS A 11 1.449 14.922 2.823 1.00 0.00 C ATOM 173 CD LYS A 11 2.048 16.120 3.586 1.00 0.00 C ATOM 174 CE LYS A 11 0.928 16.973 4.200 1.00 0.00 C ATOM 175 NZ LYS A 11 1.439 18.346 4.471 1.00 0.00 N ATOM 0 H LYS A 11 2.844 17.073 1.251 1.00 0.00 H new ATOM 0 HA LYS A 11 2.821 14.285 0.666 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.707 16.358 1.372 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.248 14.702 1.027 1.00 0.00 H new ATOM 0 HG2 LYS A 11 0.567 14.554 3.348 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.169 14.104 2.797 1.00 0.00 H new ATOM 0 HD2 LYS A 11 2.715 15.764 4.371 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.648 16.728 2.909 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.077 17.018 3.520 1.00 0.00 H new ATOM 0 HE3 LYS A 11 0.574 16.516 5.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 0.680 18.923 4.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 2.238 18.294 5.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.756 18.780 3.581 1.00 0.00 H new ATOM 189 N SER A 12 2.164 16.074 -1.841 1.00 0.00 N ATOM 190 CA SER A 12 1.720 16.091 -3.271 1.00 0.00 C ATOM 191 C SER A 12 2.914 15.793 -4.180 1.00 0.00 C ATOM 192 O SER A 12 3.095 16.419 -5.206 1.00 0.00 O ATOM 193 CB SER A 12 1.162 17.474 -3.610 1.00 0.00 C ATOM 194 OG SER A 12 0.455 17.408 -4.841 1.00 0.00 O ATOM 0 H SER A 12 2.780 16.843 -1.576 1.00 0.00 H new ATOM 0 HA SER A 12 0.949 15.335 -3.422 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.499 17.816 -2.815 1.00 0.00 H new ATOM 0 HB3 SER A 12 1.973 18.198 -3.682 1.00 0.00 H new ATOM 0 HG SER A 12 1.054 17.083 -5.545 1.00 0.00 H new ATOM 200 N LYS A 13 3.730 14.836 -3.816 1.00 0.00 N ATOM 201 CA LYS A 13 4.915 14.490 -4.666 1.00 0.00 C ATOM 202 C LYS A 13 5.133 12.976 -4.639 1.00 0.00 C ATOM 203 O LYS A 13 5.096 12.346 -3.602 1.00 0.00 O ATOM 204 CB LYS A 13 6.163 15.207 -4.131 1.00 0.00 C ATOM 205 CG LYS A 13 7.236 15.254 -5.226 1.00 0.00 C ATOM 206 CD LYS A 13 8.489 15.972 -4.707 1.00 0.00 C ATOM 207 CE LYS A 13 8.157 17.427 -4.343 1.00 0.00 C ATOM 208 NZ LYS A 13 9.392 18.253 -4.453 1.00 0.00 N ATOM 0 H LYS A 13 3.629 14.278 -2.968 1.00 0.00 H new ATOM 0 HA LYS A 13 4.734 14.811 -5.692 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.907 16.218 -3.815 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.546 14.686 -3.254 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.491 14.242 -5.539 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.848 15.771 -6.104 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.879 15.451 -3.833 1.00 0.00 H new ATOM 0 HD3 LYS A 13 9.270 15.949 -5.467 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.386 17.814 -5.009 1.00 0.00 H new ATOM 0 HE3 LYS A 13 7.759 17.479 -3.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.173 19.240 -4.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 10.114 17.886 -3.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.752 18.211 -5.428 1.00 0.00 H new ATOM 222 N VAL A 14 5.340 12.389 -5.784 1.00 0.00 N ATOM 223 CA VAL A 14 5.535 10.914 -5.854 1.00 0.00 C ATOM 224 C VAL A 14 6.731 10.471 -5.006 1.00 0.00 C ATOM 225 O VAL A 14 7.854 10.866 -5.245 1.00 0.00 O ATOM 226 CB VAL A 14 5.792 10.506 -7.308 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.639 8.985 -7.459 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.801 11.229 -8.231 1.00 0.00 C ATOM 0 H VAL A 14 5.383 12.872 -6.682 1.00 0.00 H new ATOM 0 HA VAL A 14 4.634 10.435 -5.470 1.00 0.00 H new ATOM 0 HB VAL A 14 6.808 10.787 -7.586 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.823 8.702 -8.495 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.357 8.481 -6.812 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.628 8.691 -7.177 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.987 10.937 -9.265 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.782 10.958 -7.955 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.930 12.307 -8.130 1.00 0.00 H new ATOM 238 N ALA A 15 6.500 9.615 -4.044 1.00 0.00 N ATOM 239 CA ALA A 15 7.624 9.097 -3.207 1.00 0.00 C ATOM 240 C ALA A 15 8.041 7.744 -3.782 1.00 0.00 C ATOM 241 O ALA A 15 9.048 7.174 -3.408 1.00 0.00 O ATOM 242 CB ALA A 15 7.159 8.918 -1.759 1.00 0.00 C ATOM 0 H ALA A 15 5.578 9.251 -3.801 1.00 0.00 H new ATOM 0 HA ALA A 15 8.460 9.797 -3.217 1.00 0.00 H new ATOM 0 HB1 ALA A 15 7.985 8.540 -1.156 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.829 9.878 -1.362 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.332 8.209 -1.727 1.00 0.00 H new ATOM 248 N GLY A 16 7.262 7.232 -4.700 1.00 0.00 N ATOM 249 CA GLY A 16 7.587 5.918 -5.326 1.00 0.00 C ATOM 250 C GLY A 16 6.429 5.487 -6.232 1.00 0.00 C ATOM 251 O GLY A 16 5.273 5.666 -5.904 1.00 0.00 O ATOM 0 H GLY A 16 6.409 7.672 -5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.507 5.996 -5.905 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.759 5.167 -4.554 1.00 0.00 H new ATOM 255 N TYR A 17 6.729 4.920 -7.374 1.00 0.00 N ATOM 256 CA TYR A 17 5.648 4.475 -8.306 1.00 0.00 C ATOM 257 C TYR A 17 5.339 3.002 -8.062 1.00 0.00 C ATOM 258 O TYR A 17 6.214 2.163 -8.137 1.00 0.00 O ATOM 259 CB TYR A 17 6.111 4.629 -9.758 1.00 0.00 C ATOM 260 CG TYR A 17 6.371 6.079 -10.083 1.00 0.00 C ATOM 261 CD1 TYR A 17 7.604 6.659 -9.762 1.00 0.00 C ATOM 262 CD2 TYR A 17 5.385 6.839 -10.725 1.00 0.00 C ATOM 263 CE1 TYR A 17 7.851 8.000 -10.078 1.00 0.00 C ATOM 264 CE2 TYR A 17 5.633 8.180 -11.044 1.00 0.00 C ATOM 265 CZ TYR A 17 6.867 8.760 -10.720 1.00 0.00 C ATOM 266 OH TYR A 17 7.113 10.081 -11.034 1.00 0.00 O ATOM 0 H TYR A 17 7.679 4.746 -7.702 1.00 0.00 H new ATOM 0 HA TYR A 17 4.763 5.086 -8.129 1.00 0.00 H new ATOM 0 HB2 TYR A 17 7.018 4.047 -9.920 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.352 4.231 -10.431 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.365 6.071 -9.270 1.00 0.00 H new ATOM 0 HD2 TYR A 17 4.434 6.391 -10.974 1.00 0.00 H new ATOM 0 HE1 TYR A 17 8.801 8.448 -9.826 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.874 8.767 -11.539 1.00 0.00 H new ATOM 0 HH TYR A 17 6.327 10.464 -11.477 1.00 0.00 H new ATOM 276 N ILE A 18 4.101 2.667 -7.803 1.00 0.00 N ATOM 277 CA ILE A 18 3.751 1.231 -7.594 1.00 0.00 C ATOM 278 C ILE A 18 3.256 0.682 -8.936 1.00 0.00 C ATOM 279 O ILE A 18 2.609 1.384 -9.686 1.00 0.00 O ATOM 280 CB ILE A 18 2.653 1.116 -6.519 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.528 -0.348 -6.045 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.308 1.586 -7.092 1.00 0.00 C ATOM 283 CD1 ILE A 18 3.588 -0.662 -4.978 1.00 0.00 C ATOM 0 H ILE A 18 3.322 3.321 -7.728 1.00 0.00 H new ATOM 0 HA ILE A 18 4.614 0.661 -7.251 1.00 0.00 H new ATOM 0 HB ILE A 18 2.924 1.746 -5.672 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.532 -0.521 -5.638 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.647 -1.022 -6.893 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.537 1.502 -6.326 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.391 2.625 -7.410 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.040 0.965 -7.947 1.00 0.00 H new ATOM 0 HD11 ILE A 18 3.484 -1.698 -4.656 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.583 -0.510 -5.397 1.00 0.00 H new ATOM 0 HD13 ILE A 18 3.450 -0.001 -4.123 1.00 0.00 H new ATOM 295 N GLU A 19 3.564 -0.547 -9.269 1.00 0.00 N ATOM 296 CA GLU A 19 3.111 -1.084 -10.592 1.00 0.00 C ATOM 297 C GLU A 19 2.840 -2.585 -10.508 1.00 0.00 C ATOM 298 O GLU A 19 3.582 -3.335 -9.905 1.00 0.00 O ATOM 299 CB GLU A 19 4.206 -0.837 -11.628 1.00 0.00 C ATOM 300 CG GLU A 19 3.689 -1.202 -13.021 1.00 0.00 C ATOM 301 CD GLU A 19 4.797 -0.976 -14.052 1.00 0.00 C ATOM 302 OE1 GLU A 19 5.902 -1.433 -13.813 1.00 0.00 O ATOM 303 OE2 GLU A 19 4.520 -0.350 -15.062 1.00 0.00 O ATOM 0 H GLU A 19 4.101 -1.195 -8.693 1.00 0.00 H new ATOM 0 HA GLU A 19 2.189 -0.577 -10.877 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.512 0.209 -11.606 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.087 -1.432 -11.389 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.367 -2.243 -13.040 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.818 -0.595 -13.268 1.00 0.00 H new ATOM 310 N ILE A 20 1.779 -3.024 -11.134 1.00 0.00 N ATOM 311 CA ILE A 20 1.430 -4.473 -11.133 1.00 0.00 C ATOM 312 C ILE A 20 0.697 -4.780 -12.456 1.00 0.00 C ATOM 313 O ILE A 20 -0.249 -4.099 -12.798 1.00 0.00 O ATOM 314 CB ILE A 20 0.517 -4.770 -9.922 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.380 -4.780 -8.646 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.176 -6.139 -10.092 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.571 -5.217 -7.413 1.00 0.00 C ATOM 0 H ILE A 20 1.132 -2.430 -11.653 1.00 0.00 H new ATOM 0 HA ILE A 20 2.321 -5.096 -11.053 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.253 -4.001 -9.850 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.225 -5.454 -8.784 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.791 -3.785 -8.477 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.815 -6.333 -9.231 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.781 -6.130 -10.998 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.579 -6.922 -10.167 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.216 -5.211 -6.534 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.259 -4.527 -7.259 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.182 -6.223 -7.571 1.00 0.00 H new ATOM 329 N PRO A 21 1.115 -5.782 -13.205 1.00 0.00 N ATOM 330 CA PRO A 21 0.454 -6.127 -14.500 1.00 0.00 C ATOM 331 C PRO A 21 -0.878 -6.858 -14.295 1.00 0.00 C ATOM 332 O PRO A 21 -1.862 -6.565 -14.943 1.00 0.00 O ATOM 333 CB PRO A 21 1.477 -7.037 -15.189 1.00 0.00 C ATOM 334 CG PRO A 21 2.191 -7.715 -14.065 1.00 0.00 C ATOM 335 CD PRO A 21 2.244 -6.694 -12.922 1.00 0.00 C ATOM 0 HA PRO A 21 0.200 -5.241 -15.081 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.989 -7.760 -15.843 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.166 -6.462 -15.808 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.665 -8.619 -13.757 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.194 -8.017 -14.366 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.134 -7.176 -11.951 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.194 -6.160 -12.907 1.00 0.00 H new ATOM 343 N ASP A 22 -0.915 -7.807 -13.399 1.00 0.00 N ATOM 344 CA ASP A 22 -2.182 -8.551 -13.160 1.00 0.00 C ATOM 345 C ASP A 22 -3.322 -7.552 -12.952 1.00 0.00 C ATOM 346 O ASP A 22 -4.467 -7.833 -13.243 1.00 0.00 O ATOM 347 CB ASP A 22 -2.035 -9.431 -11.916 1.00 0.00 C ATOM 348 CG ASP A 22 -3.158 -10.471 -11.891 1.00 0.00 C ATOM 349 OD1 ASP A 22 -4.146 -10.263 -12.573 1.00 0.00 O ATOM 350 OD2 ASP A 22 -3.007 -11.459 -11.189 1.00 0.00 O ATOM 0 H ASP A 22 -0.124 -8.098 -12.824 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.403 -9.182 -14.021 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.065 -9.928 -11.921 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.074 -8.817 -11.016 1.00 0.00 H new ATOM 355 N ALA A 23 -3.007 -6.382 -12.453 1.00 0.00 N ATOM 356 CA ALA A 23 -4.052 -5.336 -12.220 1.00 0.00 C ATOM 357 C ALA A 23 -3.798 -4.164 -13.167 1.00 0.00 C ATOM 358 O ALA A 23 -4.432 -3.132 -13.077 1.00 0.00 O ATOM 359 CB ALA A 23 -3.959 -4.847 -10.774 1.00 0.00 C ATOM 0 H ALA A 23 -2.060 -6.104 -12.194 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.043 -5.752 -12.402 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.718 -4.085 -10.598 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.122 -5.684 -10.096 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.971 -4.423 -10.596 1.00 0.00 H new ATOM 365 N ASP A 24 -2.864 -4.318 -14.071 1.00 0.00 N ATOM 366 CA ASP A 24 -2.544 -3.223 -15.036 1.00 0.00 C ATOM 367 C ASP A 24 -2.494 -1.878 -14.301 1.00 0.00 C ATOM 368 O ASP A 24 -2.792 -0.840 -14.859 1.00 0.00 O ATOM 369 CB ASP A 24 -3.611 -3.184 -16.137 1.00 0.00 C ATOM 370 CG ASP A 24 -4.930 -2.637 -15.581 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.040 -1.429 -15.456 1.00 0.00 O ATOM 372 OD2 ASP A 24 -5.804 -3.436 -15.292 1.00 0.00 O ATOM 0 H ASP A 24 -2.304 -5.164 -14.183 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.570 -3.411 -15.488 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.269 -2.559 -16.962 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.765 -4.185 -16.539 1.00 0.00 H new ATOM 377 N ILE A 25 -2.120 -1.892 -13.048 1.00 0.00 N ATOM 378 CA ILE A 25 -2.049 -0.624 -12.258 1.00 0.00 C ATOM 379 C ILE A 25 -0.629 -0.047 -12.328 1.00 0.00 C ATOM 380 O ILE A 25 0.356 -0.758 -12.364 1.00 0.00 O ATOM 381 CB ILE A 25 -2.482 -0.929 -10.799 1.00 0.00 C ATOM 382 CG1 ILE A 25 -4.003 -0.718 -10.673 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.748 -0.025 -9.793 1.00 0.00 C ATOM 384 CD1 ILE A 25 -4.497 -1.245 -9.326 1.00 0.00 C ATOM 0 H ILE A 25 -1.859 -2.733 -12.533 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.723 0.127 -12.670 1.00 0.00 H new ATOM 0 HB ILE A 25 -2.222 -1.962 -10.570 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.240 0.342 -10.767 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.518 -1.232 -11.484 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -2.075 -0.266 -8.781 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.673 -0.187 -9.875 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.975 1.019 -10.009 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.573 -1.091 -9.248 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.276 -2.310 -9.249 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.994 -0.711 -8.520 1.00 0.00 H new ATOM 396 N LYS A 26 -0.543 1.255 -12.343 1.00 0.00 N ATOM 397 CA LYS A 26 0.769 1.949 -12.406 1.00 0.00 C ATOM 398 C LYS A 26 0.519 3.390 -11.981 1.00 0.00 C ATOM 399 O LYS A 26 0.210 4.241 -12.791 1.00 0.00 O ATOM 400 CB LYS A 26 1.314 1.914 -13.835 1.00 0.00 C ATOM 401 CG LYS A 26 2.783 2.353 -13.828 1.00 0.00 C ATOM 402 CD LYS A 26 3.394 2.203 -15.235 1.00 0.00 C ATOM 403 CE LYS A 26 3.120 3.459 -16.069 1.00 0.00 C ATOM 404 NZ LYS A 26 4.075 4.534 -15.675 1.00 0.00 N ATOM 0 H LYS A 26 -1.349 1.879 -12.313 1.00 0.00 H new ATOM 0 HA LYS A 26 1.500 1.466 -11.758 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.225 0.908 -14.246 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.729 2.573 -14.476 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.858 3.390 -13.500 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.346 1.752 -13.114 1.00 0.00 H new ATOM 0 HD2 LYS A 26 4.468 2.037 -15.157 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.972 1.329 -15.731 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.226 3.234 -17.130 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.094 3.794 -15.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 4.006 5.323 -16.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 3.842 4.872 -14.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 5.044 4.157 -15.682 1.00 0.00 H new ATOM 418 N GLU A 27 0.588 3.654 -10.704 1.00 0.00 N ATOM 419 CA GLU A 27 0.287 5.026 -10.196 1.00 0.00 C ATOM 420 C GLU A 27 1.295 5.444 -9.106 1.00 0.00 C ATOM 421 O GLU A 27 1.942 4.616 -8.500 1.00 0.00 O ATOM 422 CB GLU A 27 -1.130 4.972 -9.600 1.00 0.00 C ATOM 423 CG GLU A 27 -2.174 5.344 -10.662 1.00 0.00 C ATOM 424 CD GLU A 27 -3.565 5.358 -10.028 1.00 0.00 C ATOM 425 OE1 GLU A 27 -3.836 6.266 -9.260 1.00 0.00 O ATOM 426 OE2 GLU A 27 -4.337 4.459 -10.320 1.00 0.00 O ATOM 0 H GLU A 27 0.841 2.975 -9.986 1.00 0.00 H new ATOM 0 HA GLU A 27 0.358 5.756 -11.002 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.332 3.972 -9.217 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.202 5.657 -8.755 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -1.946 6.323 -11.084 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.144 4.628 -11.483 1.00 0.00 H new ATOM 433 N PRO A 28 1.414 6.735 -8.860 1.00 0.00 N ATOM 434 CA PRO A 28 2.344 7.285 -7.823 1.00 0.00 C ATOM 435 C PRO A 28 1.821 7.115 -6.389 1.00 0.00 C ATOM 436 O PRO A 28 0.640 6.950 -6.157 1.00 0.00 O ATOM 437 CB PRO A 28 2.422 8.774 -8.181 1.00 0.00 C ATOM 438 CG PRO A 28 1.093 9.081 -8.786 1.00 0.00 C ATOM 439 CD PRO A 28 0.683 7.822 -9.552 1.00 0.00 C ATOM 0 HA PRO A 28 3.302 6.766 -7.831 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.607 9.386 -7.298 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.233 8.972 -8.882 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.361 9.327 -8.017 1.00 0.00 H new ATOM 0 HG3 PRO A 28 1.156 9.941 -9.453 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.395 7.665 -9.516 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.961 7.885 -10.604 1.00 0.00 H new ATOM 447 N VAL A 29 2.709 7.170 -5.428 1.00 0.00 N ATOM 448 CA VAL A 29 2.306 7.032 -3.992 1.00 0.00 C ATOM 449 C VAL A 29 3.037 8.102 -3.165 1.00 0.00 C ATOM 450 O VAL A 29 4.185 7.933 -2.808 1.00 0.00 O ATOM 451 CB VAL A 29 2.714 5.639 -3.495 1.00 0.00 C ATOM 452 CG1 VAL A 29 2.001 5.322 -2.177 1.00 0.00 C ATOM 453 CG2 VAL A 29 2.340 4.590 -4.547 1.00 0.00 C ATOM 0 H VAL A 29 3.709 7.306 -5.578 1.00 0.00 H new ATOM 0 HA VAL A 29 1.228 7.160 -3.889 1.00 0.00 H new ATOM 0 HB VAL A 29 3.791 5.621 -3.329 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.297 4.331 -1.832 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.275 6.064 -1.427 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.922 5.345 -2.332 1.00 0.00 H new ATOM 0 HG21 VAL A 29 2.630 3.601 -4.193 1.00 0.00 H new ATOM 0 HG22 VAL A 29 1.264 4.613 -4.717 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.860 4.809 -5.480 1.00 0.00 H new ATOM 463 N TYR A 30 2.394 9.206 -2.856 1.00 0.00 N ATOM 464 CA TYR A 30 3.091 10.266 -2.055 1.00 0.00 C ATOM 465 C TYR A 30 3.146 9.830 -0.584 1.00 0.00 C ATOM 466 O TYR A 30 2.518 8.872 -0.196 1.00 0.00 O ATOM 467 CB TYR A 30 2.348 11.628 -2.165 1.00 0.00 C ATOM 468 CG TYR A 30 1.204 11.538 -3.142 1.00 0.00 C ATOM 469 CD1 TYR A 30 1.423 11.804 -4.496 1.00 0.00 C ATOM 470 CD2 TYR A 30 -0.078 11.205 -2.689 1.00 0.00 C ATOM 471 CE1 TYR A 30 0.362 11.736 -5.402 1.00 0.00 C ATOM 472 CE2 TYR A 30 -1.144 11.137 -3.592 1.00 0.00 C ATOM 473 CZ TYR A 30 -0.924 11.402 -4.953 1.00 0.00 C ATOM 474 OH TYR A 30 -1.971 11.339 -5.847 1.00 0.00 O ATOM 0 H TYR A 30 1.431 9.417 -3.119 1.00 0.00 H new ATOM 0 HA TYR A 30 4.099 10.394 -2.448 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.972 11.922 -1.185 1.00 0.00 H new ATOM 0 HB3 TYR A 30 3.045 12.402 -2.485 1.00 0.00 H new ATOM 0 HD1 TYR A 30 2.413 12.062 -4.842 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -0.244 11.000 -1.642 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.532 11.941 -6.449 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.134 10.881 -3.243 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.633 11.077 -6.729 1.00 0.00 H new ATOM 484 N PRO A 31 3.877 10.537 0.236 1.00 0.00 N ATOM 485 CA PRO A 31 3.979 10.213 1.676 1.00 0.00 C ATOM 486 C PRO A 31 2.914 10.935 2.504 1.00 0.00 C ATOM 487 O PRO A 31 2.307 11.886 2.052 1.00 0.00 O ATOM 488 CB PRO A 31 5.366 10.727 2.028 1.00 0.00 C ATOM 489 CG PRO A 31 5.519 11.960 1.190 1.00 0.00 C ATOM 490 CD PRO A 31 4.703 11.715 -0.096 1.00 0.00 C ATOM 0 HA PRO A 31 3.827 9.154 1.883 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.450 10.954 3.091 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.135 9.990 1.798 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.153 12.839 1.721 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.568 12.143 0.956 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.087 12.578 -0.350 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.351 11.522 -0.951 1.00 0.00 H new ATOM 498 N GLY A 32 2.696 10.497 3.719 1.00 0.00 N ATOM 499 CA GLY A 32 1.682 11.161 4.598 1.00 0.00 C ATOM 500 C GLY A 32 0.737 10.119 5.190 1.00 0.00 C ATOM 501 O GLY A 32 0.758 8.964 4.816 1.00 0.00 O ATOM 0 H GLY A 32 3.179 9.704 4.143 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.184 11.704 5.399 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.115 11.893 4.023 1.00 0.00 H new ATOM 505 N PRO A 33 -0.099 10.536 6.106 1.00 0.00 N ATOM 506 CA PRO A 33 -1.086 9.640 6.761 1.00 0.00 C ATOM 507 C PRO A 33 -2.292 9.395 5.859 1.00 0.00 C ATOM 508 O PRO A 33 -2.972 10.318 5.466 1.00 0.00 O ATOM 509 CB PRO A 33 -1.486 10.416 8.018 1.00 0.00 C ATOM 510 CG PRO A 33 -1.355 11.854 7.626 1.00 0.00 C ATOM 511 CD PRO A 33 -0.196 11.916 6.620 1.00 0.00 C ATOM 0 HA PRO A 33 -0.683 8.651 6.980 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.505 10.179 8.324 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.836 10.173 8.859 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.279 12.222 7.180 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.150 12.478 8.496 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.399 12.627 5.819 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.732 12.231 7.098 1.00 0.00 H new ATOM 519 N ALA A 34 -2.543 8.161 5.521 1.00 0.00 N ATOM 520 CA ALA A 34 -3.699 7.836 4.624 1.00 0.00 C ATOM 521 C ALA A 34 -4.934 8.670 5.007 1.00 0.00 C ATOM 522 O ALA A 34 -5.771 8.240 5.776 1.00 0.00 O ATOM 523 CB ALA A 34 -4.022 6.331 4.741 1.00 0.00 C ATOM 0 H ALA A 34 -1.997 7.356 5.827 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.431 8.077 3.595 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.862 6.088 4.091 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.151 5.748 4.442 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -4.281 6.094 5.773 1.00 0.00 H new ATOM 529 N THR A 35 -5.053 9.853 4.457 1.00 0.00 N ATOM 530 CA THR A 35 -6.232 10.729 4.756 1.00 0.00 C ATOM 531 C THR A 35 -7.137 10.780 3.506 1.00 0.00 C ATOM 532 O THR A 35 -6.683 11.151 2.444 1.00 0.00 O ATOM 533 CB THR A 35 -5.741 12.148 5.072 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.667 12.477 4.202 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.259 12.223 6.524 1.00 0.00 C ATOM 0 H THR A 35 -4.377 10.255 3.807 1.00 0.00 H new ATOM 0 HA THR A 35 -6.784 10.333 5.608 1.00 0.00 H new ATOM 0 HB THR A 35 -6.561 12.852 4.930 1.00 0.00 H new ATOM 0 HG1 THR A 35 -4.352 13.384 4.400 1.00 0.00 H new ATOM 0 HG21 THR A 35 -4.912 13.233 6.740 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.081 11.970 7.194 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.440 11.519 6.672 1.00 0.00 H new ATOM 543 N PRO A 36 -8.401 10.425 3.609 1.00 0.00 N ATOM 544 CA PRO A 36 -9.325 10.460 2.439 1.00 0.00 C ATOM 545 C PRO A 36 -9.138 11.720 1.590 1.00 0.00 C ATOM 546 O PRO A 36 -9.115 11.668 0.375 1.00 0.00 O ATOM 547 CB PRO A 36 -10.711 10.452 3.085 1.00 0.00 C ATOM 548 CG PRO A 36 -10.530 9.686 4.353 1.00 0.00 C ATOM 549 CD PRO A 36 -9.094 9.954 4.824 1.00 0.00 C ATOM 0 HA PRO A 36 -9.153 9.628 1.756 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.063 11.465 3.280 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -11.448 9.978 2.437 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -11.251 10.006 5.105 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -10.692 8.621 4.189 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -9.067 10.704 5.615 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.630 9.052 5.224 1.00 0.00 H new ATOM 557 N GLU A 37 -9.007 12.853 2.221 1.00 0.00 N ATOM 558 CA GLU A 37 -8.824 14.113 1.454 1.00 0.00 C ATOM 559 C GLU A 37 -7.510 14.041 0.683 1.00 0.00 C ATOM 560 O GLU A 37 -7.272 14.801 -0.233 1.00 0.00 O ATOM 561 CB GLU A 37 -8.785 15.301 2.418 1.00 0.00 C ATOM 562 CG GLU A 37 -7.853 14.977 3.588 1.00 0.00 C ATOM 563 CD GLU A 37 -7.541 16.258 4.365 1.00 0.00 C ATOM 564 OE1 GLU A 37 -6.877 17.118 3.811 1.00 0.00 O ATOM 565 OE2 GLU A 37 -7.970 16.356 5.503 1.00 0.00 O ATOM 0 H GLU A 37 -9.019 12.960 3.235 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.653 14.242 0.759 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.437 16.194 1.898 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.788 15.517 2.787 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -8.320 14.245 4.247 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.930 14.530 3.218 1.00 0.00 H new ATOM 572 N GLN A 38 -6.650 13.128 1.052 1.00 0.00 N ATOM 573 CA GLN A 38 -5.334 13.000 0.345 1.00 0.00 C ATOM 574 C GLN A 38 -5.422 11.896 -0.715 1.00 0.00 C ATOM 575 O GLN A 38 -5.395 12.162 -1.899 1.00 0.00 O ATOM 576 CB GLN A 38 -4.240 12.657 1.367 1.00 0.00 C ATOM 577 CG GLN A 38 -2.850 12.550 0.675 1.00 0.00 C ATOM 578 CD GLN A 38 -2.203 11.195 0.989 1.00 0.00 C ATOM 579 OE1 GLN A 38 -2.933 10.116 0.934 1.00 0.00 O flip ATOM 580 NE2 GLN A 38 -1.027 11.122 1.286 1.00 0.00 N flip ATOM 0 H GLN A 38 -6.799 12.464 1.812 1.00 0.00 H new ATOM 0 HA GLN A 38 -5.089 13.943 -0.144 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.207 13.423 2.142 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.479 11.715 1.860 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.963 12.666 -0.403 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -2.203 13.358 1.017 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -0.458 11.968 1.328 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -0.609 10.215 1.493 1.00 0.00 H new ATOM 589 N LEU A 39 -5.520 10.659 -0.299 1.00 0.00 N ATOM 590 CA LEU A 39 -5.603 9.538 -1.280 1.00 0.00 C ATOM 591 C LEU A 39 -6.590 9.894 -2.390 1.00 0.00 C ATOM 592 O LEU A 39 -6.574 9.312 -3.456 1.00 0.00 O ATOM 593 CB LEU A 39 -6.083 8.264 -0.582 1.00 0.00 C ATOM 594 CG LEU A 39 -5.179 7.935 0.615 1.00 0.00 C ATOM 595 CD1 LEU A 39 -5.886 6.931 1.527 1.00 0.00 C ATOM 596 CD2 LEU A 39 -3.858 7.326 0.128 1.00 0.00 C ATOM 0 H LEU A 39 -5.546 10.378 0.681 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.613 9.372 -1.704 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.111 8.392 -0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.080 7.433 -1.287 1.00 0.00 H new ATOM 0 HG LEU A 39 -4.971 8.854 1.163 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.245 6.697 2.377 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.821 7.361 1.886 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.097 6.018 0.969 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.225 7.097 0.985 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.062 6.411 -0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.347 8.037 -0.521 1.00 0.00 H new ATOM 608 N ASN A 40 -7.439 10.854 -2.159 1.00 0.00 N ATOM 609 CA ASN A 40 -8.407 11.244 -3.215 1.00 0.00 C ATOM 610 C ASN A 40 -7.608 11.747 -4.413 1.00 0.00 C ATOM 611 O ASN A 40 -8.051 11.702 -5.543 1.00 0.00 O ATOM 612 CB ASN A 40 -9.315 12.363 -2.687 1.00 0.00 C ATOM 613 CG ASN A 40 -10.528 11.763 -1.967 1.00 0.00 C ATOM 614 OD1 ASN A 40 -10.594 10.568 -1.756 1.00 0.00 O ATOM 615 ND2 ASN A 40 -11.496 12.549 -1.580 1.00 0.00 N ATOM 0 H ASN A 40 -7.504 11.382 -1.289 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.029 10.396 -3.502 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.757 13.003 -2.004 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.647 12.992 -3.513 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -12.308 12.160 -1.100 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.440 13.552 -1.757 1.00 0.00 H new ATOM 622 N ARG A 41 -6.420 12.212 -4.160 1.00 0.00 N ATOM 623 CA ARG A 41 -5.557 12.709 -5.264 1.00 0.00 C ATOM 624 C ARG A 41 -4.851 11.512 -5.896 1.00 0.00 C ATOM 625 O ARG A 41 -4.284 11.601 -6.966 1.00 0.00 O ATOM 626 CB ARG A 41 -4.515 13.681 -4.703 1.00 0.00 C ATOM 627 CG ARG A 41 -5.205 14.972 -4.253 1.00 0.00 C ATOM 628 CD ARG A 41 -4.265 15.759 -3.336 1.00 0.00 C ATOM 629 NE ARG A 41 -4.783 17.144 -3.155 1.00 0.00 N ATOM 630 CZ ARG A 41 -4.324 17.889 -2.187 1.00 0.00 C ATOM 631 NH1 ARG A 41 -3.409 17.421 -1.383 1.00 0.00 N ATOM 632 NH2 ARG A 41 -4.775 19.103 -2.024 1.00 0.00 N ATOM 0 H ARG A 41 -6.006 12.270 -3.229 1.00 0.00 H new ATOM 0 HA ARG A 41 -6.160 13.228 -6.009 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.992 13.224 -3.863 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.765 13.903 -5.462 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.474 15.575 -5.120 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -6.131 14.738 -3.728 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.184 15.262 -2.369 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.263 15.788 -3.765 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.495 17.509 -3.787 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.053 16.474 -1.512 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.049 18.002 -0.626 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.488 19.471 -2.654 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.415 19.683 -1.267 1.00 0.00 H new ATOM 646 N GLY A 42 -4.888 10.387 -5.232 1.00 0.00 N ATOM 647 CA GLY A 42 -4.225 9.172 -5.788 1.00 0.00 C ATOM 648 C GLY A 42 -3.936 8.173 -4.664 1.00 0.00 C ATOM 649 O GLY A 42 -4.825 7.754 -3.949 1.00 0.00 O ATOM 0 H GLY A 42 -5.348 10.257 -4.331 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.865 8.711 -6.540 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.296 9.450 -6.286 1.00 0.00 H new ATOM 653 N VAL A 43 -2.694 7.776 -4.520 1.00 0.00 N ATOM 654 CA VAL A 43 -2.316 6.783 -3.462 1.00 0.00 C ATOM 655 C VAL A 43 -1.261 7.389 -2.528 1.00 0.00 C ATOM 656 O VAL A 43 -0.564 8.321 -2.880 1.00 0.00 O ATOM 657 CB VAL A 43 -1.723 5.543 -4.145 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.727 4.358 -3.182 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.547 5.187 -5.379 1.00 0.00 C ATOM 0 H VAL A 43 -1.917 8.101 -5.096 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.198 6.515 -2.881 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.697 5.765 -4.440 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.304 3.485 -3.678 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.129 4.601 -2.303 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.750 4.141 -2.876 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.121 4.306 -5.859 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.575 4.977 -5.082 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.535 6.023 -6.078 1.00 0.00 H new ATOM 669 N SER A 44 -1.128 6.847 -1.346 1.00 0.00 N ATOM 670 CA SER A 44 -0.108 7.365 -0.391 1.00 0.00 C ATOM 671 C SER A 44 0.150 6.305 0.684 1.00 0.00 C ATOM 672 O SER A 44 -0.614 5.371 0.830 1.00 0.00 O ATOM 673 CB SER A 44 -0.617 8.647 0.266 1.00 0.00 C ATOM 674 OG SER A 44 -1.412 8.308 1.394 1.00 0.00 O ATOM 0 H SER A 44 -1.685 6.065 -1.001 1.00 0.00 H new ATOM 0 HA SER A 44 0.816 7.583 -0.926 1.00 0.00 H new ATOM 0 HB2 SER A 44 0.222 9.272 0.572 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.203 9.227 -0.446 1.00 0.00 H new ATOM 0 HG SER A 44 -2.217 8.867 1.407 1.00 0.00 H new ATOM 680 N PHE A 45 1.213 6.423 1.443 1.00 0.00 N ATOM 681 CA PHE A 45 1.469 5.391 2.489 1.00 0.00 C ATOM 682 C PHE A 45 0.294 5.361 3.463 1.00 0.00 C ATOM 683 O PHE A 45 -0.492 6.283 3.535 1.00 0.00 O ATOM 684 CB PHE A 45 2.758 5.688 3.275 1.00 0.00 C ATOM 685 CG PHE A 45 4.003 5.503 2.412 1.00 0.00 C ATOM 686 CD1 PHE A 45 4.207 4.326 1.664 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.966 6.522 2.370 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.363 4.185 0.884 1.00 0.00 C ATOM 689 CE2 PHE A 45 6.117 6.375 1.591 1.00 0.00 C ATOM 690 CZ PHE A 45 6.315 5.209 0.846 1.00 0.00 C ATOM 0 H PHE A 45 1.900 7.174 1.384 1.00 0.00 H new ATOM 0 HA PHE A 45 1.584 4.428 1.991 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.726 6.710 3.653 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.815 5.029 4.142 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.474 3.534 1.692 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.817 7.425 2.943 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.519 3.283 0.311 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.855 7.163 1.565 1.00 0.00 H new ATOM 0 HZ PHE A 45 7.203 5.099 0.241 1.00 0.00 H new ATOM 700 N ALA A 46 0.173 4.304 4.219 1.00 0.00 N ATOM 701 CA ALA A 46 -0.947 4.207 5.196 1.00 0.00 C ATOM 702 C ALA A 46 -0.567 4.948 6.478 1.00 0.00 C ATOM 703 O ALA A 46 -1.382 5.142 7.358 1.00 0.00 O ATOM 704 CB ALA A 46 -1.223 2.736 5.522 1.00 0.00 C ATOM 0 H ALA A 46 0.803 3.502 4.202 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.842 4.655 4.764 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.043 2.669 6.237 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.494 2.206 4.609 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.329 2.285 5.952 1.00 0.00 H new ATOM 710 N GLU A 47 0.668 5.361 6.594 1.00 0.00 N ATOM 711 CA GLU A 47 1.102 6.088 7.827 1.00 0.00 C ATOM 712 C GLU A 47 2.164 7.135 7.476 1.00 0.00 C ATOM 713 O GLU A 47 2.989 6.938 6.606 1.00 0.00 O ATOM 714 CB GLU A 47 1.685 5.091 8.823 1.00 0.00 C ATOM 715 CG GLU A 47 0.676 3.969 9.079 1.00 0.00 C ATOM 716 CD GLU A 47 1.150 3.112 10.253 1.00 0.00 C ATOM 717 OE1 GLU A 47 2.233 2.558 10.157 1.00 0.00 O ATOM 718 OE2 GLU A 47 0.424 3.024 11.229 1.00 0.00 O ATOM 0 H GLU A 47 1.395 5.227 5.891 1.00 0.00 H new ATOM 0 HA GLU A 47 0.240 6.589 8.267 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.615 4.676 8.435 1.00 0.00 H new ATOM 0 HB3 GLU A 47 1.927 5.596 9.758 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -0.305 4.391 9.296 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.567 3.353 8.186 1.00 0.00 H new ATOM 725 N GLU A 48 2.135 8.251 8.151 1.00 0.00 N ATOM 726 CA GLU A 48 3.121 9.338 7.880 1.00 0.00 C ATOM 727 C GLU A 48 4.556 8.875 8.181 1.00 0.00 C ATOM 728 O GLU A 48 5.508 9.402 7.641 1.00 0.00 O ATOM 729 CB GLU A 48 2.786 10.540 8.765 1.00 0.00 C ATOM 730 CG GLU A 48 3.067 10.199 10.230 1.00 0.00 C ATOM 731 CD GLU A 48 2.411 11.244 11.134 1.00 0.00 C ATOM 732 OE1 GLU A 48 1.254 11.557 10.901 1.00 0.00 O ATOM 733 OE2 GLU A 48 3.075 11.717 12.041 1.00 0.00 O ATOM 0 H GLU A 48 1.462 8.459 8.888 1.00 0.00 H new ATOM 0 HA GLU A 48 3.062 9.607 6.825 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.380 11.403 8.463 1.00 0.00 H new ATOM 0 HB3 GLU A 48 1.738 10.814 8.640 1.00 0.00 H new ATOM 0 HG2 GLU A 48 2.681 9.207 10.464 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.142 10.172 10.408 1.00 0.00 H new ATOM 740 N ASN A 49 4.725 7.920 9.059 1.00 0.00 N ATOM 741 CA ASN A 49 6.108 7.462 9.413 1.00 0.00 C ATOM 742 C ASN A 49 6.574 6.360 8.457 1.00 0.00 C ATOM 743 O ASN A 49 7.647 5.811 8.610 1.00 0.00 O ATOM 744 CB ASN A 49 6.106 6.918 10.842 1.00 0.00 C ATOM 745 CG ASN A 49 7.547 6.770 11.335 1.00 0.00 C ATOM 746 OD1 ASN A 49 8.428 7.485 10.903 1.00 0.00 O ATOM 747 ND2 ASN A 49 7.826 5.861 12.231 1.00 0.00 N ATOM 0 H ASN A 49 3.970 7.437 9.546 1.00 0.00 H new ATOM 0 HA ASN A 49 6.789 8.309 9.331 1.00 0.00 H new ATOM 0 HB2 ASN A 49 5.554 7.591 11.498 1.00 0.00 H new ATOM 0 HB3 ASN A 49 5.599 5.954 10.874 1.00 0.00 H new ATOM 0 HD21 ASN A 49 8.783 5.753 12.567 1.00 0.00 H new ATOM 0 HD22 ASN A 49 7.087 5.260 12.595 1.00 0.00 H new ATOM 754 N GLU A 50 5.791 6.039 7.470 1.00 0.00 N ATOM 755 CA GLU A 50 6.204 4.982 6.507 1.00 0.00 C ATOM 756 C GLU A 50 7.437 5.451 5.740 1.00 0.00 C ATOM 757 O GLU A 50 7.706 6.630 5.629 1.00 0.00 O ATOM 758 CB GLU A 50 5.054 4.715 5.532 1.00 0.00 C ATOM 759 CG GLU A 50 5.253 3.360 4.848 1.00 0.00 C ATOM 760 CD GLU A 50 5.008 2.240 5.860 1.00 0.00 C ATOM 761 OE1 GLU A 50 3.863 1.849 6.015 1.00 0.00 O ATOM 762 OE2 GLU A 50 5.968 1.792 6.463 1.00 0.00 O ATOM 0 H GLU A 50 4.881 6.462 7.287 1.00 0.00 H new ATOM 0 HA GLU A 50 6.444 4.064 7.043 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.104 4.726 6.066 1.00 0.00 H new ATOM 0 HB3 GLU A 50 5.009 5.506 4.784 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.568 3.261 4.006 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.264 3.288 4.446 1.00 0.00 H new ATOM 769 N SER A 51 8.184 4.529 5.207 1.00 0.00 N ATOM 770 CA SER A 51 9.403 4.893 4.437 1.00 0.00 C ATOM 771 C SER A 51 9.613 3.860 3.332 1.00 0.00 C ATOM 772 O SER A 51 8.851 2.924 3.188 1.00 0.00 O ATOM 773 CB SER A 51 10.614 4.898 5.371 1.00 0.00 C ATOM 774 OG SER A 51 10.335 5.722 6.495 1.00 0.00 O ATOM 0 H SER A 51 8.000 3.528 5.272 1.00 0.00 H new ATOM 0 HA SER A 51 9.285 5.884 4.000 1.00 0.00 H new ATOM 0 HB2 SER A 51 10.841 3.883 5.697 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.493 5.268 4.844 1.00 0.00 H new ATOM 0 HG SER A 51 10.233 5.163 7.293 1.00 0.00 H new ATOM 780 N LEU A 52 10.644 4.019 2.554 1.00 0.00 N ATOM 781 CA LEU A 52 10.918 3.056 1.462 1.00 0.00 C ATOM 782 C LEU A 52 11.835 1.961 2.003 1.00 0.00 C ATOM 783 O LEU A 52 12.463 1.235 1.256 1.00 0.00 O ATOM 784 CB LEU A 52 11.612 3.789 0.307 1.00 0.00 C ATOM 785 CG LEU A 52 10.930 5.156 0.062 1.00 0.00 C ATOM 786 CD1 LEU A 52 11.367 6.209 1.119 1.00 0.00 C ATOM 787 CD2 LEU A 52 11.289 5.654 -1.348 1.00 0.00 C ATOM 0 H LEU A 52 11.314 4.784 2.631 1.00 0.00 H new ATOM 0 HA LEU A 52 9.989 2.616 1.100 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.667 3.936 0.540 1.00 0.00 H new ATOM 0 HB3 LEU A 52 11.567 3.183 -0.598 1.00 0.00 H new ATOM 0 HG LEU A 52 9.852 5.023 0.151 1.00 0.00 H new ATOM 0 HD11 LEU A 52 10.869 7.157 0.916 1.00 0.00 H new ATOM 0 HD12 LEU A 52 11.093 5.861 2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 52 12.447 6.349 1.068 1.00 0.00 H new ATOM 0 HD21 LEU A 52 10.811 6.617 -1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 52 12.370 5.765 -1.430 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.941 4.934 -2.088 1.00 0.00 H new ATOM 799 N ASP A 53 11.924 1.845 3.305 1.00 0.00 N ATOM 800 CA ASP A 53 12.807 0.807 3.914 1.00 0.00 C ATOM 801 C ASP A 53 12.133 0.197 5.146 1.00 0.00 C ATOM 802 O ASP A 53 12.681 -0.681 5.782 1.00 0.00 O ATOM 803 CB ASP A 53 14.131 1.448 4.335 1.00 0.00 C ATOM 804 CG ASP A 53 13.852 2.692 5.179 1.00 0.00 C ATOM 805 OD1 ASP A 53 12.951 3.435 4.825 1.00 0.00 O ATOM 806 OD2 ASP A 53 14.544 2.881 6.166 1.00 0.00 O ATOM 0 H ASP A 53 11.420 2.428 3.974 1.00 0.00 H new ATOM 0 HA ASP A 53 12.989 0.023 3.179 1.00 0.00 H new ATOM 0 HB2 ASP A 53 14.727 0.735 4.905 1.00 0.00 H new ATOM 0 HB3 ASP A 53 14.713 1.717 3.454 1.00 0.00 H new ATOM 811 N ASP A 54 10.954 0.641 5.498 1.00 0.00 N ATOM 812 CA ASP A 54 10.288 0.056 6.694 1.00 0.00 C ATOM 813 C ASP A 54 10.136 -1.456 6.491 1.00 0.00 C ATOM 814 O ASP A 54 9.421 -1.902 5.615 1.00 0.00 O ATOM 815 CB ASP A 54 8.908 0.691 6.870 1.00 0.00 C ATOM 816 CG ASP A 54 8.354 0.344 8.252 1.00 0.00 C ATOM 817 OD1 ASP A 54 9.034 -0.359 8.983 1.00 0.00 O ATOM 818 OD2 ASP A 54 7.259 0.785 8.558 1.00 0.00 O ATOM 0 H ASP A 54 10.432 1.373 5.016 1.00 0.00 H new ATOM 0 HA ASP A 54 10.888 0.249 7.583 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.978 1.773 6.757 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.230 0.332 6.095 1.00 0.00 H new ATOM 823 N GLN A 55 10.809 -2.247 7.295 1.00 0.00 N ATOM 824 CA GLN A 55 10.712 -3.737 7.156 1.00 0.00 C ATOM 825 C GLN A 55 9.253 -4.134 6.929 1.00 0.00 C ATOM 826 O GLN A 55 8.957 -5.194 6.413 1.00 0.00 O ATOM 827 CB GLN A 55 11.233 -4.403 8.433 1.00 0.00 C ATOM 828 CG GLN A 55 10.706 -3.647 9.652 1.00 0.00 C ATOM 829 CD GLN A 55 10.917 -4.492 10.910 1.00 0.00 C ATOM 830 OE1 GLN A 55 10.008 -5.365 11.255 1.00 0.00 O flip ATOM 831 NE2 GLN A 55 11.918 -4.359 11.586 1.00 0.00 N flip ATOM 0 H GLN A 55 11.423 -1.924 8.043 1.00 0.00 H new ATOM 0 HA GLN A 55 11.312 -4.064 6.307 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.912 -5.444 8.470 1.00 0.00 H new ATOM 0 HB3 GLN A 55 12.323 -4.405 8.436 1.00 0.00 H new ATOM 0 HG2 GLN A 55 11.223 -2.692 9.752 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.647 -3.424 9.525 1.00 0.00 H new ATOM 0 HE21 GLN A 55 12.628 -3.678 11.317 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.048 -4.929 12.422 1.00 0.00 H new ATOM 840 N ASN A 56 8.342 -3.272 7.295 1.00 0.00 N ATOM 841 CA ASN A 56 6.891 -3.554 7.092 1.00 0.00 C ATOM 842 C ASN A 56 6.240 -2.295 6.519 1.00 0.00 C ATOM 843 O ASN A 56 6.018 -1.321 7.210 1.00 0.00 O ATOM 844 CB ASN A 56 6.238 -3.927 8.430 1.00 0.00 C ATOM 845 CG ASN A 56 6.237 -2.718 9.365 1.00 0.00 C ATOM 846 OD1 ASN A 56 7.280 -2.268 9.797 1.00 0.00 O ATOM 847 ND2 ASN A 56 5.101 -2.168 9.695 1.00 0.00 N ATOM 0 H ASN A 56 8.545 -2.373 7.732 1.00 0.00 H new ATOM 0 HA ASN A 56 6.759 -4.390 6.405 1.00 0.00 H new ATOM 0 HB2 ASN A 56 5.217 -4.269 8.263 1.00 0.00 H new ATOM 0 HB3 ASN A 56 6.779 -4.753 8.891 1.00 0.00 H new ATOM 0 HD21 ASN A 56 5.087 -1.359 10.316 1.00 0.00 H new ATOM 0 HD22 ASN A 56 4.226 -2.547 9.332 1.00 0.00 H new ATOM 854 N ILE A 57 5.952 -2.296 5.248 1.00 0.00 N ATOM 855 CA ILE A 57 5.337 -1.091 4.618 1.00 0.00 C ATOM 856 C ILE A 57 3.818 -1.247 4.603 1.00 0.00 C ATOM 857 O ILE A 57 3.295 -2.343 4.645 1.00 0.00 O ATOM 858 CB ILE A 57 5.858 -0.957 3.186 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.351 -0.616 3.219 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.100 0.159 2.461 1.00 0.00 C ATOM 861 CD1 ILE A 57 7.948 -0.789 1.820 1.00 0.00 C ATOM 0 H ILE A 57 6.115 -3.080 4.616 1.00 0.00 H new ATOM 0 HA ILE A 57 5.600 -0.199 5.186 1.00 0.00 H new ATOM 0 HB ILE A 57 5.706 -1.898 2.658 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.493 0.409 3.562 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.867 -1.263 3.928 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.475 0.251 1.442 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.037 -0.080 2.437 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.248 1.101 2.988 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.010 -0.546 1.845 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.820 -1.821 1.495 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.440 -0.123 1.123 1.00 0.00 H new ATOM 873 N SER A 58 3.104 -0.153 4.548 1.00 0.00 N ATOM 874 CA SER A 58 1.613 -0.220 4.536 1.00 0.00 C ATOM 875 C SER A 58 1.071 0.849 3.587 1.00 0.00 C ATOM 876 O SER A 58 1.021 2.015 3.917 1.00 0.00 O ATOM 877 CB SER A 58 1.084 0.031 5.948 1.00 0.00 C ATOM 878 OG SER A 58 1.604 1.262 6.434 1.00 0.00 O ATOM 0 H SER A 58 3.492 0.789 4.511 1.00 0.00 H new ATOM 0 HA SER A 58 1.290 -1.205 4.199 1.00 0.00 H new ATOM 0 HB2 SER A 58 -0.006 0.061 5.940 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.375 -0.786 6.608 1.00 0.00 H new ATOM 0 HG SER A 58 2.546 1.146 6.677 1.00 0.00 H new ATOM 884 N ILE A 59 0.670 0.457 2.403 1.00 0.00 N ATOM 885 CA ILE A 59 0.134 1.448 1.419 1.00 0.00 C ATOM 886 C ILE A 59 -1.395 1.443 1.457 1.00 0.00 C ATOM 887 O ILE A 59 -2.017 0.515 1.936 1.00 0.00 O ATOM 888 CB ILE A 59 0.607 1.077 0.005 1.00 0.00 C ATOM 889 CG1 ILE A 59 2.121 1.281 -0.099 1.00 0.00 C ATOM 890 CG2 ILE A 59 -0.093 1.969 -1.025 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.632 0.653 -1.399 1.00 0.00 C ATOM 0 H ILE A 59 0.691 -0.509 2.075 1.00 0.00 H new ATOM 0 HA ILE A 59 0.499 2.441 1.679 1.00 0.00 H new ATOM 0 HB ILE A 59 0.363 0.033 -0.191 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.358 2.345 -0.079 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.620 0.827 0.757 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.245 1.703 -2.026 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.171 1.827 -0.956 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.149 3.013 -0.826 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.710 0.798 -1.474 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.408 -0.414 -1.400 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.142 1.127 -2.249 1.00 0.00 H new ATOM 903 N ALA A 60 -2.001 2.478 0.940 1.00 0.00 N ATOM 904 CA ALA A 60 -3.490 2.561 0.917 1.00 0.00 C ATOM 905 C ALA A 60 -3.907 3.271 -0.369 1.00 0.00 C ATOM 906 O ALA A 60 -3.338 4.281 -0.734 1.00 0.00 O ATOM 907 CB ALA A 60 -3.979 3.358 2.127 1.00 0.00 C ATOM 0 H ALA A 60 -1.522 3.279 0.528 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.925 1.562 0.955 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.067 3.417 2.108 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.659 2.862 3.043 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.560 4.364 2.094 1.00 0.00 H new ATOM 913 N GLY A 61 -4.883 2.756 -1.073 1.00 0.00 N ATOM 914 CA GLY A 61 -5.309 3.417 -2.349 1.00 0.00 C ATOM 915 C GLY A 61 -6.820 3.290 -2.530 1.00 0.00 C ATOM 916 O GLY A 61 -7.460 2.436 -1.950 1.00 0.00 O ATOM 0 H GLY A 61 -5.401 1.913 -0.824 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.024 4.469 -2.335 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.794 2.959 -3.194 1.00 0.00 H new ATOM 920 N HIS A 62 -7.392 4.147 -3.330 1.00 0.00 N ATOM 921 CA HIS A 62 -8.870 4.092 -3.553 1.00 0.00 C ATOM 922 C HIS A 62 -9.226 2.860 -4.398 1.00 0.00 C ATOM 923 O HIS A 62 -8.371 2.095 -4.789 1.00 0.00 O ATOM 924 CB HIS A 62 -9.328 5.379 -4.272 1.00 0.00 C ATOM 925 CG HIS A 62 -9.697 6.438 -3.264 1.00 0.00 C ATOM 926 ND1 HIS A 62 -10.998 6.614 -2.819 1.00 0.00 N ATOM 927 CD2 HIS A 62 -8.948 7.382 -2.611 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.992 7.632 -1.940 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.767 8.136 -1.776 1.00 0.00 N ATOM 0 H HIS A 62 -6.903 4.883 -3.840 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.379 4.016 -2.592 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.531 5.745 -4.919 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.184 5.162 -4.911 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.883 7.520 -2.727 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.871 7.997 -1.429 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -9.491 8.908 -1.169 1.00 0.00 H new ATOM 937 N THR A 63 -10.491 2.671 -4.685 1.00 0.00 N ATOM 938 CA THR A 63 -10.915 1.501 -5.505 1.00 0.00 C ATOM 939 C THR A 63 -12.288 1.790 -6.123 1.00 0.00 C ATOM 940 O THR A 63 -13.308 1.343 -5.636 1.00 0.00 O ATOM 941 CB THR A 63 -10.991 0.234 -4.637 1.00 0.00 C ATOM 942 OG1 THR A 63 -11.717 -0.766 -5.334 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.694 0.521 -3.311 1.00 0.00 C ATOM 0 H THR A 63 -11.250 3.282 -4.383 1.00 0.00 H new ATOM 0 HA THR A 63 -10.182 1.335 -6.295 1.00 0.00 H new ATOM 0 HB THR A 63 -9.976 -0.104 -4.430 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.652 -0.487 -5.427 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.735 -0.391 -2.716 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.142 1.286 -2.765 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.707 0.873 -3.505 1.00 0.00 H new ATOM 951 N PHE A 64 -12.323 2.538 -7.194 1.00 0.00 N ATOM 952 CA PHE A 64 -13.628 2.864 -7.845 1.00 0.00 C ATOM 953 C PHE A 64 -13.973 1.765 -8.856 1.00 0.00 C ATOM 954 O PHE A 64 -13.373 1.661 -9.905 1.00 0.00 O ATOM 955 CB PHE A 64 -13.512 4.217 -8.568 1.00 0.00 C ATOM 956 CG PHE A 64 -13.740 5.349 -7.587 1.00 0.00 C ATOM 957 CD1 PHE A 64 -12.924 5.467 -6.456 1.00 0.00 C ATOM 958 CD2 PHE A 64 -14.768 6.278 -7.807 1.00 0.00 C ATOM 959 CE1 PHE A 64 -13.133 6.511 -5.548 1.00 0.00 C ATOM 960 CE2 PHE A 64 -14.975 7.322 -6.897 1.00 0.00 C ATOM 961 CZ PHE A 64 -14.157 7.437 -5.768 1.00 0.00 C ATOM 0 H PHE A 64 -11.502 2.939 -7.648 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.413 2.925 -7.092 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.526 4.312 -9.023 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.243 4.271 -9.375 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -12.133 4.752 -6.284 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -15.400 6.188 -8.678 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -12.502 6.602 -4.676 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -15.766 8.038 -7.067 1.00 0.00 H new ATOM 0 HZ PHE A 64 -14.317 8.242 -5.066 1.00 0.00 H new ATOM 971 N ILE A 65 -14.937 0.946 -8.539 1.00 0.00 N ATOM 972 CA ILE A 65 -15.327 -0.158 -9.467 1.00 0.00 C ATOM 973 C ILE A 65 -15.743 0.414 -10.818 1.00 0.00 C ATOM 974 O ILE A 65 -15.624 -0.231 -11.842 1.00 0.00 O ATOM 975 CB ILE A 65 -16.527 -0.919 -8.895 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.334 -1.162 -7.400 1.00 0.00 C ATOM 977 CG2 ILE A 65 -16.667 -2.260 -9.617 1.00 0.00 C ATOM 978 CD1 ILE A 65 -17.496 -2.007 -6.883 1.00 0.00 C ATOM 0 H ILE A 65 -15.475 0.992 -7.674 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.471 -0.823 -9.584 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.429 -0.325 -9.042 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.388 -1.672 -7.220 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.291 -0.213 -6.866 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -17.520 -2.804 -9.212 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -16.820 -2.086 -10.682 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -15.760 -2.848 -9.472 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.368 -2.187 -5.816 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -18.434 -1.478 -7.052 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -17.516 -2.960 -7.412 1.00 0.00 H new ATOM 990 N ASP A 66 -16.261 1.605 -10.824 1.00 0.00 N ATOM 991 CA ASP A 66 -16.726 2.208 -12.095 1.00 0.00 C ATOM 992 C ASP A 66 -15.543 2.840 -12.819 1.00 0.00 C ATOM 993 O ASP A 66 -15.698 3.582 -13.769 1.00 0.00 O ATOM 994 CB ASP A 66 -17.791 3.263 -11.785 1.00 0.00 C ATOM 995 CG ASP A 66 -17.139 4.493 -11.143 1.00 0.00 C ATOM 996 OD1 ASP A 66 -16.576 4.348 -10.070 1.00 0.00 O ATOM 997 OD2 ASP A 66 -17.215 5.556 -11.736 1.00 0.00 O ATOM 0 H ASP A 66 -16.383 2.190 -9.997 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.159 1.442 -12.738 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.307 3.551 -12.701 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -18.542 2.847 -11.113 1.00 0.00 H new ATOM 1002 N ARG A 67 -14.360 2.538 -12.374 1.00 0.00 N ATOM 1003 CA ARG A 67 -13.143 3.101 -13.023 1.00 0.00 C ATOM 1004 C ARG A 67 -11.981 2.117 -12.856 1.00 0.00 C ATOM 1005 O ARG A 67 -11.002 2.411 -12.203 1.00 0.00 O ATOM 1006 CB ARG A 67 -12.782 4.438 -12.370 1.00 0.00 C ATOM 1007 CG ARG A 67 -13.744 5.526 -12.855 1.00 0.00 C ATOM 1008 CD ARG A 67 -13.293 6.885 -12.316 1.00 0.00 C ATOM 1009 NE ARG A 67 -14.297 7.923 -12.687 1.00 0.00 N ATOM 1010 CZ ARG A 67 -14.281 9.086 -12.097 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -13.384 9.341 -11.184 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -15.161 9.994 -12.421 1.00 0.00 N ATOM 0 H ARG A 67 -14.180 1.921 -11.582 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.337 3.262 -14.084 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -12.835 4.350 -11.285 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.756 4.709 -12.618 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -13.768 5.545 -13.945 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -14.757 5.307 -12.517 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -13.183 6.841 -11.232 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -12.317 7.145 -12.725 1.00 0.00 H new ATOM 0 HE ARG A 67 -14.996 7.724 -13.402 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -12.696 8.631 -10.932 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -13.371 10.250 -10.722 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -15.861 9.794 -13.135 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -15.149 10.904 -11.960 1.00 0.00 H new ATOM 1026 N PRO A 68 -12.090 0.957 -13.441 1.00 0.00 N ATOM 1027 CA PRO A 68 -11.035 -0.092 -13.352 1.00 0.00 C ATOM 1028 C PRO A 68 -9.622 0.488 -13.445 1.00 0.00 C ATOM 1029 O PRO A 68 -8.656 -0.133 -13.048 1.00 0.00 O ATOM 1030 CB PRO A 68 -11.344 -0.993 -14.549 1.00 0.00 C ATOM 1031 CG PRO A 68 -12.830 -0.904 -14.714 1.00 0.00 C ATOM 1032 CD PRO A 68 -13.232 0.509 -14.258 1.00 0.00 C ATOM 0 HA PRO A 68 -11.049 -0.615 -12.396 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -10.824 -0.654 -15.445 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.026 -2.019 -14.365 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -13.117 -1.074 -15.752 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -13.334 -1.663 -14.116 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.399 1.171 -15.108 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.156 0.494 -13.679 1.00 0.00 H new ATOM 1040 N ASN A 69 -9.497 1.675 -13.970 1.00 0.00 N ATOM 1041 CA ASN A 69 -8.149 2.312 -14.100 1.00 0.00 C ATOM 1042 C ASN A 69 -7.916 3.289 -12.943 1.00 0.00 C ATOM 1043 O ASN A 69 -7.199 4.261 -13.081 1.00 0.00 O ATOM 1044 CB ASN A 69 -8.079 3.079 -15.423 1.00 0.00 C ATOM 1045 CG ASN A 69 -9.219 4.096 -15.485 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -9.583 4.682 -14.483 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -9.803 4.334 -16.626 1.00 0.00 N ATOM 0 H ASN A 69 -10.274 2.238 -14.318 1.00 0.00 H new ATOM 0 HA ASN A 69 -7.384 1.536 -14.076 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -7.119 3.588 -15.510 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -8.150 2.386 -16.261 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.564 5.011 -16.678 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -9.499 3.843 -17.467 1.00 0.00 H new ATOM 1054 N TYR A 70 -8.513 3.052 -11.803 1.00 0.00 N ATOM 1055 CA TYR A 70 -8.316 3.985 -10.649 1.00 0.00 C ATOM 1056 C TYR A 70 -7.106 3.536 -9.820 1.00 0.00 C ATOM 1057 O TYR A 70 -6.186 2.920 -10.320 1.00 0.00 O ATOM 1058 CB TYR A 70 -9.586 4.008 -9.767 1.00 0.00 C ATOM 1059 CG TYR A 70 -9.819 5.402 -9.214 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -10.175 6.443 -10.080 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -9.680 5.651 -7.841 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -10.393 7.731 -9.577 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -9.898 6.940 -7.338 1.00 0.00 C ATOM 1064 CZ TYR A 70 -10.254 7.980 -8.206 1.00 0.00 C ATOM 1065 OH TYR A 70 -10.470 9.250 -7.711 1.00 0.00 O ATOM 0 H TYR A 70 -9.126 2.257 -11.620 1.00 0.00 H new ATOM 0 HA TYR A 70 -8.133 4.990 -11.028 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -10.449 3.693 -10.353 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -9.481 3.297 -8.947 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -10.282 6.252 -11.138 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -9.405 4.849 -7.172 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -10.668 8.533 -10.246 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -9.792 7.132 -6.281 1.00 0.00 H new ATOM 0 HH TYR A 70 -10.333 9.251 -6.741 1.00 0.00 H new ATOM 1075 N GLN A 71 -7.100 3.870 -8.560 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.954 3.504 -7.678 1.00 0.00 C ATOM 1077 C GLN A 71 -5.953 2.001 -7.358 1.00 0.00 C ATOM 1078 O GLN A 71 -5.440 1.193 -8.106 1.00 0.00 O ATOM 1079 CB GLN A 71 -6.073 4.294 -6.367 1.00 0.00 C ATOM 1080 CG GLN A 71 -5.595 5.739 -6.567 1.00 0.00 C ATOM 1081 CD GLN A 71 -6.610 6.511 -7.408 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -6.762 6.261 -8.587 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -7.310 7.455 -6.844 1.00 0.00 N ATOM 0 H GLN A 71 -7.848 4.387 -8.098 1.00 0.00 H new ATOM 0 HA GLN A 71 -5.025 3.744 -8.196 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.108 4.291 -6.026 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.480 3.812 -5.590 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -5.466 6.226 -5.600 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -4.623 5.745 -7.059 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -7.181 7.663 -5.854 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -7.987 7.985 -7.393 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.494 1.635 -6.224 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.503 0.199 -5.800 1.00 0.00 C ATOM 1094 C PHE A 72 -7.787 -0.489 -6.277 1.00 0.00 C ATOM 1095 O PHE A 72 -8.342 -1.321 -5.589 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.433 0.152 -4.257 1.00 0.00 C ATOM 1097 CG PHE A 72 -5.720 -1.095 -3.783 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -4.331 -1.080 -3.626 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -6.445 -2.256 -3.490 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -3.666 -2.224 -3.176 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -5.779 -3.403 -3.042 1.00 0.00 C ATOM 1102 CZ PHE A 72 -4.388 -3.387 -2.885 1.00 0.00 C ATOM 0 H PHE A 72 -6.935 2.276 -5.565 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.651 -0.321 -6.238 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.913 1.035 -3.886 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.441 0.178 -3.843 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -3.772 -0.184 -3.852 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -7.518 -2.267 -3.610 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.593 -2.210 -3.053 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -6.338 -4.300 -2.818 1.00 0.00 H new ATOM 0 HZ PHE A 72 -3.873 -4.271 -2.540 1.00 0.00 H new ATOM 1112 N THR A 73 -8.266 -0.158 -7.441 1.00 0.00 N ATOM 1113 CA THR A 73 -9.512 -0.811 -7.930 1.00 0.00 C ATOM 1114 C THR A 73 -9.191 -2.222 -8.439 1.00 0.00 C ATOM 1115 O THR A 73 -9.856 -3.180 -8.102 1.00 0.00 O ATOM 1116 CB THR A 73 -10.114 0.007 -9.076 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.525 1.275 -8.591 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.326 -0.729 -9.645 1.00 0.00 C ATOM 0 H THR A 73 -7.854 0.530 -8.071 1.00 0.00 H new ATOM 0 HA THR A 73 -10.226 -0.869 -7.108 1.00 0.00 H new ATOM 0 HB THR A 73 -9.364 0.140 -9.856 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.177 1.666 -9.209 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.755 -0.147 -10.461 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.016 -1.705 -10.019 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.072 -0.861 -8.862 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.185 -2.352 -9.267 1.00 0.00 N ATOM 1127 CA ASN A 74 -7.830 -3.697 -9.824 1.00 0.00 C ATOM 1128 C ASN A 74 -6.752 -4.367 -8.970 1.00 0.00 C ATOM 1129 O ASN A 74 -6.572 -5.566 -9.025 1.00 0.00 O ATOM 1130 CB ASN A 74 -7.302 -3.527 -11.250 1.00 0.00 C ATOM 1131 CG ASN A 74 -8.449 -3.115 -12.174 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -9.512 -2.744 -11.714 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -8.280 -3.165 -13.466 1.00 0.00 N ATOM 0 H ASN A 74 -7.592 -1.584 -9.583 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.722 -4.323 -9.822 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.516 -2.772 -11.270 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.858 -4.460 -11.598 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -9.039 -2.893 -14.091 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.389 -3.476 -13.852 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.024 -3.618 -8.191 1.00 0.00 N ATOM 1141 CA LEU A 75 -4.961 -4.250 -7.360 1.00 0.00 C ATOM 1142 C LEU A 75 -5.580 -5.397 -6.551 1.00 0.00 C ATOM 1143 O LEU A 75 -4.931 -6.377 -6.244 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.337 -3.188 -6.425 1.00 0.00 C ATOM 1145 CG LEU A 75 -2.824 -3.428 -6.203 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.552 -4.886 -5.817 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -2.025 -3.057 -7.463 1.00 0.00 C ATOM 0 H LEU A 75 -6.116 -2.607 -8.093 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.172 -4.652 -7.995 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.488 -2.196 -6.851 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.851 -3.204 -5.464 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.501 -2.788 -5.382 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.482 -5.029 -5.667 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -3.083 -5.123 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.897 -5.544 -6.614 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.964 -3.233 -7.286 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.360 -3.670 -8.300 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.184 -2.005 -7.698 1.00 0.00 H new ATOM 1159 N LYS A 76 -6.840 -5.295 -6.226 1.00 0.00 N ATOM 1160 CA LYS A 76 -7.499 -6.389 -5.460 1.00 0.00 C ATOM 1161 C LYS A 76 -7.875 -7.498 -6.437 1.00 0.00 C ATOM 1162 O LYS A 76 -8.319 -8.563 -6.055 1.00 0.00 O ATOM 1163 CB LYS A 76 -8.761 -5.854 -4.779 1.00 0.00 C ATOM 1164 CG LYS A 76 -9.590 -5.061 -5.790 1.00 0.00 C ATOM 1165 CD LYS A 76 -10.997 -4.831 -5.230 1.00 0.00 C ATOM 1166 CE LYS A 76 -11.712 -3.772 -6.070 1.00 0.00 C ATOM 1167 NZ LYS A 76 -13.020 -3.436 -5.440 1.00 0.00 N ATOM 0 H LYS A 76 -7.440 -4.503 -6.457 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.823 -6.773 -4.696 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -9.349 -6.680 -4.379 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -8.490 -5.218 -3.936 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.110 -4.105 -6.000 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.647 -5.603 -6.734 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.562 -5.763 -5.242 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -10.938 -4.508 -4.191 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -11.094 -2.877 -6.149 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.869 -4.142 -7.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -13.789 -3.633 -6.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -13.151 -4.012 -4.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -13.034 -2.428 -5.185 1.00 0.00 H new ATOM 1181 N ALA A 77 -7.695 -7.246 -7.702 1.00 0.00 N ATOM 1182 CA ALA A 77 -8.028 -8.264 -8.731 1.00 0.00 C ATOM 1183 C ALA A 77 -6.849 -9.227 -8.873 1.00 0.00 C ATOM 1184 O ALA A 77 -6.991 -10.339 -9.343 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.285 -7.555 -10.063 1.00 0.00 C ATOM 0 H ALA A 77 -7.327 -6.368 -8.069 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.918 -8.822 -8.440 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.531 -8.293 -10.827 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.116 -6.859 -9.950 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.391 -7.007 -10.362 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.685 -8.804 -8.463 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.490 -9.685 -8.564 1.00 0.00 C ATOM 1193 C ALA A 78 -4.768 -11.005 -7.837 1.00 0.00 C ATOM 1194 O ALA A 78 -5.890 -11.300 -7.478 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.291 -8.990 -7.917 1.00 0.00 C ATOM 0 H ALA A 78 -5.511 -7.883 -8.061 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.272 -9.886 -9.613 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.414 -9.634 -7.990 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.094 -8.049 -8.432 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.509 -8.791 -6.868 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.755 -11.803 -7.617 1.00 0.00 N ATOM 1202 CA LYS A 79 -3.962 -13.102 -6.919 1.00 0.00 C ATOM 1203 C LYS A 79 -2.640 -13.520 -6.252 1.00 0.00 C ATOM 1204 O LYS A 79 -1.566 -13.156 -6.691 1.00 0.00 O ATOM 1205 CB LYS A 79 -4.434 -14.144 -7.965 1.00 0.00 C ATOM 1206 CG LYS A 79 -3.772 -15.508 -7.739 1.00 0.00 C ATOM 1207 CD LYS A 79 -4.459 -16.562 -8.609 1.00 0.00 C ATOM 1208 CE LYS A 79 -3.695 -17.883 -8.507 1.00 0.00 C ATOM 1209 NZ LYS A 79 -4.409 -18.932 -9.286 1.00 0.00 N ATOM 0 H LYS A 79 -2.792 -11.608 -7.892 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.722 -13.024 -6.141 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -5.517 -14.251 -7.910 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.199 -13.786 -8.968 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -2.711 -15.454 -7.985 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.842 -15.788 -6.688 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.491 -16.700 -8.285 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -4.492 -16.228 -9.646 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.681 -17.759 -8.888 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.609 -18.186 -7.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.889 -19.830 -9.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.368 -19.056 -8.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.469 -18.643 -10.283 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.716 -14.282 -5.193 1.00 0.00 N ATOM 1224 CA LYS A 80 -1.475 -14.725 -4.493 1.00 0.00 C ATOM 1225 C LYS A 80 -0.493 -15.313 -5.508 1.00 0.00 C ATOM 1226 O LYS A 80 -0.693 -16.395 -6.025 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.827 -15.792 -3.451 1.00 0.00 C ATOM 1228 CG LYS A 80 -0.637 -16.010 -2.511 1.00 0.00 C ATOM 1229 CD LYS A 80 -1.057 -16.906 -1.339 1.00 0.00 C ATOM 1230 CE LYS A 80 -1.280 -18.341 -1.827 1.00 0.00 C ATOM 1231 NZ LYS A 80 -1.313 -19.261 -0.655 1.00 0.00 N ATOM 0 H LYS A 80 -3.587 -14.618 -4.782 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.017 -13.869 -3.998 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.702 -15.481 -2.880 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.086 -16.727 -3.947 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.188 -16.470 -3.055 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.277 -15.052 -2.137 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.288 -16.892 -0.566 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.971 -16.521 -0.886 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.216 -18.407 -2.382 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.483 -18.633 -2.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -1.464 -20.236 -0.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -0.409 -19.204 -0.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.089 -18.986 -0.019 1.00 0.00 H new ATOM 1245 N GLY A 81 0.573 -14.609 -5.795 1.00 0.00 N ATOM 1246 CA GLY A 81 1.585 -15.115 -6.773 1.00 0.00 C ATOM 1247 C GLY A 81 2.023 -13.970 -7.688 1.00 0.00 C ATOM 1248 O GLY A 81 3.039 -14.046 -8.351 1.00 0.00 O ATOM 0 H GLY A 81 0.787 -13.698 -5.390 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.446 -15.522 -6.244 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.161 -15.926 -7.365 1.00 0.00 H new ATOM 1252 N SER A 82 1.272 -12.904 -7.721 1.00 0.00 N ATOM 1253 CA SER A 82 1.647 -11.754 -8.576 1.00 0.00 C ATOM 1254 C SER A 82 2.928 -11.148 -8.028 1.00 0.00 C ATOM 1255 O SER A 82 3.531 -11.679 -7.115 1.00 0.00 O ATOM 1256 CB SER A 82 0.531 -10.709 -8.551 1.00 0.00 C ATOM 1257 OG SER A 82 -0.569 -11.176 -9.319 1.00 0.00 O ATOM 0 H SER A 82 0.411 -12.784 -7.188 1.00 0.00 H new ATOM 0 HA SER A 82 1.798 -12.084 -9.604 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.218 -10.520 -7.524 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.894 -9.763 -8.953 1.00 0.00 H new ATOM 0 HG SER A 82 -1.136 -10.418 -9.572 1.00 0.00 H new ATOM 1263 N MET A 83 3.340 -10.031 -8.563 1.00 0.00 N ATOM 1264 CA MET A 83 4.578 -9.365 -8.066 1.00 0.00 C ATOM 1265 C MET A 83 4.262 -7.898 -7.780 1.00 0.00 C ATOM 1266 O MET A 83 3.165 -7.439 -8.018 1.00 0.00 O ATOM 1267 CB MET A 83 5.675 -9.457 -9.131 1.00 0.00 C ATOM 1268 CG MET A 83 6.259 -10.872 -9.151 1.00 0.00 C ATOM 1269 SD MET A 83 7.424 -11.063 -7.777 1.00 0.00 S ATOM 1270 CE MET A 83 8.897 -10.466 -8.643 1.00 0.00 C ATOM 0 H MET A 83 2.869 -9.548 -9.328 1.00 0.00 H new ATOM 0 HA MET A 83 4.925 -9.855 -7.156 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.266 -9.208 -10.110 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.461 -8.732 -8.920 1.00 0.00 H new ATOM 0 HG2 MET A 83 5.459 -11.608 -9.069 1.00 0.00 H new ATOM 0 HG3 MET A 83 6.765 -11.055 -10.099 1.00 0.00 H new ATOM 0 HE1 MET A 83 9.753 -10.498 -7.969 1.00 0.00 H new ATOM 0 HE2 MET A 83 9.092 -11.100 -9.508 1.00 0.00 H new ATOM 0 HE3 MET A 83 8.734 -9.440 -8.974 1.00 0.00 H new ATOM 1280 N VAL A 84 5.210 -7.156 -7.272 1.00 0.00 N ATOM 1281 CA VAL A 84 4.955 -5.714 -6.968 1.00 0.00 C ATOM 1282 C VAL A 84 6.237 -4.913 -7.210 1.00 0.00 C ATOM 1283 O VAL A 84 7.195 -5.023 -6.471 1.00 0.00 O ATOM 1284 CB VAL A 84 4.523 -5.572 -5.502 1.00 0.00 C ATOM 1285 CG1 VAL A 84 3.790 -4.242 -5.303 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.589 -6.729 -5.128 1.00 0.00 C ATOM 0 H VAL A 84 6.151 -7.485 -7.054 1.00 0.00 H new ATOM 0 HA VAL A 84 4.164 -5.335 -7.615 1.00 0.00 H new ATOM 0 HB VAL A 84 5.407 -5.595 -4.865 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.486 -4.147 -4.261 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.454 -3.418 -5.564 1.00 0.00 H new ATOM 0 HG13 VAL A 84 2.908 -4.214 -5.943 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.283 -6.627 -4.087 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.708 -6.707 -5.769 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.112 -7.676 -5.262 1.00 0.00 H new ATOM 1296 N TYR A 85 6.266 -4.113 -8.245 1.00 0.00 N ATOM 1297 CA TYR A 85 7.490 -3.311 -8.541 1.00 0.00 C ATOM 1298 C TYR A 85 7.363 -1.904 -7.947 1.00 0.00 C ATOM 1299 O TYR A 85 6.660 -1.059 -8.467 1.00 0.00 O ATOM 1300 CB TYR A 85 7.670 -3.206 -10.055 1.00 0.00 C ATOM 1301 CG TYR A 85 7.784 -4.593 -10.648 1.00 0.00 C ATOM 1302 CD1 TYR A 85 8.913 -5.377 -10.379 1.00 0.00 C ATOM 1303 CD2 TYR A 85 6.761 -5.096 -11.465 1.00 0.00 C ATOM 1304 CE1 TYR A 85 9.020 -6.661 -10.926 1.00 0.00 C ATOM 1305 CE2 TYR A 85 6.870 -6.380 -12.011 1.00 0.00 C ATOM 1306 CZ TYR A 85 8.000 -7.163 -11.742 1.00 0.00 C ATOM 1307 OH TYR A 85 8.106 -8.429 -12.281 1.00 0.00 O ATOM 0 H TYR A 85 5.494 -3.981 -8.898 1.00 0.00 H new ATOM 0 HA TYR A 85 8.353 -3.806 -8.096 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.824 -2.679 -10.497 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.563 -2.626 -10.286 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.701 -4.991 -9.750 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.890 -4.493 -11.673 1.00 0.00 H new ATOM 0 HE1 TYR A 85 9.891 -7.265 -10.718 1.00 0.00 H new ATOM 0 HE2 TYR A 85 6.082 -6.767 -12.640 1.00 0.00 H new ATOM 0 HH TYR A 85 7.312 -8.622 -12.821 1.00 0.00 H new ATOM 1317 N PHE A 86 8.066 -1.642 -6.877 1.00 0.00 N ATOM 1318 CA PHE A 86 8.030 -0.282 -6.255 1.00 0.00 C ATOM 1319 C PHE A 86 9.222 0.490 -6.821 1.00 0.00 C ATOM 1320 O PHE A 86 10.358 0.147 -6.562 1.00 0.00 O ATOM 1321 CB PHE A 86 8.163 -0.430 -4.732 1.00 0.00 C ATOM 1322 CG PHE A 86 7.984 0.905 -4.030 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.781 1.614 -4.155 1.00 0.00 C ATOM 1324 CD2 PHE A 86 9.020 1.424 -3.235 1.00 0.00 C ATOM 1325 CE1 PHE A 86 6.618 2.838 -3.492 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.852 2.646 -2.570 1.00 0.00 C ATOM 1327 CZ PHE A 86 7.652 3.352 -2.700 1.00 0.00 C ATOM 0 H PHE A 86 8.668 -2.315 -6.403 1.00 0.00 H new ATOM 0 HA PHE A 86 7.099 0.242 -6.470 1.00 0.00 H new ATOM 0 HB2 PHE A 86 7.419 -1.138 -4.367 1.00 0.00 H new ATOM 0 HB3 PHE A 86 9.142 -0.843 -4.489 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.980 1.217 -4.762 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.948 0.880 -3.136 1.00 0.00 H new ATOM 0 HE1 PHE A 86 5.693 3.386 -3.592 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.649 3.042 -1.958 1.00 0.00 H new ATOM 0 HZ PHE A 86 7.523 4.295 -2.189 1.00 0.00 H new ATOM 1337 N LYS A 87 8.981 1.500 -7.627 1.00 0.00 N ATOM 1338 CA LYS A 87 10.120 2.257 -8.249 1.00 0.00 C ATOM 1339 C LYS A 87 10.275 3.634 -7.610 1.00 0.00 C ATOM 1340 O LYS A 87 9.312 4.286 -7.261 1.00 0.00 O ATOM 1341 CB LYS A 87 9.850 2.415 -9.750 1.00 0.00 C ATOM 1342 CG LYS A 87 9.201 1.137 -10.285 1.00 0.00 C ATOM 1343 CD LYS A 87 9.213 1.154 -11.817 1.00 0.00 C ATOM 1344 CE LYS A 87 8.323 2.289 -12.332 1.00 0.00 C ATOM 1345 NZ LYS A 87 8.001 2.054 -13.767 1.00 0.00 N ATOM 0 H LYS A 87 8.050 1.832 -7.880 1.00 0.00 H new ATOM 0 HA LYS A 87 11.043 1.701 -8.087 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.196 3.269 -9.925 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.782 2.613 -10.280 1.00 0.00 H new ATOM 0 HG2 LYS A 87 9.739 0.263 -9.917 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.177 1.058 -9.921 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.232 1.286 -12.180 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.858 0.198 -12.203 1.00 0.00 H new ATOM 0 HE2 LYS A 87 7.405 2.341 -11.746 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.831 3.246 -12.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 7.397 2.824 -14.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 8.881 2.025 -14.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 7.500 1.148 -13.867 1.00 0.00 H new ATOM 1359 N VAL A 88 11.492 4.083 -7.466 1.00 0.00 N ATOM 1360 CA VAL A 88 11.733 5.420 -6.863 1.00 0.00 C ATOM 1361 C VAL A 88 13.196 5.824 -7.080 1.00 0.00 C ATOM 1362 O VAL A 88 14.107 5.071 -6.795 1.00 0.00 O ATOM 1363 CB VAL A 88 11.428 5.363 -5.364 1.00 0.00 C ATOM 1364 CG1 VAL A 88 12.481 4.509 -4.650 1.00 0.00 C ATOM 1365 CG2 VAL A 88 11.442 6.781 -4.794 1.00 0.00 C ATOM 0 H VAL A 88 12.333 3.576 -7.742 1.00 0.00 H new ATOM 0 HA VAL A 88 11.084 6.157 -7.336 1.00 0.00 H new ATOM 0 HB VAL A 88 10.446 4.916 -5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 88 12.258 4.473 -3.584 1.00 0.00 H new ATOM 0 HG12 VAL A 88 12.468 3.498 -5.058 1.00 0.00 H new ATOM 0 HG13 VAL A 88 13.468 4.948 -4.800 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.225 6.746 -3.726 1.00 0.00 H new ATOM 0 HG22 VAL A 88 12.424 7.226 -4.950 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.686 7.383 -5.298 1.00 0.00 H new ATOM 1375 N GLY A 89 13.426 7.006 -7.583 1.00 0.00 N ATOM 1376 CA GLY A 89 14.828 7.459 -7.815 1.00 0.00 C ATOM 1377 C GLY A 89 15.446 6.671 -8.973 1.00 0.00 C ATOM 1378 O GLY A 89 15.135 6.896 -10.125 1.00 0.00 O ATOM 0 H GLY A 89 12.704 7.678 -7.843 1.00 0.00 H new ATOM 0 HA2 GLY A 89 14.842 8.525 -8.041 1.00 0.00 H new ATOM 0 HA3 GLY A 89 15.420 7.317 -6.911 1.00 0.00 H new ATOM 1382 N ASN A 90 16.324 5.747 -8.673 1.00 0.00 N ATOM 1383 CA ASN A 90 16.975 4.935 -9.751 1.00 0.00 C ATOM 1384 C ASN A 90 17.097 3.484 -9.284 1.00 0.00 C ATOM 1385 O ASN A 90 17.910 2.728 -9.777 1.00 0.00 O ATOM 1386 CB ASN A 90 18.368 5.496 -10.041 1.00 0.00 C ATOM 1387 CG ASN A 90 18.894 4.907 -11.352 1.00 0.00 C ATOM 1388 OD1 ASN A 90 19.663 3.854 -11.318 1.00 0.00 O flip ATOM 1389 ND2 ASN A 90 18.602 5.412 -12.418 1.00 0.00 N flip ATOM 0 H ASN A 90 16.620 5.518 -7.724 1.00 0.00 H new ATOM 0 HA ASN A 90 16.371 4.979 -10.658 1.00 0.00 H new ATOM 0 HB2 ASN A 90 18.327 6.583 -10.109 1.00 0.00 H new ATOM 0 HB3 ASN A 90 19.047 5.254 -9.223 1.00 0.00 H new ATOM 0 HD21 ASN A 90 18.001 6.235 -12.445 1.00 0.00 H new ATOM 0 HD22 ASN A 90 18.958 5.012 -13.286 1.00 0.00 H new ATOM 1396 N GLU A 91 16.286 3.089 -8.338 1.00 0.00 N ATOM 1397 CA GLU A 91 16.335 1.685 -7.827 1.00 0.00 C ATOM 1398 C GLU A 91 14.904 1.206 -7.588 1.00 0.00 C ATOM 1399 O GLU A 91 14.073 1.947 -7.101 1.00 0.00 O ATOM 1400 CB GLU A 91 17.118 1.645 -6.514 1.00 0.00 C ATOM 1401 CG GLU A 91 18.604 1.868 -6.803 1.00 0.00 C ATOM 1402 CD GLU A 91 19.387 1.867 -5.489 1.00 0.00 C ATOM 1403 OE1 GLU A 91 18.820 2.260 -4.483 1.00 0.00 O ATOM 1404 OE2 GLU A 91 20.541 1.473 -5.512 1.00 0.00 O ATOM 0 H GLU A 91 15.586 3.683 -7.893 1.00 0.00 H new ATOM 0 HA GLU A 91 16.828 1.039 -8.553 1.00 0.00 H new ATOM 0 HB2 GLU A 91 16.749 2.413 -5.834 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.972 0.685 -6.020 1.00 0.00 H new ATOM 0 HG2 GLU A 91 18.978 1.085 -7.462 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.746 2.816 -7.322 1.00 0.00 H new ATOM 1411 N THR A 92 14.605 -0.022 -7.943 1.00 0.00 N ATOM 1412 CA THR A 92 13.217 -0.553 -7.759 1.00 0.00 C ATOM 1413 C THR A 92 13.222 -1.770 -6.837 1.00 0.00 C ATOM 1414 O THR A 92 14.076 -2.631 -6.921 1.00 0.00 O ATOM 1415 CB THR A 92 12.654 -0.953 -9.125 1.00 0.00 C ATOM 1416 OG1 THR A 92 11.279 -1.282 -8.992 1.00 0.00 O ATOM 1417 CG2 THR A 92 13.421 -2.162 -9.667 1.00 0.00 C ATOM 0 H THR A 92 15.266 -0.681 -8.354 1.00 0.00 H new ATOM 0 HA THR A 92 12.598 0.222 -7.306 1.00 0.00 H new ATOM 0 HB THR A 92 12.763 -0.119 -9.818 1.00 0.00 H new ATOM 0 HG1 THR A 92 10.924 -0.878 -8.173 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.017 -2.443 -10.639 1.00 0.00 H new ATOM 0 HG22 THR A 92 14.475 -1.907 -9.772 1.00 0.00 H new ATOM 0 HG23 THR A 92 13.318 -2.998 -8.976 1.00 0.00 H new ATOM 1425 N ARG A 93 12.254 -1.846 -5.961 1.00 0.00 N ATOM 1426 CA ARG A 93 12.168 -3.010 -5.025 1.00 0.00 C ATOM 1427 C ARG A 93 11.294 -4.097 -5.663 1.00 0.00 C ATOM 1428 O ARG A 93 10.661 -3.877 -6.678 1.00 0.00 O ATOM 1429 CB ARG A 93 11.541 -2.560 -3.699 1.00 0.00 C ATOM 1430 CG ARG A 93 11.989 -1.137 -3.368 1.00 0.00 C ATOM 1431 CD ARG A 93 13.514 -1.072 -3.360 1.00 0.00 C ATOM 1432 NE ARG A 93 14.060 -2.294 -2.703 1.00 0.00 N ATOM 1433 CZ ARG A 93 15.319 -2.607 -2.844 1.00 0.00 C ATOM 1434 NH1 ARG A 93 16.104 -1.849 -3.559 1.00 0.00 N ATOM 1435 NH2 ARG A 93 15.792 -3.679 -2.269 1.00 0.00 N ATOM 0 H ARG A 93 11.516 -1.150 -5.852 1.00 0.00 H new ATOM 0 HA ARG A 93 13.166 -3.403 -4.833 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.454 -2.601 -3.768 1.00 0.00 H new ATOM 0 HB3 ARG A 93 11.836 -3.239 -2.899 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.589 -0.438 -4.102 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.597 -0.838 -2.396 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.891 -0.995 -4.380 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.848 -0.181 -2.829 1.00 0.00 H new ATOM 0 HE ARG A 93 13.448 -2.887 -2.142 1.00 0.00 H new ATOM 0 HH11 ARG A 93 15.734 -1.011 -4.008 1.00 0.00 H new ATOM 0 HH12 ARG A 93 17.088 -2.094 -3.669 1.00 0.00 H new ATOM 0 HH21 ARG A 93 15.178 -4.271 -1.710 1.00 0.00 H new ATOM 0 HH22 ARG A 93 16.776 -3.925 -2.379 1.00 0.00 H new ATOM 1449 N LYS A 94 11.251 -5.268 -5.079 1.00 0.00 N ATOM 1450 CA LYS A 94 10.415 -6.363 -5.663 1.00 0.00 C ATOM 1451 C LYS A 94 9.839 -7.248 -4.549 1.00 0.00 C ATOM 1452 O LYS A 94 10.554 -7.745 -3.701 1.00 0.00 O ATOM 1453 CB LYS A 94 11.287 -7.212 -6.595 1.00 0.00 C ATOM 1454 CG LYS A 94 12.668 -7.406 -5.964 1.00 0.00 C ATOM 1455 CD LYS A 94 13.413 -8.525 -6.693 1.00 0.00 C ATOM 1456 CE LYS A 94 13.670 -8.114 -8.145 1.00 0.00 C ATOM 1457 NZ LYS A 94 14.726 -8.991 -8.726 1.00 0.00 N ATOM 0 H LYS A 94 11.756 -5.513 -4.227 1.00 0.00 H new ATOM 0 HA LYS A 94 9.588 -5.925 -6.222 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.816 -8.179 -6.770 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.384 -6.724 -7.565 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.238 -6.479 -6.021 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.565 -7.653 -4.907 1.00 0.00 H new ATOM 0 HD2 LYS A 94 14.358 -8.733 -6.191 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.828 -9.444 -6.663 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.752 -8.197 -8.726 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.982 -7.071 -8.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.903 -8.714 -9.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 15.603 -8.890 -8.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.410 -9.981 -8.696 1.00 0.00 H new ATOM 1471 N TYR A 95 8.546 -7.467 -4.567 1.00 0.00 N ATOM 1472 CA TYR A 95 7.891 -8.343 -3.542 1.00 0.00 C ATOM 1473 C TYR A 95 7.044 -9.383 -4.278 1.00 0.00 C ATOM 1474 O TYR A 95 6.874 -9.314 -5.480 1.00 0.00 O ATOM 1475 CB TYR A 95 6.971 -7.515 -2.635 1.00 0.00 C ATOM 1476 CG TYR A 95 7.719 -6.356 -2.018 1.00 0.00 C ATOM 1477 CD1 TYR A 95 7.816 -5.141 -2.705 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.301 -6.489 -0.747 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.495 -4.060 -2.126 1.00 0.00 C ATOM 1480 CE2 TYR A 95 8.978 -5.408 -0.170 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.074 -4.194 -0.860 1.00 0.00 C ATOM 1482 OH TYR A 95 9.739 -3.128 -0.289 1.00 0.00 O ATOM 0 H TYR A 95 7.908 -7.071 -5.257 1.00 0.00 H new ATOM 0 HA TYR A 95 8.657 -8.818 -2.929 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.126 -7.141 -3.213 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.563 -8.150 -1.848 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.368 -5.036 -3.682 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.226 -7.426 -0.214 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.571 -3.123 -2.658 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.426 -5.511 0.807 1.00 0.00 H new ATOM 0 HH TYR A 95 10.080 -3.389 0.592 1.00 0.00 H new ATOM 1492 N LYS A 96 6.500 -10.340 -3.571 1.00 0.00 N ATOM 1493 CA LYS A 96 5.652 -11.379 -4.233 1.00 0.00 C ATOM 1494 C LYS A 96 4.476 -11.718 -3.316 1.00 0.00 C ATOM 1495 O LYS A 96 4.655 -12.196 -2.212 1.00 0.00 O ATOM 1496 CB LYS A 96 6.490 -12.640 -4.502 1.00 0.00 C ATOM 1497 CG LYS A 96 5.844 -13.461 -5.629 1.00 0.00 C ATOM 1498 CD LYS A 96 6.695 -14.710 -5.936 1.00 0.00 C ATOM 1499 CE LYS A 96 6.282 -15.871 -5.021 1.00 0.00 C ATOM 1500 NZ LYS A 96 7.385 -16.872 -4.957 1.00 0.00 N ATOM 0 H LYS A 96 6.606 -10.448 -2.562 1.00 0.00 H new ATOM 0 HA LYS A 96 5.276 -10.999 -5.183 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.506 -12.360 -4.779 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.561 -13.241 -3.596 1.00 0.00 H new ATOM 0 HG2 LYS A 96 4.837 -13.761 -5.339 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.748 -12.848 -6.525 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.569 -14.997 -6.980 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.752 -14.483 -5.793 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.057 -15.498 -4.022 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.373 -16.340 -5.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.432 -17.276 -4.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 7.205 -17.631 -5.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.288 -16.408 -5.182 1.00 0.00 H new ATOM 1514 N MET A 97 3.276 -11.458 -3.761 1.00 0.00 N ATOM 1515 CA MET A 97 2.086 -11.753 -2.915 1.00 0.00 C ATOM 1516 C MET A 97 2.168 -13.190 -2.404 1.00 0.00 C ATOM 1517 O MET A 97 1.682 -14.110 -3.031 1.00 0.00 O ATOM 1518 CB MET A 97 0.810 -11.563 -3.739 1.00 0.00 C ATOM 1519 CG MET A 97 0.626 -10.078 -4.060 1.00 0.00 C ATOM 1520 SD MET A 97 -1.021 -9.810 -4.762 1.00 0.00 S ATOM 1521 CE MET A 97 -0.724 -8.147 -5.413 1.00 0.00 C ATOM 0 H MET A 97 3.069 -11.054 -4.674 1.00 0.00 H new ATOM 0 HA MET A 97 2.065 -11.071 -2.065 1.00 0.00 H new ATOM 0 HB2 MET A 97 0.871 -12.141 -4.661 1.00 0.00 H new ATOM 0 HB3 MET A 97 -0.052 -11.936 -3.186 1.00 0.00 H new ATOM 0 HG2 MET A 97 0.749 -9.482 -3.156 1.00 0.00 H new ATOM 0 HG3 MET A 97 1.391 -9.750 -4.764 1.00 0.00 H new ATOM 0 HE1 MET A 97 -1.628 -7.779 -5.898 1.00 0.00 H new ATOM 0 HE2 MET A 97 -0.454 -7.479 -4.595 1.00 0.00 H new ATOM 0 HE3 MET A 97 0.089 -8.180 -6.138 1.00 0.00 H new ATOM 1531 N THR A 98 2.786 -13.384 -1.265 1.00 0.00 N ATOM 1532 CA THR A 98 2.923 -14.755 -0.681 1.00 0.00 C ATOM 1533 C THR A 98 2.220 -14.788 0.680 1.00 0.00 C ATOM 1534 O THR A 98 2.553 -15.575 1.543 1.00 0.00 O ATOM 1535 CB THR A 98 4.415 -15.077 -0.501 1.00 0.00 C ATOM 1536 OG1 THR A 98 5.140 -14.572 -1.614 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.615 -16.592 -0.411 1.00 0.00 C ATOM 0 H THR A 98 3.207 -12.641 -0.708 1.00 0.00 H new ATOM 0 HA THR A 98 2.470 -15.493 -1.343 1.00 0.00 H new ATOM 0 HB THR A 98 4.775 -14.613 0.417 1.00 0.00 H new ATOM 0 HG1 THR A 98 5.196 -13.596 -1.552 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.675 -16.812 -0.284 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.058 -16.983 0.441 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.254 -17.062 -1.326 1.00 0.00 H new ATOM 1545 N SER A 99 1.252 -13.936 0.875 1.00 0.00 N ATOM 1546 CA SER A 99 0.529 -13.911 2.171 1.00 0.00 C ATOM 1547 C SER A 99 -0.622 -12.921 2.047 1.00 0.00 C ATOM 1548 O SER A 99 -0.477 -11.863 1.468 1.00 0.00 O ATOM 1549 CB SER A 99 1.480 -13.465 3.282 1.00 0.00 C ATOM 1550 OG SER A 99 2.289 -14.565 3.676 1.00 0.00 O ATOM 0 H SER A 99 0.931 -13.254 0.187 1.00 0.00 H new ATOM 0 HA SER A 99 0.150 -14.903 2.416 1.00 0.00 H new ATOM 0 HB2 SER A 99 2.107 -12.644 2.933 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.912 -13.092 4.135 1.00 0.00 H new ATOM 0 HG SER A 99 2.166 -15.304 3.045 1.00 0.00 H new ATOM 1556 N ILE A 100 -1.771 -13.258 2.563 1.00 0.00 N ATOM 1557 CA ILE A 100 -2.942 -12.339 2.454 1.00 0.00 C ATOM 1558 C ILE A 100 -3.732 -12.367 3.766 1.00 0.00 C ATOM 1559 O ILE A 100 -4.068 -13.417 4.278 1.00 0.00 O ATOM 1560 CB ILE A 100 -3.823 -12.803 1.283 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.143 -12.443 -0.044 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.189 -12.116 1.350 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.872 -13.130 -1.200 1.00 0.00 C ATOM 0 H ILE A 100 -1.952 -14.132 3.057 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.610 -11.317 2.271 1.00 0.00 H new ATOM 0 HB ILE A 100 -3.959 -13.883 1.348 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.152 -11.362 -0.187 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.098 -12.753 -0.024 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.806 -12.451 0.516 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.679 -12.371 2.290 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.056 -11.036 1.292 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.386 -12.872 -2.141 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.840 -14.210 -1.059 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.910 -12.798 -1.224 1.00 0.00 H new ATOM 1575 N ARG A 101 -4.024 -11.213 4.314 1.00 0.00 N ATOM 1576 CA ARG A 101 -4.789 -11.143 5.598 1.00 0.00 C ATOM 1577 C ARG A 101 -6.231 -10.712 5.316 1.00 0.00 C ATOM 1578 O ARG A 101 -7.031 -10.579 6.219 1.00 0.00 O ATOM 1579 CB ARG A 101 -4.121 -10.130 6.531 1.00 0.00 C ATOM 1580 CG ARG A 101 -2.723 -10.629 6.907 1.00 0.00 C ATOM 1581 CD ARG A 101 -2.108 -9.699 7.955 1.00 0.00 C ATOM 1582 NE ARG A 101 -1.711 -8.416 7.311 1.00 0.00 N ATOM 1583 CZ ARG A 101 -1.442 -7.374 8.048 1.00 0.00 C ATOM 1584 NH1 ARG A 101 -1.517 -7.458 9.348 1.00 0.00 N ATOM 1585 NH2 ARG A 101 -1.095 -6.248 7.486 1.00 0.00 N ATOM 0 H ARG A 101 -3.762 -10.308 3.923 1.00 0.00 H new ATOM 0 HA ARG A 101 -4.796 -12.125 6.072 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -4.053 -9.158 6.042 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -4.724 -9.993 7.429 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -2.782 -11.645 7.298 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -2.089 -10.665 6.021 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -2.825 -9.510 8.754 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -1.239 -10.173 8.412 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.650 -8.352 6.295 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -1.786 -8.338 9.788 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -1.307 -6.643 9.925 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -1.034 -6.183 6.470 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -0.885 -5.434 8.063 1.00 0.00 H new ATOM 1599 N ASP A 102 -6.569 -10.497 4.068 1.00 0.00 N ATOM 1600 CA ASP A 102 -7.965 -10.087 3.728 1.00 0.00 C ATOM 1601 C ASP A 102 -8.918 -11.241 4.055 1.00 0.00 C ATOM 1602 O ASP A 102 -9.656 -11.708 3.211 1.00 0.00 O ATOM 1603 CB ASP A 102 -8.059 -9.773 2.234 1.00 0.00 C ATOM 1604 CG ASP A 102 -9.511 -9.456 1.871 1.00 0.00 C ATOM 1605 OD1 ASP A 102 -10.168 -8.801 2.661 1.00 0.00 O ATOM 1606 OD2 ASP A 102 -9.941 -9.879 0.810 1.00 0.00 O ATOM 0 H ASP A 102 -5.938 -10.588 3.272 1.00 0.00 H new ATOM 0 HA ASP A 102 -8.235 -9.202 4.304 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -7.418 -8.926 1.988 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.704 -10.622 1.650 1.00 0.00 H new ATOM 1611 N VAL A 103 -8.892 -11.711 5.271 1.00 0.00 N ATOM 1612 CA VAL A 103 -9.778 -12.844 5.665 1.00 0.00 C ATOM 1613 C VAL A 103 -10.020 -12.782 7.174 1.00 0.00 C ATOM 1614 O VAL A 103 -11.074 -12.387 7.630 1.00 0.00 O ATOM 1615 CB VAL A 103 -9.081 -14.164 5.319 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -9.880 -15.335 5.894 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -8.982 -14.312 3.797 1.00 0.00 C ATOM 0 H VAL A 103 -8.291 -11.357 6.015 1.00 0.00 H new ATOM 0 HA VAL A 103 -10.728 -12.779 5.135 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.079 -14.163 5.749 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.382 -16.272 5.646 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -9.945 -15.234 6.977 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.884 -15.334 5.469 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -8.486 -15.252 3.554 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.983 -14.308 3.365 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.407 -13.482 3.387 1.00 0.00 H new ATOM 1627 N LYS A 104 -9.036 -13.171 7.945 1.00 0.00 N ATOM 1628 CA LYS A 104 -9.157 -13.143 9.436 1.00 0.00 C ATOM 1629 C LYS A 104 -8.101 -12.180 9.988 1.00 0.00 C ATOM 1630 O LYS A 104 -7.224 -12.579 10.729 1.00 0.00 O ATOM 1631 CB LYS A 104 -8.897 -14.548 9.992 1.00 0.00 C ATOM 1632 CG LYS A 104 -7.638 -15.141 9.348 1.00 0.00 C ATOM 1633 CD LYS A 104 -7.134 -16.316 10.191 1.00 0.00 C ATOM 1634 CE LYS A 104 -5.936 -16.967 9.497 1.00 0.00 C ATOM 1635 NZ LYS A 104 -4.927 -15.922 9.164 1.00 0.00 N ATOM 0 H LYS A 104 -8.139 -13.512 7.599 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.156 -12.817 9.727 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -8.775 -14.503 11.074 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -9.754 -15.191 9.794 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -7.859 -15.476 8.335 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -6.864 -14.378 9.270 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.848 -15.968 11.184 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.930 -17.048 10.327 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.493 -17.722 10.146 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.260 -17.477 8.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -3.973 -16.333 9.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.101 -15.565 8.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.002 -15.138 9.843 1.00 0.00 H new ATOM 1649 N PRO A 105 -8.164 -10.924 9.617 1.00 0.00 N ATOM 1650 CA PRO A 105 -7.166 -9.915 10.077 1.00 0.00 C ATOM 1651 C PRO A 105 -7.072 -9.862 11.605 1.00 0.00 C ATOM 1652 O PRO A 105 -7.749 -9.092 12.256 1.00 0.00 O ATOM 1653 CB PRO A 105 -7.674 -8.578 9.492 1.00 0.00 C ATOM 1654 CG PRO A 105 -9.095 -8.833 9.091 1.00 0.00 C ATOM 1655 CD PRO A 105 -9.176 -10.317 8.739 1.00 0.00 C ATOM 0 HA PRO A 105 -6.157 -10.156 9.742 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -7.612 -7.778 10.229 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -7.073 -8.270 8.636 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -9.779 -8.587 9.903 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -9.376 -8.214 8.239 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -10.170 -10.723 8.929 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -8.955 -10.494 7.686 1.00 0.00 H new ATOM 1663 N THR A 106 -6.231 -10.679 12.176 1.00 0.00 N ATOM 1664 CA THR A 106 -6.082 -10.688 13.657 1.00 0.00 C ATOM 1665 C THR A 106 -4.822 -11.475 14.026 1.00 0.00 C ATOM 1666 O THR A 106 -4.806 -12.231 14.978 1.00 0.00 O ATOM 1667 CB THR A 106 -7.314 -11.350 14.286 1.00 0.00 C ATOM 1668 OG1 THR A 106 -8.482 -10.907 13.609 1.00 0.00 O ATOM 1669 CG2 THR A 106 -7.408 -10.971 15.764 1.00 0.00 C ATOM 0 H THR A 106 -5.638 -11.343 11.678 1.00 0.00 H new ATOM 0 HA THR A 106 -5.995 -9.668 14.030 1.00 0.00 H new ATOM 0 HB THR A 106 -7.226 -12.433 14.198 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.448 -9.934 13.501 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.285 -11.444 16.206 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.512 -11.310 16.284 1.00 0.00 H new ATOM 0 HG23 THR A 106 -7.494 -9.888 15.857 1.00 0.00 H new ATOM 1677 N ASP A 107 -3.767 -11.304 13.275 1.00 0.00 N ATOM 1678 CA ASP A 107 -2.508 -12.043 13.576 1.00 0.00 C ATOM 1679 C ASP A 107 -1.831 -11.427 14.800 1.00 0.00 C ATOM 1680 O ASP A 107 -2.483 -10.955 15.709 1.00 0.00 O ATOM 1681 CB ASP A 107 -1.567 -11.951 12.372 1.00 0.00 C ATOM 1682 CG ASP A 107 -2.314 -12.368 11.106 1.00 0.00 C ATOM 1683 OD1 ASP A 107 -3.418 -11.888 10.907 1.00 0.00 O ATOM 1684 OD2 ASP A 107 -1.770 -13.161 10.354 1.00 0.00 O ATOM 0 H ASP A 107 -3.723 -10.684 12.466 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.740 -13.088 13.780 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -1.193 -10.933 12.267 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -0.701 -12.595 12.524 1.00 0.00 H new ATOM 1689 N VAL A 108 -0.527 -11.431 14.831 1.00 0.00 N ATOM 1690 CA VAL A 108 0.192 -10.847 15.997 1.00 0.00 C ATOM 1691 C VAL A 108 0.222 -9.325 15.865 1.00 0.00 C ATOM 1692 O VAL A 108 1.094 -8.664 16.389 1.00 0.00 O ATOM 1693 CB VAL A 108 1.623 -11.385 16.037 1.00 0.00 C ATOM 1694 CG1 VAL A 108 1.593 -12.911 16.146 1.00 0.00 C ATOM 1695 CG2 VAL A 108 2.353 -10.981 14.754 1.00 0.00 C ATOM 0 H VAL A 108 0.072 -11.814 14.099 1.00 0.00 H new ATOM 0 HA VAL A 108 -0.324 -11.122 16.917 1.00 0.00 H new ATOM 0 HB VAL A 108 2.143 -10.970 16.900 1.00 0.00 H new ATOM 0 HG11 VAL A 108 2.613 -13.294 16.174 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.071 -13.200 17.058 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.073 -13.327 15.283 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.373 -11.363 14.780 1.00 0.00 H new ATOM 0 HG22 VAL A 108 1.831 -11.397 13.892 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.375 -9.894 14.675 1.00 0.00 H new ATOM 1705 N GLY A 109 -0.733 -8.768 15.167 1.00 0.00 N ATOM 1706 CA GLY A 109 -0.778 -7.283 14.991 1.00 0.00 C ATOM 1707 C GLY A 109 -1.165 -6.954 13.547 1.00 0.00 C ATOM 1708 O GLY A 109 -0.621 -7.501 12.609 1.00 0.00 O ATOM 0 H GLY A 109 -1.488 -9.279 14.709 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.499 -6.846 15.681 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.193 -6.848 15.227 1.00 0.00 H new ATOM 1712 N VAL A 110 -2.090 -6.054 13.363 1.00 0.00 N ATOM 1713 CA VAL A 110 -2.500 -5.679 11.985 1.00 0.00 C ATOM 1714 C VAL A 110 -1.338 -4.954 11.320 1.00 0.00 C ATOM 1715 O VAL A 110 -1.088 -5.102 10.141 1.00 0.00 O ATOM 1716 CB VAL A 110 -3.721 -4.758 12.045 1.00 0.00 C ATOM 1717 CG1 VAL A 110 -4.342 -4.640 10.652 1.00 0.00 C ATOM 1718 CG2 VAL A 110 -4.755 -5.343 13.012 1.00 0.00 C ATOM 0 H VAL A 110 -2.580 -5.562 14.110 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.760 -6.570 11.413 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.413 -3.772 12.392 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -5.211 -3.984 10.696 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.609 -4.225 9.961 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.649 -5.627 10.306 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.625 -4.687 13.055 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -5.061 -6.330 12.664 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.316 -5.429 14.006 1.00 0.00 H new ATOM 1728 N LEU A 111 -0.620 -4.169 12.083 1.00 0.00 N ATOM 1729 CA LEU A 111 0.544 -3.419 11.528 1.00 0.00 C ATOM 1730 C LEU A 111 1.696 -3.480 12.533 1.00 0.00 C ATOM 1731 O LEU A 111 1.999 -2.512 13.202 1.00 0.00 O ATOM 1732 CB LEU A 111 0.156 -1.954 11.300 1.00 0.00 C ATOM 1733 CG LEU A 111 -0.823 -1.838 10.117 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -1.564 -0.500 10.199 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -0.064 -1.910 8.781 1.00 0.00 C ATOM 0 H LEU A 111 -0.794 -4.015 13.076 1.00 0.00 H new ATOM 0 HA LEU A 111 0.846 -3.864 10.580 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -0.303 -1.548 12.201 1.00 0.00 H new ATOM 0 HB3 LEU A 111 1.049 -1.361 11.101 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.532 -2.664 10.168 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -2.257 -0.416 9.362 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.118 -0.448 11.136 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -0.844 0.318 10.157 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.771 -1.826 7.956 1.00 0.00 H new ATOM 0 HD22 LEU A 111 0.655 -1.093 8.727 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.463 -2.862 8.713 1.00 0.00 H new ATOM 1747 N ASP A 112 2.337 -4.613 12.653 1.00 0.00 N ATOM 1748 CA ASP A 112 3.466 -4.742 13.621 1.00 0.00 C ATOM 1749 C ASP A 112 4.784 -4.451 12.891 1.00 0.00 C ATOM 1750 O ASP A 112 5.011 -4.914 11.791 1.00 0.00 O ATOM 1751 CB ASP A 112 3.464 -6.181 14.197 1.00 0.00 C ATOM 1752 CG ASP A 112 3.578 -6.153 15.727 1.00 0.00 C ATOM 1753 OD1 ASP A 112 2.910 -5.335 16.337 1.00 0.00 O ATOM 1754 OD2 ASP A 112 4.328 -6.953 16.260 1.00 0.00 O ATOM 0 H ASP A 112 2.126 -5.457 12.121 1.00 0.00 H new ATOM 0 HA ASP A 112 3.356 -4.032 14.440 1.00 0.00 H new ATOM 0 HB2 ASP A 112 2.547 -6.694 13.905 1.00 0.00 H new ATOM 0 HB3 ASP A 112 4.294 -6.748 13.776 1.00 0.00 H new ATOM 1759 N GLU A 113 5.657 -3.694 13.502 1.00 0.00 N ATOM 1760 CA GLU A 113 6.965 -3.377 12.854 1.00 0.00 C ATOM 1761 C GLU A 113 7.999 -4.390 13.336 1.00 0.00 C ATOM 1762 O GLU A 113 9.192 -4.189 13.225 1.00 0.00 O ATOM 1763 CB GLU A 113 7.402 -1.951 13.226 1.00 0.00 C ATOM 1764 CG GLU A 113 7.001 -1.642 14.672 1.00 0.00 C ATOM 1765 CD GLU A 113 5.508 -1.308 14.737 1.00 0.00 C ATOM 1766 OE1 GLU A 113 5.103 -0.368 14.073 1.00 0.00 O ATOM 1767 OE2 GLU A 113 4.798 -1.996 15.451 1.00 0.00 O ATOM 0 H GLU A 113 5.521 -3.280 14.424 1.00 0.00 H new ATOM 0 HA GLU A 113 6.871 -3.433 11.770 1.00 0.00 H new ATOM 0 HB2 GLU A 113 8.481 -1.850 13.109 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.940 -1.232 12.550 1.00 0.00 H new ATOM 0 HG2 GLU A 113 7.219 -2.498 15.310 1.00 0.00 H new ATOM 0 HG3 GLU A 113 7.587 -0.804 15.050 1.00 0.00 H new ATOM 1774 N GLN A 114 7.534 -5.487 13.860 1.00 0.00 N ATOM 1775 CA GLN A 114 8.454 -6.552 14.350 1.00 0.00 C ATOM 1776 C GLN A 114 7.794 -7.910 14.123 1.00 0.00 C ATOM 1777 O GLN A 114 7.991 -8.838 14.882 1.00 0.00 O ATOM 1778 CB GLN A 114 8.736 -6.360 15.846 1.00 0.00 C ATOM 1779 CG GLN A 114 7.416 -6.214 16.621 1.00 0.00 C ATOM 1780 CD GLN A 114 6.924 -4.766 16.553 1.00 0.00 C ATOM 1781 OE1 GLN A 114 5.879 -4.478 15.826 1.00 0.00 O flip ATOM 1782 NE2 GLN A 114 7.496 -3.889 17.169 1.00 0.00 N flip ATOM 0 H GLN A 114 6.542 -5.695 13.972 1.00 0.00 H new ATOM 0 HA GLN A 114 9.398 -6.498 13.808 1.00 0.00 H new ATOM 0 HB2 GLN A 114 9.299 -7.211 16.229 1.00 0.00 H new ATOM 0 HB3 GLN A 114 9.354 -5.475 15.996 1.00 0.00 H new ATOM 0 HG2 GLN A 114 6.663 -6.882 16.202 1.00 0.00 H new ATOM 0 HG3 GLN A 114 7.561 -6.509 17.660 1.00 0.00 H new ATOM 0 HE21 GLN A 114 8.313 -4.114 17.737 1.00 0.00 H new ATOM 0 HE22 GLN A 114 7.160 -2.927 17.118 1.00 0.00 H new ATOM 1791 N LYS A 115 6.996 -8.022 13.087 1.00 0.00 N ATOM 1792 CA LYS A 115 6.295 -9.310 12.793 1.00 0.00 C ATOM 1793 C LYS A 115 7.224 -10.498 13.076 1.00 0.00 C ATOM 1794 O LYS A 115 6.942 -11.327 13.918 1.00 0.00 O ATOM 1795 CB LYS A 115 5.878 -9.339 11.318 1.00 0.00 C ATOM 1796 CG LYS A 115 4.838 -8.240 11.036 1.00 0.00 C ATOM 1797 CD LYS A 115 3.433 -8.710 11.445 1.00 0.00 C ATOM 1798 CE LYS A 115 2.389 -7.712 10.937 1.00 0.00 C ATOM 1799 NZ LYS A 115 2.143 -7.947 9.485 1.00 0.00 N ATOM 0 H LYS A 115 6.800 -7.269 12.428 1.00 0.00 H new ATOM 0 HA LYS A 115 5.414 -9.385 13.431 1.00 0.00 H new ATOM 0 HB2 LYS A 115 6.752 -9.194 10.683 1.00 0.00 H new ATOM 0 HB3 LYS A 115 5.462 -10.315 11.070 1.00 0.00 H new ATOM 0 HG2 LYS A 115 5.099 -7.335 11.584 1.00 0.00 H new ATOM 0 HG3 LYS A 115 4.848 -7.985 9.976 1.00 0.00 H new ATOM 0 HD2 LYS A 115 3.235 -9.700 11.033 1.00 0.00 H new ATOM 0 HD3 LYS A 115 3.369 -8.798 12.530 1.00 0.00 H new ATOM 0 HE2 LYS A 115 1.461 -7.824 11.497 1.00 0.00 H new ATOM 0 HE3 LYS A 115 2.737 -6.692 11.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 1.320 -7.391 9.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 2.980 -7.657 8.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 1.958 -8.958 9.323 1.00 0.00 H new ATOM 1813 N GLY A 116 8.333 -10.579 12.381 1.00 0.00 N ATOM 1814 CA GLY A 116 9.293 -11.707 12.607 1.00 0.00 C ATOM 1815 C GLY A 116 9.763 -12.260 11.260 1.00 0.00 C ATOM 1816 O GLY A 116 10.606 -13.133 11.198 1.00 0.00 O ATOM 0 H GLY A 116 8.616 -9.911 11.664 1.00 0.00 H new ATOM 0 HA2 GLY A 116 10.148 -11.359 13.187 1.00 0.00 H new ATOM 0 HA3 GLY A 116 8.813 -12.495 13.187 1.00 0.00 H new ATOM 1820 N LYS A 117 9.220 -11.764 10.176 1.00 0.00 N ATOM 1821 CA LYS A 117 9.630 -12.267 8.828 1.00 0.00 C ATOM 1822 C LYS A 117 10.713 -11.348 8.244 1.00 0.00 C ATOM 1823 O LYS A 117 11.535 -10.812 8.960 1.00 0.00 O ATOM 1824 CB LYS A 117 8.397 -12.287 7.903 1.00 0.00 C ATOM 1825 CG LYS A 117 8.537 -13.397 6.854 1.00 0.00 C ATOM 1826 CD LYS A 117 7.365 -13.319 5.873 1.00 0.00 C ATOM 1827 CE LYS A 117 7.496 -14.424 4.822 1.00 0.00 C ATOM 1828 NZ LYS A 117 6.187 -14.615 4.137 1.00 0.00 N ATOM 0 H LYS A 117 8.510 -11.032 10.166 1.00 0.00 H new ATOM 0 HA LYS A 117 10.034 -13.276 8.915 1.00 0.00 H new ATOM 0 HB2 LYS A 117 7.494 -12.446 8.493 1.00 0.00 H new ATOM 0 HB3 LYS A 117 8.289 -11.322 7.409 1.00 0.00 H new ATOM 0 HG2 LYS A 117 9.481 -13.291 6.319 1.00 0.00 H new ATOM 0 HG3 LYS A 117 8.554 -14.372 7.340 1.00 0.00 H new ATOM 0 HD2 LYS A 117 6.422 -13.424 6.409 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.349 -12.343 5.388 1.00 0.00 H new ATOM 0 HE2 LYS A 117 8.264 -14.160 4.095 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.811 -15.355 5.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 6.275 -15.366 3.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.466 -14.885 4.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.905 -13.728 3.674 1.00 0.00 H new ATOM 1842 N ASP A 118 10.706 -11.159 6.946 1.00 0.00 N ATOM 1843 CA ASP A 118 11.715 -10.270 6.286 1.00 0.00 C ATOM 1844 C ASP A 118 10.956 -9.146 5.603 1.00 0.00 C ATOM 1845 O ASP A 118 9.770 -9.254 5.443 1.00 0.00 O ATOM 1846 CB ASP A 118 12.487 -11.073 5.238 1.00 0.00 C ATOM 1847 CG ASP A 118 13.476 -12.008 5.937 1.00 0.00 C ATOM 1848 OD1 ASP A 118 13.028 -12.979 6.524 1.00 0.00 O ATOM 1849 OD2 ASP A 118 14.664 -11.736 5.875 1.00 0.00 O ATOM 0 H ASP A 118 10.036 -11.588 6.308 1.00 0.00 H new ATOM 0 HA ASP A 118 12.419 -9.872 7.017 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.795 -11.651 4.625 1.00 0.00 H new ATOM 0 HB3 ASP A 118 13.020 -10.399 4.568 1.00 0.00 H new ATOM 1854 N LYS A 119 11.628 -8.083 5.196 1.00 0.00 N ATOM 1855 CA LYS A 119 10.943 -6.926 4.499 1.00 0.00 C ATOM 1856 C LYS A 119 9.606 -7.382 3.896 1.00 0.00 C ATOM 1857 O LYS A 119 9.526 -8.417 3.264 1.00 0.00 O ATOM 1858 CB LYS A 119 11.867 -6.399 3.388 1.00 0.00 C ATOM 1859 CG LYS A 119 12.995 -5.509 3.992 1.00 0.00 C ATOM 1860 CD LYS A 119 12.759 -4.026 3.651 1.00 0.00 C ATOM 1861 CE LYS A 119 13.143 -3.744 2.192 1.00 0.00 C ATOM 1862 NZ LYS A 119 13.300 -2.275 1.998 1.00 0.00 N ATOM 0 H LYS A 119 12.634 -7.965 5.318 1.00 0.00 H new ATOM 0 HA LYS A 119 10.742 -6.134 5.221 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.307 -7.236 2.846 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.287 -5.822 2.668 1.00 0.00 H new ATOM 0 HG2 LYS A 119 13.027 -5.638 5.074 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.963 -5.827 3.604 1.00 0.00 H new ATOM 0 HD2 LYS A 119 11.712 -3.771 3.814 1.00 0.00 H new ATOM 0 HD3 LYS A 119 13.348 -3.395 4.317 1.00 0.00 H new ATOM 0 HE2 LYS A 119 14.072 -4.256 1.943 1.00 0.00 H new ATOM 0 HE3 LYS A 119 12.376 -4.131 1.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 13.610 -2.085 1.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 12.390 -1.803 2.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 14.011 -1.911 2.664 1.00 0.00 H new ATOM 1876 N GLN A 120 8.547 -6.650 4.140 1.00 0.00 N ATOM 1877 CA GLN A 120 7.201 -7.076 3.643 1.00 0.00 C ATOM 1878 C GLN A 120 6.466 -5.879 3.040 1.00 0.00 C ATOM 1879 O GLN A 120 6.969 -4.773 3.004 1.00 0.00 O ATOM 1880 CB GLN A 120 6.360 -7.656 4.819 1.00 0.00 C ATOM 1881 CG GLN A 120 7.256 -8.306 5.891 1.00 0.00 C ATOM 1882 CD GLN A 120 6.529 -8.351 7.234 1.00 0.00 C ATOM 1883 OE1 GLN A 120 5.364 -8.688 7.304 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.185 -8.016 8.311 1.00 0.00 N ATOM 0 H GLN A 120 8.556 -5.774 4.663 1.00 0.00 H new ATOM 0 HA GLN A 120 7.335 -7.842 2.880 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.769 -6.860 5.272 1.00 0.00 H new ATOM 0 HB3 GLN A 120 5.657 -8.395 4.435 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.529 -9.316 5.583 1.00 0.00 H new ATOM 0 HG3 GLN A 120 8.183 -7.742 5.991 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.163 -7.734 8.245 1.00 0.00 H new ATOM 0 HE22 GLN A 120 6.720 -8.036 9.219 1.00 0.00 H new ATOM 1893 N LEU A 121 5.272 -6.102 2.562 1.00 0.00 N ATOM 1894 CA LEU A 121 4.481 -4.999 1.948 1.00 0.00 C ATOM 1895 C LEU A 121 3.000 -5.220 2.248 1.00 0.00 C ATOM 1896 O LEU A 121 2.369 -6.095 1.689 1.00 0.00 O ATOM 1897 CB LEU A 121 4.705 -5.016 0.434 1.00 0.00 C ATOM 1898 CG LEU A 121 3.931 -3.872 -0.239 1.00 0.00 C ATOM 1899 CD1 LEU A 121 4.434 -2.510 0.269 1.00 0.00 C ATOM 1900 CD2 LEU A 121 4.143 -3.962 -1.752 1.00 0.00 C ATOM 0 H LEU A 121 4.807 -7.010 2.571 1.00 0.00 H new ATOM 0 HA LEU A 121 4.795 -4.038 2.356 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.769 -4.920 0.217 1.00 0.00 H new ATOM 0 HB3 LEU A 121 4.381 -5.972 0.024 1.00 0.00 H new ATOM 0 HG LEU A 121 2.872 -3.962 0.002 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.875 -1.711 -0.218 1.00 0.00 H new ATOM 0 HD12 LEU A 121 4.290 -2.448 1.348 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.494 -2.404 0.038 1.00 0.00 H new ATOM 0 HD21 LEU A 121 3.599 -3.156 -2.244 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.206 -3.873 -1.976 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.775 -4.922 -2.114 1.00 0.00 H new ATOM 1912 N THR A 122 2.433 -4.431 3.121 1.00 0.00 N ATOM 1913 CA THR A 122 0.986 -4.593 3.450 1.00 0.00 C ATOM 1914 C THR A 122 0.176 -3.640 2.569 1.00 0.00 C ATOM 1915 O THR A 122 0.477 -2.469 2.471 1.00 0.00 O ATOM 1916 CB THR A 122 0.759 -4.257 4.931 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.350 -5.268 5.735 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.742 -4.185 5.226 1.00 0.00 C ATOM 0 H THR A 122 2.909 -3.680 3.621 1.00 0.00 H new ATOM 0 HA THR A 122 0.670 -5.620 3.268 1.00 0.00 H new ATOM 0 HB THR A 122 1.214 -3.292 5.156 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.209 -5.057 6.682 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.895 -3.946 6.278 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.197 -3.411 4.608 1.00 0.00 H new ATOM 0 HG23 THR A 122 -1.203 -5.147 5.001 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.843 -4.136 1.918 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.678 -3.267 1.031 1.00 0.00 C ATOM 1928 C LEU A 123 -3.056 -3.082 1.662 1.00 0.00 C ATOM 1929 O LEU A 123 -3.548 -3.941 2.365 1.00 0.00 O ATOM 1930 CB LEU A 123 -1.836 -3.933 -0.342 1.00 0.00 C ATOM 1931 CG LEU A 123 -0.443 -4.256 -0.948 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -0.013 -5.687 -0.576 1.00 0.00 C ATOM 1933 CD2 LEU A 123 -0.499 -4.123 -2.482 1.00 0.00 C ATOM 0 H LEU A 123 -1.136 -5.112 1.962 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.193 -2.298 0.911 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.419 -4.849 -0.245 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.388 -3.274 -1.012 1.00 0.00 H new ATOM 0 HG LEU A 123 0.283 -3.551 -0.544 1.00 0.00 H new ATOM 0 HD11 LEU A 123 0.965 -5.897 -1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.042 -5.780 0.509 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -0.742 -6.398 -0.964 1.00 0.00 H new ATOM 0 HD21 LEU A 123 0.480 -4.350 -2.903 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -1.236 -4.820 -2.881 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.781 -3.104 -2.749 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.682 -1.961 1.420 1.00 0.00 N ATOM 1946 CA ILE A 124 -5.031 -1.703 2.006 1.00 0.00 C ATOM 1947 C ILE A 124 -5.887 -0.958 0.983 1.00 0.00 C ATOM 1948 O ILE A 124 -5.414 -0.076 0.298 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.895 -0.827 3.263 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.724 -1.307 4.124 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -6.184 -0.905 4.082 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.558 -0.353 5.305 1.00 0.00 C ATOM 0 H ILE A 124 -3.315 -1.208 0.838 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.495 -2.654 2.269 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.712 0.202 2.954 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -3.908 -2.320 4.481 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.809 -1.339 3.533 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.087 -0.284 4.973 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.020 -0.548 3.480 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.365 -1.938 4.378 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.726 -0.685 5.926 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.356 0.652 4.935 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.473 -0.345 5.898 1.00 0.00 H new ATOM 1964 N THR A 125 -7.146 -1.285 0.880 1.00 0.00 N ATOM 1965 CA THR A 125 -8.022 -0.562 -0.092 1.00 0.00 C ATOM 1966 C THR A 125 -8.713 0.591 0.638 1.00 0.00 C ATOM 1967 O THR A 125 -8.690 0.666 1.851 1.00 0.00 O ATOM 1968 CB THR A 125 -9.077 -1.514 -0.662 1.00 0.00 C ATOM 1969 OG1 THR A 125 -10.240 -1.474 0.152 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.524 -2.939 -0.692 1.00 0.00 C ATOM 0 H THR A 125 -7.606 -2.016 1.422 1.00 0.00 H new ATOM 0 HA THR A 125 -7.418 -0.179 -0.914 1.00 0.00 H new ATOM 0 HB THR A 125 -9.331 -1.205 -1.676 1.00 0.00 H new ATOM 0 HG1 THR A 125 -10.916 -2.082 -0.213 1.00 0.00 H new ATOM 0 HG21 THR A 125 -9.278 -3.613 -1.098 1.00 0.00 H new ATOM 0 HG22 THR A 125 -7.633 -2.970 -1.319 1.00 0.00 H new ATOM 0 HG23 THR A 125 -8.266 -3.251 0.320 1.00 0.00 H new ATOM 1978 N CYS A 126 -9.323 1.495 -0.081 1.00 0.00 N ATOM 1979 CA CYS A 126 -10.008 2.645 0.586 1.00 0.00 C ATOM 1980 C CYS A 126 -11.250 3.043 -0.214 1.00 0.00 C ATOM 1981 O CYS A 126 -11.189 3.259 -1.405 1.00 0.00 O ATOM 1982 CB CYS A 126 -9.045 3.831 0.652 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.780 3.511 1.905 1.00 0.00 S ATOM 0 H CYS A 126 -9.378 1.489 -1.100 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.308 2.355 1.593 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.578 3.988 -0.320 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.590 4.743 0.895 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.097 4.123 3.007 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.377 3.146 0.433 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.619 3.536 -0.293 1.00 0.00 C ATOM 1991 C ASP A 127 -14.755 3.710 0.717 1.00 0.00 C ATOM 1992 O ASP A 127 -14.975 2.870 1.566 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.986 2.447 -1.310 1.00 0.00 C ATOM 1994 CG ASP A 127 -15.376 2.724 -1.889 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -15.556 3.786 -2.463 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -16.235 1.870 -1.749 1.00 0.00 O ATOM 0 H ASP A 127 -12.493 2.977 1.432 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.457 4.474 -0.823 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -13.247 2.421 -2.111 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.970 1.468 -0.830 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.473 4.797 0.630 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.593 5.032 1.585 1.00 0.00 C ATOM 2003 C ASP A 128 -16.030 5.133 3.001 1.00 0.00 C ATOM 2004 O ASP A 128 -16.270 4.286 3.832 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.593 3.870 1.503 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.734 3.421 0.046 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -17.365 4.189 -0.828 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -18.207 2.318 -0.169 1.00 0.00 O ATOM 0 H ASP A 128 -15.332 5.533 -0.062 1.00 0.00 H new ATOM 0 HA ASP A 128 -17.105 5.960 1.330 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -17.252 3.038 2.120 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.562 4.181 1.894 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.277 6.156 3.286 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.707 6.282 4.654 1.00 0.00 C ATOM 2015 C TYR A 129 -15.842 6.454 5.667 1.00 0.00 C ATOM 2016 O TYR A 129 -16.700 7.298 5.510 1.00 0.00 O ATOM 2017 CB TYR A 129 -13.757 7.486 4.712 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.117 7.567 6.080 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -13.833 8.082 7.168 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -11.801 7.129 6.257 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.229 8.154 8.430 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.197 7.201 7.515 1.00 0.00 C ATOM 2023 CZ TYR A 129 -11.911 7.713 8.603 1.00 0.00 C ATOM 2024 OH TYR A 129 -11.317 7.786 9.846 1.00 0.00 O ATOM 0 H TYR A 129 -15.033 6.904 2.637 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.146 5.380 4.899 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -12.988 7.391 3.945 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.305 8.404 4.502 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.849 8.423 7.034 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.249 6.733 5.417 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -13.780 8.550 9.270 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.180 6.862 7.647 1.00 0.00 H new ATOM 0 HH TYR A 129 -10.744 7.003 9.981 1.00 0.00 H new ATOM 2034 N ASN A 130 -15.859 5.657 6.708 1.00 0.00 N ATOM 2035 CA ASN A 130 -16.946 5.779 7.723 1.00 0.00 C ATOM 2036 C ASN A 130 -16.572 6.858 8.744 1.00 0.00 C ATOM 2037 O ASN A 130 -15.623 6.722 9.490 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.116 4.435 8.440 1.00 0.00 C ATOM 2039 CG ASN A 130 -18.090 4.589 9.608 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -17.871 5.393 10.492 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -19.161 3.845 9.653 1.00 0.00 N ATOM 0 H ASN A 130 -15.168 4.930 6.896 1.00 0.00 H new ATOM 0 HA ASN A 130 -17.879 6.054 7.231 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -17.487 3.685 7.742 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -16.151 4.082 8.804 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -19.815 3.938 10.431 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -19.345 3.170 8.911 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.315 7.935 8.777 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.013 9.032 9.743 1.00 0.00 C ATOM 2050 C GLU A 131 -17.666 8.723 11.091 1.00 0.00 C ATOM 2051 O GLU A 131 -17.507 9.450 12.050 1.00 0.00 O ATOM 2052 CB GLU A 131 -17.565 10.352 9.200 1.00 0.00 C ATOM 2053 CG GLU A 131 -18.989 10.137 8.686 1.00 0.00 C ATOM 2054 CD GLU A 131 -19.669 11.492 8.482 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -19.847 12.197 9.461 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -19.998 11.802 7.348 1.00 0.00 O ATOM 0 H GLU A 131 -18.121 8.101 8.174 1.00 0.00 H new ATOM 0 HA GLU A 131 -15.934 9.113 9.874 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.560 11.110 9.983 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.929 10.721 8.396 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -18.968 9.584 7.747 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -19.557 9.537 9.397 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.397 7.648 11.170 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.060 7.289 12.456 1.00 0.00 C ATOM 2065 C LYS A 132 -18.051 6.584 13.363 1.00 0.00 C ATOM 2066 O LYS A 132 -17.927 6.895 14.532 1.00 0.00 O ATOM 2067 CB LYS A 132 -20.242 6.359 12.176 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.244 7.076 11.266 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.542 6.262 11.168 1.00 0.00 C ATOM 2070 CE LYS A 132 -22.320 5.019 10.299 1.00 0.00 C ATOM 2071 NZ LYS A 132 -23.639 4.416 9.958 1.00 0.00 N ATOM 0 H LYS A 132 -18.565 7.001 10.400 1.00 0.00 H new ATOM 0 HA LYS A 132 -19.422 8.191 12.949 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -19.894 5.442 11.701 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -20.723 6.071 13.111 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.458 8.070 11.659 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -20.814 7.211 10.273 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -22.870 5.965 12.164 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -23.335 6.877 10.741 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -21.784 5.288 9.389 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -21.702 4.295 10.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -23.493 3.572 9.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.134 4.146 10.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -24.213 5.108 9.435 1.00 0.00 H new ATOM 2085 N THR A 133 -17.321 5.638 12.833 1.00 0.00 N ATOM 2086 CA THR A 133 -16.309 4.910 13.657 1.00 0.00 C ATOM 2087 C THR A 133 -14.934 5.549 13.450 1.00 0.00 C ATOM 2088 O THR A 133 -14.021 5.349 14.225 1.00 0.00 O ATOM 2089 CB THR A 133 -16.257 3.444 13.221 1.00 0.00 C ATOM 2090 OG1 THR A 133 -15.846 3.369 11.863 1.00 0.00 O ATOM 2091 CG2 THR A 133 -17.643 2.817 13.372 1.00 0.00 C ATOM 0 H THR A 133 -17.382 5.336 11.861 1.00 0.00 H new ATOM 0 HA THR A 133 -16.586 4.968 14.710 1.00 0.00 H new ATOM 0 HB THR A 133 -15.546 2.904 13.846 1.00 0.00 H new ATOM 0 HG1 THR A 133 -15.811 2.430 11.583 1.00 0.00 H new ATOM 0 HG21 THR A 133 -17.606 1.773 13.061 1.00 0.00 H new ATOM 0 HG22 THR A 133 -17.957 2.875 14.414 1.00 0.00 H new ATOM 0 HG23 THR A 133 -18.356 3.356 12.748 1.00 0.00 H new ATOM 2099 N GLY A 134 -14.782 6.320 12.407 1.00 0.00 N ATOM 2100 CA GLY A 134 -13.467 6.975 12.148 1.00 0.00 C ATOM 2101 C GLY A 134 -12.517 5.975 11.489 1.00 0.00 C ATOM 2102 O GLY A 134 -11.331 5.963 11.756 1.00 0.00 O ATOM 0 H GLY A 134 -15.511 6.525 11.723 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.602 7.843 11.503 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.039 7.337 13.083 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.028 5.129 10.631 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.156 4.122 9.953 1.00 0.00 C ATOM 2108 C VAL A 135 -12.682 3.858 8.542 1.00 0.00 C ATOM 2109 O VAL A 135 -13.839 4.085 8.250 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.184 2.809 10.744 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -10.988 1.941 10.347 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -12.118 3.110 12.243 1.00 0.00 C ATOM 0 H VAL A 135 -14.013 5.092 10.370 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.137 4.505 9.903 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.108 2.276 10.520 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -11.012 1.009 10.911 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.036 1.721 9.281 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.063 2.474 10.566 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -12.138 2.175 12.803 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.196 3.647 12.466 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -12.973 3.723 12.529 1.00 0.00 H new ATOM 2122 N TRP A 136 -11.850 3.363 7.668 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.320 3.069 6.294 1.00 0.00 C ATOM 2124 C TRP A 136 -13.435 2.025 6.374 1.00 0.00 C ATOM 2125 O TRP A 136 -13.206 0.891 6.744 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.147 2.546 5.451 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.360 3.709 4.928 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.145 4.099 5.374 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.731 4.646 3.879 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -8.750 5.218 4.660 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.691 5.589 3.726 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.859 4.762 3.055 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.765 6.615 2.785 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -11.942 5.794 2.104 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -10.896 6.719 1.969 1.00 0.00 C ATOM 0 H TRP A 136 -10.869 3.151 7.849 1.00 0.00 H new ATOM 0 HA TRP A 136 -12.706 3.973 5.822 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.508 1.901 6.055 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.519 1.942 4.624 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.577 3.618 6.157 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -7.868 5.708 4.808 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.669 4.054 3.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -8.956 7.323 2.687 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.816 5.875 1.474 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -10.964 7.510 1.237 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.643 2.417 6.050 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.803 1.475 6.117 1.00 0.00 C ATOM 2148 C GLU A 137 -15.386 0.079 5.635 1.00 0.00 C ATOM 2149 O GLU A 137 -15.032 -0.777 6.420 1.00 0.00 O ATOM 2150 CB GLU A 137 -16.949 2.004 5.246 1.00 0.00 C ATOM 2151 CG GLU A 137 -18.195 1.129 5.429 1.00 0.00 C ATOM 2152 CD GLU A 137 -18.729 1.287 6.854 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -19.528 2.183 7.070 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -18.329 0.509 7.705 1.00 0.00 O ATOM 0 H GLU A 137 -14.877 3.360 5.739 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.138 1.402 7.152 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.176 3.035 5.517 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.648 2.008 4.198 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -18.962 1.415 4.709 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -17.950 0.085 5.235 1.00 0.00 H new ATOM 2161 N LYS A 138 -15.420 -0.155 4.349 1.00 0.00 N ATOM 2162 CA LYS A 138 -15.019 -1.495 3.816 1.00 0.00 C ATOM 2163 C LYS A 138 -13.543 -1.453 3.416 1.00 0.00 C ATOM 2164 O LYS A 138 -13.022 -0.418 3.048 1.00 0.00 O ATOM 2165 CB LYS A 138 -15.871 -1.834 2.588 1.00 0.00 C ATOM 2166 CG LYS A 138 -17.268 -2.276 3.034 1.00 0.00 C ATOM 2167 CD LYS A 138 -18.075 -2.735 1.817 1.00 0.00 C ATOM 2168 CE LYS A 138 -19.306 -3.515 2.283 1.00 0.00 C ATOM 2169 NZ LYS A 138 -20.107 -2.672 3.213 1.00 0.00 N ATOM 0 H LYS A 138 -15.708 0.523 3.643 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.172 -2.255 4.582 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -15.946 -0.965 1.934 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -15.395 -2.627 2.011 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -17.190 -3.087 3.758 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -17.779 -1.452 3.532 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -18.381 -1.873 1.224 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -17.457 -3.361 1.173 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -19.912 -3.805 1.425 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -18.999 -4.435 2.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -21.070 -3.058 3.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -19.659 -2.669 4.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -20.153 -1.699 2.848 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.862 -2.565 3.488 1.00 0.00 N ATOM 2184 CA ARG A 139 -11.420 -2.569 3.111 1.00 0.00 C ATOM 2185 C ARG A 139 -10.885 -4.005 3.102 1.00 0.00 C ATOM 2186 O ARG A 139 -11.419 -4.883 3.751 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.630 -1.741 4.126 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.966 -2.213 5.542 1.00 0.00 C ATOM 2189 CD ARG A 139 -10.111 -1.446 6.553 1.00 0.00 C ATOM 2190 NE ARG A 139 -10.529 -1.812 7.936 1.00 0.00 N ATOM 2191 CZ ARG A 139 -9.752 -1.531 8.947 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -8.609 -0.933 8.743 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -10.117 -1.848 10.159 1.00 0.00 N ATOM 0 H ARG A 139 -13.238 -3.464 3.789 1.00 0.00 H new ATOM 0 HA ARG A 139 -11.309 -2.139 2.116 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -9.561 -1.844 3.941 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.873 -0.684 4.016 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -12.024 -2.052 5.749 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -10.783 -3.284 5.633 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -9.057 -1.681 6.406 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -10.223 -0.373 6.400 1.00 0.00 H new ATOM 0 HE ARG A 139 -11.421 -2.281 8.092 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -8.325 -0.686 7.795 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.001 -0.713 9.532 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -11.010 -2.316 10.317 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -9.510 -1.628 10.948 1.00 0.00 H new ATOM 2207 N LYS A 140 -9.823 -4.240 2.371 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.216 -5.607 2.303 1.00 0.00 C ATOM 2209 C LYS A 140 -7.713 -5.480 2.563 1.00 0.00 C ATOM 2210 O LYS A 140 -7.161 -4.396 2.492 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.455 -6.205 0.914 1.00 0.00 C ATOM 2212 CG LYS A 140 -10.954 -6.483 0.735 1.00 0.00 C ATOM 2213 CD LYS A 140 -11.194 -7.286 -0.550 1.00 0.00 C ATOM 2214 CE LYS A 140 -11.055 -6.374 -1.774 1.00 0.00 C ATOM 2215 NZ LYS A 140 -11.517 -7.105 -2.988 1.00 0.00 N ATOM 0 H LYS A 140 -9.345 -3.534 1.811 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.669 -6.260 3.049 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.106 -5.517 0.144 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -8.886 -7.127 0.799 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.334 -7.036 1.594 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.503 -5.542 0.693 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -10.479 -8.106 -0.615 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -12.189 -7.731 -0.530 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -11.644 -5.467 -1.635 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -10.017 -6.064 -1.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -10.694 -7.379 -3.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.040 -7.957 -2.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -12.140 -6.489 -3.548 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.049 -6.569 2.886 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.580 -6.502 3.178 1.00 0.00 C ATOM 2231 C ILE A 141 -4.822 -7.640 2.483 1.00 0.00 C ATOM 2232 O ILE A 141 -5.174 -8.798 2.593 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.373 -6.617 4.692 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.433 -5.779 5.414 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -3.975 -6.112 5.063 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -6.130 -5.742 6.915 1.00 0.00 C ATOM 0 H ILE A 141 -7.462 -7.499 2.959 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.194 -5.554 2.804 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.467 -7.660 4.993 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -6.446 -4.766 5.011 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -7.423 -6.202 5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.832 -6.196 6.140 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.223 -6.712 4.550 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -3.874 -5.069 4.763 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.886 -5.145 7.424 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -6.140 -6.757 7.313 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -5.148 -5.298 7.077 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.757 -7.306 1.796 1.00 0.00 N ATOM 2249 CA PHE A 142 -2.918 -8.336 1.104 1.00 0.00 C ATOM 2250 C PHE A 142 -1.484 -8.197 1.629 1.00 0.00 C ATOM 2251 O PHE A 142 -1.149 -7.209 2.253 1.00 0.00 O ATOM 2252 CB PHE A 142 -2.937 -8.093 -0.410 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.347 -8.237 -0.937 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -5.312 -7.265 -0.633 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -4.693 -9.338 -1.731 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -6.617 -7.397 -1.122 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -5.999 -9.469 -2.219 1.00 0.00 C ATOM 2258 CZ PHE A 142 -6.960 -8.499 -1.915 1.00 0.00 C ATOM 0 H PHE A 142 -3.428 -6.347 1.683 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.305 -9.336 1.299 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -2.557 -7.096 -0.632 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.278 -8.804 -0.909 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -5.048 -6.415 -0.022 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -3.951 -10.087 -1.967 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -7.360 -6.649 -0.888 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -6.264 -10.319 -2.830 1.00 0.00 H new ATOM 0 HZ PHE A 142 -7.967 -8.600 -2.292 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.631 -9.164 1.398 1.00 0.00 N ATOM 2269 CA VAL A 143 0.775 -9.053 1.910 1.00 0.00 C ATOM 2270 C VAL A 143 1.754 -9.723 0.940 1.00 0.00 C ATOM 2271 O VAL A 143 1.438 -10.706 0.292 1.00 0.00 O ATOM 2272 CB VAL A 143 0.878 -9.733 3.277 1.00 0.00 C ATOM 2273 CG1 VAL A 143 2.258 -9.459 3.882 1.00 0.00 C ATOM 2274 CG2 VAL A 143 -0.202 -9.176 4.207 1.00 0.00 C ATOM 0 H VAL A 143 -0.842 -10.019 0.882 1.00 0.00 H new ATOM 0 HA VAL A 143 1.030 -7.997 1.999 1.00 0.00 H new ATOM 0 HB VAL A 143 0.739 -10.807 3.158 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.331 -9.943 4.856 1.00 0.00 H new ATOM 0 HG12 VAL A 143 3.030 -9.854 3.221 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.397 -8.384 4.000 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -0.129 -9.660 5.181 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.062 -8.101 4.325 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.186 -9.369 3.779 1.00 0.00 H new ATOM 2284 N ALA A 144 2.950 -9.192 0.847 1.00 0.00 N ATOM 2285 CA ALA A 144 3.979 -9.772 -0.067 1.00 0.00 C ATOM 2286 C ALA A 144 5.354 -9.665 0.602 1.00 0.00 C ATOM 2287 O ALA A 144 5.657 -8.685 1.251 1.00 0.00 O ATOM 2288 CB ALA A 144 3.992 -8.979 -1.375 1.00 0.00 C ATOM 0 H ALA A 144 3.258 -8.373 1.372 1.00 0.00 H new ATOM 0 HA ALA A 144 3.747 -10.817 -0.274 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.741 -9.398 -2.047 1.00 0.00 H new ATOM 0 HB2 ALA A 144 3.010 -9.037 -1.845 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.234 -7.937 -1.166 1.00 0.00 H new ATOM 2294 N THR A 145 6.186 -10.668 0.456 1.00 0.00 N ATOM 2295 CA THR A 145 7.544 -10.621 1.095 1.00 0.00 C ATOM 2296 C THR A 145 8.590 -10.191 0.065 1.00 0.00 C ATOM 2297 O THR A 145 8.491 -10.510 -1.103 1.00 0.00 O ATOM 2298 CB THR A 145 7.911 -12.006 1.632 1.00 0.00 C ATOM 2299 OG1 THR A 145 9.141 -11.924 2.340 1.00 0.00 O ATOM 2300 CG2 THR A 145 8.057 -12.987 0.469 1.00 0.00 C ATOM 0 H THR A 145 5.987 -11.515 -0.076 1.00 0.00 H new ATOM 0 HA THR A 145 7.523 -9.903 1.915 1.00 0.00 H new ATOM 0 HB THR A 145 7.125 -12.356 2.301 1.00 0.00 H new ATOM 0 HG1 THR A 145 9.378 -12.809 2.687 1.00 0.00 H new ATOM 0 HG21 THR A 145 8.318 -13.972 0.855 1.00 0.00 H new ATOM 0 HG22 THR A 145 7.115 -13.049 -0.075 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.842 -12.640 -0.203 1.00 0.00 H new ATOM 2308 N GLU A 146 9.598 -9.475 0.491 1.00 0.00 N ATOM 2309 CA GLU A 146 10.662 -9.033 -0.459 1.00 0.00 C ATOM 2310 C GLU A 146 11.424 -10.255 -0.993 1.00 0.00 C ATOM 2311 O GLU A 146 12.614 -10.201 -1.229 1.00 0.00 O ATOM 2312 CB GLU A 146 11.632 -8.093 0.268 1.00 0.00 C ATOM 2313 CG GLU A 146 12.415 -7.259 -0.752 1.00 0.00 C ATOM 2314 CD GLU A 146 13.298 -6.250 -0.017 1.00 0.00 C ATOM 2315 OE1 GLU A 146 13.974 -6.653 0.916 1.00 0.00 O ATOM 2316 OE2 GLU A 146 13.285 -5.092 -0.399 1.00 0.00 O ATOM 0 H GLU A 146 9.730 -9.177 1.457 1.00 0.00 H new ATOM 0 HA GLU A 146 10.205 -8.507 -1.297 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.080 -7.436 0.940 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.321 -8.672 0.883 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.029 -7.910 -1.375 1.00 0.00 H new ATOM 0 HG3 GLU A 146 11.726 -6.738 -1.417 1.00 0.00 H new ATOM 2323 N VAL A 147 10.748 -11.359 -1.183 1.00 0.00 N ATOM 2324 CA VAL A 147 11.428 -12.587 -1.695 1.00 0.00 C ATOM 2325 C VAL A 147 10.439 -13.387 -2.544 1.00 0.00 C ATOM 2326 O VAL A 147 9.675 -12.839 -3.314 1.00 0.00 O ATOM 2327 CB VAL A 147 11.907 -13.450 -0.509 1.00 0.00 C ATOM 2328 CG1 VAL A 147 13.054 -14.367 -0.957 1.00 0.00 C ATOM 2329 CG2 VAL A 147 12.400 -12.544 0.626 1.00 0.00 C ATOM 0 H VAL A 147 9.749 -11.463 -1.005 1.00 0.00 H new ATOM 0 HA VAL A 147 12.289 -12.303 -2.300 1.00 0.00 H new ATOM 0 HB VAL A 147 11.074 -14.058 -0.157 1.00 0.00 H new ATOM 0 HG11 VAL A 147 13.386 -14.973 -0.114 1.00 0.00 H new ATOM 0 HG12 VAL A 147 12.706 -15.020 -1.758 1.00 0.00 H new ATOM 0 HG13 VAL A 147 13.885 -13.761 -1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 147 12.737 -13.158 1.461 1.00 0.00 H new ATOM 0 HG22 VAL A 147 13.228 -11.931 0.269 1.00 0.00 H new ATOM 0 HG23 VAL A 147 11.586 -11.898 0.956 1.00 0.00 H new ATOM 2339 N LYS A 148 10.448 -14.681 -2.401 1.00 0.00 N ATOM 2340 CA LYS A 148 9.511 -15.533 -3.187 1.00 0.00 C ATOM 2341 C LYS A 148 8.166 -15.607 -2.462 1.00 0.00 C ATOM 2342 O LYS A 148 7.719 -14.580 -1.980 1.00 0.00 O ATOM 2343 CB LYS A 148 10.093 -16.942 -3.324 1.00 0.00 C ATOM 2344 CG LYS A 148 11.297 -16.904 -4.268 1.00 0.00 C ATOM 2345 CD LYS A 148 11.794 -18.329 -4.528 1.00 0.00 C ATOM 2346 CE LYS A 148 12.928 -18.291 -5.553 1.00 0.00 C ATOM 2347 NZ LYS A 148 12.462 -17.592 -6.785 1.00 0.00 N ATOM 2348 OXT LYS A 148 7.607 -16.689 -2.399 1.00 0.00 O ATOM 0 H LYS A 148 11.067 -15.190 -1.770 1.00 0.00 H new ATOM 0 HA LYS A 148 9.370 -15.101 -4.178 1.00 0.00 H new ATOM 0 HB2 LYS A 148 10.395 -17.320 -2.347 1.00 0.00 H new ATOM 0 HB3 LYS A 148 9.336 -17.625 -3.710 1.00 0.00 H new ATOM 0 HG2 LYS A 148 11.019 -16.428 -5.208 1.00 0.00 H new ATOM 0 HG3 LYS A 148 12.095 -16.304 -3.831 1.00 0.00 H new ATOM 0 HD2 LYS A 148 12.143 -18.779 -3.599 1.00 0.00 H new ATOM 0 HD3 LYS A 148 10.977 -18.950 -4.896 1.00 0.00 H new ATOM 0 HE2 LYS A 148 13.793 -17.776 -5.135 1.00 0.00 H new ATOM 0 HE3 LYS A 148 13.247 -19.305 -5.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 12.925 -18.010 -7.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 11.431 -17.695 -6.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 12.705 -16.583 -6.724 1.00 0.00 H new TER 2362 LYS A 148