USER MOD reduce.3.24.130724 H: found=0, std=0, add=1137, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1140 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 96 ZNZN :(H bumps) USER MOD NoAdj-H: A 49 HIS HE2 : A 49 HIS NE2 : A 97 ZNZN :(H bumps) USER MOD NoAdj-H: A 73 HIS HE2 : A 73 HIS NE2 : A 98 ZNZN :(H bumps) USER MOD Set 1.1: A 57 LYS NZ :NH3+ 165:sc= 1.09 (180deg=0.751) USER MOD Set 1.2: B 134 ASN : amide:sc= 1.06 K(o=2.2,f=-2.3) USER MOD Set 2.1: A 51 THR OG1 : rot 74:sc= 0.0277 USER MOD Set 2.2: A 52 HIS : no HE2:sc= 1.16 K(o=1.2,f=-3.6!) USER MOD Set 3.1: A 20 HIS : no HE2:sc= 1.04 K(o=1.9,f=-5.7!) USER MOD Set 3.2: A 23 GLN : amide:sc= 0.886 K(o=1.9,f=-2!) USER MOD Set 4.1: A 11 GLN : amide:sc= 0.659 K(o=0.98,f=-2.8) USER MOD Set 4.2: A 12 GLN : amide:sc= 0.364 K(o=0.98,f=-3.2) USER MOD Set 4.3: A 43 MET CE :methyl -173:sc= -0.0396 (180deg=-0.104) USER MOD Single : A 1 ALA N :NH3+ -117:sc= 0.0687 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 176:sc= 1.3 (180deg=1.21) USER MOD Single : A 7 LYS NZ :NH3+ 176:sc= 1.26 (180deg=1.15) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 21 LYS NZ :NH3+ -158:sc= 0.77 (180deg=-0.303) USER MOD Single : A 27 GLN : amide:sc= -0.229 X(o=-0.23,f=-0.23) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= -0.0999 X(o=-0.1,f=-0.32) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 167:sc= 2.69 (180deg=1.43) USER MOD Single : A 45 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 MET CE :methyl -174:sc= -0.146 (180deg=-0.251) USER MOD Single : A 54 GLN : amide:sc= 0.806 K(o=0.81,f=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 HIS : no HD1:sc= 0.267 K(o=0.27,f=-2!) USER MOD Single : A 66 SER OG : rot -103:sc= 1.3 USER MOD Single : A 67 SER OG : rot -80:sc= 1.19 USER MOD Single : A 69 GLN : amide:sc=-0.00353 X(o=-0.0035,f=-0.35) USER MOD Single : A 72 SER OG : rot 160:sc= 1.06 USER MOD Single : A 75 LYS NZ :NH3+ -169:sc= 0.632 (180deg=0.567) USER MOD Single : A 76 ASN : amide:sc= 1.77 K(o=1.8,f=-6.6!) USER MOD Single : A 78 THR OG1 : rot -44:sc= 0.295 USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 LYS NZ :NH3+ -160:sc= 1.01 (180deg=0.702) USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -176:sc= 1.16 (180deg=1.08) USER MOD Single : B 99 SER OG : rot 35:sc= 0.0768 USER MOD Single : B 103 CYS SG : rot 11:sc= -0.191 USER MOD Single : B 108 GLN : amide:sc= 0.835 K(o=0.84,f=0) USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 110 MET CE :methyl -176:sc= 0 (180deg=-0.0259) USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 119 THR OG1 : rot -81:sc= 1.22 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 CYS SG : rot 81:sc= -0.372 USER MOD Single : B 126 ASN : amide:sc= 1.79 K(o=1.8,f=-4.4!) USER MOD Single : B 130 GLN : amide:sc= 0.234 K(o=0.23,f=-5.6!) USER MOD Single : B 132 SER OG : rot 180:sc= 0.00159 USER MOD Single : B 137 GLN : amide:sc= 0.105 K(o=0.1,f=-2.3) USER MOD Single : B 147 GLN : amide:sc= 0.795 K(o=0.8,f=0) USER MOD Single : B 149 ASN : amide:sc= 0.884 K(o=0.88,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 6.597 -11.729 16.481 1.00 0.00 N ATOM 2 CA ALA A 1 5.846 -10.503 16.116 1.00 0.00 C ATOM 3 C ALA A 1 5.941 -9.450 17.229 1.00 0.00 C ATOM 4 O ALA A 1 6.267 -9.771 18.375 1.00 0.00 O ATOM 5 CB ALA A 1 4.385 -10.834 15.755 1.00 0.00 C ATOM 0 H1 ALA A 1 7.375 -11.873 15.807 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.985 -11.626 17.440 1.00 0.00 H new ATOM 0 H3 ALA A 1 5.958 -12.549 16.452 1.00 0.00 H new ATOM 0 HA ALA A 1 6.305 -10.074 15.226 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.858 -9.917 15.492 1.00 0.00 H new ATOM 0 HB2 ALA A 1 4.366 -11.519 14.908 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.896 -11.301 16.610 1.00 0.00 H new ATOM 13 N ASP A 2 5.674 -8.184 16.902 1.00 0.00 N ATOM 14 CA ASP A 2 5.737 -7.020 17.796 1.00 0.00 C ATOM 15 C ASP A 2 4.588 -6.028 17.483 1.00 0.00 C ATOM 16 O ASP A 2 4.343 -5.737 16.307 1.00 0.00 O ATOM 17 CB ASP A 2 7.116 -6.365 17.620 1.00 0.00 C ATOM 18 CG ASP A 2 7.267 -5.089 18.456 1.00 0.00 C ATOM 19 OD1 ASP A 2 6.864 -4.012 17.964 1.00 0.00 O ATOM 20 OD2 ASP A 2 7.783 -5.169 19.596 1.00 0.00 O ATOM 0 H ASP A 2 5.393 -7.927 15.956 1.00 0.00 H new ATOM 0 HA ASP A 2 5.610 -7.327 18.834 1.00 0.00 H new ATOM 0 HB2 ASP A 2 7.892 -7.076 17.904 1.00 0.00 H new ATOM 0 HB3 ASP A 2 7.271 -6.127 16.568 1.00 0.00 H new ATOM 25 N PRO A 3 3.865 -5.500 18.492 1.00 0.00 N ATOM 26 CA PRO A 3 2.731 -4.594 18.281 1.00 0.00 C ATOM 27 C PRO A 3 3.108 -3.293 17.563 1.00 0.00 C ATOM 28 O PRO A 3 2.406 -2.898 16.638 1.00 0.00 O ATOM 29 CB PRO A 3 2.113 -4.358 19.663 1.00 0.00 C ATOM 30 CG PRO A 3 3.255 -4.654 20.632 1.00 0.00 C ATOM 31 CD PRO A 3 4.045 -5.747 19.917 1.00 0.00 C ATOM 0 HA PRO A 3 2.008 -5.046 17.603 1.00 0.00 H new ATOM 0 HB2 PRO A 3 1.753 -3.335 19.770 1.00 0.00 H new ATOM 0 HB3 PRO A 3 1.261 -5.015 19.837 1.00 0.00 H new ATOM 0 HG2 PRO A 3 3.866 -3.770 20.816 1.00 0.00 H new ATOM 0 HG3 PRO A 3 2.885 -4.992 21.600 1.00 0.00 H new ATOM 0 HD2 PRO A 3 5.100 -5.709 20.190 1.00 0.00 H new ATOM 0 HD3 PRO A 3 3.680 -6.737 20.191 1.00 0.00 H new ATOM 39 N GLU A 4 4.199 -2.618 17.929 1.00 0.00 N ATOM 40 CA GLU A 4 4.632 -1.388 17.245 1.00 0.00 C ATOM 41 C GLU A 4 5.029 -1.664 15.787 1.00 0.00 C ATOM 42 O GLU A 4 4.641 -0.903 14.900 1.00 0.00 O ATOM 43 CB GLU A 4 5.736 -0.649 18.010 1.00 0.00 C ATOM 44 CG GLU A 4 5.222 0.203 19.181 1.00 0.00 C ATOM 45 CD GLU A 4 4.515 -0.615 20.278 1.00 0.00 C ATOM 46 OE1 GLU A 4 5.203 -1.166 21.172 1.00 0.00 O ATOM 47 OE2 GLU A 4 3.261 -0.680 20.265 1.00 0.00 O ATOM 0 H GLU A 4 4.805 -2.901 18.699 1.00 0.00 H new ATOM 0 HA GLU A 4 3.772 -0.718 17.227 1.00 0.00 H new ATOM 0 HB2 GLU A 4 6.451 -1.379 18.391 1.00 0.00 H new ATOM 0 HB3 GLU A 4 6.277 -0.006 17.316 1.00 0.00 H new ATOM 0 HG2 GLU A 4 6.061 0.740 19.624 1.00 0.00 H new ATOM 0 HG3 GLU A 4 4.531 0.953 18.797 1.00 0.00 H new ATOM 54 N LYS A 5 5.727 -2.771 15.495 1.00 0.00 N ATOM 55 CA LYS A 5 5.998 -3.178 14.098 1.00 0.00 C ATOM 56 C LYS A 5 4.684 -3.381 13.335 1.00 0.00 C ATOM 57 O LYS A 5 4.594 -3.016 12.163 1.00 0.00 O ATOM 58 CB LYS A 5 6.880 -4.431 14.000 1.00 0.00 C ATOM 59 CG LYS A 5 8.321 -4.159 14.455 1.00 0.00 C ATOM 60 CD LYS A 5 9.219 -5.372 14.173 1.00 0.00 C ATOM 61 CE LYS A 5 10.665 -5.065 14.577 1.00 0.00 C ATOM 62 NZ LYS A 5 11.568 -6.196 14.246 1.00 0.00 N ATOM 0 H LYS A 5 6.114 -3.400 16.198 1.00 0.00 H new ATOM 0 HA LYS A 5 6.560 -2.366 13.637 1.00 0.00 H new ATOM 0 HB2 LYS A 5 6.451 -5.225 14.611 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.887 -4.790 12.971 1.00 0.00 H new ATOM 0 HG2 LYS A 5 8.712 -3.283 13.937 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.334 -3.931 15.521 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.856 -6.239 14.725 1.00 0.00 H new ATOM 0 HD3 LYS A 5 9.176 -5.627 13.114 1.00 0.00 H new ATOM 0 HE2 LYS A 5 11.004 -4.164 14.066 1.00 0.00 H new ATOM 0 HE3 LYS A 5 10.711 -4.861 15.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 12.549 -5.933 14.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 11.298 -7.031 14.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 11.490 -6.417 13.233 1.00 0.00 H new ATOM 76 N ARG A 6 3.640 -3.901 13.995 1.00 0.00 N ATOM 77 CA ARG A 6 2.294 -4.067 13.425 1.00 0.00 C ATOM 78 C ARG A 6 1.704 -2.695 13.070 1.00 0.00 C ATOM 79 O ARG A 6 1.220 -2.542 11.950 1.00 0.00 O ATOM 80 CB ARG A 6 1.416 -4.934 14.352 1.00 0.00 C ATOM 81 CG ARG A 6 0.318 -5.701 13.600 1.00 0.00 C ATOM 82 CD ARG A 6 -0.941 -4.859 13.357 1.00 0.00 C ATOM 83 NE ARG A 6 -1.832 -5.507 12.374 1.00 0.00 N ATOM 84 CZ ARG A 6 -1.735 -5.462 11.056 1.00 0.00 C ATOM 85 NH1 ARG A 6 -0.820 -4.761 10.446 1.00 0.00 N ATOM 86 NH2 ARG A 6 -2.563 -6.133 10.311 1.00 0.00 N ATOM 0 H ARG A 6 3.708 -4.225 14.960 1.00 0.00 H new ATOM 0 HA ARG A 6 2.341 -4.619 12.486 1.00 0.00 H new ATOM 0 HB2 ARG A 6 2.050 -5.645 14.882 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.954 -4.296 15.106 1.00 0.00 H new ATOM 0 HG2 ARG A 6 0.711 -6.042 12.642 1.00 0.00 H new ATOM 0 HG3 ARG A 6 0.049 -6.591 14.169 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -1.474 -4.716 14.297 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -0.657 -3.870 12.998 1.00 0.00 H new ATOM 0 HE ARG A 6 -2.608 -6.049 12.754 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.145 -4.221 10.988 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.779 -4.753 9.427 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -3.294 -6.699 10.743 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.482 -6.093 9.295 1.00 0.00 H new ATOM 100 N LYS A 7 1.798 -1.697 13.962 1.00 0.00 N ATOM 101 CA LYS A 7 1.385 -0.291 13.722 1.00 0.00 C ATOM 102 C LYS A 7 2.095 0.288 12.494 1.00 0.00 C ATOM 103 O LYS A 7 1.452 0.864 11.619 1.00 0.00 O ATOM 104 CB LYS A 7 1.658 0.618 14.936 1.00 0.00 C ATOM 105 CG LYS A 7 0.933 0.197 16.219 1.00 0.00 C ATOM 106 CD LYS A 7 1.349 1.095 17.389 1.00 0.00 C ATOM 107 CE LYS A 7 0.472 0.885 18.630 1.00 0.00 C ATOM 108 NZ LYS A 7 0.687 -0.444 19.258 1.00 0.00 N ATOM 0 H LYS A 7 2.173 -1.842 14.899 1.00 0.00 H new ATOM 0 HA LYS A 7 0.309 -0.316 13.549 1.00 0.00 H new ATOM 0 HB2 LYS A 7 2.731 0.634 15.128 1.00 0.00 H new ATOM 0 HB3 LYS A 7 1.364 1.637 14.685 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -0.145 0.258 16.071 1.00 0.00 H new ATOM 0 HG3 LYS A 7 1.165 -0.843 16.450 1.00 0.00 H new ATOM 0 HD2 LYS A 7 2.389 0.894 17.645 1.00 0.00 H new ATOM 0 HD3 LYS A 7 1.292 2.139 17.080 1.00 0.00 H new ATOM 0 HE2 LYS A 7 0.686 1.667 19.359 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -0.577 0.987 18.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.123 -0.512 20.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.394 -1.192 18.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 1.695 -0.560 19.488 1.00 0.00 H new ATOM 122 N LEU A 8 3.417 0.119 12.411 1.00 0.00 N ATOM 123 CA LEU A 8 4.237 0.546 11.272 1.00 0.00 C ATOM 124 C LEU A 8 3.740 -0.099 9.967 1.00 0.00 C ATOM 125 O LEU A 8 3.597 0.588 8.958 1.00 0.00 O ATOM 126 CB LEU A 8 5.723 0.255 11.553 1.00 0.00 C ATOM 127 CG LEU A 8 6.334 1.132 12.664 1.00 0.00 C ATOM 128 CD1 LEU A 8 7.740 0.628 12.994 1.00 0.00 C ATOM 129 CD2 LEU A 8 6.424 2.607 12.259 1.00 0.00 C ATOM 0 H LEU A 8 3.960 -0.328 13.150 1.00 0.00 H new ATOM 0 HA LEU A 8 4.138 1.623 11.140 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.831 -0.793 11.831 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.291 0.402 10.635 1.00 0.00 H new ATOM 0 HG LEU A 8 5.678 1.059 13.532 1.00 0.00 H new ATOM 0 HD11 LEU A 8 8.173 1.247 13.779 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.685 -0.406 13.335 1.00 0.00 H new ATOM 0 HD13 LEU A 8 8.365 0.683 12.103 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.861 3.182 13.075 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.050 2.703 11.372 1.00 0.00 H new ATOM 0 HD23 LEU A 8 5.425 2.986 12.042 1.00 0.00 H new ATOM 141 N ILE A 9 3.429 -1.399 9.978 1.00 0.00 N ATOM 142 CA ILE A 9 2.839 -2.105 8.829 1.00 0.00 C ATOM 143 C ILE A 9 1.490 -1.463 8.449 1.00 0.00 C ATOM 144 O ILE A 9 1.309 -1.134 7.279 1.00 0.00 O ATOM 145 CB ILE A 9 2.771 -3.627 9.091 1.00 0.00 C ATOM 146 CG1 ILE A 9 4.206 -4.202 9.052 1.00 0.00 C ATOM 147 CG2 ILE A 9 1.907 -4.360 8.051 1.00 0.00 C ATOM 148 CD1 ILE A 9 4.333 -5.583 9.692 1.00 0.00 C ATOM 0 H ILE A 9 3.580 -1.998 10.789 1.00 0.00 H new ATOM 0 HA ILE A 9 3.482 -1.995 7.956 1.00 0.00 H new ATOM 0 HB ILE A 9 2.311 -3.780 10.067 1.00 0.00 H new ATOM 0 HG12 ILE A 9 4.536 -4.260 8.015 1.00 0.00 H new ATOM 0 HG13 ILE A 9 4.878 -3.512 9.562 1.00 0.00 H new ATOM 0 HG21 ILE A 9 1.890 -5.426 8.278 1.00 0.00 H new ATOM 0 HG22 ILE A 9 0.891 -3.967 8.080 1.00 0.00 H new ATOM 0 HG23 ILE A 9 2.327 -4.207 7.057 1.00 0.00 H new ATOM 0 HD11 ILE A 9 5.367 -5.921 9.627 1.00 0.00 H new ATOM 0 HD12 ILE A 9 4.035 -5.528 10.739 1.00 0.00 H new ATOM 0 HD13 ILE A 9 3.688 -6.288 9.168 1.00 0.00 H new ATOM 160 N GLN A 10 0.571 -1.231 9.403 1.00 0.00 N ATOM 161 CA GLN A 10 -0.721 -0.545 9.165 1.00 0.00 C ATOM 162 C GLN A 10 -0.509 0.795 8.437 1.00 0.00 C ATOM 163 O GLN A 10 -1.116 1.050 7.396 1.00 0.00 O ATOM 164 CB GLN A 10 -1.498 -0.282 10.472 1.00 0.00 C ATOM 165 CG GLN A 10 -1.947 -1.523 11.249 1.00 0.00 C ATOM 166 CD GLN A 10 -2.545 -1.180 12.612 1.00 0.00 C ATOM 167 OE1 GLN A 10 -2.041 -1.571 13.656 1.00 0.00 O ATOM 168 NE2 GLN A 10 -3.639 -0.449 12.664 1.00 0.00 N ATOM 0 H GLN A 10 0.702 -1.516 10.374 1.00 0.00 H new ATOM 0 HA GLN A 10 -1.310 -1.218 8.542 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.873 0.325 11.127 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -2.381 0.311 10.233 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -2.684 -2.068 10.660 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -1.095 -2.188 11.388 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -4.071 -0.116 11.802 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -4.054 -0.216 13.566 1.00 0.00 H new ATOM 177 N GLN A 11 0.377 1.637 8.981 1.00 0.00 N ATOM 178 CA GLN A 11 0.784 2.932 8.435 1.00 0.00 C ATOM 179 C GLN A 11 1.237 2.790 6.973 1.00 0.00 C ATOM 180 O GLN A 11 0.646 3.408 6.089 1.00 0.00 O ATOM 181 CB GLN A 11 1.880 3.519 9.341 1.00 0.00 C ATOM 182 CG GLN A 11 2.493 4.833 8.843 1.00 0.00 C ATOM 183 CD GLN A 11 3.742 5.171 9.654 1.00 0.00 C ATOM 184 OE1 GLN A 11 3.680 5.505 10.827 1.00 0.00 O ATOM 185 NE2 GLN A 11 4.922 5.058 9.086 1.00 0.00 N ATOM 0 H GLN A 11 0.852 1.421 9.857 1.00 0.00 H new ATOM 0 HA GLN A 11 -0.060 3.622 8.422 1.00 0.00 H new ATOM 0 HB2 GLN A 11 1.461 3.684 10.334 1.00 0.00 H new ATOM 0 HB3 GLN A 11 2.675 2.782 9.449 1.00 0.00 H new ATOM 0 HG2 GLN A 11 2.748 4.747 7.787 1.00 0.00 H new ATOM 0 HG3 GLN A 11 1.764 5.639 8.930 1.00 0.00 H new ATOM 0 HE21 GLN A 11 4.992 4.780 8.107 1.00 0.00 H new ATOM 0 HE22 GLN A 11 5.767 5.248 9.624 1.00 0.00 H new ATOM 194 N GLN A 12 2.265 1.977 6.701 1.00 0.00 N ATOM 195 CA GLN A 12 2.784 1.753 5.346 1.00 0.00 C ATOM 196 C GLN A 12 1.723 1.225 4.369 1.00 0.00 C ATOM 197 O GLN A 12 1.705 1.667 3.222 1.00 0.00 O ATOM 198 CB GLN A 12 4.036 0.858 5.372 1.00 0.00 C ATOM 199 CG GLN A 12 5.236 1.502 6.095 1.00 0.00 C ATOM 200 CD GLN A 12 5.454 2.962 5.714 1.00 0.00 C ATOM 201 OE1 GLN A 12 5.294 3.871 6.516 1.00 0.00 O ATOM 202 NE2 GLN A 12 5.795 3.244 4.477 1.00 0.00 N ATOM 0 H GLN A 12 2.764 1.452 7.420 1.00 0.00 H new ATOM 0 HA GLN A 12 3.076 2.730 4.962 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.790 -0.084 5.862 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.324 0.619 4.348 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.082 1.433 7.172 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.138 0.935 5.865 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.931 2.492 3.801 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.924 4.215 4.192 1.00 0.00 H new ATOM 211 N LEU A 13 0.827 0.329 4.802 1.00 0.00 N ATOM 212 CA LEU A 13 -0.286 -0.203 4.012 1.00 0.00 C ATOM 213 C LEU A 13 -1.148 0.973 3.512 1.00 0.00 C ATOM 214 O LEU A 13 -1.321 1.153 2.307 1.00 0.00 O ATOM 215 CB LEU A 13 -1.039 -1.248 4.869 1.00 0.00 C ATOM 216 CG LEU A 13 -1.712 -2.382 4.079 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.194 -3.482 5.020 1.00 0.00 C ATOM 218 CD2 LEU A 13 -2.884 -1.894 3.249 1.00 0.00 C ATOM 0 H LEU A 13 0.860 -0.058 5.745 1.00 0.00 H new ATOM 0 HA LEU A 13 0.047 -0.728 3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.336 -1.688 5.577 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.801 -0.733 5.454 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.955 -2.776 3.400 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.667 -4.275 4.441 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.345 -3.890 5.568 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.915 -3.068 5.725 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.324 -2.734 2.711 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.634 -1.450 3.904 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.538 -1.147 2.535 1.00 0.00 H new ATOM 230 N VAL A 14 -1.623 1.816 4.435 1.00 0.00 N ATOM 231 CA VAL A 14 -2.393 3.040 4.151 1.00 0.00 C ATOM 232 C VAL A 14 -1.629 4.005 3.238 1.00 0.00 C ATOM 233 O VAL A 14 -2.185 4.420 2.219 1.00 0.00 O ATOM 234 CB VAL A 14 -2.857 3.705 5.463 1.00 0.00 C ATOM 235 CG1 VAL A 14 -3.455 5.111 5.288 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.930 2.799 6.077 1.00 0.00 C ATOM 0 H VAL A 14 -1.480 1.664 5.433 1.00 0.00 H new ATOM 0 HA VAL A 14 -3.286 2.754 3.596 1.00 0.00 H new ATOM 0 HB VAL A 14 -1.976 3.826 6.093 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.754 5.503 6.260 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -2.709 5.771 4.845 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.326 5.057 4.635 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.285 3.236 7.010 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.764 2.700 5.382 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.505 1.815 6.276 1.00 0.00 H new ATOM 246 N LEU A 15 -0.375 4.359 3.558 1.00 0.00 N ATOM 247 CA LEU A 15 0.436 5.258 2.723 1.00 0.00 C ATOM 248 C LEU A 15 0.572 4.748 1.283 1.00 0.00 C ATOM 249 O LEU A 15 0.406 5.524 0.348 1.00 0.00 O ATOM 250 CB LEU A 15 1.846 5.501 3.291 1.00 0.00 C ATOM 251 CG LEU A 15 1.971 6.236 4.631 1.00 0.00 C ATOM 252 CD1 LEU A 15 3.439 6.605 4.840 1.00 0.00 C ATOM 253 CD2 LEU A 15 1.154 7.524 4.691 1.00 0.00 C ATOM 0 H LEU A 15 0.103 4.032 4.398 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.108 6.202 2.726 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.334 4.532 3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 15 2.412 6.064 2.548 1.00 0.00 H new ATOM 0 HG LEU A 15 1.591 5.566 5.402 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.551 7.130 5.789 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.044 5.698 4.853 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.771 7.251 4.027 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.287 7.994 5.665 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.491 8.206 3.910 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.099 7.293 4.540 1.00 0.00 H new ATOM 265 N LEU A 16 0.886 3.465 1.089 1.00 0.00 N ATOM 266 CA LEU A 16 1.057 2.838 -0.224 1.00 0.00 C ATOM 267 C LEU A 16 -0.224 2.884 -1.075 1.00 0.00 C ATOM 268 O LEU A 16 -0.183 3.244 -2.253 1.00 0.00 O ATOM 269 CB LEU A 16 1.548 1.402 -0.004 1.00 0.00 C ATOM 270 CG LEU A 16 1.912 0.674 -1.303 1.00 0.00 C ATOM 271 CD1 LEU A 16 3.114 1.320 -1.989 1.00 0.00 C ATOM 272 CD2 LEU A 16 2.290 -0.757 -0.949 1.00 0.00 C ATOM 0 H LEU A 16 1.032 2.816 1.862 1.00 0.00 H new ATOM 0 HA LEU A 16 1.796 3.400 -0.795 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.420 1.421 0.649 1.00 0.00 H new ATOM 0 HB3 LEU A 16 0.773 0.837 0.515 1.00 0.00 H new ATOM 0 HG LEU A 16 1.058 0.719 -1.978 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.344 0.778 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.882 2.358 -2.229 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.975 1.286 -1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.554 -1.299 -1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.142 -0.751 -0.269 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.445 -1.248 -0.466 1.00 0.00 H new ATOM 284 N LEU A 17 -1.363 2.533 -0.476 1.00 0.00 N ATOM 285 CA LEU A 17 -2.687 2.592 -1.105 1.00 0.00 C ATOM 286 C LEU A 17 -3.007 4.028 -1.538 1.00 0.00 C ATOM 287 O LEU A 17 -3.310 4.280 -2.707 1.00 0.00 O ATOM 288 CB LEU A 17 -3.740 2.071 -0.120 1.00 0.00 C ATOM 289 CG LEU A 17 -3.650 0.560 0.138 1.00 0.00 C ATOM 290 CD1 LEU A 17 -4.507 0.239 1.353 1.00 0.00 C ATOM 291 CD2 LEU A 17 -4.163 -0.266 -1.036 1.00 0.00 C ATOM 0 H LEU A 17 -1.393 2.191 0.484 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.695 1.964 -1.996 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.632 2.599 0.827 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -4.732 2.306 -0.505 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.601 0.307 0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -4.461 -0.830 1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.135 0.791 2.216 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.540 0.526 1.156 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -4.076 -1.327 -0.800 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -5.208 -0.020 -1.225 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -3.572 -0.042 -1.924 1.00 0.00 H new ATOM 303 N HIS A 18 -2.900 4.966 -0.592 1.00 0.00 N ATOM 304 CA HIS A 18 -3.084 6.395 -0.820 1.00 0.00 C ATOM 305 C HIS A 18 -2.163 6.884 -1.945 1.00 0.00 C ATOM 306 O HIS A 18 -2.653 7.526 -2.859 1.00 0.00 O ATOM 307 CB HIS A 18 -2.836 7.162 0.489 1.00 0.00 C ATOM 308 CG HIS A 18 -2.904 8.663 0.334 1.00 0.00 C ATOM 309 ND1 HIS A 18 -3.924 9.486 0.764 1.00 0.00 N ATOM 310 CD2 HIS A 18 -1.970 9.453 -0.286 1.00 0.00 C ATOM 311 CE1 HIS A 18 -3.612 10.743 0.394 1.00 0.00 C ATOM 312 NE2 HIS A 18 -2.439 10.768 -0.263 1.00 0.00 N ATOM 0 H HIS A 18 -2.677 4.742 0.378 1.00 0.00 H new ATOM 0 HA HIS A 18 -4.110 6.582 -1.137 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -3.572 6.848 1.229 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -1.855 6.890 0.879 1.00 0.00 H new ATOM 0 HD1 HIS A 18 -4.761 9.196 1.269 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -1.038 9.118 -0.716 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -4.221 11.612 0.597 1.00 0.00 H new ATOM 320 N ALA A 19 -0.859 6.591 -1.906 1.00 0.00 N ATOM 321 CA ALA A 19 0.141 7.008 -2.892 1.00 0.00 C ATOM 322 C ALA A 19 -0.338 6.854 -4.344 1.00 0.00 C ATOM 323 O ALA A 19 -0.425 7.847 -5.066 1.00 0.00 O ATOM 324 CB ALA A 19 1.454 6.269 -2.624 1.00 0.00 C ATOM 0 H ALA A 19 -0.455 6.033 -1.154 1.00 0.00 H new ATOM 0 HA ALA A 19 0.309 8.078 -2.773 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.201 6.577 -3.356 1.00 0.00 H new ATOM 0 HB2 ALA A 19 1.808 6.509 -1.621 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.289 5.194 -2.703 1.00 0.00 H new ATOM 330 N HIS A 20 -0.678 5.637 -4.789 1.00 0.00 N ATOM 331 CA HIS A 20 -1.189 5.424 -6.154 1.00 0.00 C ATOM 332 C HIS A 20 -2.499 6.183 -6.412 1.00 0.00 C ATOM 333 O HIS A 20 -2.649 6.808 -7.463 1.00 0.00 O ATOM 334 CB HIS A 20 -1.313 3.931 -6.463 1.00 0.00 C ATOM 335 CG HIS A 20 -1.760 3.653 -7.879 1.00 0.00 C ATOM 336 ND1 HIS A 20 -1.120 4.092 -9.024 1.00 0.00 N ATOM 337 CD2 HIS A 20 -2.887 2.974 -8.251 1.00 0.00 C ATOM 338 CE1 HIS A 20 -1.847 3.678 -10.081 1.00 0.00 C ATOM 339 NE2 HIS A 20 -2.922 2.991 -9.637 1.00 0.00 N ATOM 0 H HIS A 20 -0.610 4.787 -4.229 1.00 0.00 H new ATOM 0 HA HIS A 20 -0.459 5.843 -6.846 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -0.350 3.450 -6.291 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -2.023 3.480 -5.769 1.00 0.00 H new ATOM 0 HD1 HIS A 20 -0.255 4.631 -9.062 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -3.609 2.514 -7.593 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -1.608 3.866 -11.117 1.00 0.00 H new ATOM 348 N LYS A 21 -3.436 6.172 -5.456 1.00 0.00 N ATOM 349 CA LYS A 21 -4.708 6.916 -5.530 1.00 0.00 C ATOM 350 C LYS A 21 -4.468 8.429 -5.740 1.00 0.00 C ATOM 351 O LYS A 21 -5.117 9.058 -6.575 1.00 0.00 O ATOM 352 CB LYS A 21 -5.549 6.584 -4.274 1.00 0.00 C ATOM 353 CG LYS A 21 -7.034 6.980 -4.342 1.00 0.00 C ATOM 354 CD LYS A 21 -7.769 6.464 -5.584 1.00 0.00 C ATOM 355 CE LYS A 21 -7.742 4.933 -5.726 1.00 0.00 C ATOM 356 NZ LYS A 21 -8.210 4.521 -7.075 1.00 0.00 N ATOM 0 H LYS A 21 -3.334 5.638 -4.593 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.279 6.603 -6.404 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -5.486 5.511 -4.090 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -5.098 7.082 -3.415 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -7.539 6.603 -3.453 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.110 8.067 -4.315 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -8.806 6.798 -5.547 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.321 6.910 -6.472 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -6.730 4.565 -5.559 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -8.375 4.481 -4.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.539 3.535 -7.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.993 5.137 -7.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.427 4.602 -7.754 1.00 0.00 H new ATOM 370 N CYS A 22 -3.506 8.988 -5.011 1.00 0.00 N ATOM 371 CA CYS A 22 -3.027 10.366 -5.024 1.00 0.00 C ATOM 372 C CYS A 22 -2.322 10.737 -6.351 1.00 0.00 C ATOM 373 O CYS A 22 -2.455 11.873 -6.801 1.00 0.00 O ATOM 374 CB CYS A 22 -2.164 10.552 -3.764 1.00 0.00 C ATOM 375 SG CYS A 22 -1.835 12.296 -3.378 1.00 0.00 S ATOM 0 H CYS A 22 -2.992 8.431 -4.329 1.00 0.00 H new ATOM 0 HA CYS A 22 -3.858 11.071 -4.988 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -2.665 10.086 -2.915 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -1.216 10.031 -3.900 1.00 0.00 H new ATOM 380 N GLN A 23 -1.635 9.803 -7.036 1.00 0.00 N ATOM 381 CA GLN A 23 -1.051 10.057 -8.373 1.00 0.00 C ATOM 382 C GLN A 23 -2.126 10.602 -9.333 1.00 0.00 C ATOM 383 O GLN A 23 -1.911 11.615 -10.001 1.00 0.00 O ATOM 384 CB GLN A 23 -0.389 8.812 -8.994 1.00 0.00 C ATOM 385 CG GLN A 23 0.883 8.349 -8.274 1.00 0.00 C ATOM 386 CD GLN A 23 1.497 7.122 -8.945 1.00 0.00 C ATOM 387 OE1 GLN A 23 0.925 6.039 -8.968 1.00 0.00 O ATOM 388 NE2 GLN A 23 2.678 7.231 -9.514 1.00 0.00 N ATOM 0 H GLN A 23 -1.469 8.860 -6.685 1.00 0.00 H new ATOM 0 HA GLN A 23 -0.266 10.799 -8.227 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.110 7.994 -8.996 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -0.146 9.025 -10.035 1.00 0.00 H new ATOM 0 HG2 GLN A 23 1.611 9.160 -8.263 1.00 0.00 H new ATOM 0 HG3 GLN A 23 0.649 8.117 -7.235 1.00 0.00 H new ATOM 0 HE21 GLN A 23 3.168 8.125 -9.504 1.00 0.00 H new ATOM 0 HE22 GLN A 23 3.103 6.421 -9.965 1.00 0.00 H new ATOM 397 N ARG A 24 -3.303 9.953 -9.369 1.00 0.00 N ATOM 398 CA ARG A 24 -4.475 10.383 -10.154 1.00 0.00 C ATOM 399 C ARG A 24 -4.939 11.782 -9.719 1.00 0.00 C ATOM 400 O ARG A 24 -5.157 12.643 -10.569 1.00 0.00 O ATOM 401 CB ARG A 24 -5.597 9.335 -10.050 1.00 0.00 C ATOM 402 CG ARG A 24 -6.759 9.649 -11.006 1.00 0.00 C ATOM 403 CD ARG A 24 -7.845 8.569 -10.928 1.00 0.00 C ATOM 404 NE ARG A 24 -8.984 8.884 -11.815 1.00 0.00 N ATOM 405 CZ ARG A 24 -9.105 8.627 -13.105 1.00 0.00 C ATOM 406 NH1 ARG A 24 -8.178 8.014 -13.788 1.00 0.00 N ATOM 407 NH2 ARG A 24 -10.178 8.988 -13.750 1.00 0.00 N ATOM 0 H ARG A 24 -3.470 9.096 -8.842 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.194 10.457 -11.205 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.195 8.348 -10.278 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.968 9.300 -9.026 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.188 10.619 -10.756 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.385 9.720 -12.027 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -7.421 7.604 -11.206 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.197 8.478 -9.900 1.00 0.00 H new ATOM 0 HE ARG A 24 -9.774 9.358 -11.377 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -7.319 7.713 -13.327 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -8.312 7.835 -14.783 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.930 9.472 -13.259 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.266 8.787 -14.746 1.00 0.00 H new ATOM 421 N ARG A 25 -5.065 12.016 -8.407 1.00 0.00 N ATOM 422 CA ARG A 25 -5.445 13.308 -7.803 1.00 0.00 C ATOM 423 C ARG A 25 -4.532 14.447 -8.271 1.00 0.00 C ATOM 424 O ARG A 25 -5.011 15.391 -8.895 1.00 0.00 O ATOM 425 CB ARG A 25 -5.508 13.175 -6.268 1.00 0.00 C ATOM 426 CG ARG A 25 -5.966 14.464 -5.570 1.00 0.00 C ATOM 427 CD ARG A 25 -6.213 14.263 -4.067 1.00 0.00 C ATOM 428 NE ARG A 25 -4.985 13.931 -3.311 1.00 0.00 N ATOM 429 CZ ARG A 25 -4.699 14.251 -2.062 1.00 0.00 C ATOM 430 NH1 ARG A 25 -5.486 14.975 -1.313 1.00 0.00 N ATOM 431 NH2 ARG A 25 -3.598 13.837 -1.533 1.00 0.00 N ATOM 0 H ARG A 25 -4.901 11.290 -7.710 1.00 0.00 H new ATOM 0 HA ARG A 25 -6.443 13.577 -8.148 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -6.190 12.366 -6.007 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -4.523 12.896 -5.893 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.211 15.238 -5.711 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -6.881 14.823 -6.041 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -6.652 15.171 -3.653 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.943 13.465 -3.929 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.278 13.393 -3.812 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -6.369 15.322 -1.687 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -5.218 15.194 -0.354 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -2.953 13.265 -2.079 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.372 14.081 -0.569 1.00 0.00 H new ATOM 445 N GLU A 26 -3.234 14.364 -7.984 1.00 0.00 N ATOM 446 CA GLU A 26 -2.244 15.391 -8.344 1.00 0.00 C ATOM 447 C GLU A 26 -2.134 15.646 -9.857 1.00 0.00 C ATOM 448 O GLU A 26 -2.092 16.808 -10.270 1.00 0.00 O ATOM 449 CB GLU A 26 -0.874 15.145 -7.682 1.00 0.00 C ATOM 450 CG GLU A 26 -0.029 13.990 -8.236 1.00 0.00 C ATOM 451 CD GLU A 26 1.330 13.901 -7.515 1.00 0.00 C ATOM 452 OE1 GLU A 26 1.380 13.452 -6.344 1.00 0.00 O ATOM 453 OE2 GLU A 26 2.364 14.271 -8.124 1.00 0.00 O ATOM 0 H GLU A 26 -2.829 13.571 -7.487 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.631 16.321 -7.928 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.289 16.061 -7.763 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -1.039 14.965 -6.620 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -0.569 13.051 -8.117 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.131 14.133 -9.305 1.00 0.00 H new ATOM 460 N GLN A 27 -2.091 14.599 -10.695 1.00 0.00 N ATOM 461 CA GLN A 27 -2.007 14.766 -12.156 1.00 0.00 C ATOM 462 C GLN A 27 -3.263 15.447 -12.738 1.00 0.00 C ATOM 463 O GLN A 27 -3.150 16.235 -13.680 1.00 0.00 O ATOM 464 CB GLN A 27 -1.584 13.465 -12.867 1.00 0.00 C ATOM 465 CG GLN A 27 -2.668 12.400 -13.111 1.00 0.00 C ATOM 466 CD GLN A 27 -3.515 12.638 -14.364 1.00 0.00 C ATOM 467 OE1 GLN A 27 -4.722 12.829 -14.313 1.00 0.00 O ATOM 468 NE2 GLN A 27 -2.928 12.613 -15.544 1.00 0.00 N ATOM 0 H GLN A 27 -2.113 13.627 -10.387 1.00 0.00 H new ATOM 0 HA GLN A 27 -1.197 15.466 -12.364 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -1.155 13.734 -13.832 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -0.788 13.006 -12.281 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -2.190 11.424 -13.190 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -3.327 12.363 -12.243 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -1.922 12.455 -15.610 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -3.479 12.751 -16.391 1.00 0.00 H new ATOM 477 N ALA A 28 -4.448 15.186 -12.167 1.00 0.00 N ATOM 478 CA ALA A 28 -5.704 15.836 -12.544 1.00 0.00 C ATOM 479 C ALA A 28 -5.694 17.321 -12.119 1.00 0.00 C ATOM 480 O ALA A 28 -5.896 18.209 -12.952 1.00 0.00 O ATOM 481 CB ALA A 28 -6.885 15.064 -11.939 1.00 0.00 C ATOM 0 H ALA A 28 -4.558 14.504 -11.417 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.816 15.819 -13.628 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.819 15.549 -12.221 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -6.881 14.040 -12.313 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -6.795 15.053 -10.853 1.00 0.00 H new ATOM 487 N ASN A 29 -5.443 17.596 -10.832 1.00 0.00 N ATOM 488 CA ASN A 29 -5.337 18.938 -10.251 1.00 0.00 C ATOM 489 C ASN A 29 -4.360 18.952 -9.054 1.00 0.00 C ATOM 490 O ASN A 29 -4.608 18.317 -8.025 1.00 0.00 O ATOM 491 CB ASN A 29 -6.740 19.429 -9.843 1.00 0.00 C ATOM 492 CG ASN A 29 -6.697 20.811 -9.207 1.00 0.00 C ATOM 493 OD1 ASN A 29 -6.948 20.988 -8.022 1.00 0.00 O ATOM 494 ND2 ASN A 29 -6.376 21.835 -9.966 1.00 0.00 N ATOM 0 H ASN A 29 -5.303 16.859 -10.141 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.930 19.620 -10.998 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.385 19.454 -10.721 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -7.183 18.721 -9.142 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -6.337 22.773 -9.567 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -6.166 21.692 -10.954 1.00 0.00 H new ATOM 501 N GLY A 30 -3.253 19.689 -9.180 1.00 0.00 N ATOM 502 CA GLY A 30 -2.224 19.810 -8.143 1.00 0.00 C ATOM 503 C GLY A 30 -1.049 20.714 -8.538 1.00 0.00 C ATOM 504 O GLY A 30 -1.021 21.302 -9.623 1.00 0.00 O ATOM 0 H GLY A 30 -3.043 20.228 -10.020 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -2.682 20.201 -7.234 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -1.842 18.817 -7.906 1.00 0.00 H new ATOM 508 N GLU A 31 -0.064 20.810 -7.645 1.00 0.00 N ATOM 509 CA GLU A 31 1.171 21.603 -7.779 1.00 0.00 C ATOM 510 C GLU A 31 2.425 20.711 -7.607 1.00 0.00 C ATOM 511 O GLU A 31 2.320 19.482 -7.556 1.00 0.00 O ATOM 512 CB GLU A 31 1.155 22.761 -6.754 1.00 0.00 C ATOM 513 CG GLU A 31 -0.005 23.762 -6.894 1.00 0.00 C ATOM 514 CD GLU A 31 -1.355 23.258 -6.337 1.00 0.00 C ATOM 515 OE1 GLU A 31 -1.407 22.771 -5.181 1.00 0.00 O ATOM 516 OE2 GLU A 31 -2.389 23.383 -7.040 1.00 0.00 O ATOM 0 H GLU A 31 -0.103 20.311 -6.756 1.00 0.00 H new ATOM 0 HA GLU A 31 1.216 22.027 -8.782 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.123 22.334 -5.752 1.00 0.00 H new ATOM 0 HB3 GLU A 31 2.094 23.308 -6.837 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.264 24.685 -6.380 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.130 24.009 -7.948 1.00 0.00 H new ATOM 523 N VAL A 32 3.621 21.314 -7.502 1.00 0.00 N ATOM 524 CA VAL A 32 4.924 20.630 -7.305 1.00 0.00 C ATOM 525 C VAL A 32 4.868 19.638 -6.131 1.00 0.00 C ATOM 526 O VAL A 32 5.380 18.518 -6.226 1.00 0.00 O ATOM 527 CB VAL A 32 6.071 21.650 -7.120 1.00 0.00 C ATOM 528 CG1 VAL A 32 7.437 20.964 -6.982 1.00 0.00 C ATOM 529 CG2 VAL A 32 6.166 22.613 -8.314 1.00 0.00 C ATOM 0 H VAL A 32 3.718 22.328 -7.553 1.00 0.00 H new ATOM 0 HA VAL A 32 5.131 20.057 -8.209 1.00 0.00 H new ATOM 0 HB VAL A 32 5.833 22.194 -6.206 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.212 21.719 -6.854 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.427 20.304 -6.115 1.00 0.00 H new ATOM 0 HG13 VAL A 32 7.643 20.381 -7.879 1.00 0.00 H new ATOM 0 HG21 VAL A 32 6.983 23.316 -8.150 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.353 22.045 -9.225 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.230 23.162 -8.414 1.00 0.00 H new ATOM 539 N ARG A 33 4.208 20.030 -5.034 1.00 0.00 N ATOM 540 CA ARG A 33 3.948 19.205 -3.844 1.00 0.00 C ATOM 541 C ARG A 33 2.467 19.337 -3.461 1.00 0.00 C ATOM 542 O ARG A 33 2.105 20.016 -2.499 1.00 0.00 O ATOM 543 CB ARG A 33 4.941 19.575 -2.721 1.00 0.00 C ATOM 544 CG ARG A 33 5.025 18.496 -1.626 1.00 0.00 C ATOM 545 CD ARG A 33 5.818 17.248 -2.051 1.00 0.00 C ATOM 546 NE ARG A 33 7.273 17.507 -2.108 1.00 0.00 N ATOM 547 CZ ARG A 33 8.048 17.689 -3.164 1.00 0.00 C ATOM 548 NH1 ARG A 33 7.601 17.706 -4.388 1.00 0.00 N ATOM 549 NH2 ARG A 33 9.329 17.858 -3.005 1.00 0.00 N ATOM 0 H ARG A 33 3.824 20.971 -4.946 1.00 0.00 H new ATOM 0 HA ARG A 33 4.121 18.148 -4.044 1.00 0.00 H new ATOM 0 HB2 ARG A 33 5.930 19.728 -3.152 1.00 0.00 H new ATOM 0 HB3 ARG A 33 4.639 20.521 -2.271 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.489 18.926 -0.738 1.00 0.00 H new ATOM 0 HG3 ARG A 33 4.015 18.196 -1.345 1.00 0.00 H new ATOM 0 HD2 ARG A 33 5.622 16.438 -1.349 1.00 0.00 H new ATOM 0 HD3 ARG A 33 5.471 16.914 -3.029 1.00 0.00 H new ATOM 0 HE ARG A 33 7.746 17.552 -1.205 1.00 0.00 H new ATOM 0 HH11 ARG A 33 6.606 17.575 -4.569 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.246 17.851 -5.165 1.00 0.00 H new ATOM 0 HH21 ARG A 33 9.732 17.850 -2.068 1.00 0.00 H new ATOM 0 HH22 ARG A 33 9.930 17.999 -3.817 1.00 0.00 H new ATOM 563 N ALA A 34 1.612 18.708 -4.270 1.00 0.00 N ATOM 564 CA ALA A 34 0.151 18.717 -4.148 1.00 0.00 C ATOM 565 C ALA A 34 -0.342 18.208 -2.778 1.00 0.00 C ATOM 566 O ALA A 34 -1.067 18.912 -2.066 1.00 0.00 O ATOM 567 CB ALA A 34 -0.435 17.894 -5.304 1.00 0.00 C ATOM 0 H ALA A 34 1.933 18.153 -5.064 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.198 19.748 -4.210 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.523 17.888 -5.232 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.137 18.338 -6.254 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.062 16.871 -5.248 1.00 0.00 H new ATOM 573 N CYS A 35 0.044 16.980 -2.429 1.00 0.00 N ATOM 574 CA CYS A 35 -0.317 16.307 -1.185 1.00 0.00 C ATOM 575 C CYS A 35 0.407 16.910 0.041 1.00 0.00 C ATOM 576 O CYS A 35 1.556 17.363 -0.044 1.00 0.00 O ATOM 577 CB CYS A 35 -0.030 14.811 -1.365 1.00 0.00 C ATOM 578 SG CYS A 35 -0.891 13.840 -0.096 1.00 0.00 S ATOM 0 H CYS A 35 0.638 16.408 -3.028 1.00 0.00 H new ATOM 0 HA CYS A 35 -1.377 16.453 -0.978 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -0.350 14.490 -2.356 1.00 0.00 H new ATOM 0 HB3 CYS A 35 1.043 14.631 -1.303 1.00 0.00 H new ATOM 583 N SER A 36 -0.275 16.917 1.191 1.00 0.00 N ATOM 584 CA SER A 36 0.231 17.438 2.471 1.00 0.00 C ATOM 585 C SER A 36 1.386 16.605 3.042 1.00 0.00 C ATOM 586 O SER A 36 2.350 17.169 3.565 1.00 0.00 O ATOM 587 CB SER A 36 -0.894 17.519 3.512 1.00 0.00 C ATOM 588 OG SER A 36 -1.869 18.483 3.135 1.00 0.00 O ATOM 0 H SER A 36 -1.224 16.550 1.262 1.00 0.00 H new ATOM 0 HA SER A 36 0.614 18.436 2.257 1.00 0.00 H new ATOM 0 HB2 SER A 36 -1.366 16.542 3.620 1.00 0.00 H new ATOM 0 HB3 SER A 36 -0.476 17.780 4.484 1.00 0.00 H new ATOM 0 HG SER A 36 -2.576 18.515 3.813 1.00 0.00 H new ATOM 594 N LEU A 37 1.306 15.271 2.960 1.00 0.00 N ATOM 595 CA LEU A 37 2.339 14.350 3.447 1.00 0.00 C ATOM 596 C LEU A 37 3.558 14.365 2.493 1.00 0.00 C ATOM 597 O LEU A 37 3.412 13.984 1.329 1.00 0.00 O ATOM 598 CB LEU A 37 1.781 12.908 3.542 1.00 0.00 C ATOM 599 CG LEU A 37 0.933 12.576 4.786 1.00 0.00 C ATOM 600 CD1 LEU A 37 -0.458 13.209 4.760 1.00 0.00 C ATOM 601 CD2 LEU A 37 0.734 11.060 4.909 1.00 0.00 C ATOM 0 H LEU A 37 0.506 14.793 2.545 1.00 0.00 H new ATOM 0 HA LEU A 37 2.649 14.678 4.439 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.175 12.718 2.656 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.621 12.215 3.508 1.00 0.00 H new ATOM 0 HG LEU A 37 1.489 12.983 5.630 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.000 12.934 5.665 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.363 14.294 4.709 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.004 12.851 3.887 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.133 10.842 5.792 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.223 10.687 4.022 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.704 10.572 5.001 1.00 0.00 H new ATOM 613 N PRO A 38 4.781 14.725 2.939 1.00 0.00 N ATOM 614 CA PRO A 38 5.975 14.640 2.086 1.00 0.00 C ATOM 615 C PRO A 38 6.294 13.168 1.753 1.00 0.00 C ATOM 616 O PRO A 38 6.752 12.840 0.658 1.00 0.00 O ATOM 617 CB PRO A 38 7.092 15.332 2.874 1.00 0.00 C ATOM 618 CG PRO A 38 6.671 15.162 4.334 1.00 0.00 C ATOM 619 CD PRO A 38 5.141 15.184 4.275 1.00 0.00 C ATOM 0 HA PRO A 38 5.839 15.128 1.121 1.00 0.00 H new ATOM 0 HB2 PRO A 38 8.061 14.872 2.681 1.00 0.00 H new ATOM 0 HB3 PRO A 38 7.179 16.384 2.603 1.00 0.00 H new ATOM 0 HG2 PRO A 38 7.042 14.226 4.752 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.059 15.966 4.959 1.00 0.00 H new ATOM 0 HD2 PRO A 38 4.712 14.535 5.039 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.758 16.188 4.458 1.00 0.00 H new ATOM 627 N HIS A 39 6.008 12.271 2.706 1.00 0.00 N ATOM 628 CA HIS A 39 6.164 10.812 2.645 1.00 0.00 C ATOM 629 C HIS A 39 5.336 10.145 1.530 1.00 0.00 C ATOM 630 O HIS A 39 5.744 9.100 1.024 1.00 0.00 O ATOM 631 CB HIS A 39 5.862 10.242 4.041 1.00 0.00 C ATOM 632 CG HIS A 39 6.719 10.880 5.116 1.00 0.00 C ATOM 633 ND1 HIS A 39 6.265 11.620 6.196 1.00 0.00 N ATOM 634 CD2 HIS A 39 8.087 10.911 5.130 1.00 0.00 C ATOM 635 CE1 HIS A 39 7.347 12.066 6.870 1.00 0.00 C ATOM 636 NE2 HIS A 39 8.464 11.646 6.240 1.00 0.00 N ATOM 0 H HIS A 39 5.634 12.569 3.607 1.00 0.00 H new ATOM 0 HA HIS A 39 7.192 10.580 2.369 1.00 0.00 H new ATOM 0 HB2 HIS A 39 4.809 10.400 4.276 1.00 0.00 H new ATOM 0 HB3 HIS A 39 6.030 9.165 4.036 1.00 0.00 H new ATOM 0 HD2 HIS A 39 8.747 10.449 4.411 1.00 0.00 H new ATOM 0 HE1 HIS A 39 7.322 12.663 7.769 1.00 0.00 H new ATOM 0 HE2 HIS A 39 9.422 11.838 6.532 1.00 0.00 H new ATOM 645 N CYS A 40 4.231 10.765 1.097 1.00 0.00 N ATOM 646 CA CYS A 40 3.400 10.332 -0.033 1.00 0.00 C ATOM 647 C CYS A 40 4.285 10.162 -1.290 1.00 0.00 C ATOM 648 O CYS A 40 4.280 9.114 -1.943 1.00 0.00 O ATOM 649 CB CYS A 40 2.272 11.373 -0.190 1.00 0.00 C ATOM 650 SG CYS A 40 0.989 10.909 -1.393 1.00 0.00 S ATOM 0 H CYS A 40 3.878 11.613 1.541 1.00 0.00 H new ATOM 0 HA CYS A 40 2.939 9.358 0.131 1.00 0.00 H new ATOM 0 HB2 CYS A 40 1.803 11.533 0.781 1.00 0.00 H new ATOM 0 HB3 CYS A 40 2.710 12.324 -0.492 1.00 0.00 H new ATOM 655 N ARG A 41 5.130 11.166 -1.577 1.00 0.00 N ATOM 656 CA ARG A 41 6.126 11.165 -2.664 1.00 0.00 C ATOM 657 C ARG A 41 7.116 9.997 -2.554 1.00 0.00 C ATOM 658 O ARG A 41 7.463 9.404 -3.574 1.00 0.00 O ATOM 659 CB ARG A 41 6.831 12.531 -2.728 1.00 0.00 C ATOM 660 CG ARG A 41 7.430 12.785 -4.121 1.00 0.00 C ATOM 661 CD ARG A 41 8.109 14.158 -4.210 1.00 0.00 C ATOM 662 NE ARG A 41 9.351 14.213 -3.410 1.00 0.00 N ATOM 663 CZ ARG A 41 10.583 13.938 -3.806 1.00 0.00 C ATOM 664 NH1 ARG A 41 10.863 13.586 -5.030 1.00 0.00 N ATOM 665 NH2 ARG A 41 11.575 14.011 -2.968 1.00 0.00 N ATOM 0 H ARG A 41 5.139 12.033 -1.039 1.00 0.00 H new ATOM 0 HA ARG A 41 5.601 11.008 -3.606 1.00 0.00 H new ATOM 0 HB2 ARG A 41 6.120 13.321 -2.486 1.00 0.00 H new ATOM 0 HB3 ARG A 41 7.620 12.571 -1.977 1.00 0.00 H new ATOM 0 HG2 ARG A 41 8.156 12.005 -4.352 1.00 0.00 H new ATOM 0 HG3 ARG A 41 6.643 12.720 -4.872 1.00 0.00 H new ATOM 0 HD2 ARG A 41 8.338 14.383 -5.252 1.00 0.00 H new ATOM 0 HD3 ARG A 41 7.419 14.927 -3.862 1.00 0.00 H new ATOM 0 HE ARG A 41 9.245 14.497 -2.436 1.00 0.00 H new ATOM 0 HH11 ARG A 41 10.118 13.514 -5.723 1.00 0.00 H new ATOM 0 HH12 ARG A 41 11.827 13.382 -5.294 1.00 0.00 H new ATOM 0 HH21 ARG A 41 11.405 14.282 -1.999 1.00 0.00 H new ATOM 0 HH22 ARG A 41 12.523 13.798 -3.280 1.00 0.00 H new ATOM 679 N THR A 42 7.546 9.627 -1.342 1.00 0.00 N ATOM 680 CA THR A 42 8.418 8.454 -1.103 1.00 0.00 C ATOM 681 C THR A 42 7.690 7.180 -1.533 1.00 0.00 C ATOM 682 O THR A 42 8.218 6.427 -2.349 1.00 0.00 O ATOM 683 CB THR A 42 8.901 8.335 0.355 1.00 0.00 C ATOM 684 OG1 THR A 42 9.642 9.487 0.705 1.00 0.00 O ATOM 685 CG2 THR A 42 9.834 7.133 0.569 1.00 0.00 C ATOM 0 H THR A 42 7.301 10.131 -0.490 1.00 0.00 H new ATOM 0 HA THR A 42 9.316 8.595 -1.705 1.00 0.00 H new ATOM 0 HB THR A 42 8.007 8.215 0.967 1.00 0.00 H new ATOM 0 HG1 THR A 42 9.947 9.410 1.633 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.145 7.095 1.613 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.307 6.214 0.314 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.712 7.236 -0.068 1.00 0.00 H new ATOM 693 N MET A 43 6.466 6.945 -1.041 1.00 0.00 N ATOM 694 CA MET A 43 5.648 5.795 -1.454 1.00 0.00 C ATOM 695 C MET A 43 5.416 5.784 -2.979 1.00 0.00 C ATOM 696 O MET A 43 5.473 4.717 -3.581 1.00 0.00 O ATOM 697 CB MET A 43 4.327 5.711 -0.680 1.00 0.00 C ATOM 698 CG MET A 43 4.434 5.013 0.682 1.00 0.00 C ATOM 699 SD MET A 43 5.499 5.783 1.934 1.00 0.00 S ATOM 700 CE MET A 43 6.996 4.786 1.728 1.00 0.00 C ATOM 0 H MET A 43 6.016 7.544 -0.348 1.00 0.00 H new ATOM 0 HA MET A 43 6.215 4.899 -1.201 1.00 0.00 H new ATOM 0 HB2 MET A 43 3.944 6.720 -0.528 1.00 0.00 H new ATOM 0 HB3 MET A 43 3.596 5.181 -1.290 1.00 0.00 H new ATOM 0 HG2 MET A 43 3.430 4.931 1.098 1.00 0.00 H new ATOM 0 HG3 MET A 43 4.793 3.998 0.513 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.714 5.042 2.507 1.00 0.00 H new ATOM 0 HE2 MET A 43 6.742 3.729 1.802 1.00 0.00 H new ATOM 0 HE3 MET A 43 7.435 4.986 0.750 1.00 0.00 H new ATOM 710 N LYS A 44 5.195 6.938 -3.628 1.00 0.00 N ATOM 711 CA LYS A 44 5.058 7.069 -5.098 1.00 0.00 C ATOM 712 C LYS A 44 6.335 6.644 -5.836 1.00 0.00 C ATOM 713 O LYS A 44 6.255 5.906 -6.817 1.00 0.00 O ATOM 714 CB LYS A 44 4.629 8.497 -5.478 1.00 0.00 C ATOM 715 CG LYS A 44 3.151 8.722 -5.131 1.00 0.00 C ATOM 716 CD LYS A 44 2.753 10.203 -5.184 1.00 0.00 C ATOM 717 CE LYS A 44 1.258 10.317 -4.875 1.00 0.00 C ATOM 718 NZ LYS A 44 0.894 11.622 -4.303 1.00 0.00 N ATOM 0 H LYS A 44 5.104 7.829 -3.140 1.00 0.00 H new ATOM 0 HA LYS A 44 4.273 6.385 -5.419 1.00 0.00 H new ATOM 0 HB2 LYS A 44 5.248 9.222 -4.949 1.00 0.00 H new ATOM 0 HB3 LYS A 44 4.788 8.660 -6.544 1.00 0.00 H new ATOM 0 HG2 LYS A 44 2.528 8.157 -5.825 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.952 8.331 -4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.334 10.777 -4.462 1.00 0.00 H new ATOM 0 HD3 LYS A 44 2.969 10.618 -6.169 1.00 0.00 H new ATOM 0 HE2 LYS A 44 0.689 10.155 -5.790 1.00 0.00 H new ATOM 0 HE3 LYS A 44 0.974 9.528 -4.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -0.140 11.731 -4.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 1.235 11.678 -3.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.330 12.381 -4.865 1.00 0.00 H new ATOM 732 N ASN A 45 7.513 7.061 -5.363 1.00 0.00 N ATOM 733 CA ASN A 45 8.812 6.636 -5.910 1.00 0.00 C ATOM 734 C ASN A 45 8.967 5.109 -5.778 1.00 0.00 C ATOM 735 O ASN A 45 9.283 4.426 -6.754 1.00 0.00 O ATOM 736 CB ASN A 45 9.964 7.392 -5.220 1.00 0.00 C ATOM 737 CG ASN A 45 10.247 8.729 -5.879 1.00 0.00 C ATOM 738 OD1 ASN A 45 11.140 8.865 -6.705 1.00 0.00 O ATOM 739 ND2 ASN A 45 9.503 9.758 -5.551 1.00 0.00 N ATOM 0 H ASN A 45 7.596 7.710 -4.581 1.00 0.00 H new ATOM 0 HA ASN A 45 8.852 6.884 -6.971 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.715 7.551 -4.171 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.865 6.779 -5.244 1.00 0.00 H new ATOM 0 HD21 ASN A 45 9.670 10.666 -5.984 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.758 9.650 -4.863 1.00 0.00 H new ATOM 746 N VAL A 46 8.698 4.575 -4.580 1.00 0.00 N ATOM 747 CA VAL A 46 8.689 3.136 -4.256 1.00 0.00 C ATOM 748 C VAL A 46 7.772 2.387 -5.231 1.00 0.00 C ATOM 749 O VAL A 46 8.228 1.463 -5.893 1.00 0.00 O ATOM 750 CB VAL A 46 8.311 2.932 -2.773 1.00 0.00 C ATOM 751 CG1 VAL A 46 7.902 1.501 -2.413 1.00 0.00 C ATOM 752 CG2 VAL A 46 9.489 3.338 -1.876 1.00 0.00 C ATOM 0 H VAL A 46 8.470 5.156 -3.773 1.00 0.00 H new ATOM 0 HA VAL A 46 9.686 2.713 -4.381 1.00 0.00 H new ATOM 0 HB VAL A 46 7.438 3.563 -2.608 1.00 0.00 H new ATOM 0 HG11 VAL A 46 7.653 1.449 -1.353 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.033 1.211 -3.004 1.00 0.00 H new ATOM 0 HG13 VAL A 46 8.728 0.822 -2.625 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.217 3.192 -0.831 1.00 0.00 H new ATOM 0 HG22 VAL A 46 10.357 2.723 -2.115 1.00 0.00 H new ATOM 0 HG23 VAL A 46 9.730 4.387 -2.045 1.00 0.00 H new ATOM 762 N LEU A 47 6.508 2.804 -5.362 1.00 0.00 N ATOM 763 CA LEU A 47 5.473 2.299 -6.274 1.00 0.00 C ATOM 764 C LEU A 47 5.966 2.217 -7.729 1.00 0.00 C ATOM 765 O LEU A 47 5.911 1.147 -8.340 1.00 0.00 O ATOM 766 CB LEU A 47 4.223 3.189 -6.096 1.00 0.00 C ATOM 767 CG LEU A 47 2.953 2.834 -6.882 1.00 0.00 C ATOM 768 CD1 LEU A 47 2.957 3.243 -8.353 1.00 0.00 C ATOM 769 CD2 LEU A 47 2.655 1.349 -6.791 1.00 0.00 C ATOM 0 H LEU A 47 6.152 3.567 -4.786 1.00 0.00 H new ATOM 0 HA LEU A 47 5.217 1.269 -6.025 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.967 3.193 -5.037 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.502 4.209 -6.360 1.00 0.00 H new ATOM 0 HG LEU A 47 2.173 3.424 -6.400 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.016 2.947 -8.816 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.075 4.324 -8.430 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.784 2.751 -8.865 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.751 1.124 -7.356 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.491 0.784 -7.204 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.509 1.070 -5.747 1.00 0.00 H new ATOM 781 N ASN A 48 6.459 3.331 -8.278 1.00 0.00 N ATOM 782 CA ASN A 48 7.009 3.419 -9.636 1.00 0.00 C ATOM 783 C ASN A 48 8.130 2.394 -9.870 1.00 0.00 C ATOM 784 O ASN A 48 8.191 1.755 -10.921 1.00 0.00 O ATOM 785 CB ASN A 48 7.520 4.848 -9.865 1.00 0.00 C ATOM 786 CG ASN A 48 8.084 5.020 -11.267 1.00 0.00 C ATOM 787 OD1 ASN A 48 7.374 4.964 -12.261 1.00 0.00 O ATOM 788 ND2 ASN A 48 9.376 5.224 -11.396 1.00 0.00 N ATOM 0 H ASN A 48 6.488 4.220 -7.778 1.00 0.00 H new ATOM 0 HA ASN A 48 6.221 3.185 -10.351 1.00 0.00 H new ATOM 0 HB2 ASN A 48 6.706 5.556 -9.710 1.00 0.00 H new ATOM 0 HB3 ASN A 48 8.290 5.082 -9.130 1.00 0.00 H new ATOM 0 HD21 ASN A 48 9.785 5.335 -12.324 1.00 0.00 H new ATOM 0 HD22 ASN A 48 9.970 5.271 -10.568 1.00 0.00 H new ATOM 795 N HIS A 49 9.028 2.233 -8.899 1.00 0.00 N ATOM 796 CA HIS A 49 10.098 1.244 -8.954 1.00 0.00 C ATOM 797 C HIS A 49 9.522 -0.192 -8.867 1.00 0.00 C ATOM 798 O HIS A 49 9.865 -1.034 -9.695 1.00 0.00 O ATOM 799 CB HIS A 49 11.126 1.579 -7.864 1.00 0.00 C ATOM 800 CG HIS A 49 12.246 0.573 -7.782 1.00 0.00 C ATOM 801 ND1 HIS A 49 13.389 0.549 -8.556 1.00 0.00 N ATOM 802 CD2 HIS A 49 12.240 -0.556 -7.012 1.00 0.00 C ATOM 803 CE1 HIS A 49 14.044 -0.596 -8.273 1.00 0.00 C ATOM 804 NE2 HIS A 49 13.387 -1.294 -7.332 1.00 0.00 N ATOM 0 H HIS A 49 9.031 2.791 -8.045 1.00 0.00 H new ATOM 0 HA HIS A 49 10.617 1.280 -9.912 1.00 0.00 H new ATOM 0 HB2 HIS A 49 11.545 2.566 -8.059 1.00 0.00 H new ATOM 0 HB3 HIS A 49 10.621 1.632 -6.900 1.00 0.00 H new ATOM 0 HD1 HIS A 49 13.684 1.265 -9.220 1.00 0.00 H new ATOM 0 HD2 HIS A 49 11.487 -0.830 -6.288 1.00 0.00 H new ATOM 0 HE1 HIS A 49 14.968 -0.908 -8.738 1.00 0.00 H new ATOM 812 N MET A 50 8.627 -0.461 -7.906 1.00 0.00 N ATOM 813 CA MET A 50 7.941 -1.736 -7.618 1.00 0.00 C ATOM 814 C MET A 50 7.418 -2.482 -8.856 1.00 0.00 C ATOM 815 O MET A 50 7.635 -3.687 -8.990 1.00 0.00 O ATOM 816 CB MET A 50 6.766 -1.513 -6.640 1.00 0.00 C ATOM 817 CG MET A 50 6.781 -2.472 -5.450 1.00 0.00 C ATOM 818 SD MET A 50 5.172 -2.784 -4.665 1.00 0.00 S ATOM 819 CE MET A 50 4.402 -1.145 -4.644 1.00 0.00 C ATOM 0 H MET A 50 8.337 0.267 -7.253 1.00 0.00 H new ATOM 0 HA MET A 50 8.710 -2.368 -7.174 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.798 -0.488 -6.272 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.826 -1.629 -7.180 1.00 0.00 H new ATOM 0 HG2 MET A 50 7.193 -3.425 -5.781 1.00 0.00 H new ATOM 0 HG3 MET A 50 7.461 -2.075 -4.696 1.00 0.00 H new ATOM 0 HE1 MET A 50 3.463 -1.191 -4.093 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.072 -0.434 -4.160 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.207 -0.821 -5.666 1.00 0.00 H new ATOM 829 N THR A 51 6.705 -1.788 -9.751 1.00 0.00 N ATOM 830 CA THR A 51 6.137 -2.356 -10.990 1.00 0.00 C ATOM 831 C THR A 51 7.217 -2.906 -11.923 1.00 0.00 C ATOM 832 O THR A 51 7.103 -4.027 -12.426 1.00 0.00 O ATOM 833 CB THR A 51 5.291 -1.329 -11.759 1.00 0.00 C ATOM 834 OG1 THR A 51 5.950 -0.085 -11.828 1.00 0.00 O ATOM 835 CG2 THR A 51 3.933 -1.113 -11.097 1.00 0.00 C ATOM 0 H THR A 51 6.500 -0.795 -9.636 1.00 0.00 H new ATOM 0 HA THR A 51 5.497 -3.178 -10.669 1.00 0.00 H new ATOM 0 HB THR A 51 5.146 -1.732 -12.761 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.690 -0.142 -12.468 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.362 -0.381 -11.668 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.388 -2.056 -11.069 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.078 -0.747 -10.080 1.00 0.00 H new ATOM 843 N HIS A 52 8.259 -2.108 -12.169 1.00 0.00 N ATOM 844 CA HIS A 52 9.403 -2.424 -13.031 1.00 0.00 C ATOM 845 C HIS A 52 10.309 -3.510 -12.425 1.00 0.00 C ATOM 846 O HIS A 52 10.621 -4.492 -13.105 1.00 0.00 O ATOM 847 CB HIS A 52 10.165 -1.126 -13.339 1.00 0.00 C ATOM 848 CG HIS A 52 9.320 -0.127 -14.098 1.00 0.00 C ATOM 849 ND1 HIS A 52 8.619 0.934 -13.553 1.00 0.00 N ATOM 850 CD2 HIS A 52 9.071 -0.152 -15.442 1.00 0.00 C ATOM 851 CE1 HIS A 52 7.970 1.558 -14.557 1.00 0.00 C ATOM 852 NE2 HIS A 52 8.232 0.917 -15.716 1.00 0.00 N ATOM 0 H HIS A 52 8.332 -1.179 -11.753 1.00 0.00 H new ATOM 0 HA HIS A 52 9.038 -2.848 -13.966 1.00 0.00 H new ATOM 0 HB2 HIS A 52 10.503 -0.676 -12.405 1.00 0.00 H new ATOM 0 HB3 HIS A 52 11.056 -1.361 -13.921 1.00 0.00 H new ATOM 0 HD1 HIS A 52 8.597 1.197 -12.568 1.00 0.00 H new ATOM 0 HD2 HIS A 52 9.455 -0.868 -16.154 1.00 0.00 H new ATOM 0 HE1 HIS A 52 7.342 2.430 -14.451 1.00 0.00 H new ATOM 861 N CYS A 53 10.721 -3.345 -11.168 1.00 0.00 N ATOM 862 CA CYS A 53 11.568 -4.258 -10.398 1.00 0.00 C ATOM 863 C CYS A 53 10.967 -5.681 -10.312 1.00 0.00 C ATOM 864 O CYS A 53 9.775 -5.861 -10.036 1.00 0.00 O ATOM 865 CB CYS A 53 11.772 -3.622 -9.016 1.00 0.00 C ATOM 866 SG CYS A 53 12.745 -4.676 -7.887 1.00 0.00 S ATOM 0 H CYS A 53 10.457 -2.521 -10.627 1.00 0.00 H new ATOM 0 HA CYS A 53 12.529 -4.394 -10.894 1.00 0.00 H new ATOM 0 HB2 CYS A 53 12.275 -2.662 -9.134 1.00 0.00 H new ATOM 0 HB3 CYS A 53 10.799 -3.419 -8.568 1.00 0.00 H new ATOM 871 N GLN A 54 11.807 -6.697 -10.536 1.00 0.00 N ATOM 872 CA GLN A 54 11.459 -8.127 -10.476 1.00 0.00 C ATOM 873 C GLN A 54 12.235 -8.881 -9.373 1.00 0.00 C ATOM 874 O GLN A 54 11.979 -10.064 -9.132 1.00 0.00 O ATOM 875 CB GLN A 54 11.705 -8.787 -11.848 1.00 0.00 C ATOM 876 CG GLN A 54 11.002 -8.115 -13.041 1.00 0.00 C ATOM 877 CD GLN A 54 9.483 -8.028 -12.892 1.00 0.00 C ATOM 878 OE1 GLN A 54 8.785 -9.016 -12.698 1.00 0.00 O ATOM 879 NE2 GLN A 54 8.912 -6.849 -13.000 1.00 0.00 N ATOM 0 H GLN A 54 12.787 -6.543 -10.774 1.00 0.00 H new ATOM 0 HA GLN A 54 10.401 -8.192 -10.221 1.00 0.00 H new ATOM 0 HB2 GLN A 54 12.778 -8.798 -12.040 1.00 0.00 H new ATOM 0 HB3 GLN A 54 11.380 -9.826 -11.795 1.00 0.00 H new ATOM 0 HG2 GLN A 54 11.404 -7.110 -13.168 1.00 0.00 H new ATOM 0 HG3 GLN A 54 11.238 -8.670 -13.949 1.00 0.00 H new ATOM 0 HE21 GLN A 54 9.482 -6.019 -13.162 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.899 -6.764 -12.922 1.00 0.00 H new ATOM 888 N ALA A 55 13.181 -8.217 -8.701 1.00 0.00 N ATOM 889 CA ALA A 55 14.026 -8.772 -7.643 1.00 0.00 C ATOM 890 C ALA A 55 13.253 -9.038 -6.334 1.00 0.00 C ATOM 891 O ALA A 55 13.404 -10.111 -5.743 1.00 0.00 O ATOM 892 CB ALA A 55 15.216 -7.827 -7.441 1.00 0.00 C ATOM 0 H ALA A 55 13.386 -7.236 -8.889 1.00 0.00 H new ATOM 0 HA ALA A 55 14.386 -9.754 -7.949 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.863 -8.219 -6.656 1.00 0.00 H new ATOM 0 HB2 ALA A 55 15.780 -7.749 -8.370 1.00 0.00 H new ATOM 0 HB3 ALA A 55 14.852 -6.841 -7.153 1.00 0.00 H new ATOM 898 N GLY A 56 12.439 -8.081 -5.869 1.00 0.00 N ATOM 899 CA GLY A 56 11.625 -8.182 -4.647 1.00 0.00 C ATOM 900 C GLY A 56 12.457 -8.451 -3.388 1.00 0.00 C ATOM 901 O GLY A 56 13.072 -7.537 -2.840 1.00 0.00 O ATOM 0 H GLY A 56 12.324 -7.187 -6.346 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.065 -7.256 -4.514 1.00 0.00 H new ATOM 0 HA3 GLY A 56 10.895 -8.982 -4.770 1.00 0.00 H new ATOM 905 N LYS A 57 12.512 -9.717 -2.949 1.00 0.00 N ATOM 906 CA LYS A 57 13.320 -10.182 -1.802 1.00 0.00 C ATOM 907 C LYS A 57 14.807 -9.843 -1.977 1.00 0.00 C ATOM 908 O LYS A 57 15.479 -9.465 -1.017 1.00 0.00 O ATOM 909 CB LYS A 57 13.159 -11.706 -1.612 1.00 0.00 C ATOM 910 CG LYS A 57 11.753 -12.199 -1.231 1.00 0.00 C ATOM 911 CD LYS A 57 11.277 -11.629 0.114 1.00 0.00 C ATOM 912 CE LYS A 57 9.974 -12.262 0.617 1.00 0.00 C ATOM 913 NZ LYS A 57 10.166 -13.652 1.104 1.00 0.00 N ATOM 0 H LYS A 57 11.983 -10.469 -3.391 1.00 0.00 H new ATOM 0 HA LYS A 57 12.954 -9.661 -0.917 1.00 0.00 H new ATOM 0 HB2 LYS A 57 13.456 -12.200 -2.537 1.00 0.00 H new ATOM 0 HB3 LYS A 57 13.857 -12.030 -0.840 1.00 0.00 H new ATOM 0 HG2 LYS A 57 11.048 -11.916 -2.012 1.00 0.00 H new ATOM 0 HG3 LYS A 57 11.754 -13.288 -1.181 1.00 0.00 H new ATOM 0 HD2 LYS A 57 12.057 -11.779 0.860 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.135 -10.553 0.014 1.00 0.00 H new ATOM 0 HE2 LYS A 57 9.565 -11.652 1.422 1.00 0.00 H new ATOM 0 HE3 LYS A 57 9.239 -12.261 -0.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 9.336 -13.943 1.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 10.282 -14.291 0.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 11.015 -13.696 1.703 1.00 0.00 H new ATOM 927 N ALA A 58 15.316 -10.003 -3.201 1.00 0.00 N ATOM 928 CA ALA A 58 16.708 -9.757 -3.583 1.00 0.00 C ATOM 929 C ALA A 58 17.079 -8.263 -3.753 1.00 0.00 C ATOM 930 O ALA A 58 18.271 -7.937 -3.751 1.00 0.00 O ATOM 931 CB ALA A 58 16.985 -10.551 -4.866 1.00 0.00 C ATOM 0 H ALA A 58 14.746 -10.321 -3.985 1.00 0.00 H new ATOM 0 HA ALA A 58 17.343 -10.091 -2.763 1.00 0.00 H new ATOM 0 HB1 ALA A 58 18.017 -10.389 -5.178 1.00 0.00 H new ATOM 0 HB2 ALA A 58 16.825 -11.613 -4.679 1.00 0.00 H new ATOM 0 HB3 ALA A 58 16.310 -10.216 -5.654 1.00 0.00 H new ATOM 937 N CYS A 59 16.103 -7.355 -3.901 1.00 0.00 N ATOM 938 CA CYS A 59 16.336 -5.921 -4.073 1.00 0.00 C ATOM 939 C CYS A 59 16.921 -5.295 -2.786 1.00 0.00 C ATOM 940 O CYS A 59 16.476 -5.577 -1.666 1.00 0.00 O ATOM 941 CB CYS A 59 15.026 -5.246 -4.524 1.00 0.00 C ATOM 942 SG CYS A 59 15.344 -3.683 -5.419 1.00 0.00 S ATOM 0 H CYS A 59 15.114 -7.605 -3.904 1.00 0.00 H new ATOM 0 HA CYS A 59 17.082 -5.759 -4.851 1.00 0.00 H new ATOM 0 HB2 CYS A 59 14.469 -5.927 -5.167 1.00 0.00 H new ATOM 0 HB3 CYS A 59 14.401 -5.046 -3.654 1.00 0.00 H new ATOM 947 N GLN A 60 17.949 -4.460 -2.950 1.00 0.00 N ATOM 948 CA GLN A 60 18.668 -3.782 -1.862 1.00 0.00 C ATOM 949 C GLN A 60 17.788 -2.784 -1.083 1.00 0.00 C ATOM 950 O GLN A 60 17.951 -2.624 0.129 1.00 0.00 O ATOM 951 CB GLN A 60 19.919 -3.073 -2.411 1.00 0.00 C ATOM 952 CG GLN A 60 20.944 -4.060 -2.996 1.00 0.00 C ATOM 953 CD GLN A 60 22.222 -3.351 -3.440 1.00 0.00 C ATOM 954 OE1 GLN A 60 22.396 -2.980 -4.595 1.00 0.00 O ATOM 955 NE2 GLN A 60 23.170 -3.133 -2.550 1.00 0.00 N ATOM 0 H GLN A 60 18.318 -4.228 -3.872 1.00 0.00 H new ATOM 0 HA GLN A 60 18.964 -4.556 -1.154 1.00 0.00 H new ATOM 0 HB2 GLN A 60 19.621 -2.363 -3.182 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.387 -2.498 -1.612 1.00 0.00 H new ATOM 0 HG2 GLN A 60 21.188 -4.816 -2.250 1.00 0.00 H new ATOM 0 HG3 GLN A 60 20.503 -4.581 -3.846 1.00 0.00 H new ATOM 0 HE21 GLN A 60 23.042 -3.435 -1.584 1.00 0.00 H new ATOM 0 HE22 GLN A 60 24.031 -2.662 -2.827 1.00 0.00 H new ATOM 964 N VAL A 61 16.863 -2.106 -1.769 1.00 0.00 N ATOM 965 CA VAL A 61 15.927 -1.123 -1.199 1.00 0.00 C ATOM 966 C VAL A 61 14.948 -1.813 -0.234 1.00 0.00 C ATOM 967 O VAL A 61 14.256 -2.759 -0.610 1.00 0.00 O ATOM 968 CB VAL A 61 15.158 -0.391 -2.322 1.00 0.00 C ATOM 969 CG1 VAL A 61 14.220 0.687 -1.757 1.00 0.00 C ATOM 970 CG2 VAL A 61 16.108 0.305 -3.311 1.00 0.00 C ATOM 0 H VAL A 61 16.738 -2.229 -2.774 1.00 0.00 H new ATOM 0 HA VAL A 61 16.500 -0.384 -0.639 1.00 0.00 H new ATOM 0 HB VAL A 61 14.585 -1.164 -2.834 1.00 0.00 H new ATOM 0 HG11 VAL A 61 13.697 1.180 -2.576 1.00 0.00 H new ATOM 0 HG12 VAL A 61 13.494 0.224 -1.089 1.00 0.00 H new ATOM 0 HG13 VAL A 61 14.803 1.423 -1.204 1.00 0.00 H new ATOM 0 HG21 VAL A 61 15.525 0.807 -4.083 1.00 0.00 H new ATOM 0 HG22 VAL A 61 16.713 1.039 -2.779 1.00 0.00 H new ATOM 0 HG23 VAL A 61 16.760 -0.437 -3.773 1.00 0.00 H new ATOM 980 N ALA A 62 14.874 -1.342 1.018 1.00 0.00 N ATOM 981 CA ALA A 62 13.989 -1.887 2.057 1.00 0.00 C ATOM 982 C ALA A 62 12.508 -1.871 1.629 1.00 0.00 C ATOM 983 O ALA A 62 11.870 -2.919 1.511 1.00 0.00 O ATOM 984 CB ALA A 62 14.212 -1.100 3.359 1.00 0.00 C ATOM 0 H ALA A 62 15.438 -0.557 1.343 1.00 0.00 H new ATOM 0 HA ALA A 62 14.240 -2.935 2.219 1.00 0.00 H new ATOM 0 HB1 ALA A 62 13.561 -1.495 4.139 1.00 0.00 H new ATOM 0 HB2 ALA A 62 15.252 -1.199 3.670 1.00 0.00 H new ATOM 0 HB3 ALA A 62 13.982 -0.048 3.192 1.00 0.00 H new ATOM 990 N HIS A 63 11.984 -0.662 1.388 1.00 0.00 N ATOM 991 CA HIS A 63 10.602 -0.343 0.989 1.00 0.00 C ATOM 992 C HIS A 63 10.061 -1.205 -0.164 1.00 0.00 C ATOM 993 O HIS A 63 8.885 -1.565 -0.157 1.00 0.00 O ATOM 994 CB HIS A 63 10.498 1.157 0.665 1.00 0.00 C ATOM 995 CG HIS A 63 10.979 2.052 1.784 1.00 0.00 C ATOM 996 ND1 HIS A 63 12.203 2.698 1.851 1.00 0.00 N ATOM 997 CD2 HIS A 63 10.311 2.285 2.953 1.00 0.00 C ATOM 998 CE1 HIS A 63 12.292 3.274 3.069 1.00 0.00 C ATOM 999 NE2 HIS A 63 11.160 3.022 3.760 1.00 0.00 N ATOM 0 H HIS A 63 12.553 0.180 1.472 1.00 0.00 H new ATOM 0 HA HIS A 63 9.963 -0.587 1.838 1.00 0.00 H new ATOM 0 HB2 HIS A 63 11.079 1.367 -0.233 1.00 0.00 H new ATOM 0 HB3 HIS A 63 9.460 1.400 0.437 1.00 0.00 H new ATOM 0 HD2 HIS A 63 9.312 1.957 3.200 1.00 0.00 H new ATOM 0 HE1 HIS A 63 13.134 3.845 3.432 1.00 0.00 H new ATOM 0 HE2 HIS A 63 10.964 3.323 4.714 1.00 0.00 H new ATOM 1008 N CYS A 64 10.912 -1.530 -1.138 1.00 0.00 N ATOM 1009 CA CYS A 64 10.634 -2.359 -2.312 1.00 0.00 C ATOM 1010 C CYS A 64 10.081 -3.749 -1.906 1.00 0.00 C ATOM 1011 O CYS A 64 9.036 -4.196 -2.393 1.00 0.00 O ATOM 1012 CB CYS A 64 11.951 -2.420 -3.105 1.00 0.00 C ATOM 1013 SG CYS A 64 11.748 -3.065 -4.785 1.00 0.00 S ATOM 0 H CYS A 64 11.877 -1.200 -1.127 1.00 0.00 H new ATOM 0 HA CYS A 64 9.848 -1.937 -2.938 1.00 0.00 H new ATOM 0 HB2 CYS A 64 12.382 -1.420 -3.157 1.00 0.00 H new ATOM 0 HB3 CYS A 64 12.662 -3.046 -2.567 1.00 0.00 H new ATOM 1018 N ALA A 65 10.750 -4.420 -0.961 1.00 0.00 N ATOM 1019 CA ALA A 65 10.305 -5.694 -0.400 1.00 0.00 C ATOM 1020 C ALA A 65 9.012 -5.521 0.424 1.00 0.00 C ATOM 1021 O ALA A 65 8.056 -6.277 0.234 1.00 0.00 O ATOM 1022 CB ALA A 65 11.433 -6.305 0.439 1.00 0.00 C ATOM 0 H ALA A 65 11.627 -4.086 -0.561 1.00 0.00 H new ATOM 0 HA ALA A 65 10.068 -6.378 -1.215 1.00 0.00 H new ATOM 0 HB1 ALA A 65 11.101 -7.255 0.858 1.00 0.00 H new ATOM 0 HB2 ALA A 65 12.306 -6.471 -0.192 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.694 -5.623 1.248 1.00 0.00 H new ATOM 1028 N SER A 66 8.978 -4.535 1.334 1.00 0.00 N ATOM 1029 CA SER A 66 7.836 -4.231 2.212 1.00 0.00 C ATOM 1030 C SER A 66 6.533 -4.049 1.426 1.00 0.00 C ATOM 1031 O SER A 66 5.566 -4.778 1.639 1.00 0.00 O ATOM 1032 CB SER A 66 8.063 -2.976 3.084 1.00 0.00 C ATOM 1033 OG SER A 66 9.421 -2.622 3.245 1.00 0.00 O ATOM 0 H SER A 66 9.768 -3.908 1.484 1.00 0.00 H new ATOM 0 HA SER A 66 7.749 -5.099 2.865 1.00 0.00 H new ATOM 0 HB2 SER A 66 7.530 -2.136 2.638 1.00 0.00 H new ATOM 0 HB3 SER A 66 7.624 -3.146 4.067 1.00 0.00 H new ATOM 0 HG SER A 66 9.727 -2.896 4.135 1.00 0.00 H new ATOM 1039 N SER A 67 6.515 -3.064 0.522 1.00 0.00 N ATOM 1040 CA SER A 67 5.376 -2.662 -0.315 1.00 0.00 C ATOM 1041 C SER A 67 4.705 -3.815 -1.067 1.00 0.00 C ATOM 1042 O SER A 67 3.477 -3.898 -1.083 1.00 0.00 O ATOM 1043 CB SER A 67 5.755 -1.505 -1.244 1.00 0.00 C ATOM 1044 OG SER A 67 6.902 -1.795 -2.014 1.00 0.00 O ATOM 0 H SER A 67 7.341 -2.493 0.343 1.00 0.00 H new ATOM 0 HA SER A 67 4.611 -2.307 0.376 1.00 0.00 H new ATOM 0 HB2 SER A 67 4.919 -1.286 -1.908 1.00 0.00 H new ATOM 0 HB3 SER A 67 5.935 -0.608 -0.651 1.00 0.00 H new ATOM 0 HG SER A 67 7.705 -1.649 -1.472 1.00 0.00 H new ATOM 1050 N ARG A 68 5.469 -4.746 -1.645 1.00 0.00 N ATOM 1051 CA ARG A 68 4.892 -5.940 -2.284 1.00 0.00 C ATOM 1052 C ARG A 68 4.127 -6.796 -1.262 1.00 0.00 C ATOM 1053 O ARG A 68 2.974 -7.148 -1.502 1.00 0.00 O ATOM 1054 CB ARG A 68 5.977 -6.742 -3.007 1.00 0.00 C ATOM 1055 CG ARG A 68 6.531 -6.013 -4.238 1.00 0.00 C ATOM 1056 CD ARG A 68 7.461 -6.971 -4.983 1.00 0.00 C ATOM 1057 NE ARG A 68 8.103 -6.376 -6.164 1.00 0.00 N ATOM 1058 CZ ARG A 68 9.178 -5.612 -6.152 1.00 0.00 C ATOM 1059 NH1 ARG A 68 9.649 -5.106 -5.060 1.00 0.00 N ATOM 1060 NH2 ARG A 68 9.826 -5.355 -7.237 1.00 0.00 N ATOM 0 H ARG A 68 6.487 -4.699 -1.686 1.00 0.00 H new ATOM 0 HA ARG A 68 4.170 -5.617 -3.034 1.00 0.00 H new ATOM 0 HB2 ARG A 68 6.793 -6.948 -2.314 1.00 0.00 H new ATOM 0 HB3 ARG A 68 5.568 -7.705 -3.313 1.00 0.00 H new ATOM 0 HG2 ARG A 68 5.717 -5.692 -4.888 1.00 0.00 H new ATOM 0 HG3 ARG A 68 7.072 -5.116 -3.937 1.00 0.00 H new ATOM 0 HD2 ARG A 68 8.234 -7.319 -4.298 1.00 0.00 H new ATOM 0 HD3 ARG A 68 6.892 -7.847 -5.293 1.00 0.00 H new ATOM 0 HE ARG A 68 7.680 -6.571 -7.072 1.00 0.00 H new ATOM 0 HH11 ARG A 68 9.187 -5.293 -4.170 1.00 0.00 H new ATOM 0 HH12 ARG A 68 10.483 -4.519 -5.088 1.00 0.00 H new ATOM 0 HH21 ARG A 68 9.509 -5.745 -8.125 1.00 0.00 H new ATOM 0 HH22 ARG A 68 10.655 -4.762 -7.207 1.00 0.00 H new ATOM 1074 N GLN A 69 4.755 -7.104 -0.121 1.00 0.00 N ATOM 1075 CA GLN A 69 4.210 -7.896 0.996 1.00 0.00 C ATOM 1076 C GLN A 69 2.865 -7.347 1.513 1.00 0.00 C ATOM 1077 O GLN A 69 1.882 -8.087 1.571 1.00 0.00 O ATOM 1078 CB GLN A 69 5.268 -7.986 2.119 1.00 0.00 C ATOM 1079 CG GLN A 69 5.349 -9.340 2.845 1.00 0.00 C ATOM 1080 CD GLN A 69 4.176 -9.745 3.744 1.00 0.00 C ATOM 1081 OE1 GLN A 69 3.907 -10.923 3.924 1.00 0.00 O ATOM 1082 NE2 GLN A 69 3.463 -8.843 4.384 1.00 0.00 N ATOM 0 H GLN A 69 5.709 -6.792 0.061 1.00 0.00 H new ATOM 0 HA GLN A 69 3.991 -8.899 0.631 1.00 0.00 H new ATOM 0 HB2 GLN A 69 6.246 -7.763 1.692 1.00 0.00 H new ATOM 0 HB3 GLN A 69 5.058 -7.210 2.855 1.00 0.00 H new ATOM 0 HG2 GLN A 69 5.475 -10.116 2.091 1.00 0.00 H new ATOM 0 HG3 GLN A 69 6.252 -9.338 3.455 1.00 0.00 H new ATOM 0 HE21 GLN A 69 3.662 -7.851 4.256 1.00 0.00 H new ATOM 0 HE22 GLN A 69 2.711 -9.136 5.008 1.00 0.00 H new ATOM 1091 N ILE A 70 2.799 -6.058 1.885 1.00 0.00 N ATOM 1092 CA ILE A 70 1.553 -5.420 2.364 1.00 0.00 C ATOM 1093 C ILE A 70 0.380 -5.543 1.377 1.00 0.00 C ATOM 1094 O ILE A 70 -0.744 -5.821 1.802 1.00 0.00 O ATOM 1095 CB ILE A 70 1.733 -3.965 2.878 1.00 0.00 C ATOM 1096 CG1 ILE A 70 2.858 -3.144 2.234 1.00 0.00 C ATOM 1097 CG2 ILE A 70 1.874 -3.977 4.407 1.00 0.00 C ATOM 1098 CD1 ILE A 70 2.758 -1.628 2.444 1.00 0.00 C ATOM 0 H ILE A 70 3.601 -5.428 1.864 1.00 0.00 H new ATOM 0 HA ILE A 70 1.283 -6.008 3.241 1.00 0.00 H new ATOM 0 HB ILE A 70 0.829 -3.443 2.565 1.00 0.00 H new ATOM 0 HG12 ILE A 70 3.812 -3.488 2.633 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.868 -3.347 1.163 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.000 -2.957 4.769 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.979 -4.411 4.852 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.743 -4.572 4.688 1.00 0.00 H new ATOM 0 HD11 ILE A 70 3.597 -1.136 1.952 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.823 -1.263 2.019 1.00 0.00 H new ATOM 0 HD13 ILE A 70 2.782 -1.406 3.511 1.00 0.00 H new ATOM 1110 N ILE A 71 0.614 -5.374 0.070 1.00 0.00 N ATOM 1111 CA ILE A 71 -0.441 -5.543 -0.947 1.00 0.00 C ATOM 1112 C ILE A 71 -0.846 -7.013 -1.086 1.00 0.00 C ATOM 1113 O ILE A 71 -2.046 -7.292 -1.146 1.00 0.00 O ATOM 1114 CB ILE A 71 -0.064 -4.870 -2.278 1.00 0.00 C ATOM 1115 CG1 ILE A 71 0.182 -3.361 -2.063 1.00 0.00 C ATOM 1116 CG2 ILE A 71 -1.149 -5.061 -3.352 1.00 0.00 C ATOM 1117 CD1 ILE A 71 -0.888 -2.608 -1.247 1.00 0.00 C ATOM 0 H ILE A 71 1.525 -5.120 -0.313 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.334 -5.019 -0.605 1.00 0.00 H new ATOM 0 HB ILE A 71 0.849 -5.350 -2.632 1.00 0.00 H new ATOM 0 HG12 ILE A 71 1.143 -3.238 -1.564 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.267 -2.885 -3.040 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.839 -4.569 -4.274 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.292 -6.125 -3.539 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.085 -4.624 -3.005 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.608 -1.558 -1.162 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -1.852 -2.687 -1.750 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.961 -3.046 -0.252 1.00 0.00 H new ATOM 1129 N SER A 72 0.110 -7.953 -1.070 1.00 0.00 N ATOM 1130 CA SER A 72 -0.186 -9.395 -1.052 1.00 0.00 C ATOM 1131 C SER A 72 -1.171 -9.718 0.079 1.00 0.00 C ATOM 1132 O SER A 72 -2.165 -10.403 -0.160 1.00 0.00 O ATOM 1133 CB SER A 72 1.064 -10.253 -0.857 1.00 0.00 C ATOM 1134 OG SER A 72 2.039 -10.045 -1.854 1.00 0.00 O ATOM 0 H SER A 72 1.107 -7.737 -1.069 1.00 0.00 H new ATOM 0 HA SER A 72 -0.616 -9.632 -2.025 1.00 0.00 H new ATOM 0 HB2 SER A 72 1.498 -10.035 0.119 1.00 0.00 H new ATOM 0 HB3 SER A 72 0.778 -11.305 -0.851 1.00 0.00 H new ATOM 0 HG SER A 72 2.910 -10.358 -1.530 1.00 0.00 H new ATOM 1140 N HIS A 73 -0.921 -9.197 1.293 1.00 0.00 N ATOM 1141 CA HIS A 73 -1.817 -9.355 2.442 1.00 0.00 C ATOM 1142 C HIS A 73 -3.223 -8.835 2.107 1.00 0.00 C ATOM 1143 O HIS A 73 -4.148 -9.640 2.063 1.00 0.00 O ATOM 1144 CB HIS A 73 -1.262 -8.705 3.725 1.00 0.00 C ATOM 1145 CG HIS A 73 -2.140 -8.961 4.939 1.00 0.00 C ATOM 1146 ND1 HIS A 73 -1.912 -9.902 5.918 1.00 0.00 N ATOM 1147 CD2 HIS A 73 -3.374 -8.413 5.196 1.00 0.00 C ATOM 1148 CE1 HIS A 73 -2.988 -9.944 6.723 1.00 0.00 C ATOM 1149 NE2 HIS A 73 -3.916 -9.060 6.319 1.00 0.00 N ATOM 0 H HIS A 73 -0.085 -8.651 1.501 1.00 0.00 H new ATOM 0 HA HIS A 73 -1.886 -10.423 2.651 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -0.261 -9.090 3.918 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -1.166 -7.630 3.571 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -1.071 -10.470 6.016 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -3.845 -7.622 4.632 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -3.092 -10.598 7.576 1.00 0.00 H new ATOM 1157 N TRP A 74 -3.408 -7.526 1.871 1.00 0.00 N ATOM 1158 CA TRP A 74 -4.737 -6.939 1.612 1.00 0.00 C ATOM 1159 C TRP A 74 -5.542 -7.653 0.511 1.00 0.00 C ATOM 1160 O TRP A 74 -6.744 -7.888 0.672 1.00 0.00 O ATOM 1161 CB TRP A 74 -4.652 -5.429 1.338 1.00 0.00 C ATOM 1162 CG TRP A 74 -5.988 -4.735 1.338 1.00 0.00 C ATOM 1163 CD1 TRP A 74 -6.919 -4.871 2.308 1.00 0.00 C ATOM 1164 CD2 TRP A 74 -6.577 -3.813 0.362 1.00 0.00 C ATOM 1165 NE1 TRP A 74 -8.045 -4.133 1.999 1.00 0.00 N ATOM 1166 CE2 TRP A 74 -7.885 -3.452 0.814 1.00 0.00 C ATOM 1167 CE3 TRP A 74 -6.145 -3.233 -0.851 1.00 0.00 C ATOM 1168 CZ2 TRP A 74 -8.713 -2.565 0.113 1.00 0.00 C ATOM 1169 CZ3 TRP A 74 -6.958 -2.314 -1.546 1.00 0.00 C ATOM 1170 CH2 TRP A 74 -8.234 -1.975 -1.064 1.00 0.00 C ATOM 0 H TRP A 74 -2.647 -6.847 1.854 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.294 -7.095 2.536 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -4.014 -4.968 2.092 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -4.171 -5.271 0.373 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.800 -5.471 3.198 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -8.886 -4.097 2.575 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -5.178 -3.497 -1.252 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -9.705 -2.340 0.475 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -6.596 -1.865 -2.459 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -8.843 -1.262 -1.599 1.00 0.00 H new ATOM 1181 N LYS A 75 -4.890 -8.010 -0.606 1.00 0.00 N ATOM 1182 CA LYS A 75 -5.506 -8.723 -1.735 1.00 0.00 C ATOM 1183 C LYS A 75 -6.051 -10.102 -1.326 1.00 0.00 C ATOM 1184 O LYS A 75 -7.208 -10.417 -1.610 1.00 0.00 O ATOM 1185 CB LYS A 75 -4.498 -8.812 -2.893 1.00 0.00 C ATOM 1186 CG LYS A 75 -5.177 -9.251 -4.200 1.00 0.00 C ATOM 1187 CD LYS A 75 -4.171 -9.264 -5.355 1.00 0.00 C ATOM 1188 CE LYS A 75 -4.878 -9.523 -6.692 1.00 0.00 C ATOM 1189 NZ LYS A 75 -3.917 -9.444 -7.820 1.00 0.00 N ATOM 0 H LYS A 75 -3.901 -7.807 -0.752 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.374 -8.157 -2.073 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.022 -7.842 -3.037 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.709 -9.519 -2.636 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -5.608 -10.244 -4.076 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -5.998 -8.574 -4.434 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.645 -8.310 -5.396 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.420 -10.035 -5.180 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.347 -10.507 -6.676 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.674 -8.793 -6.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.438 -9.436 -8.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.355 -8.573 -7.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.283 -10.268 -7.795 1.00 0.00 H new ATOM 1203 N ASN A 76 -5.223 -10.931 -0.686 1.00 0.00 N ATOM 1204 CA ASN A 76 -5.563 -12.289 -0.240 1.00 0.00 C ATOM 1205 C ASN A 76 -6.495 -12.335 0.988 1.00 0.00 C ATOM 1206 O ASN A 76 -7.383 -13.191 1.041 1.00 0.00 O ATOM 1207 CB ASN A 76 -4.270 -13.076 0.012 1.00 0.00 C ATOM 1208 CG ASN A 76 -3.629 -13.546 -1.284 1.00 0.00 C ATOM 1209 OD1 ASN A 76 -3.390 -12.793 -2.217 1.00 0.00 O ATOM 1210 ND2 ASN A 76 -3.356 -14.823 -1.413 1.00 0.00 N ATOM 0 H ASN A 76 -4.265 -10.669 -0.455 1.00 0.00 H new ATOM 0 HA ASN A 76 -6.136 -12.755 -1.042 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -3.565 -12.450 0.559 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -4.487 -13.938 0.643 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -2.951 -15.173 -2.281 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -3.549 -15.466 -0.645 1.00 0.00 H new ATOM 1217 N CYS A 77 -6.286 -11.456 1.971 1.00 0.00 N ATOM 1218 CA CYS A 77 -7.046 -11.371 3.216 1.00 0.00 C ATOM 1219 C CYS A 77 -8.557 -11.220 2.959 1.00 0.00 C ATOM 1220 O CYS A 77 -9.015 -10.304 2.260 1.00 0.00 O ATOM 1221 CB CYS A 77 -6.469 -10.229 4.071 1.00 0.00 C ATOM 1222 SG CYS A 77 -7.197 -10.164 5.743 1.00 0.00 S ATOM 0 H CYS A 77 -5.549 -10.753 1.916 1.00 0.00 H new ATOM 0 HA CYS A 77 -6.943 -12.305 3.769 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -5.389 -10.353 4.154 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -6.643 -9.279 3.566 1.00 0.00 H new ATOM 1227 N THR A 78 -9.335 -12.145 3.523 1.00 0.00 N ATOM 1228 CA THR A 78 -10.804 -12.208 3.437 1.00 0.00 C ATOM 1229 C THR A 78 -11.462 -12.234 4.829 1.00 0.00 C ATOM 1230 O THR A 78 -12.663 -12.491 4.963 1.00 0.00 O ATOM 1231 CB THR A 78 -11.236 -13.362 2.511 1.00 0.00 C ATOM 1232 OG1 THR A 78 -12.608 -13.269 2.185 1.00 0.00 O ATOM 1233 CG2 THR A 78 -10.970 -14.761 3.070 1.00 0.00 C ATOM 0 H THR A 78 -8.946 -12.907 4.078 1.00 0.00 H new ATOM 0 HA THR A 78 -11.172 -11.290 2.978 1.00 0.00 H new ATOM 0 HB THR A 78 -10.613 -13.241 1.625 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.123 -13.062 2.993 1.00 0.00 H new ATOM 0 HG21 THR A 78 -11.305 -15.509 2.352 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.902 -14.884 3.250 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.513 -14.888 4.007 1.00 0.00 H new ATOM 1241 N ARG A 79 -10.691 -11.914 5.880 1.00 0.00 N ATOM 1242 CA ARG A 79 -11.134 -11.803 7.276 1.00 0.00 C ATOM 1243 C ARG A 79 -12.093 -10.611 7.421 1.00 0.00 C ATOM 1244 O ARG A 79 -11.739 -9.472 7.110 1.00 0.00 O ATOM 1245 CB ARG A 79 -9.890 -11.650 8.172 1.00 0.00 C ATOM 1246 CG ARG A 79 -10.237 -11.540 9.662 1.00 0.00 C ATOM 1247 CD ARG A 79 -8.996 -11.282 10.522 1.00 0.00 C ATOM 1248 NE ARG A 79 -9.390 -10.860 11.877 1.00 0.00 N ATOM 1249 CZ ARG A 79 -8.620 -10.348 12.816 1.00 0.00 C ATOM 1250 NH1 ARG A 79 -7.332 -10.212 12.660 1.00 0.00 N ATOM 1251 NH2 ARG A 79 -9.134 -9.955 13.944 1.00 0.00 N ATOM 0 H ARG A 79 -9.696 -11.717 5.773 1.00 0.00 H new ATOM 0 HA ARG A 79 -11.676 -12.697 7.583 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -9.232 -12.505 8.020 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -9.336 -10.763 7.867 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -10.954 -10.732 9.809 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -10.721 -12.460 9.990 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -8.390 -12.186 10.578 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -8.379 -10.512 10.059 1.00 0.00 H new ATOM 0 HE ARG A 79 -10.374 -10.978 12.117 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -6.890 -10.506 11.789 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -6.767 -9.811 13.409 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -10.137 -10.042 14.105 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -8.534 -9.559 14.668 1.00 0.00 H new ATOM 1265 N HIS A 80 -13.311 -10.867 7.905 1.00 0.00 N ATOM 1266 CA HIS A 80 -14.381 -9.867 8.091 1.00 0.00 C ATOM 1267 C HIS A 80 -14.141 -8.836 9.215 1.00 0.00 C ATOM 1268 O HIS A 80 -15.008 -7.996 9.456 1.00 0.00 O ATOM 1269 CB HIS A 80 -15.720 -10.604 8.285 1.00 0.00 C ATOM 1270 CG HIS A 80 -16.029 -11.599 7.189 1.00 0.00 C ATOM 1271 ND1 HIS A 80 -16.263 -12.952 7.363 1.00 0.00 N ATOM 1272 CD2 HIS A 80 -16.087 -11.324 5.849 1.00 0.00 C ATOM 1273 CE1 HIS A 80 -16.454 -13.493 6.140 1.00 0.00 C ATOM 1274 NE2 HIS A 80 -16.352 -12.522 5.206 1.00 0.00 N ATOM 0 H HIS A 80 -13.595 -11.805 8.189 1.00 0.00 H new ATOM 0 HA HIS A 80 -14.395 -9.260 7.186 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -15.703 -11.125 9.242 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -16.525 -9.870 8.335 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -15.952 -10.359 5.383 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -16.656 -14.535 5.941 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -16.453 -12.649 4.199 1.00 0.00 H new ATOM 1283 N ASP A 81 -13.002 -8.885 9.913 1.00 0.00 N ATOM 1284 CA ASP A 81 -12.648 -7.980 11.019 1.00 0.00 C ATOM 1285 C ASP A 81 -11.137 -7.651 11.158 1.00 0.00 C ATOM 1286 O ASP A 81 -10.716 -7.194 12.225 1.00 0.00 O ATOM 1287 CB ASP A 81 -13.221 -8.550 12.337 1.00 0.00 C ATOM 1288 CG ASP A 81 -12.406 -9.728 12.901 1.00 0.00 C ATOM 1289 OD1 ASP A 81 -12.208 -10.738 12.187 1.00 0.00 O ATOM 1290 OD2 ASP A 81 -11.930 -9.657 14.058 1.00 0.00 O ATOM 0 H ASP A 81 -12.276 -9.576 9.721 1.00 0.00 H new ATOM 0 HA ASP A 81 -13.100 -7.017 10.781 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.259 -7.755 13.082 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.247 -8.876 12.167 1.00 0.00 H new ATOM 1295 N CYS A 82 -10.314 -7.831 10.110 1.00 0.00 N ATOM 1296 CA CYS A 82 -8.879 -7.485 10.146 1.00 0.00 C ATOM 1297 C CYS A 82 -8.738 -5.958 10.413 1.00 0.00 C ATOM 1298 O CYS A 82 -9.503 -5.176 9.828 1.00 0.00 O ATOM 1299 CB CYS A 82 -8.218 -7.890 8.811 1.00 0.00 C ATOM 1300 SG CYS A 82 -6.450 -8.365 8.918 1.00 0.00 S ATOM 0 H CYS A 82 -10.621 -8.218 9.218 1.00 0.00 H new ATOM 0 HA CYS A 82 -8.374 -8.025 10.946 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -8.776 -8.726 8.388 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -8.311 -7.058 8.112 1.00 0.00 H new ATOM 1305 N PRO A 83 -7.814 -5.497 11.281 1.00 0.00 N ATOM 1306 CA PRO A 83 -7.678 -4.087 11.668 1.00 0.00 C ATOM 1307 C PRO A 83 -7.511 -3.074 10.524 1.00 0.00 C ATOM 1308 O PRO A 83 -7.937 -1.928 10.686 1.00 0.00 O ATOM 1309 CB PRO A 83 -6.511 -4.029 12.664 1.00 0.00 C ATOM 1310 CG PRO A 83 -5.742 -5.317 12.386 1.00 0.00 C ATOM 1311 CD PRO A 83 -6.855 -6.293 12.026 1.00 0.00 C ATOM 0 HA PRO A 83 -8.623 -3.766 12.105 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -5.890 -3.148 12.504 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -6.864 -3.987 13.694 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -5.029 -5.196 11.571 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -5.177 -5.649 13.257 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -6.477 -7.121 11.427 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -7.307 -6.725 12.919 1.00 0.00 H new ATOM 1319 N VAL A 84 -6.904 -3.455 9.392 1.00 0.00 N ATOM 1320 CA VAL A 84 -6.691 -2.553 8.238 1.00 0.00 C ATOM 1321 C VAL A 84 -7.634 -2.895 7.088 1.00 0.00 C ATOM 1322 O VAL A 84 -8.306 -2.021 6.542 1.00 0.00 O ATOM 1323 CB VAL A 84 -5.250 -2.546 7.693 1.00 0.00 C ATOM 1324 CG1 VAL A 84 -4.969 -1.155 7.108 1.00 0.00 C ATOM 1325 CG2 VAL A 84 -4.221 -2.825 8.777 1.00 0.00 C ATOM 0 H VAL A 84 -6.544 -4.398 9.244 1.00 0.00 H new ATOM 0 HA VAL A 84 -6.899 -1.558 8.631 1.00 0.00 H new ATOM 0 HB VAL A 84 -5.167 -3.332 6.943 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.953 -1.124 6.715 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -5.676 -0.949 6.304 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.079 -0.403 7.889 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -3.221 -2.809 8.343 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -4.292 -2.061 9.551 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -4.411 -3.805 9.215 1.00 0.00 H new ATOM 1335 N CYS A 85 -7.658 -4.167 6.694 1.00 0.00 N ATOM 1336 CA CYS A 85 -8.424 -4.707 5.589 1.00 0.00 C ATOM 1337 C CYS A 85 -9.921 -4.386 5.704 1.00 0.00 C ATOM 1338 O CYS A 85 -10.482 -3.841 4.756 1.00 0.00 O ATOM 1339 CB CYS A 85 -8.130 -6.212 5.475 1.00 0.00 C ATOM 1340 SG CYS A 85 -6.359 -6.579 5.747 1.00 0.00 S ATOM 0 H CYS A 85 -7.109 -4.884 7.169 1.00 0.00 H new ATOM 0 HA CYS A 85 -8.114 -4.225 4.662 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -8.730 -6.756 6.204 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -8.428 -6.567 4.488 1.00 0.00 H new ATOM 1345 N LEU A 86 -10.569 -4.689 6.838 1.00 0.00 N ATOM 1346 CA LEU A 86 -11.994 -4.397 7.043 1.00 0.00 C ATOM 1347 C LEU A 86 -12.361 -2.929 6.738 1.00 0.00 C ATOM 1348 O LEU A 86 -13.179 -2.731 5.836 1.00 0.00 O ATOM 1349 CB LEU A 86 -12.482 -4.900 8.417 1.00 0.00 C ATOM 1350 CG LEU A 86 -14.004 -4.814 8.672 1.00 0.00 C ATOM 1351 CD1 LEU A 86 -14.518 -3.414 9.021 1.00 0.00 C ATOM 1352 CD2 LEU A 86 -14.823 -5.370 7.505 1.00 0.00 C ATOM 0 H LEU A 86 -10.122 -5.141 7.635 1.00 0.00 H new ATOM 0 HA LEU A 86 -12.552 -4.968 6.301 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -12.173 -5.939 8.531 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -11.972 -4.329 9.192 1.00 0.00 H new ATOM 0 HG LEU A 86 -14.148 -5.438 9.554 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -15.595 -3.452 9.183 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -14.027 -3.062 9.928 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -14.298 -2.731 8.201 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -15.885 -5.287 7.734 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -14.601 -4.802 6.601 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -14.567 -6.418 7.347 1.00 0.00 H new ATOM 1364 N PRO A 87 -11.815 -1.896 7.421 1.00 0.00 N ATOM 1365 CA PRO A 87 -12.162 -0.507 7.121 1.00 0.00 C ATOM 1366 C PRO A 87 -11.897 -0.143 5.648 1.00 0.00 C ATOM 1367 O PRO A 87 -12.761 0.471 5.023 1.00 0.00 O ATOM 1368 CB PRO A 87 -11.423 0.357 8.148 1.00 0.00 C ATOM 1369 CG PRO A 87 -10.279 -0.526 8.636 1.00 0.00 C ATOM 1370 CD PRO A 87 -10.856 -1.940 8.520 1.00 0.00 C ATOM 0 HA PRO A 87 -13.233 -0.328 7.218 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -11.050 1.277 7.698 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -12.079 0.647 8.969 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -9.386 -0.404 8.023 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -9.996 -0.289 9.662 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -10.069 -2.667 8.322 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.341 -2.241 9.449 1.00 0.00 H new ATOM 1378 N LEU A 88 -10.769 -0.569 5.062 1.00 0.00 N ATOM 1379 CA LEU A 88 -10.449 -0.374 3.637 1.00 0.00 C ATOM 1380 C LEU A 88 -11.522 -0.961 2.697 1.00 0.00 C ATOM 1381 O LEU A 88 -11.991 -0.265 1.794 1.00 0.00 O ATOM 1382 CB LEU A 88 -9.070 -0.971 3.321 1.00 0.00 C ATOM 1383 CG LEU A 88 -7.877 -0.177 3.868 1.00 0.00 C ATOM 1384 CD1 LEU A 88 -6.616 -1.014 3.679 1.00 0.00 C ATOM 1385 CD2 LEU A 88 -7.700 1.150 3.124 1.00 0.00 C ATOM 0 H LEU A 88 -10.040 -1.067 5.572 1.00 0.00 H new ATOM 0 HA LEU A 88 -10.431 0.701 3.456 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -9.028 -1.983 3.724 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -8.966 -1.054 2.239 1.00 0.00 H new ATOM 0 HG LEU A 88 -8.056 0.041 4.921 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.755 -0.466 4.062 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.719 -1.954 4.221 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.472 -1.221 2.618 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.846 1.687 3.537 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -7.528 0.954 2.066 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -8.600 1.755 3.239 1.00 0.00 H new ATOM 1397 N LYS A 89 -11.921 -2.226 2.898 1.00 0.00 N ATOM 1398 CA LYS A 89 -12.972 -2.918 2.125 1.00 0.00 C ATOM 1399 C LYS A 89 -14.320 -2.207 2.259 1.00 0.00 C ATOM 1400 O LYS A 89 -15.006 -1.958 1.266 1.00 0.00 O ATOM 1401 CB LYS A 89 -13.156 -4.367 2.615 1.00 0.00 C ATOM 1402 CG LYS A 89 -12.000 -5.316 2.285 1.00 0.00 C ATOM 1403 CD LYS A 89 -12.284 -6.688 2.912 1.00 0.00 C ATOM 1404 CE LYS A 89 -11.047 -7.600 2.969 1.00 0.00 C ATOM 1405 NZ LYS A 89 -10.503 -7.939 1.627 1.00 0.00 N ATOM 0 H LYS A 89 -11.512 -2.816 3.623 1.00 0.00 H new ATOM 0 HA LYS A 89 -12.648 -2.910 1.084 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -13.297 -4.353 3.696 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -14.071 -4.768 2.179 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -11.888 -5.412 1.205 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -11.062 -4.914 2.668 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -12.668 -6.545 3.922 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -13.067 -7.186 2.340 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -10.270 -7.110 3.555 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -11.307 -8.521 3.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -9.913 -8.793 1.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -11.288 -8.114 0.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -9.927 -7.148 1.276 1.00 0.00 H new ATOM 1419 N ASN A 90 -14.710 -1.936 3.504 1.00 0.00 N ATOM 1420 CA ASN A 90 -15.978 -1.331 3.893 1.00 0.00 C ATOM 1421 C ASN A 90 -16.173 0.097 3.338 1.00 0.00 C ATOM 1422 O ASN A 90 -17.279 0.456 2.928 1.00 0.00 O ATOM 1423 CB ASN A 90 -16.062 -1.351 5.427 1.00 0.00 C ATOM 1424 CG ASN A 90 -17.427 -0.938 5.952 1.00 0.00 C ATOM 1425 OD1 ASN A 90 -18.468 -1.404 5.506 1.00 0.00 O ATOM 1426 ND2 ASN A 90 -17.469 -0.071 6.938 1.00 0.00 N ATOM 0 H ASN A 90 -14.118 -2.144 4.308 1.00 0.00 H new ATOM 0 HA ASN A 90 -16.788 -1.915 3.455 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -15.829 -2.354 5.785 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -15.304 -0.683 5.836 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -18.367 0.212 7.330 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -16.604 0.319 7.312 1.00 0.00 H new ATOM 1433 N ALA A 91 -15.115 0.917 3.353 1.00 0.00 N ATOM 1434 CA ALA A 91 -15.106 2.303 2.886 1.00 0.00 C ATOM 1435 C ALA A 91 -15.497 2.433 1.396 1.00 0.00 C ATOM 1436 O ALA A 91 -14.739 2.051 0.500 1.00 0.00 O ATOM 1437 CB ALA A 91 -13.717 2.903 3.151 1.00 0.00 C ATOM 0 H ALA A 91 -14.206 0.618 3.706 1.00 0.00 H new ATOM 0 HA ALA A 91 -15.863 2.858 3.440 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -13.696 3.937 2.807 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -13.505 2.871 4.220 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -12.963 2.327 2.614 1.00 0.00 H new ATOM 1443 N SER A 92 -16.681 3.000 1.146 1.00 0.00 N ATOM 1444 CA SER A 92 -17.258 3.239 -0.188 1.00 0.00 C ATOM 1445 C SER A 92 -17.855 4.649 -0.275 1.00 0.00 C ATOM 1446 O SER A 92 -18.865 4.947 0.367 1.00 0.00 O ATOM 1447 CB SER A 92 -18.338 2.193 -0.504 1.00 0.00 C ATOM 1448 OG SER A 92 -17.768 0.902 -0.674 1.00 0.00 O ATOM 0 H SER A 92 -17.293 3.320 1.897 1.00 0.00 H new ATOM 0 HA SER A 92 -16.458 3.152 -0.923 1.00 0.00 H new ATOM 0 HB2 SER A 92 -19.070 2.167 0.303 1.00 0.00 H new ATOM 0 HB3 SER A 92 -18.872 2.480 -1.410 1.00 0.00 H new ATOM 0 HG SER A 92 -18.477 0.255 -0.872 1.00 0.00 H new ATOM 1454 N ASP A 93 -17.229 5.528 -1.063 1.00 0.00 N ATOM 1455 CA ASP A 93 -17.638 6.925 -1.274 1.00 0.00 C ATOM 1456 C ASP A 93 -17.262 7.424 -2.683 1.00 0.00 C ATOM 1457 O ASP A 93 -16.157 7.164 -3.168 1.00 0.00 O ATOM 1458 CB ASP A 93 -16.978 7.816 -0.207 1.00 0.00 C ATOM 1459 CG ASP A 93 -17.344 9.293 -0.412 1.00 0.00 C ATOM 1460 OD1 ASP A 93 -18.547 9.636 -0.348 1.00 0.00 O ATOM 1461 OD2 ASP A 93 -16.444 10.123 -0.672 1.00 0.00 O ATOM 0 H ASP A 93 -16.393 5.280 -1.592 1.00 0.00 H new ATOM 0 HA ASP A 93 -18.723 6.979 -1.186 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -17.295 7.495 0.785 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -15.895 7.698 -0.250 1.00 0.00 H new ATOM 1466 N LYS A 94 -18.174 8.161 -3.333 1.00 0.00 N ATOM 1467 CA LYS A 94 -18.010 8.747 -4.676 1.00 0.00 C ATOM 1468 C LYS A 94 -18.408 10.230 -4.658 1.00 0.00 C ATOM 1469 O LYS A 94 -19.592 10.561 -4.522 1.00 0.00 O ATOM 1470 CB LYS A 94 -18.832 7.949 -5.712 1.00 0.00 C ATOM 1471 CG LYS A 94 -18.386 6.489 -5.924 1.00 0.00 C ATOM 1472 CD LYS A 94 -16.986 6.363 -6.551 1.00 0.00 C ATOM 1473 CE LYS A 94 -16.661 4.927 -6.987 1.00 0.00 C ATOM 1474 NZ LYS A 94 -16.534 3.995 -5.838 1.00 0.00 N ATOM 0 H LYS A 94 -19.083 8.375 -2.923 1.00 0.00 H new ATOM 0 HA LYS A 94 -16.962 8.687 -4.969 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -19.877 7.951 -5.401 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -18.783 8.469 -6.669 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -18.394 5.971 -4.965 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -19.110 5.985 -6.565 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -16.918 7.025 -7.414 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -16.238 6.698 -5.832 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -17.444 4.569 -7.656 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -15.731 4.926 -7.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -16.248 3.056 -6.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -15.816 4.355 -5.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -17.449 3.920 -5.349 1.00 0.00 H new ATOM 1488 N ARG A 95 -17.413 11.116 -4.773 1.00 0.00 N ATOM 1489 CA ARG A 95 -17.551 12.588 -4.782 1.00 0.00 C ATOM 1490 C ARG A 95 -18.289 13.104 -6.027 1.00 0.00 C ATOM 1491 O ARG A 95 -19.141 14.008 -5.876 1.00 0.00 O ATOM 1492 CB ARG A 95 -16.164 13.250 -4.657 1.00 0.00 C ATOM 1493 CG ARG A 95 -15.364 12.921 -3.379 1.00 0.00 C ATOM 1494 CD ARG A 95 -15.932 13.533 -2.088 1.00 0.00 C ATOM 1495 NE ARG A 95 -17.053 12.756 -1.527 1.00 0.00 N ATOM 1496 CZ ARG A 95 -18.258 13.172 -1.192 1.00 0.00 C ATOM 1497 NH1 ARG A 95 -18.642 14.408 -1.342 1.00 0.00 N ATOM 1498 NH2 ARG A 95 -19.120 12.341 -0.691 1.00 0.00 N ATOM 1499 OXT ARG A 95 -18.006 12.618 -7.148 1.00 0.00 O ATOM 0 H ARG A 95 -16.442 10.819 -4.867 1.00 0.00 H new ATOM 0 HA ARG A 95 -18.161 12.862 -3.921 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -15.566 12.958 -5.520 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -16.294 14.331 -4.711 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -15.321 11.838 -3.263 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -14.339 13.269 -3.509 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -15.137 13.602 -1.345 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -16.268 14.550 -2.292 1.00 0.00 H new ATOM 0 HE ARG A 95 -16.871 11.763 -1.378 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -18.000 15.098 -1.733 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -19.585 14.686 -1.069 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -18.866 11.363 -0.555 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -20.052 12.666 -0.433 1.00 0.00 H new TER 1513 ARG A 95 ATOM 1514 N SER B 99 -11.555 12.548 4.620 1.00 0.00 N ATOM 1515 CA SER B 99 -10.864 11.894 5.756 1.00 0.00 C ATOM 1516 C SER B 99 -10.653 10.409 5.481 1.00 0.00 C ATOM 1517 O SER B 99 -11.541 9.738 4.950 1.00 0.00 O ATOM 1518 CB SER B 99 -11.652 12.069 7.058 1.00 0.00 C ATOM 1519 OG SER B 99 -11.859 13.449 7.330 1.00 0.00 O ATOM 0 HA SER B 99 -9.893 12.376 5.868 1.00 0.00 H new ATOM 0 HB2 SER B 99 -12.612 11.559 6.981 1.00 0.00 H new ATOM 0 HB3 SER B 99 -11.111 11.606 7.883 1.00 0.00 H new ATOM 0 HG SER B 99 -11.981 13.934 6.487 1.00 0.00 H new ATOM 1527 N ASP B 100 -9.481 9.875 5.840 1.00 0.00 N ATOM 1528 CA ASP B 100 -9.138 8.453 5.676 1.00 0.00 C ATOM 1529 C ASP B 100 -9.984 7.536 6.586 1.00 0.00 C ATOM 1530 O ASP B 100 -10.394 7.937 7.680 1.00 0.00 O ATOM 1531 CB ASP B 100 -7.640 8.264 5.970 1.00 0.00 C ATOM 1532 CG ASP B 100 -7.209 6.802 5.785 1.00 0.00 C ATOM 1533 OD1 ASP B 100 -7.172 6.340 4.620 1.00 0.00 O ATOM 1534 OD2 ASP B 100 -6.972 6.111 6.801 1.00 0.00 O ATOM 0 H ASP B 100 -8.731 10.424 6.259 1.00 0.00 H new ATOM 0 HA ASP B 100 -9.360 8.166 4.648 1.00 0.00 H new ATOM 0 HB2 ASP B 100 -7.055 8.903 5.308 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -7.426 8.581 6.991 1.00 0.00 H new ATOM 1539 N LEU B 101 -10.206 6.290 6.155 1.00 0.00 N ATOM 1540 CA LEU B 101 -10.905 5.245 6.908 1.00 0.00 C ATOM 1541 C LEU B 101 -10.137 3.917 6.790 1.00 0.00 C ATOM 1542 O LEU B 101 -10.478 3.030 6.006 1.00 0.00 O ATOM 1543 CB LEU B 101 -12.385 5.166 6.487 1.00 0.00 C ATOM 1544 CG LEU B 101 -13.211 4.142 7.295 1.00 0.00 C ATOM 1545 CD1 LEU B 101 -13.164 4.389 8.807 1.00 0.00 C ATOM 1546 CD2 LEU B 101 -14.671 4.212 6.854 1.00 0.00 C ATOM 0 H LEU B 101 -9.892 5.970 5.239 1.00 0.00 H new ATOM 0 HA LEU B 101 -10.924 5.492 7.969 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -12.837 6.152 6.598 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -12.439 4.908 5.429 1.00 0.00 H new ATOM 0 HG LEU B 101 -12.772 3.164 7.099 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -13.764 3.636 9.318 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -12.132 4.327 9.154 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -13.562 5.380 9.026 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -15.258 3.490 7.422 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -15.057 5.215 7.033 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -14.742 3.980 5.791 1.00 0.00 H new ATOM 1558 N ALA B 102 -9.073 3.833 7.586 1.00 0.00 N ATOM 1559 CA ALA B 102 -8.123 2.730 7.747 1.00 0.00 C ATOM 1560 C ALA B 102 -7.215 3.051 8.950 1.00 0.00 C ATOM 1561 O ALA B 102 -7.241 2.357 9.967 1.00 0.00 O ATOM 1562 CB ALA B 102 -7.336 2.531 6.451 1.00 0.00 C ATOM 0 H ALA B 102 -8.829 4.613 8.196 1.00 0.00 H new ATOM 0 HA ALA B 102 -8.638 1.790 7.947 1.00 0.00 H new ATOM 0 HB1 ALA B 102 -6.631 1.709 6.576 1.00 0.00 H new ATOM 0 HB2 ALA B 102 -8.025 2.297 5.639 1.00 0.00 H new ATOM 0 HB3 ALA B 102 -6.791 3.444 6.213 1.00 0.00 H new ATOM 1568 N CYS B 103 -6.496 4.171 8.848 1.00 0.00 N ATOM 1569 CA CYS B 103 -5.662 4.803 9.870 1.00 0.00 C ATOM 1570 C CYS B 103 -6.006 6.306 9.858 1.00 0.00 C ATOM 1571 O CYS B 103 -5.174 7.143 9.502 1.00 0.00 O ATOM 1572 CB CYS B 103 -4.170 4.533 9.600 1.00 0.00 C ATOM 1573 SG CYS B 103 -3.770 2.774 9.822 1.00 0.00 S ATOM 0 H CYS B 103 -6.482 4.702 7.977 1.00 0.00 H new ATOM 0 HA CYS B 103 -5.859 4.391 10.860 1.00 0.00 H new ATOM 0 HB2 CYS B 103 -3.920 4.840 8.584 1.00 0.00 H new ATOM 0 HB3 CYS B 103 -3.561 5.135 10.274 1.00 0.00 H new ATOM 0 HG CYS B 103 -4.869 2.091 9.943 1.00 0.00 H new ATOM 1579 N ARG B 104 -7.264 6.623 10.221 1.00 0.00 N ATOM 1580 CA ARG B 104 -7.916 7.956 10.226 1.00 0.00 C ATOM 1581 C ARG B 104 -6.950 9.114 10.491 1.00 0.00 C ATOM 1582 O ARG B 104 -6.829 10.026 9.671 1.00 0.00 O ATOM 1583 CB ARG B 104 -9.121 8.002 11.190 1.00 0.00 C ATOM 1584 CG ARG B 104 -10.154 6.874 10.999 1.00 0.00 C ATOM 1585 CD ARG B 104 -9.999 5.727 12.013 1.00 0.00 C ATOM 1586 NE ARG B 104 -10.373 6.138 13.383 1.00 0.00 N ATOM 1587 CZ ARG B 104 -11.585 6.203 13.911 1.00 0.00 C ATOM 1588 NH1 ARG B 104 -12.660 5.903 13.238 1.00 0.00 N ATOM 1589 NH2 ARG B 104 -11.742 6.580 15.148 1.00 0.00 N ATOM 0 H ARG B 104 -7.905 5.899 10.545 1.00 0.00 H new ATOM 0 HA ARG B 104 -8.286 8.099 9.211 1.00 0.00 H new ATOM 0 HB2 ARG B 104 -8.749 7.964 12.214 1.00 0.00 H new ATOM 0 HB3 ARG B 104 -9.626 8.960 11.070 1.00 0.00 H new ATOM 0 HG2 ARG B 104 -11.157 7.292 11.084 1.00 0.00 H new ATOM 0 HG3 ARG B 104 -10.060 6.472 9.990 1.00 0.00 H new ATOM 0 HD2 ARG B 104 -10.621 4.886 11.705 1.00 0.00 H new ATOM 0 HD3 ARG B 104 -8.966 5.378 12.009 1.00 0.00 H new ATOM 0 HE ARG B 104 -9.603 6.404 13.996 1.00 0.00 H new ATOM 0 HH11 ARG B 104 -12.586 5.604 12.266 1.00 0.00 H new ATOM 0 HH12 ARG B 104 -13.575 5.967 13.684 1.00 0.00 H new ATOM 0 HH21 ARG B 104 -10.929 6.826 15.713 1.00 0.00 H new ATOM 0 HH22 ARG B 104 -12.678 6.629 15.551 1.00 0.00 H new ATOM 1603 N LEU B 105 -6.246 9.043 11.621 1.00 0.00 N ATOM 1604 CA LEU B 105 -5.198 9.978 12.027 1.00 0.00 C ATOM 1605 C LEU B 105 -3.843 9.275 11.842 1.00 0.00 C ATOM 1606 O LEU B 105 -3.329 8.657 12.776 1.00 0.00 O ATOM 1607 CB LEU B 105 -5.421 10.455 13.480 1.00 0.00 C ATOM 1608 CG LEU B 105 -6.422 11.610 13.661 1.00 0.00 C ATOM 1609 CD1 LEU B 105 -7.866 11.236 13.326 1.00 0.00 C ATOM 1610 CD2 LEU B 105 -6.386 12.077 15.118 1.00 0.00 C ATOM 0 H LEU B 105 -6.397 8.302 12.306 1.00 0.00 H new ATOM 0 HA LEU B 105 -5.221 10.876 11.409 1.00 0.00 H new ATOM 0 HB2 LEU B 105 -5.764 9.606 14.072 1.00 0.00 H new ATOM 0 HB3 LEU B 105 -4.460 10.764 13.892 1.00 0.00 H new ATOM 0 HG LEU B 105 -6.116 12.391 12.965 1.00 0.00 H new ATOM 0 HD11 LEU B 105 -8.511 12.102 13.478 1.00 0.00 H new ATOM 0 HD12 LEU B 105 -7.927 10.916 12.286 1.00 0.00 H new ATOM 0 HD13 LEU B 105 -8.191 10.423 13.975 1.00 0.00 H new ATOM 0 HD21 LEU B 105 -7.093 12.896 15.255 1.00 0.00 H new ATOM 0 HD22 LEU B 105 -6.658 11.249 15.772 1.00 0.00 H new ATOM 0 HD23 LEU B 105 -5.381 12.420 15.366 1.00 0.00 H new ATOM 1622 N LEU B 106 -3.254 9.372 10.645 1.00 0.00 N ATOM 1623 CA LEU B 106 -1.932 8.802 10.327 1.00 0.00 C ATOM 1624 C LEU B 106 -0.861 9.355 11.283 1.00 0.00 C ATOM 1625 O LEU B 106 -0.023 8.599 11.778 1.00 0.00 O ATOM 1626 CB LEU B 106 -1.575 9.079 8.852 1.00 0.00 C ATOM 1627 CG LEU B 106 -2.027 7.990 7.854 1.00 0.00 C ATOM 1628 CD1 LEU B 106 -1.963 8.563 6.440 1.00 0.00 C ATOM 1629 CD2 LEU B 106 -1.109 6.764 7.925 1.00 0.00 C ATOM 0 H LEU B 106 -3.685 9.855 9.856 1.00 0.00 H new ATOM 0 HA LEU B 106 -1.968 7.721 10.466 1.00 0.00 H new ATOM 0 HB2 LEU B 106 -2.023 10.028 8.558 1.00 0.00 H new ATOM 0 HB3 LEU B 106 -0.494 9.198 8.772 1.00 0.00 H new ATOM 0 HG LEU B 106 -3.042 7.685 8.108 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -2.280 7.804 5.725 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -2.623 9.428 6.368 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.940 8.867 6.217 1.00 0.00 H new ATOM 0 HD21 LEU B 106 -1.450 6.013 7.212 1.00 0.00 H new ATOM 0 HD22 LEU B 106 -0.088 7.059 7.681 1.00 0.00 H new ATOM 0 HD23 LEU B 106 -1.136 6.347 8.932 1.00 0.00 H new ATOM 1641 N GLY B 107 -0.925 10.667 11.562 1.00 0.00 N ATOM 1642 CA GLY B 107 -0.075 11.442 12.480 1.00 0.00 C ATOM 1643 C GLY B 107 0.356 10.681 13.738 1.00 0.00 C ATOM 1644 O GLY B 107 1.534 10.708 14.094 1.00 0.00 O ATOM 0 H GLY B 107 -1.627 11.259 11.117 1.00 0.00 H new ATOM 0 HA2 GLY B 107 0.816 11.767 11.943 1.00 0.00 H new ATOM 0 HA3 GLY B 107 -0.612 12.342 12.780 1.00 0.00 H new ATOM 1648 N GLN B 108 -0.586 9.971 14.371 1.00 0.00 N ATOM 1649 CA GLN B 108 -0.406 9.098 15.542 1.00 0.00 C ATOM 1650 C GLN B 108 0.888 8.269 15.473 1.00 0.00 C ATOM 1651 O GLN B 108 1.726 8.311 16.376 1.00 0.00 O ATOM 1652 CB GLN B 108 -1.595 8.123 15.613 1.00 0.00 C ATOM 1653 CG GLN B 108 -2.913 8.776 16.059 1.00 0.00 C ATOM 1654 CD GLN B 108 -4.046 7.751 16.125 1.00 0.00 C ATOM 1655 OE1 GLN B 108 -4.525 7.373 17.188 1.00 0.00 O ATOM 1656 NE2 GLN B 108 -4.514 7.261 14.996 1.00 0.00 N ATOM 0 H GLN B 108 -1.557 9.991 14.060 1.00 0.00 H new ATOM 0 HA GLN B 108 -0.347 9.739 16.422 1.00 0.00 H new ATOM 0 HB2 GLN B 108 -1.739 7.670 14.632 1.00 0.00 H new ATOM 0 HB3 GLN B 108 -1.349 7.316 16.303 1.00 0.00 H new ATOM 0 HG2 GLN B 108 -2.780 9.238 17.037 1.00 0.00 H new ATOM 0 HG3 GLN B 108 -3.180 9.572 15.364 1.00 0.00 H new ATOM 0 HE21 GLN B 108 -4.123 7.568 14.106 1.00 0.00 H new ATOM 0 HE22 GLN B 108 -5.268 6.574 15.012 1.00 0.00 H new ATOM 1665 N SER B 109 1.017 7.499 14.394 1.00 0.00 N ATOM 1666 CA SER B 109 2.126 6.596 14.094 1.00 0.00 C ATOM 1667 C SER B 109 3.266 7.304 13.352 1.00 0.00 C ATOM 1668 O SER B 109 4.434 7.077 13.675 1.00 0.00 O ATOM 1669 CB SER B 109 1.595 5.431 13.260 1.00 0.00 C ATOM 1670 OG SER B 109 0.612 4.694 13.973 1.00 0.00 O ATOM 0 H SER B 109 0.307 7.489 13.662 1.00 0.00 H new ATOM 0 HA SER B 109 2.540 6.234 15.035 1.00 0.00 H new ATOM 0 HB2 SER B 109 1.167 5.810 12.332 1.00 0.00 H new ATOM 0 HB3 SER B 109 2.419 4.772 12.985 1.00 0.00 H new ATOM 0 HG SER B 109 0.288 3.956 13.415 1.00 0.00 H new ATOM 1676 N MET B 110 2.948 8.180 12.386 1.00 0.00 N ATOM 1677 CA MET B 110 3.932 8.951 11.602 1.00 0.00 C ATOM 1678 C MET B 110 4.939 9.693 12.496 1.00 0.00 C ATOM 1679 O MET B 110 6.135 9.717 12.211 1.00 0.00 O ATOM 1680 CB MET B 110 3.230 9.948 10.664 1.00 0.00 C ATOM 1681 CG MET B 110 2.366 9.291 9.579 1.00 0.00 C ATOM 1682 SD MET B 110 3.210 8.224 8.383 1.00 0.00 S ATOM 1683 CE MET B 110 4.236 9.422 7.503 1.00 0.00 C ATOM 0 H MET B 110 1.983 8.378 12.121 1.00 0.00 H new ATOM 0 HA MET B 110 4.488 8.229 11.004 1.00 0.00 H new ATOM 0 HB2 MET B 110 2.603 10.610 11.260 1.00 0.00 H new ATOM 0 HB3 MET B 110 3.985 10.571 10.184 1.00 0.00 H new ATOM 0 HG2 MET B 110 1.594 8.701 10.073 1.00 0.00 H new ATOM 0 HG3 MET B 110 1.858 10.082 9.027 1.00 0.00 H new ATOM 0 HE1 MET B 110 4.760 8.923 6.688 1.00 0.00 H new ATOM 0 HE2 MET B 110 3.605 10.213 7.098 1.00 0.00 H new ATOM 0 HE3 MET B 110 4.962 9.854 8.191 1.00 0.00 H new ATOM 1693 N ASP B 111 4.459 10.286 13.590 1.00 0.00 N ATOM 1694 CA ASP B 111 5.238 11.018 14.597 1.00 0.00 C ATOM 1695 C ASP B 111 6.401 10.212 15.218 1.00 0.00 C ATOM 1696 O ASP B 111 7.437 10.785 15.560 1.00 0.00 O ATOM 1697 CB ASP B 111 4.266 11.472 15.695 1.00 0.00 C ATOM 1698 CG ASP B 111 4.962 12.288 16.798 1.00 0.00 C ATOM 1699 OD1 ASP B 111 5.322 13.464 16.544 1.00 0.00 O ATOM 1700 OD2 ASP B 111 5.124 11.771 17.929 1.00 0.00 O ATOM 0 H ASP B 111 3.464 10.269 13.812 1.00 0.00 H new ATOM 0 HA ASP B 111 5.716 11.860 14.096 1.00 0.00 H new ATOM 0 HB2 ASP B 111 3.474 12.073 15.248 1.00 0.00 H new ATOM 0 HB3 ASP B 111 3.791 10.597 16.140 1.00 0.00 H new ATOM 1705 N GLU B 112 6.240 8.895 15.387 1.00 0.00 N ATOM 1706 CA GLU B 112 7.223 8.004 16.023 1.00 0.00 C ATOM 1707 C GLU B 112 8.587 7.944 15.313 1.00 0.00 C ATOM 1708 O GLU B 112 9.628 8.025 15.973 1.00 0.00 O ATOM 1709 CB GLU B 112 6.655 6.583 16.190 1.00 0.00 C ATOM 1710 CG GLU B 112 5.389 6.547 17.058 1.00 0.00 C ATOM 1711 CD GLU B 112 4.973 5.097 17.373 1.00 0.00 C ATOM 1712 OE1 GLU B 112 5.496 4.518 18.357 1.00 0.00 O ATOM 1713 OE2 GLU B 112 4.116 4.530 16.652 1.00 0.00 O ATOM 0 H GLU B 112 5.401 8.404 15.078 1.00 0.00 H new ATOM 0 HA GLU B 112 7.411 8.448 17.001 1.00 0.00 H new ATOM 0 HB2 GLU B 112 6.428 6.169 15.207 1.00 0.00 H new ATOM 0 HB3 GLU B 112 7.415 5.943 16.638 1.00 0.00 H new ATOM 0 HG2 GLU B 112 5.566 7.088 17.988 1.00 0.00 H new ATOM 0 HG3 GLU B 112 4.576 7.058 16.542 1.00 0.00 H new ATOM 1720 N SER B 113 8.598 7.755 13.989 1.00 0.00 N ATOM 1721 CA SER B 113 9.828 7.588 13.188 1.00 0.00 C ATOM 1722 C SER B 113 9.803 8.161 11.759 1.00 0.00 C ATOM 1723 O SER B 113 10.806 8.062 11.043 1.00 0.00 O ATOM 1724 CB SER B 113 10.181 6.093 13.132 1.00 0.00 C ATOM 1725 OG SER B 113 9.172 5.351 12.461 1.00 0.00 O ATOM 0 H SER B 113 7.745 7.712 13.431 1.00 0.00 H new ATOM 0 HA SER B 113 10.583 8.182 13.703 1.00 0.00 H new ATOM 0 HB2 SER B 113 11.134 5.961 12.620 1.00 0.00 H new ATOM 0 HB3 SER B 113 10.307 5.708 14.144 1.00 0.00 H new ATOM 0 HG SER B 113 9.423 4.404 12.438 1.00 0.00 H new ATOM 1731 N GLY B 114 8.696 8.765 11.310 1.00 0.00 N ATOM 1732 CA GLY B 114 8.536 9.315 9.960 1.00 0.00 C ATOM 1733 C GLY B 114 8.191 8.209 8.960 1.00 0.00 C ATOM 1734 O GLY B 114 7.039 8.071 8.551 1.00 0.00 O ATOM 0 H GLY B 114 7.866 8.887 11.891 1.00 0.00 H new ATOM 0 HA2 GLY B 114 7.749 10.069 9.961 1.00 0.00 H new ATOM 0 HA3 GLY B 114 9.456 9.814 9.654 1.00 0.00 H new ATOM 1738 N LEU B 115 9.191 7.400 8.602 1.00 0.00 N ATOM 1739 CA LEU B 115 9.096 6.228 7.726 1.00 0.00 C ATOM 1740 C LEU B 115 10.046 5.115 8.220 1.00 0.00 C ATOM 1741 O LEU B 115 11.239 5.380 8.408 1.00 0.00 O ATOM 1742 CB LEU B 115 9.454 6.595 6.274 1.00 0.00 C ATOM 1743 CG LEU B 115 8.357 7.322 5.480 1.00 0.00 C ATOM 1744 CD1 LEU B 115 8.891 7.609 4.078 1.00 0.00 C ATOM 1745 CD2 LEU B 115 7.096 6.471 5.319 1.00 0.00 C ATOM 0 H LEU B 115 10.143 7.553 8.934 1.00 0.00 H new ATOM 0 HA LEU B 115 8.067 5.870 7.755 1.00 0.00 H new ATOM 0 HB2 LEU B 115 10.345 7.223 6.287 1.00 0.00 H new ATOM 0 HB3 LEU B 115 9.717 5.681 5.742 1.00 0.00 H new ATOM 0 HG LEU B 115 8.099 8.229 6.026 1.00 0.00 H new ATOM 0 HD11 LEU B 115 8.127 8.125 3.496 1.00 0.00 H new ATOM 0 HD12 LEU B 115 9.780 8.236 4.148 1.00 0.00 H new ATOM 0 HD13 LEU B 115 9.148 6.670 3.587 1.00 0.00 H new ATOM 0 HD21 LEU B 115 6.351 7.028 4.751 1.00 0.00 H new ATOM 0 HD22 LEU B 115 7.343 5.551 4.789 1.00 0.00 H new ATOM 0 HD23 LEU B 115 6.694 6.226 6.302 1.00 0.00 H new ATOM 1757 N PRO B 116 9.557 3.876 8.422 1.00 0.00 N ATOM 1758 CA PRO B 116 10.370 2.748 8.870 1.00 0.00 C ATOM 1759 C PRO B 116 11.129 2.080 7.707 1.00 0.00 C ATOM 1760 O PRO B 116 10.995 2.463 6.540 1.00 0.00 O ATOM 1761 CB PRO B 116 9.339 1.791 9.481 1.00 0.00 C ATOM 1762 CG PRO B 116 8.147 1.948 8.537 1.00 0.00 C ATOM 1763 CD PRO B 116 8.175 3.445 8.238 1.00 0.00 C ATOM 0 HA PRO B 116 11.148 3.050 9.571 1.00 0.00 H new ATOM 0 HB2 PRO B 116 9.704 0.764 9.508 1.00 0.00 H new ATOM 0 HB3 PRO B 116 9.086 2.066 10.505 1.00 0.00 H new ATOM 0 HG2 PRO B 116 8.260 1.349 7.633 1.00 0.00 H new ATOM 0 HG3 PRO B 116 7.212 1.643 9.006 1.00 0.00 H new ATOM 0 HD2 PRO B 116 7.838 3.644 7.221 1.00 0.00 H new ATOM 0 HD3 PRO B 116 7.507 3.987 8.907 1.00 0.00 H new ATOM 1771 N GLN B 117 11.883 1.027 8.031 1.00 0.00 N ATOM 1772 CA GLN B 117 12.602 0.151 7.097 1.00 0.00 C ATOM 1773 C GLN B 117 12.227 -1.304 7.421 1.00 0.00 C ATOM 1774 O GLN B 117 13.054 -2.117 7.842 1.00 0.00 O ATOM 1775 CB GLN B 117 14.119 0.419 7.141 1.00 0.00 C ATOM 1776 CG GLN B 117 14.481 1.738 6.446 1.00 0.00 C ATOM 1777 CD GLN B 117 15.981 2.019 6.501 1.00 0.00 C ATOM 1778 OE1 GLN B 117 16.484 2.698 7.389 1.00 0.00 O ATOM 1779 NE2 GLN B 117 16.758 1.519 5.562 1.00 0.00 N ATOM 0 H GLN B 117 12.017 0.746 9.002 1.00 0.00 H new ATOM 0 HA GLN B 117 12.307 0.358 6.068 1.00 0.00 H new ATOM 0 HB2 GLN B 117 14.453 0.450 8.178 1.00 0.00 H new ATOM 0 HB3 GLN B 117 14.648 -0.403 6.660 1.00 0.00 H new ATOM 0 HG2 GLN B 117 14.157 1.701 5.406 1.00 0.00 H new ATOM 0 HG3 GLN B 117 13.941 2.558 6.919 1.00 0.00 H new ATOM 0 HE21 GLN B 117 16.356 0.952 4.816 1.00 0.00 H new ATOM 0 HE22 GLN B 117 17.762 1.699 5.581 1.00 0.00 H new ATOM 1788 N LEU B 118 10.942 -1.614 7.226 1.00 0.00 N ATOM 1789 CA LEU B 118 10.341 -2.930 7.448 1.00 0.00 C ATOM 1790 C LEU B 118 10.930 -3.938 6.451 1.00 0.00 C ATOM 1791 O LEU B 118 10.643 -3.880 5.254 1.00 0.00 O ATOM 1792 CB LEU B 118 8.814 -2.829 7.273 1.00 0.00 C ATOM 1793 CG LEU B 118 8.076 -2.007 8.342 1.00 0.00 C ATOM 1794 CD1 LEU B 118 6.671 -1.671 7.845 1.00 0.00 C ATOM 1795 CD2 LEU B 118 7.956 -2.781 9.655 1.00 0.00 C ATOM 0 H LEU B 118 10.265 -0.926 6.896 1.00 0.00 H new ATOM 0 HA LEU B 118 10.559 -3.271 8.460 1.00 0.00 H new ATOM 0 HB2 LEU B 118 8.606 -2.392 6.296 1.00 0.00 H new ATOM 0 HB3 LEU B 118 8.400 -3.837 7.265 1.00 0.00 H new ATOM 0 HG LEU B 118 8.650 -1.098 8.521 1.00 0.00 H new ATOM 0 HD11 LEU B 118 6.147 -1.088 8.602 1.00 0.00 H new ATOM 0 HD12 LEU B 118 6.740 -1.092 6.924 1.00 0.00 H new ATOM 0 HD13 LEU B 118 6.123 -2.593 7.653 1.00 0.00 H new ATOM 0 HD21 LEU B 118 7.429 -2.172 10.390 1.00 0.00 H new ATOM 0 HD22 LEU B 118 7.401 -3.704 9.484 1.00 0.00 H new ATOM 0 HD23 LEU B 118 8.952 -3.020 10.029 1.00 0.00 H new ATOM 1807 N THR B 119 11.761 -4.861 6.925 1.00 0.00 N ATOM 1808 CA THR B 119 12.382 -5.882 6.079 1.00 0.00 C ATOM 1809 C THR B 119 11.363 -6.941 5.649 1.00 0.00 C ATOM 1810 O THR B 119 10.237 -7.001 6.159 1.00 0.00 O ATOM 1811 CB THR B 119 13.571 -6.554 6.793 1.00 0.00 C ATOM 1812 OG1 THR B 119 13.149 -7.299 7.913 1.00 0.00 O ATOM 1813 CG2 THR B 119 14.626 -5.536 7.238 1.00 0.00 C ATOM 0 H THR B 119 12.025 -4.925 7.908 1.00 0.00 H new ATOM 0 HA THR B 119 12.755 -5.378 5.188 1.00 0.00 H new ATOM 0 HB THR B 119 14.020 -7.226 6.062 1.00 0.00 H new ATOM 0 HG1 THR B 119 13.022 -6.698 8.677 1.00 0.00 H new ATOM 0 HG21 THR B 119 15.445 -6.055 7.736 1.00 0.00 H new ATOM 0 HG22 THR B 119 15.010 -5.005 6.367 1.00 0.00 H new ATOM 0 HG23 THR B 119 14.175 -4.823 7.928 1.00 0.00 H new ATOM 1821 N SER B 120 11.773 -7.810 4.724 1.00 0.00 N ATOM 1822 CA SER B 120 10.979 -8.952 4.242 1.00 0.00 C ATOM 1823 C SER B 120 10.477 -9.772 5.437 1.00 0.00 C ATOM 1824 O SER B 120 9.275 -10.003 5.584 1.00 0.00 O ATOM 1825 CB SER B 120 11.820 -9.845 3.322 1.00 0.00 C ATOM 1826 OG SER B 120 12.407 -9.085 2.279 1.00 0.00 O ATOM 0 H SER B 120 12.687 -7.742 4.276 1.00 0.00 H new ATOM 0 HA SER B 120 10.129 -8.571 3.676 1.00 0.00 H new ATOM 0 HB2 SER B 120 12.600 -10.339 3.901 1.00 0.00 H new ATOM 0 HB3 SER B 120 11.193 -10.630 2.898 1.00 0.00 H new ATOM 0 HG SER B 120 12.940 -9.674 1.705 1.00 0.00 H new ATOM 1832 N TYR B 121 11.414 -10.137 6.321 1.00 0.00 N ATOM 1833 CA TYR B 121 11.190 -10.853 7.574 1.00 0.00 C ATOM 1834 C TYR B 121 10.131 -10.157 8.440 1.00 0.00 C ATOM 1835 O TYR B 121 9.126 -10.782 8.766 1.00 0.00 O ATOM 1836 CB TYR B 121 12.526 -11.000 8.315 1.00 0.00 C ATOM 1837 CG TYR B 121 12.429 -11.747 9.632 1.00 0.00 C ATOM 1838 CD1 TYR B 121 12.540 -13.151 9.653 1.00 0.00 C ATOM 1839 CD2 TYR B 121 12.225 -11.040 10.834 1.00 0.00 C ATOM 1840 CE1 TYR B 121 12.454 -13.848 10.874 1.00 0.00 C ATOM 1841 CE2 TYR B 121 12.126 -11.733 12.056 1.00 0.00 C ATOM 1842 CZ TYR B 121 12.248 -13.142 12.080 1.00 0.00 C ATOM 1843 OH TYR B 121 12.158 -13.825 13.255 1.00 0.00 O ATOM 0 H TYR B 121 12.401 -9.927 6.169 1.00 0.00 H new ATOM 0 HA TYR B 121 10.799 -11.846 7.353 1.00 0.00 H new ATOM 0 HB2 TYR B 121 13.232 -11.519 7.667 1.00 0.00 H new ATOM 0 HB3 TYR B 121 12.935 -10.007 8.503 1.00 0.00 H new ATOM 0 HD1 TYR B 121 12.691 -13.694 8.732 1.00 0.00 H new ATOM 0 HD2 TYR B 121 12.144 -9.963 10.818 1.00 0.00 H new ATOM 0 HE1 TYR B 121 12.546 -14.924 10.888 1.00 0.00 H new ATOM 0 HE2 TYR B 121 11.957 -11.189 12.974 1.00 0.00 H new ATOM 0 HH TYR B 121 12.017 -13.193 13.991 1.00 0.00 H new ATOM 1853 N ASP B 122 10.326 -8.878 8.793 1.00 0.00 N ATOM 1854 CA ASP B 122 9.383 -8.095 9.612 1.00 0.00 C ATOM 1855 C ASP B 122 7.944 -8.200 9.085 1.00 0.00 C ATOM 1856 O ASP B 122 7.031 -8.570 9.829 1.00 0.00 O ATOM 1857 CB ASP B 122 9.785 -6.611 9.690 1.00 0.00 C ATOM 1858 CG ASP B 122 11.134 -6.369 10.373 1.00 0.00 C ATOM 1859 OD1 ASP B 122 11.305 -6.786 11.542 1.00 0.00 O ATOM 1860 OD2 ASP B 122 12.010 -5.727 9.745 1.00 0.00 O ATOM 0 H ASP B 122 11.153 -8.350 8.515 1.00 0.00 H new ATOM 0 HA ASP B 122 9.425 -8.525 10.613 1.00 0.00 H new ATOM 0 HB2 ASP B 122 9.821 -6.201 8.681 1.00 0.00 H new ATOM 0 HB3 ASP B 122 9.012 -6.063 10.229 1.00 0.00 H new ATOM 1865 N CYS B 123 7.753 -7.888 7.800 1.00 0.00 N ATOM 1866 CA CYS B 123 6.467 -7.925 7.108 1.00 0.00 C ATOM 1867 C CYS B 123 5.823 -9.323 7.142 1.00 0.00 C ATOM 1868 O CYS B 123 4.700 -9.472 7.624 1.00 0.00 O ATOM 1869 CB CYS B 123 6.644 -7.424 5.670 1.00 0.00 C ATOM 1870 SG CYS B 123 7.261 -5.722 5.628 1.00 0.00 S ATOM 0 H CYS B 123 8.518 -7.593 7.194 1.00 0.00 H new ATOM 0 HA CYS B 123 5.779 -7.263 7.635 1.00 0.00 H new ATOM 0 HB2 CYS B 123 7.338 -8.076 5.140 1.00 0.00 H new ATOM 0 HB3 CYS B 123 5.690 -7.479 5.145 1.00 0.00 H new ATOM 0 HG CYS B 123 8.547 -5.722 5.817 1.00 0.00 H new ATOM 1876 N GLU B 124 6.524 -10.345 6.643 1.00 0.00 N ATOM 1877 CA GLU B 124 6.066 -11.743 6.597 1.00 0.00 C ATOM 1878 C GLU B 124 5.675 -12.293 7.980 1.00 0.00 C ATOM 1879 O GLU B 124 4.645 -12.955 8.121 1.00 0.00 O ATOM 1880 CB GLU B 124 7.144 -12.627 5.946 1.00 0.00 C ATOM 1881 CG GLU B 124 7.269 -12.363 4.438 1.00 0.00 C ATOM 1882 CD GLU B 124 8.408 -13.178 3.803 1.00 0.00 C ATOM 1883 OE1 GLU B 124 9.602 -12.903 4.063 1.00 0.00 O ATOM 1884 OE2 GLU B 124 8.122 -14.075 2.974 1.00 0.00 O ATOM 0 H GLU B 124 7.456 -10.222 6.247 1.00 0.00 H new ATOM 0 HA GLU B 124 5.160 -11.764 5.991 1.00 0.00 H new ATOM 0 HB2 GLU B 124 8.104 -12.442 6.428 1.00 0.00 H new ATOM 0 HB3 GLU B 124 6.901 -13.677 6.112 1.00 0.00 H new ATOM 0 HG2 GLU B 124 6.328 -12.612 3.947 1.00 0.00 H new ATOM 0 HG3 GLU B 124 7.446 -11.301 4.269 1.00 0.00 H new ATOM 1891 N VAL B 125 6.490 -12.023 9.005 1.00 0.00 N ATOM 1892 CA VAL B 125 6.290 -12.439 10.403 1.00 0.00 C ATOM 1893 C VAL B 125 5.048 -11.798 11.032 1.00 0.00 C ATOM 1894 O VAL B 125 4.206 -12.495 11.598 1.00 0.00 O ATOM 1895 CB VAL B 125 7.559 -12.115 11.224 1.00 0.00 C ATOM 1896 CG1 VAL B 125 7.359 -12.087 12.745 1.00 0.00 C ATOM 1897 CG2 VAL B 125 8.649 -13.143 10.901 1.00 0.00 C ATOM 0 H VAL B 125 7.347 -11.484 8.880 1.00 0.00 H new ATOM 0 HA VAL B 125 6.117 -13.515 10.413 1.00 0.00 H new ATOM 0 HB VAL B 125 7.841 -11.104 10.931 1.00 0.00 H new ATOM 0 HG11 VAL B 125 8.305 -11.851 13.232 1.00 0.00 H new ATOM 0 HG12 VAL B 125 6.620 -11.328 13.001 1.00 0.00 H new ATOM 0 HG13 VAL B 125 7.009 -13.062 13.084 1.00 0.00 H new ATOM 0 HG21 VAL B 125 9.545 -12.917 11.479 1.00 0.00 H new ATOM 0 HG22 VAL B 125 8.295 -14.142 11.157 1.00 0.00 H new ATOM 0 HG23 VAL B 125 8.883 -13.103 9.837 1.00 0.00 H new ATOM 1907 N ASN B 126 4.955 -10.467 10.988 1.00 0.00 N ATOM 1908 CA ASN B 126 3.888 -9.696 11.633 1.00 0.00 C ATOM 1909 C ASN B 126 2.546 -9.726 10.879 1.00 0.00 C ATOM 1910 O ASN B 126 1.494 -9.701 11.522 1.00 0.00 O ATOM 1911 CB ASN B 126 4.388 -8.264 11.868 1.00 0.00 C ATOM 1912 CG ASN B 126 5.441 -8.192 12.957 1.00 0.00 C ATOM 1913 OD1 ASN B 126 5.148 -7.948 14.114 1.00 0.00 O ATOM 1914 ND2 ASN B 126 6.693 -8.438 12.652 1.00 0.00 N ATOM 0 H ASN B 126 5.631 -9.884 10.494 1.00 0.00 H new ATOM 0 HA ASN B 126 3.664 -10.172 12.588 1.00 0.00 H new ATOM 0 HB2 ASN B 126 4.801 -7.869 10.940 1.00 0.00 H new ATOM 0 HB3 ASN B 126 3.545 -7.627 12.138 1.00 0.00 H new ATOM 0 HD21 ASN B 126 7.408 -8.424 13.380 1.00 0.00 H new ATOM 0 HD22 ASN B 126 6.952 -8.644 11.687 1.00 0.00 H new ATOM 1921 N ALA B 127 2.561 -9.780 9.543 1.00 0.00 N ATOM 1922 CA ALA B 127 1.366 -9.819 8.696 1.00 0.00 C ATOM 1923 C ALA B 127 1.457 -10.900 7.585 1.00 0.00 C ATOM 1924 O ALA B 127 1.642 -10.557 6.408 1.00 0.00 O ATOM 1925 CB ALA B 127 1.119 -8.401 8.157 1.00 0.00 C ATOM 0 H ALA B 127 3.429 -9.798 9.007 1.00 0.00 H new ATOM 0 HA ALA B 127 0.503 -10.125 9.287 1.00 0.00 H new ATOM 0 HB1 ALA B 127 0.233 -8.402 7.522 1.00 0.00 H new ATOM 0 HB2 ALA B 127 0.967 -7.716 8.991 1.00 0.00 H new ATOM 0 HB3 ALA B 127 1.982 -8.078 7.575 1.00 0.00 H new ATOM 1931 N PRO B 128 1.297 -12.200 7.934 1.00 0.00 N ATOM 1932 CA PRO B 128 1.290 -13.323 6.984 1.00 0.00 C ATOM 1933 C PRO B 128 0.198 -13.191 5.905 1.00 0.00 C ATOM 1934 O PRO B 128 -0.753 -12.426 6.067 1.00 0.00 O ATOM 1935 CB PRO B 128 1.057 -14.589 7.820 1.00 0.00 C ATOM 1936 CG PRO B 128 1.459 -14.185 9.236 1.00 0.00 C ATOM 1937 CD PRO B 128 1.090 -12.706 9.286 1.00 0.00 C ATOM 0 HA PRO B 128 2.236 -13.350 6.442 1.00 0.00 H new ATOM 0 HB2 PRO B 128 0.015 -14.907 7.778 1.00 0.00 H new ATOM 0 HB3 PRO B 128 1.660 -15.422 7.458 1.00 0.00 H new ATOM 0 HG2 PRO B 128 0.921 -14.761 9.989 1.00 0.00 H new ATOM 0 HG3 PRO B 128 2.523 -14.342 9.414 1.00 0.00 H new ATOM 0 HD2 PRO B 128 0.055 -12.571 9.600 1.00 0.00 H new ATOM 0 HD3 PRO B 128 1.713 -12.171 10.003 1.00 0.00 H new ATOM 1945 N ILE B 129 0.308 -13.947 4.810 1.00 0.00 N ATOM 1946 CA ILE B 129 -0.622 -13.904 3.662 1.00 0.00 C ATOM 1947 C ILE B 129 -1.416 -15.215 3.554 1.00 0.00 C ATOM 1948 O ILE B 129 -0.849 -16.304 3.675 1.00 0.00 O ATOM 1949 CB ILE B 129 0.160 -13.618 2.359 1.00 0.00 C ATOM 1950 CG1 ILE B 129 1.036 -12.344 2.448 1.00 0.00 C ATOM 1951 CG2 ILE B 129 -0.807 -13.462 1.168 1.00 0.00 C ATOM 1952 CD1 ILE B 129 2.255 -12.444 1.530 1.00 0.00 C ATOM 0 H ILE B 129 1.061 -14.624 4.687 1.00 0.00 H new ATOM 0 HA ILE B 129 -1.337 -13.097 3.820 1.00 0.00 H new ATOM 0 HB ILE B 129 0.818 -14.475 2.211 1.00 0.00 H new ATOM 0 HG12 ILE B 129 0.442 -11.472 2.174 1.00 0.00 H new ATOM 0 HG13 ILE B 129 1.364 -12.196 3.477 1.00 0.00 H new ATOM 0 HG21 ILE B 129 -0.237 -13.261 0.261 1.00 0.00 H new ATOM 0 HG22 ILE B 129 -1.379 -14.381 1.041 1.00 0.00 H new ATOM 0 HG23 ILE B 129 -1.489 -12.633 1.359 1.00 0.00 H new ATOM 0 HD11 ILE B 129 2.850 -11.535 1.615 1.00 0.00 H new ATOM 0 HD12 ILE B 129 2.860 -13.302 1.821 1.00 0.00 H new ATOM 0 HD13 ILE B 129 1.925 -12.566 0.499 1.00 0.00 H new ATOM 1964 N GLN B 130 -2.731 -15.121 3.321 1.00 0.00 N ATOM 1965 CA GLN B 130 -3.620 -16.282 3.176 1.00 0.00 C ATOM 1966 C GLN B 130 -3.419 -16.982 1.816 1.00 0.00 C ATOM 1967 O GLN B 130 -3.907 -16.503 0.791 1.00 0.00 O ATOM 1968 CB GLN B 130 -5.100 -15.874 3.349 1.00 0.00 C ATOM 1969 CG GLN B 130 -5.396 -15.104 4.644 1.00 0.00 C ATOM 1970 CD GLN B 130 -6.865 -15.221 5.055 1.00 0.00 C ATOM 1971 OE1 GLN B 130 -7.723 -14.427 4.691 1.00 0.00 O ATOM 1972 NE2 GLN B 130 -7.223 -16.228 5.827 1.00 0.00 N ATOM 0 H GLN B 130 -3.214 -14.227 3.227 1.00 0.00 H new ATOM 0 HA GLN B 130 -3.358 -16.988 3.964 1.00 0.00 H new ATOM 0 HB2 GLN B 130 -5.397 -15.260 2.499 1.00 0.00 H new ATOM 0 HB3 GLN B 130 -5.717 -16.772 3.325 1.00 0.00 H new ATOM 0 HG2 GLN B 130 -4.763 -15.485 5.446 1.00 0.00 H new ATOM 0 HG3 GLN B 130 -5.140 -14.053 4.508 1.00 0.00 H new ATOM 0 HE21 GLN B 130 -6.525 -16.902 6.142 1.00 0.00 H new ATOM 0 HE22 GLN B 130 -8.198 -16.333 6.109 1.00 0.00 H new ATOM 1981 N GLY B 131 -2.716 -18.118 1.788 1.00 0.00 N ATOM 1982 CA GLY B 131 -2.499 -18.924 0.576 1.00 0.00 C ATOM 1983 C GLY B 131 -1.101 -18.831 -0.054 1.00 0.00 C ATOM 1984 O GLY B 131 -0.087 -18.689 0.634 1.00 0.00 O ATOM 0 H GLY B 131 -2.273 -18.512 2.618 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -2.698 -19.968 0.818 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -3.233 -18.624 -0.172 1.00 0.00 H new ATOM 1988 N SER B 132 -1.059 -18.978 -1.381 1.00 0.00 N ATOM 1989 CA SER B 132 0.140 -19.040 -2.234 1.00 0.00 C ATOM 1990 C SER B 132 0.960 -17.747 -2.362 1.00 0.00 C ATOM 1991 O SER B 132 2.192 -17.808 -2.283 1.00 0.00 O ATOM 1992 CB SER B 132 -0.258 -19.536 -3.630 1.00 0.00 C ATOM 1993 OG SER B 132 -1.281 -18.722 -4.187 1.00 0.00 O ATOM 0 H SER B 132 -1.916 -19.063 -1.928 1.00 0.00 H new ATOM 0 HA SER B 132 0.808 -19.733 -1.722 1.00 0.00 H new ATOM 0 HB2 SER B 132 0.614 -19.529 -4.284 1.00 0.00 H new ATOM 0 HB3 SER B 132 -0.603 -20.568 -3.569 1.00 0.00 H new ATOM 0 HG SER B 132 -1.517 -19.057 -5.077 1.00 0.00 H new ATOM 1999 N ARG B 133 0.322 -16.590 -2.612 1.00 0.00 N ATOM 2000 CA ARG B 133 0.999 -15.294 -2.828 1.00 0.00 C ATOM 2001 C ARG B 133 1.943 -14.915 -1.680 1.00 0.00 C ATOM 2002 O ARG B 133 1.671 -15.176 -0.509 1.00 0.00 O ATOM 2003 CB ARG B 133 -0.002 -14.151 -3.090 1.00 0.00 C ATOM 2004 CG ARG B 133 -0.834 -14.350 -4.368 1.00 0.00 C ATOM 2005 CD ARG B 133 -1.379 -13.010 -4.885 1.00 0.00 C ATOM 2006 NE ARG B 133 -2.312 -13.202 -6.012 1.00 0.00 N ATOM 2007 CZ ARG B 133 -3.634 -13.221 -5.983 1.00 0.00 C ATOM 2008 NH1 ARG B 133 -4.318 -13.035 -4.891 1.00 0.00 N ATOM 2009 NH2 ARG B 133 -4.308 -13.419 -7.078 1.00 0.00 N ATOM 0 H ARG B 133 -0.694 -16.526 -2.671 1.00 0.00 H new ATOM 0 HA ARG B 133 1.606 -15.432 -3.723 1.00 0.00 H new ATOM 0 HB2 ARG B 133 -0.675 -14.064 -2.237 1.00 0.00 H new ATOM 0 HB3 ARG B 133 0.543 -13.210 -3.163 1.00 0.00 H new ATOM 0 HG2 ARG B 133 -0.219 -14.818 -5.137 1.00 0.00 H new ATOM 0 HG3 ARG B 133 -1.662 -15.029 -4.165 1.00 0.00 H new ATOM 0 HD2 ARG B 133 -1.888 -12.487 -4.075 1.00 0.00 H new ATOM 0 HD3 ARG B 133 -0.550 -12.377 -5.202 1.00 0.00 H new ATOM 0 HE ARG B 133 -1.884 -13.337 -6.928 1.00 0.00 H new ATOM 0 HH11 ARG B 133 -3.835 -12.866 -4.009 1.00 0.00 H new ATOM 0 HH12 ARG B 133 -5.337 -13.059 -4.917 1.00 0.00 H new ATOM 0 HH21 ARG B 133 -3.817 -13.560 -7.961 1.00 0.00 H new ATOM 0 HH22 ARG B 133 -5.328 -13.433 -7.054 1.00 0.00 H new ATOM 2023 N ASN B 134 3.048 -14.270 -2.051 1.00 0.00 N ATOM 2024 CA ASN B 134 4.102 -13.783 -1.154 1.00 0.00 C ATOM 2025 C ASN B 134 4.477 -12.331 -1.485 1.00 0.00 C ATOM 2026 O ASN B 134 4.157 -11.427 -0.716 1.00 0.00 O ATOM 2027 CB ASN B 134 5.263 -14.782 -1.146 1.00 0.00 C ATOM 2028 CG ASN B 134 6.334 -14.405 -0.138 1.00 0.00 C ATOM 2029 OD1 ASN B 134 7.375 -13.861 -0.475 1.00 0.00 O ATOM 2030 ND2 ASN B 134 6.109 -14.685 1.124 1.00 0.00 N ATOM 0 H ASN B 134 3.245 -14.062 -3.030 1.00 0.00 H new ATOM 0 HA ASN B 134 3.746 -13.735 -0.125 1.00 0.00 H new ATOM 0 HB2 ASN B 134 4.883 -15.777 -0.915 1.00 0.00 H new ATOM 0 HB3 ASN B 134 5.704 -14.832 -2.141 1.00 0.00 H new ATOM 0 HD21 ASN B 134 6.805 -14.448 1.831 1.00 0.00 H new ATOM 0 HD22 ASN B 134 5.238 -15.139 1.398 1.00 0.00 H new ATOM 2037 N LEU B 135 5.074 -12.086 -2.653 1.00 0.00 N ATOM 2038 CA LEU B 135 5.382 -10.741 -3.154 1.00 0.00 C ATOM 2039 C LEU B 135 4.644 -10.495 -4.485 1.00 0.00 C ATOM 2040 O LEU B 135 5.010 -11.057 -5.520 1.00 0.00 O ATOM 2041 CB LEU B 135 6.901 -10.527 -3.319 1.00 0.00 C ATOM 2042 CG LEU B 135 7.803 -10.509 -2.066 1.00 0.00 C ATOM 2043 CD1 LEU B 135 9.106 -9.806 -2.452 1.00 0.00 C ATOM 2044 CD2 LEU B 135 7.242 -9.776 -0.847 1.00 0.00 C ATOM 0 H LEU B 135 5.363 -12.828 -3.290 1.00 0.00 H new ATOM 0 HA LEU B 135 5.035 -10.017 -2.417 1.00 0.00 H new ATOM 0 HB2 LEU B 135 7.272 -11.311 -3.978 1.00 0.00 H new ATOM 0 HB3 LEU B 135 7.044 -9.580 -3.839 1.00 0.00 H new ATOM 0 HG LEU B 135 7.915 -11.551 -1.766 1.00 0.00 H new ATOM 0 HD11 LEU B 135 9.771 -9.774 -1.589 1.00 0.00 H new ATOM 0 HD12 LEU B 135 9.588 -10.353 -3.262 1.00 0.00 H new ATOM 0 HD13 LEU B 135 8.888 -8.790 -2.780 1.00 0.00 H new ATOM 0 HD21 LEU B 135 7.960 -9.828 -0.029 1.00 0.00 H new ATOM 0 HD22 LEU B 135 7.059 -8.732 -1.103 1.00 0.00 H new ATOM 0 HD23 LEU B 135 6.307 -10.244 -0.540 1.00 0.00 H new ATOM 2056 N LEU B 136 3.606 -9.654 -4.451 1.00 0.00 N ATOM 2057 CA LEU B 136 2.778 -9.223 -5.588 1.00 0.00 C ATOM 2058 C LEU B 136 3.655 -8.441 -6.602 1.00 0.00 C ATOM 2059 O LEU B 136 4.488 -7.636 -6.186 1.00 0.00 O ATOM 2060 CB LEU B 136 1.632 -8.382 -4.977 1.00 0.00 C ATOM 2061 CG LEU B 136 0.325 -8.204 -5.764 1.00 0.00 C ATOM 2062 CD1 LEU B 136 0.519 -7.625 -7.148 1.00 0.00 C ATOM 2063 CD2 LEU B 136 -0.492 -9.481 -5.943 1.00 0.00 C ATOM 0 H LEU B 136 3.300 -9.228 -3.576 1.00 0.00 H new ATOM 0 HA LEU B 136 2.352 -10.052 -6.153 1.00 0.00 H new ATOM 0 HB2 LEU B 136 1.377 -8.827 -4.015 1.00 0.00 H new ATOM 0 HB3 LEU B 136 2.029 -7.388 -4.773 1.00 0.00 H new ATOM 0 HG LEU B 136 -0.219 -7.506 -5.127 1.00 0.00 H new ATOM 0 HD11 LEU B 136 -0.448 -7.529 -7.641 1.00 0.00 H new ATOM 0 HD12 LEU B 136 0.985 -6.643 -7.069 1.00 0.00 H new ATOM 0 HD13 LEU B 136 1.160 -8.285 -7.732 1.00 0.00 H new ATOM 0 HD21 LEU B 136 -1.396 -9.258 -6.510 1.00 0.00 H new ATOM 0 HD22 LEU B 136 0.101 -10.220 -6.482 1.00 0.00 H new ATOM 0 HD23 LEU B 136 -0.765 -9.878 -4.965 1.00 0.00 H new ATOM 2075 N GLN B 137 3.517 -8.678 -7.915 1.00 0.00 N ATOM 2076 CA GLN B 137 4.362 -8.069 -8.967 1.00 0.00 C ATOM 2077 C GLN B 137 3.602 -7.301 -10.068 1.00 0.00 C ATOM 2078 O GLN B 137 2.433 -7.568 -10.349 1.00 0.00 O ATOM 2079 CB GLN B 137 5.190 -9.172 -9.662 1.00 0.00 C ATOM 2080 CG GLN B 137 6.032 -10.078 -8.750 1.00 0.00 C ATOM 2081 CD GLN B 137 7.110 -9.356 -7.946 1.00 0.00 C ATOM 2082 OE1 GLN B 137 7.652 -8.323 -8.323 1.00 0.00 O ATOM 2083 NE2 GLN B 137 7.463 -9.878 -6.792 1.00 0.00 N ATOM 0 H GLN B 137 2.806 -9.307 -8.287 1.00 0.00 H new ATOM 0 HA GLN B 137 4.976 -7.339 -8.440 1.00 0.00 H new ATOM 0 HB2 GLN B 137 4.507 -9.802 -10.232 1.00 0.00 H new ATOM 0 HB3 GLN B 137 5.858 -8.695 -10.379 1.00 0.00 H new ATOM 0 HG2 GLN B 137 5.366 -10.592 -8.057 1.00 0.00 H new ATOM 0 HG3 GLN B 137 6.508 -10.844 -9.362 1.00 0.00 H new ATOM 0 HE21 GLN B 137 7.021 -10.737 -6.464 1.00 0.00 H new ATOM 0 HE22 GLN B 137 8.178 -9.424 -6.224 1.00 0.00 H new ATOM 2092 N GLY B 138 4.321 -6.394 -10.743 1.00 0.00 N ATOM 2093 CA GLY B 138 3.915 -5.601 -11.915 1.00 0.00 C ATOM 2094 C GLY B 138 2.505 -5.011 -11.918 1.00 0.00 C ATOM 2095 O GLY B 138 2.078 -4.401 -10.942 1.00 0.00 O ATOM 0 H GLY B 138 5.278 -6.177 -10.463 1.00 0.00 H new ATOM 0 HA2 GLY B 138 4.623 -4.780 -12.026 1.00 0.00 H new ATOM 0 HA3 GLY B 138 4.017 -6.231 -12.798 1.00 0.00 H new ATOM 2099 N GLU B 139 1.796 -5.129 -13.044 1.00 0.00 N ATOM 2100 CA GLU B 139 0.464 -4.539 -13.268 1.00 0.00 C ATOM 2101 C GLU B 139 -0.568 -4.893 -12.180 1.00 0.00 C ATOM 2102 O GLU B 139 -1.384 -4.054 -11.796 1.00 0.00 O ATOM 2103 CB GLU B 139 -0.044 -4.946 -14.662 1.00 0.00 C ATOM 2104 CG GLU B 139 -1.163 -4.043 -15.202 1.00 0.00 C ATOM 2105 CD GLU B 139 -0.627 -2.669 -15.650 1.00 0.00 C ATOM 2106 OE1 GLU B 139 -0.127 -2.554 -16.797 1.00 0.00 O ATOM 2107 OE2 GLU B 139 -0.709 -1.694 -14.865 1.00 0.00 O ATOM 0 H GLU B 139 2.138 -5.651 -13.850 1.00 0.00 H new ATOM 0 HA GLU B 139 0.580 -3.457 -13.210 1.00 0.00 H new ATOM 0 HB2 GLU B 139 0.792 -4.931 -15.362 1.00 0.00 H new ATOM 0 HB3 GLU B 139 -0.407 -5.973 -14.621 1.00 0.00 H new ATOM 0 HG2 GLU B 139 -1.651 -4.534 -16.044 1.00 0.00 H new ATOM 0 HG3 GLU B 139 -1.921 -3.903 -14.431 1.00 0.00 H new ATOM 2114 N GLU B 140 -0.518 -6.121 -11.645 1.00 0.00 N ATOM 2115 CA GLU B 140 -1.391 -6.572 -10.554 1.00 0.00 C ATOM 2116 C GLU B 140 -1.287 -5.669 -9.315 1.00 0.00 C ATOM 2117 O GLU B 140 -2.278 -5.541 -8.595 1.00 0.00 O ATOM 2118 CB GLU B 140 -1.118 -8.042 -10.183 1.00 0.00 C ATOM 2119 CG GLU B 140 -1.572 -9.045 -11.251 1.00 0.00 C ATOM 2120 CD GLU B 140 -3.093 -9.002 -11.488 1.00 0.00 C ATOM 2121 OE1 GLU B 140 -3.861 -9.395 -10.576 1.00 0.00 O ATOM 2122 OE2 GLU B 140 -3.525 -8.560 -12.579 1.00 0.00 O ATOM 0 H GLU B 140 0.137 -6.836 -11.961 1.00 0.00 H new ATOM 0 HA GLU B 140 -2.414 -6.500 -10.924 1.00 0.00 H new ATOM 0 HB2 GLU B 140 -0.050 -8.170 -10.008 1.00 0.00 H new ATOM 0 HB3 GLU B 140 -1.624 -8.270 -9.245 1.00 0.00 H new ATOM 0 HG2 GLU B 140 -1.055 -8.834 -12.187 1.00 0.00 H new ATOM 0 HG3 GLU B 140 -1.283 -10.051 -10.947 1.00 0.00 H new ATOM 2129 N LEU B 141 -0.135 -5.021 -9.073 1.00 0.00 N ATOM 2130 CA LEU B 141 0.053 -4.060 -7.981 1.00 0.00 C ATOM 2131 C LEU B 141 -0.960 -2.929 -8.146 1.00 0.00 C ATOM 2132 O LEU B 141 -1.843 -2.757 -7.315 1.00 0.00 O ATOM 2133 CB LEU B 141 1.474 -3.454 -7.977 1.00 0.00 C ATOM 2134 CG LEU B 141 2.615 -4.403 -7.587 1.00 0.00 C ATOM 2135 CD1 LEU B 141 3.948 -3.796 -8.013 1.00 0.00 C ATOM 2136 CD2 LEU B 141 2.644 -4.592 -6.071 1.00 0.00 C ATOM 0 H LEU B 141 0.702 -5.154 -9.641 1.00 0.00 H new ATOM 0 HA LEU B 141 -0.089 -4.589 -7.039 1.00 0.00 H new ATOM 0 HB2 LEU B 141 1.681 -3.060 -8.972 1.00 0.00 H new ATOM 0 HB3 LEU B 141 1.483 -2.607 -7.291 1.00 0.00 H new ATOM 0 HG LEU B 141 2.455 -5.362 -8.080 1.00 0.00 H new ATOM 0 HD11 LEU B 141 4.759 -4.469 -7.736 1.00 0.00 H new ATOM 0 HD12 LEU B 141 3.952 -3.648 -9.093 1.00 0.00 H new ATOM 0 HD13 LEU B 141 4.087 -2.837 -7.515 1.00 0.00 H new ATOM 0 HD21 LEU B 141 3.457 -5.267 -5.804 1.00 0.00 H new ATOM 0 HD22 LEU B 141 2.799 -3.628 -5.587 1.00 0.00 H new ATOM 0 HD23 LEU B 141 1.696 -5.016 -5.739 1.00 0.00 H new ATOM 2148 N LEU B 142 -0.835 -2.170 -9.238 1.00 0.00 N ATOM 2149 CA LEU B 142 -1.676 -1.018 -9.560 1.00 0.00 C ATOM 2150 C LEU B 142 -3.167 -1.377 -9.538 1.00 0.00 C ATOM 2151 O LEU B 142 -3.963 -0.633 -8.967 1.00 0.00 O ATOM 2152 CB LEU B 142 -1.236 -0.383 -10.889 1.00 0.00 C ATOM 2153 CG LEU B 142 0.277 -0.113 -11.046 1.00 0.00 C ATOM 2154 CD1 LEU B 142 0.482 0.888 -12.178 1.00 0.00 C ATOM 2155 CD2 LEU B 142 0.957 0.460 -9.799 1.00 0.00 C ATOM 0 H LEU B 142 -0.121 -2.348 -9.945 1.00 0.00 H new ATOM 0 HA LEU B 142 -1.539 -0.267 -8.782 1.00 0.00 H new ATOM 0 HB2 LEU B 142 -1.554 -1.035 -11.703 1.00 0.00 H new ATOM 0 HB3 LEU B 142 -1.767 0.561 -11.011 1.00 0.00 H new ATOM 0 HG LEU B 142 0.732 -1.084 -11.243 1.00 0.00 H new ATOM 0 HD11 LEU B 142 1.547 1.087 -12.299 1.00 0.00 H new ATOM 0 HD12 LEU B 142 0.082 0.476 -13.105 1.00 0.00 H new ATOM 0 HD13 LEU B 142 -0.036 1.817 -11.940 1.00 0.00 H new ATOM 0 HD21 LEU B 142 2.016 0.617 -10.002 1.00 0.00 H new ATOM 0 HD22 LEU B 142 0.493 1.411 -9.536 1.00 0.00 H new ATOM 0 HD23 LEU B 142 0.846 -0.239 -8.970 1.00 0.00 H new ATOM 2167 N ARG B 143 -3.537 -2.536 -10.102 1.00 0.00 N ATOM 2168 CA ARG B 143 -4.905 -3.089 -10.075 1.00 0.00 C ATOM 2169 C ARG B 143 -5.397 -3.266 -8.632 1.00 0.00 C ATOM 2170 O ARG B 143 -6.482 -2.791 -8.289 1.00 0.00 O ATOM 2171 CB ARG B 143 -4.953 -4.415 -10.854 1.00 0.00 C ATOM 2172 CG ARG B 143 -4.773 -4.205 -12.366 1.00 0.00 C ATOM 2173 CD ARG B 143 -4.598 -5.544 -13.086 1.00 0.00 C ATOM 2174 NE ARG B 143 -4.556 -5.370 -14.549 1.00 0.00 N ATOM 2175 CZ ARG B 143 -4.189 -6.270 -15.445 1.00 0.00 C ATOM 2176 NH1 ARG B 143 -3.790 -7.465 -15.121 1.00 0.00 N ATOM 2177 NH2 ARG B 143 -4.220 -5.976 -16.713 1.00 0.00 N ATOM 0 H ARG B 143 -2.878 -3.132 -10.603 1.00 0.00 H new ATOM 0 HA ARG B 143 -5.579 -2.384 -10.562 1.00 0.00 H new ATOM 0 HB2 ARG B 143 -4.172 -5.080 -10.485 1.00 0.00 H new ATOM 0 HB3 ARG B 143 -5.906 -4.910 -10.668 1.00 0.00 H new ATOM 0 HG2 ARG B 143 -5.639 -3.681 -12.770 1.00 0.00 H new ATOM 0 HG3 ARG B 143 -3.904 -3.573 -12.549 1.00 0.00 H new ATOM 0 HD2 ARG B 143 -3.678 -6.022 -12.749 1.00 0.00 H new ATOM 0 HD3 ARG B 143 -5.419 -6.210 -12.821 1.00 0.00 H new ATOM 0 HE ARG B 143 -4.840 -4.459 -14.908 1.00 0.00 H new ATOM 0 HH11 ARG B 143 -3.751 -7.741 -14.140 1.00 0.00 H new ATOM 0 HH12 ARG B 143 -3.516 -8.126 -15.848 1.00 0.00 H new ATOM 0 HH21 ARG B 143 -4.527 -5.051 -17.015 1.00 0.00 H new ATOM 0 HH22 ARG B 143 -3.937 -6.670 -17.405 1.00 0.00 H new ATOM 2191 N ALA B 144 -4.599 -3.916 -7.780 1.00 0.00 N ATOM 2192 CA ALA B 144 -4.885 -4.113 -6.359 1.00 0.00 C ATOM 2193 C ALA B 144 -4.995 -2.772 -5.598 1.00 0.00 C ATOM 2194 O ALA B 144 -5.903 -2.618 -4.783 1.00 0.00 O ATOM 2195 CB ALA B 144 -3.835 -5.051 -5.745 1.00 0.00 C ATOM 0 H ALA B 144 -3.713 -4.330 -8.069 1.00 0.00 H new ATOM 0 HA ALA B 144 -5.862 -4.586 -6.263 1.00 0.00 H new ATOM 0 HB1 ALA B 144 -4.051 -5.196 -4.686 1.00 0.00 H new ATOM 0 HB2 ALA B 144 -3.864 -6.013 -6.256 1.00 0.00 H new ATOM 0 HB3 ALA B 144 -2.844 -4.611 -5.856 1.00 0.00 H new ATOM 2201 N LEU B 145 -4.108 -1.801 -5.854 1.00 0.00 N ATOM 2202 CA LEU B 145 -4.132 -0.464 -5.238 1.00 0.00 C ATOM 2203 C LEU B 145 -5.379 0.348 -5.638 1.00 0.00 C ATOM 2204 O LEU B 145 -5.946 1.070 -4.823 1.00 0.00 O ATOM 2205 CB LEU B 145 -2.881 0.352 -5.623 1.00 0.00 C ATOM 2206 CG LEU B 145 -1.509 -0.203 -5.211 1.00 0.00 C ATOM 2207 CD1 LEU B 145 -0.420 0.793 -5.561 1.00 0.00 C ATOM 2208 CD2 LEU B 145 -1.379 -0.497 -3.729 1.00 0.00 C ATOM 0 H LEU B 145 -3.336 -1.924 -6.509 1.00 0.00 H new ATOM 0 HA LEU B 145 -4.153 -0.636 -4.162 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -2.881 0.474 -6.706 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -2.984 1.347 -5.190 1.00 0.00 H new ATOM 0 HG LEU B 145 -1.407 -1.142 -5.756 1.00 0.00 H new ATOM 0 HD11 LEU B 145 0.549 0.391 -5.265 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -0.425 0.975 -6.636 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -0.601 1.730 -5.034 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -0.382 -0.885 -3.521 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -1.537 0.420 -3.161 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -2.124 -1.237 -3.438 1.00 0.00 H new ATOM 2220 N ASP B 146 -5.779 0.292 -6.910 1.00 0.00 N ATOM 2221 CA ASP B 146 -6.892 1.062 -7.477 1.00 0.00 C ATOM 2222 C ASP B 146 -8.265 0.799 -6.826 1.00 0.00 C ATOM 2223 O ASP B 146 -9.054 1.738 -6.677 1.00 0.00 O ATOM 2224 CB ASP B 146 -6.951 0.833 -8.994 1.00 0.00 C ATOM 2225 CG ASP B 146 -7.981 1.751 -9.671 1.00 0.00 C ATOM 2226 OD1 ASP B 146 -7.863 2.989 -9.514 1.00 0.00 O ATOM 2227 OD2 ASP B 146 -8.897 1.240 -10.358 1.00 0.00 O ATOM 0 H ASP B 146 -5.324 -0.309 -7.597 1.00 0.00 H new ATOM 0 HA ASP B 146 -6.681 2.108 -7.255 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -5.966 1.010 -9.427 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -7.205 -0.208 -9.195 1.00 0.00 H new ATOM 2232 N GLN B 147 -8.562 -0.453 -6.454 1.00 0.00 N ATOM 2233 CA GLN B 147 -9.847 -0.915 -5.890 1.00 0.00 C ATOM 2234 C GLN B 147 -10.365 -0.174 -4.634 1.00 0.00 C ATOM 2235 O GLN B 147 -11.528 -0.341 -4.265 1.00 0.00 O ATOM 2236 CB GLN B 147 -9.805 -2.442 -5.673 1.00 0.00 C ATOM 2237 CG GLN B 147 -9.230 -2.859 -4.310 1.00 0.00 C ATOM 2238 CD GLN B 147 -8.954 -4.358 -4.230 1.00 0.00 C ATOM 2239 OE1 GLN B 147 -9.854 -5.192 -4.243 1.00 0.00 O ATOM 2240 NE2 GLN B 147 -7.706 -4.760 -4.142 1.00 0.00 N ATOM 0 H GLN B 147 -7.884 -1.210 -6.540 1.00 0.00 H new ATOM 0 HA GLN B 147 -10.590 -0.653 -6.644 1.00 0.00 H new ATOM 0 HB2 GLN B 147 -10.815 -2.841 -5.768 1.00 0.00 H new ATOM 0 HB3 GLN B 147 -9.207 -2.896 -6.463 1.00 0.00 H new ATOM 0 HG2 GLN B 147 -8.306 -2.312 -4.126 1.00 0.00 H new ATOM 0 HG3 GLN B 147 -9.929 -2.578 -3.522 1.00 0.00 H new ATOM 0 HE21 GLN B 147 -6.949 -4.076 -4.130 1.00 0.00 H new ATOM 0 HE22 GLN B 147 -7.494 -5.756 -4.085 1.00 0.00 H new ATOM 2249 N VAL B 148 -9.525 0.635 -3.973 1.00 0.00 N ATOM 2250 CA VAL B 148 -9.862 1.442 -2.781 1.00 0.00 C ATOM 2251 C VAL B 148 -11.023 2.415 -3.049 1.00 0.00 C ATOM 2252 O VAL B 148 -11.827 2.679 -2.152 1.00 0.00 O ATOM 2253 CB VAL B 148 -8.631 2.241 -2.297 1.00 0.00 C ATOM 2254 CG1 VAL B 148 -8.904 3.061 -1.028 1.00 0.00 C ATOM 2255 CG2 VAL B 148 -7.438 1.344 -1.960 1.00 0.00 C ATOM 0 H VAL B 148 -8.554 0.753 -4.261 1.00 0.00 H new ATOM 0 HA VAL B 148 -10.175 0.742 -2.007 1.00 0.00 H new ATOM 0 HB VAL B 148 -8.407 2.895 -3.140 1.00 0.00 H new ATOM 0 HG11 VAL B 148 -8.000 3.598 -0.741 1.00 0.00 H new ATOM 0 HG12 VAL B 148 -9.705 3.775 -1.221 1.00 0.00 H new ATOM 0 HG13 VAL B 148 -9.201 2.393 -0.220 1.00 0.00 H new ATOM 0 HG21 VAL B 148 -6.603 1.960 -1.626 1.00 0.00 H new ATOM 0 HG22 VAL B 148 -7.717 0.650 -1.167 1.00 0.00 H new ATOM 0 HG23 VAL B 148 -7.143 0.783 -2.847 1.00 0.00 H new ATOM 2265 N ASN B 149 -11.094 2.970 -4.270 1.00 0.00 N ATOM 2266 CA ASN B 149 -12.102 3.956 -4.695 1.00 0.00 C ATOM 2267 C ASN B 149 -13.568 3.512 -4.472 1.00 0.00 C ATOM 2268 O ASN B 149 -13.920 2.343 -4.749 1.00 0.00 O ATOM 2269 CB ASN B 149 -11.853 4.385 -6.158 1.00 0.00 C ATOM 2270 CG ASN B 149 -12.424 3.446 -7.218 1.00 0.00 C ATOM 2271 OD1 ASN B 149 -13.509 3.657 -7.744 1.00 0.00 O ATOM 2272 ND2 ASN B 149 -11.707 2.412 -7.599 1.00 0.00 N ATOM 2273 OXT ASN B 149 -14.389 4.377 -4.097 1.00 0.00 O ATOM 0 H ASN B 149 -10.432 2.738 -5.011 1.00 0.00 H new ATOM 0 HA ASN B 149 -11.973 4.819 -4.041 1.00 0.00 H new ATOM 0 HB2 ASN B 149 -12.280 5.377 -6.306 1.00 0.00 H new ATOM 0 HB3 ASN B 149 -10.778 4.474 -6.316 1.00 0.00 H new ATOM 0 HD21 ASN B 149 -12.056 1.791 -8.329 1.00 0.00 H new ATOM 0 HD22 ASN B 149 -10.802 2.231 -7.164 1.00 0.00 H new TER 2280 ASN B 149 HETATM 2281 ZN ZN A 96 -1.047 11.915 -1.279 1.00 0.00 ZN HETATM 2282 ZN ZN A 97 13.358 -3.118 -6.363 1.00 0.00 ZN HETATM 2283 ZN ZN A 98 -5.897 -8.571 6.716 1.00 0.00 ZN