USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1017 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 19 MET CE :methyl 135:sc= -5.4! (180deg=-8.03!) USER MOD Set 1.2: B 68 HIS : no HD1:sc= -5.49! C(o=-11!,f=-17!) USER MOD Set 2.1: B 62 GLN : amide:sc= -2.53! C(o=-2.6!,f=-1.1!) USER MOD Set 2.2: B 65 SER OG : rot 100:sc= -0.0452 USER MOD Set 3.1: B 55 THR OG1 : rot 116:sc= 0.905 USER MOD Set 3.2: B 57 SER OG : rot 180:sc= 0.79 USER MOD Set 4.1: B 19 SER OG : rot 180:sc= 0 USER MOD Set 4.2: B 20 SER OG : rot 180:sc= 0 USER MOD Set 5.1: B 7 THR OG1 : rot 118:sc= 0.405 USER MOD Set 5.2: B 9 THR OG1 : rot 180:sc= 0.408 USER MOD Set 6.1: A 35 ASN : amide:sc= 0.272 X(o=0.77,f=0.45) USER MOD Set 6.2: A 42 THR OG1 : rot 93:sc= 0.502 USER MOD Set 7.1: A 12 LYS NZ :NH3+ 136:sc= 0.984 (180deg=0.0625) USER MOD Set 7.2: A 37 ASN : amide:sc= -0.33 X(o=0.65,f=0.18!) USER MOD Single : A 6 ASN : amide:sc= -0.52 K(o=-0.52,f=-2.7!) USER MOD Single : A 9 HIS : no HD1:sc= -4.17! K(o=-4.2!,f=-2.5) USER MOD Single : A 11 SER OG : rot 86:sc= 1.27 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -107:sc= -3.1! (180deg=-5.04!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 171:sc= 0.327 (180deg=-0.0177) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 167:sc= -0.0372 (180deg=-0.284) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HE2:sc= -1.93 K(o=-1.9,f=-6.3!) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -141:sc= -3.4! (180deg=-6.1!) USER MOD Single : A 50 ASN : amide:sc= -0.853 K(o=-0.85,f=-6.5!) USER MOD Single : A 53 LYS NZ :NH3+ 164:sc= -0.0344 (180deg=-0.361) USER MOD Single : A 54 SER OG : rot 34:sc= 0.516 USER MOD Single : B 1 MET CE :methyl 144:sc= -1.55 (180deg=-2.29!) USER MOD Single : B 1 MET N :NH3+ 137:sc= 0.00433 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= -0.441 K(o=-0.44,f=-1.7) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -75:sc= 0.759 USER MOD Single : B 22 THR OG1 : rot -120:sc= -0.727 USER MOD Single : B 25 ASN : amide:sc= -1.63! K(o=-1.6!,f=-0.29) USER MOD Single : B 27 LYS NZ :NH3+ 168:sc= 0.00294 (180deg=-0.158) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -151:sc= -0.879 (180deg=-2.2) USER MOD Single : B 31 GLN : amide:sc= -1.59 K(o=-1.6,f=-0.7) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -1.18 K(o=-1.2,f=-15!) USER MOD Single : B 41 GLN : amide:sc= -1.87! K(o=-1.9!,f=-0.15) USER MOD Single : B 48 LYS NZ :NH3+ -166:sc= -0.0302 (180deg=-0.248) USER MOD Single : B 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 59 TYR OH : rot 180:sc= 0.647 USER MOD Single : B 60 ASN : amide:sc= -1.55! K(o=-1.6!,f=-0.1) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 THR OG1 : rot -13:sc= 0.476 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 6 16.546 -0.026 4.468 1.00 0.00 N ATOM 2 CA ASN A 6 16.761 0.775 3.267 1.00 0.00 C ATOM 3 C ASN A 6 17.112 -0.109 2.074 1.00 0.00 C ATOM 4 O ASN A 6 17.983 -0.973 2.163 1.00 0.00 O ATOM 5 CB ASN A 6 17.874 1.798 3.509 1.00 0.00 C ATOM 6 CG ASN A 6 18.101 2.713 2.319 1.00 0.00 C ATOM 7 OD1 ASN A 6 18.432 2.260 1.223 1.00 0.00 O ATOM 8 ND2 ASN A 6 17.926 4.013 2.532 1.00 0.00 N ATOM 0 HA ASN A 6 15.834 1.302 3.039 1.00 0.00 H new ATOM 0 HB2 ASN A 6 17.624 2.400 4.382 1.00 0.00 H new ATOM 0 HB3 ASN A 6 18.801 1.272 3.739 1.00 0.00 H new ATOM 0 HD21 ASN A 6 18.066 4.678 1.771 1.00 0.00 H new ATOM 0 HD22 ASN A 6 17.651 4.346 3.456 1.00 0.00 H new ATOM 15 N ASP A 7 16.427 0.124 0.955 1.00 0.00 N ATOM 16 CA ASP A 7 16.656 -0.639 -0.269 1.00 0.00 C ATOM 17 C ASP A 7 16.193 0.154 -1.488 1.00 0.00 C ATOM 18 O ASP A 7 16.913 0.259 -2.481 1.00 0.00 O ATOM 19 CB ASP A 7 15.916 -1.979 -0.217 1.00 0.00 C ATOM 20 CG ASP A 7 16.458 -2.910 0.850 1.00 0.00 C ATOM 21 OD1 ASP A 7 17.650 -3.274 0.771 1.00 0.00 O ATOM 22 OD2 ASP A 7 15.691 -3.275 1.766 1.00 0.00 O ATOM 0 H ASP A 7 15.705 0.840 0.872 1.00 0.00 H new ATOM 0 HA ASP A 7 17.726 -0.829 -0.352 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.858 -1.797 -0.030 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.989 -2.467 -1.189 1.00 0.00 H new ATOM 27 N ASP A 8 14.987 0.713 -1.400 1.00 0.00 N ATOM 28 CA ASP A 8 14.422 1.503 -2.491 1.00 0.00 C ATOM 29 C ASP A 8 13.102 2.140 -2.077 1.00 0.00 C ATOM 30 O ASP A 8 12.071 1.467 -2.023 1.00 0.00 O ATOM 31 CB ASP A 8 14.205 0.629 -3.729 1.00 0.00 C ATOM 32 CG ASP A 8 13.683 1.421 -4.911 1.00 0.00 C ATOM 33 OD1 ASP A 8 14.378 2.362 -5.349 1.00 0.00 O ATOM 34 OD2 ASP A 8 12.579 1.102 -5.399 1.00 0.00 O ATOM 0 H ASP A 8 14.382 0.633 -0.583 1.00 0.00 H new ATOM 0 HA ASP A 8 15.132 2.295 -2.731 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.146 0.151 -4.002 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.501 -0.167 -3.489 1.00 0.00 H new ATOM 39 N HIS A 9 13.133 3.441 -1.796 1.00 0.00 N ATOM 40 CA HIS A 9 11.923 4.148 -1.404 1.00 0.00 C ATOM 41 C HIS A 9 11.031 4.355 -2.620 1.00 0.00 C ATOM 42 O HIS A 9 9.815 4.479 -2.496 1.00 0.00 O ATOM 43 CB HIS A 9 12.233 5.488 -0.713 1.00 0.00 C ATOM 44 CG HIS A 9 12.473 6.653 -1.636 1.00 0.00 C ATOM 45 ND1 HIS A 9 12.180 7.952 -1.274 1.00 0.00 N ATOM 46 CD2 HIS A 9 12.980 6.724 -2.891 1.00 0.00 C ATOM 47 CE1 HIS A 9 12.489 8.766 -2.265 1.00 0.00 C ATOM 48 NE2 HIS A 9 12.979 8.048 -3.256 1.00 0.00 N ATOM 0 H HIS A 9 13.973 4.018 -1.833 1.00 0.00 H new ATOM 0 HA HIS A 9 11.396 3.534 -0.674 1.00 0.00 H new ATOM 0 HB2 HIS A 9 11.403 5.736 -0.051 1.00 0.00 H new ATOM 0 HB3 HIS A 9 13.114 5.357 -0.084 1.00 0.00 H new ATOM 0 HD2 HIS A 9 13.321 5.894 -3.492 1.00 0.00 H new ATOM 0 HE1 HIS A 9 12.362 9.839 -2.265 1.00 0.00 H new ATOM 0 HE2 HIS A 9 13.305 8.416 -4.150 1.00 0.00 H new ATOM 57 N GLU A 10 11.658 4.393 -3.797 1.00 0.00 N ATOM 58 CA GLU A 10 10.938 4.581 -5.049 1.00 0.00 C ATOM 59 C GLU A 10 9.813 3.565 -5.162 1.00 0.00 C ATOM 60 O GLU A 10 8.715 3.885 -5.614 1.00 0.00 O ATOM 61 CB GLU A 10 11.891 4.446 -6.239 1.00 0.00 C ATOM 62 CG GLU A 10 13.010 5.475 -6.239 1.00 0.00 C ATOM 63 CD GLU A 10 13.941 5.323 -7.426 1.00 0.00 C ATOM 64 OE1 GLU A 10 14.562 4.248 -7.560 1.00 0.00 O ATOM 65 OE2 GLU A 10 14.049 6.281 -8.221 1.00 0.00 O ATOM 0 H GLU A 10 12.668 4.295 -3.905 1.00 0.00 H new ATOM 0 HA GLU A 10 10.511 5.584 -5.058 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.327 3.447 -6.234 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.321 4.540 -7.163 1.00 0.00 H new ATOM 0 HG2 GLU A 10 12.578 6.476 -6.246 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.584 5.382 -5.317 1.00 0.00 H new ATOM 72 N SER A 11 10.094 2.343 -4.719 1.00 0.00 N ATOM 73 CA SER A 11 9.106 1.277 -4.735 1.00 0.00 C ATOM 74 C SER A 11 7.899 1.687 -3.898 1.00 0.00 C ATOM 75 O SER A 11 6.753 1.634 -4.356 1.00 0.00 O ATOM 76 CB SER A 11 9.724 -0.012 -4.192 1.00 0.00 C ATOM 77 OG SER A 11 10.606 -0.592 -5.137 1.00 0.00 O ATOM 0 H SER A 11 11.002 2.069 -4.344 1.00 0.00 H new ATOM 0 HA SER A 11 8.779 1.099 -5.759 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.263 0.200 -3.269 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.934 -0.721 -3.944 1.00 0.00 H new ATOM 0 HG SER A 11 11.497 -0.196 -5.039 1.00 0.00 H new ATOM 83 N LYS A 12 8.174 2.130 -2.676 1.00 0.00 N ATOM 84 CA LYS A 12 7.126 2.588 -1.778 1.00 0.00 C ATOM 85 C LYS A 12 6.380 3.748 -2.423 1.00 0.00 C ATOM 86 O LYS A 12 5.153 3.847 -2.342 1.00 0.00 O ATOM 87 CB LYS A 12 7.733 3.021 -0.443 1.00 0.00 C ATOM 88 CG LYS A 12 8.526 1.923 0.248 1.00 0.00 C ATOM 89 CD LYS A 12 9.149 2.411 1.545 1.00 0.00 C ATOM 90 CE LYS A 12 9.986 1.327 2.204 1.00 0.00 C ATOM 91 NZ LYS A 12 10.616 1.798 3.469 1.00 0.00 N ATOM 0 H LYS A 12 9.115 2.181 -2.287 1.00 0.00 H new ATOM 0 HA LYS A 12 6.426 1.774 -1.591 1.00 0.00 H new ATOM 0 HB2 LYS A 12 8.385 3.878 -0.611 1.00 0.00 H new ATOM 0 HB3 LYS A 12 6.934 3.353 0.220 1.00 0.00 H new ATOM 0 HG2 LYS A 12 7.871 1.076 0.455 1.00 0.00 H new ATOM 0 HG3 LYS A 12 9.309 1.565 -0.420 1.00 0.00 H new ATOM 0 HD2 LYS A 12 9.773 3.282 1.345 1.00 0.00 H new ATOM 0 HD3 LYS A 12 8.363 2.732 2.229 1.00 0.00 H new ATOM 0 HE2 LYS A 12 9.358 0.461 2.413 1.00 0.00 H new ATOM 0 HE3 LYS A 12 10.762 0.999 1.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 10.515 1.066 4.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 11.625 1.987 3.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 10.148 2.671 3.786 1.00 0.00 H new ATOM 105 N LEU A 13 7.141 4.611 -3.090 1.00 0.00 N ATOM 106 CA LEU A 13 6.582 5.758 -3.784 1.00 0.00 C ATOM 107 C LEU A 13 5.639 5.281 -4.879 1.00 0.00 C ATOM 108 O LEU A 13 4.598 5.888 -5.126 1.00 0.00 O ATOM 109 CB LEU A 13 7.704 6.615 -4.378 1.00 0.00 C ATOM 110 CG LEU A 13 7.250 7.863 -5.139 1.00 0.00 C ATOM 111 CD1 LEU A 13 6.437 8.777 -4.236 1.00 0.00 C ATOM 112 CD2 LEU A 13 8.455 8.602 -5.702 1.00 0.00 C ATOM 0 H LEU A 13 8.155 4.533 -3.162 1.00 0.00 H new ATOM 0 HA LEU A 13 6.022 6.369 -3.076 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.367 6.925 -3.570 1.00 0.00 H new ATOM 0 HB3 LEU A 13 8.293 5.994 -5.053 1.00 0.00 H new ATOM 0 HG LEU A 13 6.614 7.551 -5.967 1.00 0.00 H new ATOM 0 HD11 LEU A 13 6.124 9.658 -4.797 1.00 0.00 H new ATOM 0 HD12 LEU A 13 5.557 8.244 -3.877 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.046 9.085 -3.386 1.00 0.00 H new ATOM 0 HD21 LEU A 13 8.119 9.488 -6.241 1.00 0.00 H new ATOM 0 HD22 LEU A 13 9.112 8.901 -4.886 1.00 0.00 H new ATOM 0 HD23 LEU A 13 8.998 7.947 -6.383 1.00 0.00 H new ATOM 124 N SER A 14 6.004 4.169 -5.517 1.00 0.00 N ATOM 125 CA SER A 14 5.178 3.589 -6.566 1.00 0.00 C ATOM 126 C SER A 14 3.813 3.252 -5.989 1.00 0.00 C ATOM 127 O SER A 14 2.775 3.593 -6.567 1.00 0.00 O ATOM 128 CB SER A 14 5.837 2.334 -7.143 1.00 0.00 C ATOM 129 OG SER A 14 5.024 1.742 -8.139 1.00 0.00 O ATOM 0 H SER A 14 6.864 3.656 -5.324 1.00 0.00 H new ATOM 0 HA SER A 14 5.066 4.310 -7.376 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.807 2.592 -7.567 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.019 1.615 -6.344 1.00 0.00 H new ATOM 0 HG SER A 14 5.469 0.943 -8.492 1.00 0.00 H new ATOM 135 N ILE A 15 3.821 2.612 -4.821 1.00 0.00 N ATOM 136 CA ILE A 15 2.579 2.269 -4.145 1.00 0.00 C ATOM 137 C ILE A 15 1.769 3.533 -3.896 1.00 0.00 C ATOM 138 O ILE A 15 0.550 3.536 -4.028 1.00 0.00 O ATOM 139 CB ILE A 15 2.820 1.551 -2.794 1.00 0.00 C ATOM 140 CG1 ILE A 15 3.164 0.076 -3.007 1.00 0.00 C ATOM 141 CG2 ILE A 15 1.598 1.676 -1.896 1.00 0.00 C ATOM 142 CD1 ILE A 15 4.450 -0.152 -3.773 1.00 0.00 C ATOM 0 H ILE A 15 4.667 2.324 -4.330 1.00 0.00 H new ATOM 0 HA ILE A 15 2.036 1.583 -4.795 1.00 0.00 H new ATOM 0 HB ILE A 15 3.667 2.034 -2.307 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.240 -0.413 -2.036 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.345 -0.404 -3.542 1.00 0.00 H new ATOM 0 HG21 ILE A 15 1.787 1.165 -0.952 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.394 2.729 -1.704 1.00 0.00 H new ATOM 0 HG23 ILE A 15 0.737 1.223 -2.388 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.623 -1.223 -3.882 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.372 0.306 -4.759 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.282 0.297 -3.230 1.00 0.00 H new ATOM 154 N LEU A 16 2.466 4.606 -3.532 1.00 0.00 N ATOM 155 CA LEU A 16 1.818 5.885 -3.261 1.00 0.00 C ATOM 156 C LEU A 16 1.065 6.396 -4.487 1.00 0.00 C ATOM 157 O LEU A 16 -0.078 6.836 -4.383 1.00 0.00 O ATOM 158 CB LEU A 16 2.854 6.924 -2.827 1.00 0.00 C ATOM 159 CG LEU A 16 3.603 6.605 -1.531 1.00 0.00 C ATOM 160 CD1 LEU A 16 4.632 7.685 -1.237 1.00 0.00 C ATOM 161 CD2 LEU A 16 2.627 6.468 -0.373 1.00 0.00 C ATOM 0 H LEU A 16 3.480 4.615 -3.418 1.00 0.00 H new ATOM 0 HA LEU A 16 1.101 5.728 -2.456 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.583 7.041 -3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.353 7.885 -2.709 1.00 0.00 H new ATOM 0 HG LEU A 16 4.124 5.655 -1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.157 7.445 -0.312 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.348 7.739 -2.057 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.130 8.647 -1.130 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.176 6.241 0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.080 7.402 -0.245 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.924 5.662 -0.583 1.00 0.00 H new ATOM 173 N MET A 17 1.716 6.349 -5.645 1.00 0.00 N ATOM 174 CA MET A 17 1.105 6.823 -6.883 1.00 0.00 C ATOM 175 C MET A 17 -0.168 6.049 -7.211 1.00 0.00 C ATOM 176 O MET A 17 -1.215 6.642 -7.476 1.00 0.00 O ATOM 177 CB MET A 17 2.091 6.702 -8.047 1.00 0.00 C ATOM 178 CG MET A 17 3.388 7.461 -7.832 1.00 0.00 C ATOM 179 SD MET A 17 4.462 7.422 -9.282 1.00 0.00 S ATOM 180 CE MET A 17 4.690 5.660 -9.497 1.00 0.00 C ATOM 0 H MET A 17 2.664 5.989 -5.753 1.00 0.00 H new ATOM 0 HA MET A 17 0.842 7.871 -6.736 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.320 5.649 -8.209 1.00 0.00 H new ATOM 0 HB3 MET A 17 1.613 7.068 -8.956 1.00 0.00 H new ATOM 0 HG2 MET A 17 3.161 8.497 -7.580 1.00 0.00 H new ATOM 0 HG3 MET A 17 3.918 7.034 -6.980 1.00 0.00 H new ATOM 0 HE1 MET A 17 5.701 5.384 -9.195 1.00 0.00 H new ATOM 0 HE2 MET A 17 3.968 5.122 -8.882 1.00 0.00 H new ATOM 0 HE3 MET A 17 4.540 5.399 -10.545 1.00 0.00 H new ATOM 190 N ASP A 18 -0.071 4.724 -7.203 1.00 0.00 N ATOM 191 CA ASP A 18 -1.215 3.872 -7.514 1.00 0.00 C ATOM 192 C ASP A 18 -2.295 3.970 -6.439 1.00 0.00 C ATOM 193 O ASP A 18 -3.488 3.996 -6.746 1.00 0.00 O ATOM 194 CB ASP A 18 -0.763 2.418 -7.669 1.00 0.00 C ATOM 195 CG ASP A 18 -1.892 1.501 -8.105 1.00 0.00 C ATOM 196 OD1 ASP A 18 -2.876 1.364 -7.347 1.00 0.00 O ATOM 197 OD2 ASP A 18 -1.792 0.922 -9.207 1.00 0.00 O ATOM 0 H ASP A 18 0.786 4.216 -6.985 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.643 4.220 -8.454 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.044 2.368 -8.400 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -0.357 2.064 -6.721 1.00 0.00 H new ATOM 202 N MET A 19 -1.872 4.009 -5.181 1.00 0.00 N ATOM 203 CA MET A 19 -2.803 4.087 -4.059 1.00 0.00 C ATOM 204 C MET A 19 -3.660 5.348 -4.137 1.00 0.00 C ATOM 205 O MET A 19 -4.880 5.286 -3.982 1.00 0.00 O ATOM 206 CB MET A 19 -2.043 4.055 -2.730 1.00 0.00 C ATOM 207 CG MET A 19 -2.950 3.938 -1.517 1.00 0.00 C ATOM 208 SD MET A 19 -2.061 4.085 0.043 1.00 0.00 S ATOM 209 CE MET A 19 -1.265 2.485 0.123 1.00 0.00 C ATOM 0 H MET A 19 -0.889 3.988 -4.911 1.00 0.00 H new ATOM 0 HA MET A 19 -3.463 3.221 -4.115 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.349 3.215 -2.737 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.445 4.962 -2.641 1.00 0.00 H new ATOM 0 HG2 MET A 19 -3.716 4.712 -1.567 1.00 0.00 H new ATOM 0 HG3 MET A 19 -3.465 2.978 -1.546 1.00 0.00 H new ATOM 0 HE1 MET A 19 -0.224 2.611 0.420 1.00 0.00 H new ATOM 0 HE2 MET A 19 -1.778 1.860 0.854 1.00 0.00 H new ATOM 0 HE3 MET A 19 -1.308 2.008 -0.856 1.00 0.00 H new ATOM 219 N PHE A 20 -3.018 6.490 -4.371 1.00 0.00 N ATOM 220 CA PHE A 20 -3.733 7.760 -4.463 1.00 0.00 C ATOM 221 C PHE A 20 -3.841 8.223 -5.917 1.00 0.00 C ATOM 222 O PHE A 20 -2.954 8.907 -6.423 1.00 0.00 O ATOM 223 CB PHE A 20 -3.031 8.835 -3.630 1.00 0.00 C ATOM 224 CG PHE A 20 -2.639 8.375 -2.255 1.00 0.00 C ATOM 225 CD1 PHE A 20 -3.575 8.314 -1.236 1.00 0.00 C ATOM 226 CD2 PHE A 20 -1.335 7.993 -1.986 1.00 0.00 C ATOM 227 CE1 PHE A 20 -3.217 7.882 0.027 1.00 0.00 C ATOM 228 CE2 PHE A 20 -0.972 7.559 -0.727 1.00 0.00 C ATOM 229 CZ PHE A 20 -1.913 7.505 0.281 1.00 0.00 C ATOM 0 H PHE A 20 -2.009 6.562 -4.500 1.00 0.00 H new ATOM 0 HA PHE A 20 -4.738 7.605 -4.070 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -2.139 9.167 -4.160 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -3.689 9.699 -3.540 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -4.596 8.607 -1.431 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -0.594 8.035 -2.770 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -3.956 7.839 0.814 1.00 0.00 H new ATOM 0 HE2 PHE A 20 0.048 7.262 -0.531 1.00 0.00 H new ATOM 0 HZ PHE A 20 -1.630 7.168 1.267 1.00 0.00 H new ATOM 239 N PRO A 21 -4.938 7.858 -6.606 1.00 0.00 N ATOM 240 CA PRO A 21 -5.159 8.244 -8.002 1.00 0.00 C ATOM 241 C PRO A 21 -5.637 9.687 -8.133 1.00 0.00 C ATOM 242 O PRO A 21 -6.726 9.945 -8.649 1.00 0.00 O ATOM 243 CB PRO A 21 -6.246 7.272 -8.458 1.00 0.00 C ATOM 244 CG PRO A 21 -7.030 6.984 -7.225 1.00 0.00 C ATOM 245 CD PRO A 21 -6.054 7.045 -6.079 1.00 0.00 C ATOM 0 HA PRO A 21 -4.246 8.196 -8.596 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -6.873 7.713 -9.233 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -5.815 6.362 -8.876 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.830 7.713 -7.094 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.500 6.002 -7.284 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -6.501 7.504 -5.197 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.720 6.050 -5.785 1.00 0.00 H new ATOM 253 N ALA A 22 -4.827 10.628 -7.652 1.00 0.00 N ATOM 254 CA ALA A 22 -5.183 12.041 -7.708 1.00 0.00 C ATOM 255 C ALA A 22 -3.984 12.934 -7.429 1.00 0.00 C ATOM 256 O ALA A 22 -3.732 13.902 -8.146 1.00 0.00 O ATOM 257 CB ALA A 22 -6.272 12.341 -6.691 1.00 0.00 C ATOM 0 H ALA A 22 -3.923 10.437 -7.221 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.541 12.250 -8.716 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.533 13.398 -6.738 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.153 11.739 -6.913 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.912 12.101 -5.691 1.00 0.00 H new ATOM 263 N ILE A 23 -3.266 12.611 -6.365 1.00 0.00 N ATOM 264 CA ILE A 23 -2.107 13.388 -5.957 1.00 0.00 C ATOM 265 C ILE A 23 -0.911 13.147 -6.875 1.00 0.00 C ATOM 266 O ILE A 23 -0.601 12.010 -7.232 1.00 0.00 O ATOM 267 CB ILE A 23 -1.721 13.081 -4.495 1.00 0.00 C ATOM 268 CG1 ILE A 23 -2.857 13.493 -3.546 1.00 0.00 C ATOM 269 CG2 ILE A 23 -0.430 13.795 -4.121 1.00 0.00 C ATOM 270 CD1 ILE A 23 -4.020 12.527 -3.505 1.00 0.00 C ATOM 0 H ILE A 23 -3.468 11.811 -5.765 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.386 14.439 -6.034 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.559 12.007 -4.398 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -2.453 13.598 -2.539 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -3.226 14.474 -3.845 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -0.174 13.566 -3.086 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.374 13.460 -4.776 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.564 14.871 -4.232 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -4.775 12.896 -2.811 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -4.455 12.439 -4.501 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -3.669 11.549 -3.174 1.00 0.00 H new ATOM 282 N SER A 24 -0.248 14.237 -7.254 1.00 0.00 N ATOM 283 CA SER A 24 0.915 14.175 -8.136 1.00 0.00 C ATOM 284 C SER A 24 2.051 13.374 -7.508 1.00 0.00 C ATOM 285 O SER A 24 2.229 13.375 -6.288 1.00 0.00 O ATOM 286 CB SER A 24 1.401 15.586 -8.468 1.00 0.00 C ATOM 287 OG SER A 24 1.765 16.289 -7.294 1.00 0.00 O ATOM 0 H SER A 24 -0.499 15.181 -6.961 1.00 0.00 H new ATOM 0 HA SER A 24 0.609 13.670 -9.052 1.00 0.00 H new ATOM 0 HB2 SER A 24 2.256 15.530 -9.142 1.00 0.00 H new ATOM 0 HB3 SER A 24 0.616 16.130 -8.993 1.00 0.00 H new ATOM 0 HG SER A 24 2.074 17.188 -7.533 1.00 0.00 H new ATOM 293 N LYS A 25 2.819 12.694 -8.356 1.00 0.00 N ATOM 294 CA LYS A 25 3.947 11.886 -7.903 1.00 0.00 C ATOM 295 C LYS A 25 4.934 12.725 -7.093 1.00 0.00 C ATOM 296 O LYS A 25 5.492 12.255 -6.101 1.00 0.00 O ATOM 297 CB LYS A 25 4.661 11.264 -9.107 1.00 0.00 C ATOM 298 CG LYS A 25 5.896 10.456 -8.738 1.00 0.00 C ATOM 299 CD LYS A 25 6.613 9.941 -9.976 1.00 0.00 C ATOM 300 CE LYS A 25 7.861 9.151 -9.614 1.00 0.00 C ATOM 301 NZ LYS A 25 7.543 7.956 -8.784 1.00 0.00 N ATOM 0 H LYS A 25 2.679 12.687 -9.366 1.00 0.00 H new ATOM 0 HA LYS A 25 3.562 11.095 -7.260 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.962 10.619 -9.639 1.00 0.00 H new ATOM 0 HB3 LYS A 25 4.950 12.058 -9.796 1.00 0.00 H new ATOM 0 HG2 LYS A 25 6.576 11.075 -8.153 1.00 0.00 H new ATOM 0 HG3 LYS A 25 5.607 9.615 -8.107 1.00 0.00 H new ATOM 0 HD2 LYS A 25 5.937 9.310 -10.552 1.00 0.00 H new ATOM 0 HD3 LYS A 25 6.886 10.781 -10.614 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.367 8.835 -10.526 1.00 0.00 H new ATOM 0 HE3 LYS A 25 8.553 9.795 -9.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 8.393 7.365 -8.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 7.225 8.262 -7.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 6.789 7.406 -9.242 1.00 0.00 H new ATOM 315 N SER A 26 5.152 13.961 -7.531 1.00 0.00 N ATOM 316 CA SER A 26 6.080 14.865 -6.857 1.00 0.00 C ATOM 317 C SER A 26 5.713 15.055 -5.387 1.00 0.00 C ATOM 318 O SER A 26 6.573 14.969 -4.508 1.00 0.00 O ATOM 319 CB SER A 26 6.105 16.220 -7.564 1.00 0.00 C ATOM 320 OG SER A 26 6.540 16.088 -8.906 1.00 0.00 O ATOM 0 H SER A 26 4.698 14.361 -8.352 1.00 0.00 H new ATOM 0 HA SER A 26 7.071 14.413 -6.902 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.109 16.663 -7.543 1.00 0.00 H new ATOM 0 HB3 SER A 26 6.768 16.900 -7.029 1.00 0.00 H new ATOM 0 HG SER A 26 6.545 16.968 -9.336 1.00 0.00 H new ATOM 326 N LYS A 27 4.437 15.317 -5.123 1.00 0.00 N ATOM 327 CA LYS A 27 3.969 15.526 -3.756 1.00 0.00 C ATOM 328 C LYS A 27 4.212 14.285 -2.901 1.00 0.00 C ATOM 329 O LYS A 27 4.757 14.377 -1.800 1.00 0.00 O ATOM 330 CB LYS A 27 2.483 15.889 -3.752 1.00 0.00 C ATOM 331 CG LYS A 27 1.953 16.275 -2.381 1.00 0.00 C ATOM 332 CD LYS A 27 0.504 16.727 -2.451 1.00 0.00 C ATOM 333 CE LYS A 27 -0.020 17.137 -1.084 1.00 0.00 C ATOM 334 NZ LYS A 27 0.747 18.279 -0.516 1.00 0.00 N ATOM 0 H LYS A 27 3.710 15.390 -5.835 1.00 0.00 H new ATOM 0 HA LYS A 27 4.535 16.353 -3.326 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.318 16.717 -4.442 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.910 15.042 -4.128 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.038 15.425 -1.704 1.00 0.00 H new ATOM 0 HG3 LYS A 27 2.565 17.075 -1.965 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.417 17.566 -3.142 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.111 15.920 -2.850 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.072 17.411 -1.165 1.00 0.00 H new ATOM 0 HE3 LYS A 27 0.037 16.287 -0.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.234 18.670 0.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.685 17.949 -0.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.859 19.017 -1.241 1.00 0.00 H new ATOM 348 N LEU A 28 3.817 13.124 -3.418 1.00 0.00 N ATOM 349 CA LEU A 28 4.003 11.866 -2.702 1.00 0.00 C ATOM 350 C LEU A 28 5.476 11.655 -2.366 1.00 0.00 C ATOM 351 O LEU A 28 5.815 11.189 -1.279 1.00 0.00 O ATOM 352 CB LEU A 28 3.474 10.697 -3.537 1.00 0.00 C ATOM 353 CG LEU A 28 1.971 10.738 -3.827 1.00 0.00 C ATOM 354 CD1 LEU A 28 1.576 9.600 -4.755 1.00 0.00 C ATOM 355 CD2 LEU A 28 1.176 10.669 -2.530 1.00 0.00 C ATOM 0 H LEU A 28 3.367 13.029 -4.328 1.00 0.00 H new ATOM 0 HA LEU A 28 3.440 11.912 -1.770 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.011 10.675 -4.485 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.704 9.766 -3.018 1.00 0.00 H new ATOM 0 HG LEU A 28 1.741 11.681 -4.322 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.505 9.645 -4.950 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.120 9.691 -5.695 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.820 8.647 -4.286 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.110 10.699 -2.755 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.411 9.741 -2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.438 11.517 -1.897 1.00 0.00 H new ATOM 367 N GLN A 29 6.344 12.013 -3.307 1.00 0.00 N ATOM 368 CA GLN A 29 7.784 11.879 -3.119 1.00 0.00 C ATOM 369 C GLN A 29 8.258 12.747 -1.957 1.00 0.00 C ATOM 370 O GLN A 29 9.067 12.315 -1.137 1.00 0.00 O ATOM 371 CB GLN A 29 8.517 12.274 -4.403 1.00 0.00 C ATOM 372 CG GLN A 29 10.030 12.176 -4.304 1.00 0.00 C ATOM 373 CD GLN A 29 10.723 12.592 -5.586 1.00 0.00 C ATOM 374 OE1 GLN A 29 10.517 11.991 -6.640 1.00 0.00 O ATOM 375 NE2 GLN A 29 11.550 13.629 -5.503 1.00 0.00 N ATOM 0 H GLN A 29 6.073 12.400 -4.211 1.00 0.00 H new ATOM 0 HA GLN A 29 8.008 10.838 -2.885 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.174 11.635 -5.217 1.00 0.00 H new ATOM 0 HB3 GLN A 29 8.245 13.297 -4.665 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.379 12.805 -3.485 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.309 11.151 -4.060 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.691 14.098 -4.608 1.00 0.00 H new ATOM 0 HE22 GLN A 29 12.043 13.956 -6.334 1.00 0.00 H new ATOM 384 N VAL A 30 7.745 13.973 -1.891 1.00 0.00 N ATOM 385 CA VAL A 30 8.113 14.904 -0.829 1.00 0.00 C ATOM 386 C VAL A 30 7.747 14.346 0.544 1.00 0.00 C ATOM 387 O VAL A 30 8.562 14.365 1.467 1.00 0.00 O ATOM 388 CB VAL A 30 7.428 16.271 -1.020 1.00 0.00 C ATOM 389 CG1 VAL A 30 7.809 17.229 0.100 1.00 0.00 C ATOM 390 CG2 VAL A 30 7.786 16.861 -2.374 1.00 0.00 C ATOM 0 H VAL A 30 7.072 14.345 -2.562 1.00 0.00 H new ATOM 0 HA VAL A 30 9.193 15.038 -0.884 1.00 0.00 H new ATOM 0 HB VAL A 30 6.349 16.120 -0.984 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.313 18.187 -0.056 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.498 16.811 1.058 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.889 17.375 0.102 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.294 17.826 -2.492 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.866 16.994 -2.439 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.456 16.186 -3.164 1.00 0.00 H new ATOM 400 N HIS A 31 6.519 13.850 0.674 1.00 0.00 N ATOM 401 CA HIS A 31 6.050 13.289 1.938 1.00 0.00 C ATOM 402 C HIS A 31 6.915 12.107 2.365 1.00 0.00 C ATOM 403 O HIS A 31 7.286 11.987 3.533 1.00 0.00 O ATOM 404 CB HIS A 31 4.592 12.842 1.818 1.00 0.00 C ATOM 405 CG HIS A 31 3.644 13.953 1.497 1.00 0.00 C ATOM 406 ND1 HIS A 31 3.473 15.056 2.305 1.00 0.00 N ATOM 407 CD2 HIS A 31 2.808 14.124 0.447 1.00 0.00 C ATOM 408 CE1 HIS A 31 2.571 15.857 1.768 1.00 0.00 C ATOM 409 NE2 HIS A 31 2.152 15.315 0.640 1.00 0.00 N ATOM 0 H HIS A 31 5.832 13.825 -0.079 1.00 0.00 H new ATOM 0 HA HIS A 31 6.124 14.069 2.696 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.518 12.079 1.043 1.00 0.00 H new ATOM 0 HB3 HIS A 31 4.287 12.376 2.755 1.00 0.00 H new ATOM 0 HD1 HIS A 31 3.966 15.227 3.181 1.00 0.00 H new ATOM 0 HD2 HIS A 31 2.680 13.450 -0.387 1.00 0.00 H new ATOM 0 HE1 HIS A 31 2.234 16.796 2.182 1.00 0.00 H new ATOM 418 N LEU A 32 7.226 11.237 1.412 1.00 0.00 N ATOM 419 CA LEU A 32 8.042 10.059 1.684 1.00 0.00 C ATOM 420 C LEU A 32 9.423 10.463 2.194 1.00 0.00 C ATOM 421 O LEU A 32 9.958 9.850 3.119 1.00 0.00 O ATOM 422 CB LEU A 32 8.176 9.208 0.418 1.00 0.00 C ATOM 423 CG LEU A 32 8.871 7.857 0.605 1.00 0.00 C ATOM 424 CD1 LEU A 32 8.074 6.968 1.550 1.00 0.00 C ATOM 425 CD2 LEU A 32 9.058 7.168 -0.737 1.00 0.00 C ATOM 0 H LEU A 32 6.925 11.325 0.441 1.00 0.00 H new ATOM 0 HA LEU A 32 7.549 9.470 2.458 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.180 9.032 0.012 1.00 0.00 H new ATOM 0 HB3 LEU A 32 8.727 9.781 -0.328 1.00 0.00 H new ATOM 0 HG LEU A 32 9.852 8.034 1.046 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.585 6.013 1.669 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.986 7.456 2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.079 6.798 1.138 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.553 6.209 -0.588 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.085 7.006 -1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 32 9.670 7.795 -1.386 1.00 0.00 H new ATOM 437 N LEU A 33 9.992 11.499 1.584 1.00 0.00 N ATOM 438 CA LEU A 33 11.311 11.992 1.969 1.00 0.00 C ATOM 439 C LEU A 33 11.305 12.549 3.391 1.00 0.00 C ATOM 440 O LEU A 33 12.201 12.259 4.183 1.00 0.00 O ATOM 441 CB LEU A 33 11.777 13.076 0.993 1.00 0.00 C ATOM 442 CG LEU A 33 12.047 12.594 -0.434 1.00 0.00 C ATOM 443 CD1 LEU A 33 12.379 13.771 -1.338 1.00 0.00 C ATOM 444 CD2 LEU A 33 13.178 11.576 -0.446 1.00 0.00 C ATOM 0 H LEU A 33 9.558 12.015 0.818 1.00 0.00 H new ATOM 0 HA LEU A 33 12.002 11.150 1.935 1.00 0.00 H new ATOM 0 HB2 LEU A 33 11.021 13.860 0.958 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.688 13.529 1.385 1.00 0.00 H new ATOM 0 HG LEU A 33 11.146 12.112 -0.813 1.00 0.00 H new ATOM 0 HD11 LEU A 33 12.568 13.411 -2.349 1.00 0.00 H new ATOM 0 HD12 LEU A 33 11.540 14.467 -1.352 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.267 14.280 -0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.357 11.243 -1.468 1.00 0.00 H new ATOM 0 HD22 LEU A 33 14.084 12.034 -0.049 1.00 0.00 H new ATOM 0 HD23 LEU A 33 12.904 10.720 0.171 1.00 0.00 H new ATOM 456 N GLU A 34 10.293 13.353 3.707 1.00 0.00 N ATOM 457 CA GLU A 34 10.179 13.955 5.032 1.00 0.00 C ATOM 458 C GLU A 34 10.120 12.885 6.117 1.00 0.00 C ATOM 459 O GLU A 34 10.886 12.922 7.081 1.00 0.00 O ATOM 460 CB GLU A 34 8.936 14.844 5.105 1.00 0.00 C ATOM 461 CG GLU A 34 8.938 15.979 4.094 1.00 0.00 C ATOM 462 CD GLU A 34 7.717 16.871 4.212 1.00 0.00 C ATOM 463 OE1 GLU A 34 6.591 16.360 4.037 1.00 0.00 O ATOM 464 OE2 GLU A 34 7.888 18.077 4.480 1.00 0.00 O ATOM 0 H GLU A 34 9.541 13.602 3.064 1.00 0.00 H new ATOM 0 HA GLU A 34 11.065 14.566 5.202 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.050 14.229 4.946 1.00 0.00 H new ATOM 0 HB3 GLU A 34 8.858 15.263 6.108 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.837 16.580 4.231 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.983 15.563 3.087 1.00 0.00 H new ATOM 471 N ASN A 35 9.210 11.928 5.956 1.00 0.00 N ATOM 472 CA ASN A 35 9.058 10.846 6.923 1.00 0.00 C ATOM 473 C ASN A 35 10.061 9.727 6.649 1.00 0.00 C ATOM 474 O ASN A 35 9.773 8.556 6.893 1.00 0.00 O ATOM 475 CB ASN A 35 7.632 10.293 6.876 1.00 0.00 C ATOM 476 CG ASN A 35 6.590 11.356 7.171 1.00 0.00 C ATOM 477 OD1 ASN A 35 6.578 11.946 8.250 1.00 0.00 O ATOM 478 ND2 ASN A 35 5.709 11.604 6.209 1.00 0.00 N ATOM 0 H ASN A 35 8.567 11.880 5.165 1.00 0.00 H new ATOM 0 HA ASN A 35 9.253 11.247 7.917 1.00 0.00 H new ATOM 0 HB2 ASN A 35 7.443 9.866 5.891 1.00 0.00 H new ATOM 0 HB3 ASN A 35 7.535 9.483 7.599 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.985 12.308 6.350 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.756 11.090 5.329 1.00 0.00 H new ATOM 485 N ASN A 36 11.236 10.105 6.144 1.00 0.00 N ATOM 486 CA ASN A 36 12.301 9.156 5.825 1.00 0.00 C ATOM 487 C ASN A 36 11.880 8.213 4.702 1.00 0.00 C ATOM 488 O ASN A 36 12.351 8.332 3.571 1.00 0.00 O ATOM 489 CB ASN A 36 12.695 8.354 7.068 1.00 0.00 C ATOM 490 CG ASN A 36 13.239 9.236 8.176 1.00 0.00 C ATOM 491 OD1 ASN A 36 14.246 9.921 8.001 1.00 0.00 O ATOM 492 ND2 ASN A 36 12.573 9.221 9.325 1.00 0.00 N ATOM 0 H ASN A 36 11.475 11.076 5.945 1.00 0.00 H new ATOM 0 HA ASN A 36 13.165 9.726 5.485 1.00 0.00 H new ATOM 0 HB2 ASN A 36 11.826 7.808 7.435 1.00 0.00 H new ATOM 0 HB3 ASN A 36 13.446 7.612 6.796 1.00 0.00 H new ATOM 0 HD21 ASN A 36 12.892 9.793 10.107 1.00 0.00 H new ATOM 0 HD22 ASN A 36 11.742 8.637 9.425 1.00 0.00 H new ATOM 499 N ASN A 37 10.987 7.284 5.023 1.00 0.00 N ATOM 500 CA ASN A 37 10.488 6.320 4.045 1.00 0.00 C ATOM 501 C ASN A 37 9.439 5.407 4.671 1.00 0.00 C ATOM 502 O ASN A 37 9.304 4.243 4.287 1.00 0.00 O ATOM 503 CB ASN A 37 11.640 5.479 3.485 1.00 0.00 C ATOM 504 CG ASN A 37 12.403 4.742 4.570 1.00 0.00 C ATOM 505 OD1 ASN A 37 11.841 3.920 5.294 1.00 0.00 O ATOM 506 ND2 ASN A 37 13.693 5.034 4.688 1.00 0.00 N ATOM 0 H ASN A 37 10.591 7.177 5.957 1.00 0.00 H new ATOM 0 HA ASN A 37 10.025 6.876 3.230 1.00 0.00 H new ATOM 0 HB2 ASN A 37 11.245 4.758 2.770 1.00 0.00 H new ATOM 0 HB3 ASN A 37 12.326 6.126 2.939 1.00 0.00 H new ATOM 0 HD21 ASN A 37 14.258 4.570 5.400 1.00 0.00 H new ATOM 0 HD22 ASN A 37 14.119 5.722 4.067 1.00 0.00 H new ATOM 513 N ASP A 38 8.698 5.941 5.636 1.00 0.00 N ATOM 514 CA ASP A 38 7.658 5.174 6.316 1.00 0.00 C ATOM 515 C ASP A 38 6.338 5.258 5.554 1.00 0.00 C ATOM 516 O ASP A 38 5.864 6.347 5.232 1.00 0.00 O ATOM 517 CB ASP A 38 7.475 5.687 7.746 1.00 0.00 C ATOM 518 CG ASP A 38 6.545 4.812 8.565 1.00 0.00 C ATOM 519 OD1 ASP A 38 6.044 3.804 8.025 1.00 0.00 O ATOM 520 OD2 ASP A 38 6.320 5.135 9.751 1.00 0.00 O ATOM 0 H ASP A 38 8.797 6.901 5.965 1.00 0.00 H new ATOM 0 HA ASP A 38 7.968 4.130 6.351 1.00 0.00 H new ATOM 0 HB2 ASP A 38 8.447 5.737 8.237 1.00 0.00 H new ATOM 0 HB3 ASP A 38 7.080 6.702 7.716 1.00 0.00 H new ATOM 525 N LEU A 39 5.751 4.100 5.266 1.00 0.00 N ATOM 526 CA LEU A 39 4.486 4.043 4.539 1.00 0.00 C ATOM 527 C LEU A 39 3.298 4.326 5.450 1.00 0.00 C ATOM 528 O LEU A 39 2.476 5.188 5.152 1.00 0.00 O ATOM 529 CB LEU A 39 4.322 2.681 3.867 1.00 0.00 C ATOM 530 CG LEU A 39 5.251 2.443 2.678 1.00 0.00 C ATOM 531 CD1 LEU A 39 5.080 1.035 2.136 1.00 0.00 C ATOM 532 CD2 LEU A 39 4.982 3.470 1.588 1.00 0.00 C ATOM 0 H LEU A 39 6.130 3.189 5.524 1.00 0.00 H new ATOM 0 HA LEU A 39 4.510 4.820 3.775 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.495 1.901 4.609 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.290 2.578 3.531 1.00 0.00 H new ATOM 0 HG LEU A 39 6.281 2.554 3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.751 0.887 1.290 1.00 0.00 H new ATOM 0 HD12 LEU A 39 5.317 0.313 2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 39 4.049 0.893 1.811 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.650 3.290 0.746 1.00 0.00 H new ATOM 0 HD22 LEU A 39 3.948 3.385 1.255 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.155 4.472 1.981 1.00 0.00 H new ATOM 544 N ASP A 40 3.208 3.598 6.553 1.00 0.00 N ATOM 545 CA ASP A 40 2.107 3.780 7.492 1.00 0.00 C ATOM 546 C ASP A 40 2.008 5.235 7.951 1.00 0.00 C ATOM 547 O ASP A 40 0.911 5.784 8.066 1.00 0.00 O ATOM 548 CB ASP A 40 2.270 2.842 8.693 1.00 0.00 C ATOM 549 CG ASP A 40 3.566 3.070 9.450 1.00 0.00 C ATOM 550 OD1 ASP A 40 3.735 4.163 10.029 1.00 0.00 O ATOM 551 OD2 ASP A 40 4.412 2.151 9.464 1.00 0.00 O ATOM 0 H ASP A 40 3.880 2.879 6.821 1.00 0.00 H new ATOM 0 HA ASP A 40 1.178 3.530 6.979 1.00 0.00 H new ATOM 0 HB2 ASP A 40 1.429 2.981 9.373 1.00 0.00 H new ATOM 0 HB3 ASP A 40 2.234 1.809 8.348 1.00 0.00 H new ATOM 556 N LEU A 41 3.156 5.855 8.205 1.00 0.00 N ATOM 557 CA LEU A 41 3.194 7.246 8.650 1.00 0.00 C ATOM 558 C LEU A 41 2.758 8.189 7.536 1.00 0.00 C ATOM 559 O LEU A 41 1.723 8.854 7.633 1.00 0.00 O ATOM 560 CB LEU A 41 4.610 7.614 9.099 1.00 0.00 C ATOM 561 CG LEU A 41 4.753 8.997 9.739 1.00 0.00 C ATOM 562 CD1 LEU A 41 3.932 9.083 11.017 1.00 0.00 C ATOM 563 CD2 LEU A 41 6.216 9.305 10.020 1.00 0.00 C ATOM 0 H LEU A 41 4.073 5.417 8.111 1.00 0.00 H new ATOM 0 HA LEU A 41 2.503 7.350 9.487 1.00 0.00 H new ATOM 0 HB2 LEU A 41 4.954 6.864 9.812 1.00 0.00 H new ATOM 0 HB3 LEU A 41 5.273 7.561 8.235 1.00 0.00 H new ATOM 0 HG LEU A 41 4.374 9.741 9.039 1.00 0.00 H new ATOM 0 HD11 LEU A 41 4.047 10.074 11.457 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.881 8.908 10.787 1.00 0.00 H new ATOM 0 HD13 LEU A 41 4.279 8.329 11.724 1.00 0.00 H new ATOM 0 HD21 LEU A 41 6.299 10.292 10.475 1.00 0.00 H new ATOM 0 HD22 LEU A 41 6.621 8.556 10.701 1.00 0.00 H new ATOM 0 HD23 LEU A 41 6.777 9.288 9.086 1.00 0.00 H new ATOM 575 N THR A 42 3.562 8.238 6.478 1.00 0.00 N ATOM 576 CA THR A 42 3.278 9.098 5.336 1.00 0.00 C ATOM 577 C THR A 42 1.856 8.887 4.833 1.00 0.00 C ATOM 578 O THR A 42 1.048 9.816 4.824 1.00 0.00 O ATOM 579 CB THR A 42 4.267 8.836 4.183 1.00 0.00 C ATOM 580 OG1 THR A 42 5.606 9.109 4.614 1.00 0.00 O ATOM 581 CG2 THR A 42 3.937 9.695 2.972 1.00 0.00 C ATOM 0 H THR A 42 4.418 7.690 6.389 1.00 0.00 H new ATOM 0 HA THR A 42 3.389 10.128 5.674 1.00 0.00 H new ATOM 0 HB THR A 42 4.181 7.788 3.897 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.020 8.282 4.939 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.651 9.489 2.174 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.930 9.464 2.626 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.994 10.748 3.247 1.00 0.00 H new ATOM 589 N ILE A 43 1.555 7.659 4.431 1.00 0.00 N ATOM 590 CA ILE A 43 0.227 7.324 3.941 1.00 0.00 C ATOM 591 C ILE A 43 -0.831 7.671 4.980 1.00 0.00 C ATOM 592 O ILE A 43 -1.917 8.136 4.637 1.00 0.00 O ATOM 593 CB ILE A 43 0.116 5.832 3.576 1.00 0.00 C ATOM 594 CG1 ILE A 43 1.135 5.477 2.489 1.00 0.00 C ATOM 595 CG2 ILE A 43 -1.295 5.505 3.114 1.00 0.00 C ATOM 596 CD1 ILE A 43 1.149 4.009 2.124 1.00 0.00 C ATOM 0 H ILE A 43 2.213 6.880 4.435 1.00 0.00 H new ATOM 0 HA ILE A 43 0.058 7.913 3.039 1.00 0.00 H new ATOM 0 HB ILE A 43 0.334 5.236 4.462 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.918 6.062 1.595 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.130 5.768 2.827 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.358 4.447 2.859 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.001 5.729 3.914 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -1.539 6.105 2.237 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.895 3.834 1.349 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.396 3.417 3.005 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.166 3.717 1.755 1.00 0.00 H new ATOM 608 N GLY A 44 -0.502 7.450 6.253 1.00 0.00 N ATOM 609 CA GLY A 44 -1.436 7.758 7.321 1.00 0.00 C ATOM 610 C GLY A 44 -1.963 9.174 7.211 1.00 0.00 C ATOM 611 O GLY A 44 -3.173 9.398 7.246 1.00 0.00 O ATOM 0 H GLY A 44 0.391 7.065 6.561 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.269 7.056 7.290 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -0.944 7.626 8.285 1.00 0.00 H new ATOM 615 N LEU A 45 -1.050 10.131 7.056 1.00 0.00 N ATOM 616 CA LEU A 45 -1.434 11.531 6.915 1.00 0.00 C ATOM 617 C LEU A 45 -2.182 11.753 5.602 1.00 0.00 C ATOM 618 O LEU A 45 -3.138 12.527 5.545 1.00 0.00 O ATOM 619 CB LEU A 45 -0.205 12.444 6.983 1.00 0.00 C ATOM 620 CG LEU A 45 0.380 12.663 8.385 1.00 0.00 C ATOM 621 CD1 LEU A 45 -0.661 13.277 9.308 1.00 0.00 C ATOM 622 CD2 LEU A 45 0.906 11.359 8.965 1.00 0.00 C ATOM 0 H LEU A 45 -0.045 9.962 7.025 1.00 0.00 H new ATOM 0 HA LEU A 45 -2.097 11.783 7.743 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.573 12.024 6.345 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.472 13.414 6.564 1.00 0.00 H new ATOM 0 HG LEU A 45 1.217 13.356 8.298 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -0.228 13.425 10.297 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.983 14.237 8.905 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -1.519 12.609 9.384 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.315 11.542 9.959 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.092 10.637 9.035 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.688 10.962 8.318 1.00 0.00 H new ATOM 634 N LEU A 46 -1.741 11.064 4.550 1.00 0.00 N ATOM 635 CA LEU A 46 -2.370 11.182 3.236 1.00 0.00 C ATOM 636 C LEU A 46 -3.854 10.825 3.294 1.00 0.00 C ATOM 637 O LEU A 46 -4.682 11.491 2.673 1.00 0.00 O ATOM 638 CB LEU A 46 -1.657 10.291 2.214 1.00 0.00 C ATOM 639 CG LEU A 46 -0.489 10.943 1.465 1.00 0.00 C ATOM 640 CD1 LEU A 46 -0.989 12.077 0.583 1.00 0.00 C ATOM 641 CD2 LEU A 46 0.564 11.454 2.436 1.00 0.00 C ATOM 0 H LEU A 46 -0.951 10.419 4.582 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.282 12.222 2.923 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.285 9.405 2.729 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.390 9.951 1.482 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.029 10.184 0.832 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.147 12.529 0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.701 11.686 -0.144 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -1.478 12.830 1.201 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.381 11.912 1.879 1.00 0.00 H new ATOM 0 HD22 LEU A 46 0.118 12.195 3.100 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.949 10.622 3.026 1.00 0.00 H new ATOM 653 N LEU A 47 -4.186 9.773 4.040 1.00 0.00 N ATOM 654 CA LEU A 47 -5.575 9.343 4.171 1.00 0.00 C ATOM 655 C LEU A 47 -6.435 10.496 4.665 1.00 0.00 C ATOM 656 O LEU A 47 -7.474 10.807 4.083 1.00 0.00 O ATOM 657 CB LEU A 47 -5.680 8.161 5.136 1.00 0.00 C ATOM 658 CG LEU A 47 -4.786 6.964 4.800 1.00 0.00 C ATOM 659 CD1 LEU A 47 -5.008 5.839 5.797 1.00 0.00 C ATOM 660 CD2 LEU A 47 -5.045 6.482 3.380 1.00 0.00 C ATOM 0 H LEU A 47 -3.516 9.206 4.560 1.00 0.00 H new ATOM 0 HA LEU A 47 -5.934 9.027 3.192 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -5.433 8.508 6.139 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -6.716 7.824 5.162 1.00 0.00 H new ATOM 0 HG LEU A 47 -3.746 7.282 4.867 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.365 4.996 5.544 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.768 6.190 6.801 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.051 5.523 5.763 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.400 5.631 3.161 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.088 6.181 3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.833 7.288 2.678 1.00 0.00 H new ATOM 672 N LYS A 48 -5.982 11.137 5.738 1.00 0.00 N ATOM 673 CA LYS A 48 -6.693 12.272 6.309 1.00 0.00 C ATOM 674 C LYS A 48 -6.344 13.554 5.561 1.00 0.00 C ATOM 675 O LYS A 48 -6.133 14.603 6.172 1.00 0.00 O ATOM 676 CB LYS A 48 -6.357 12.418 7.794 1.00 0.00 C ATOM 677 CG LYS A 48 -6.798 11.234 8.639 1.00 0.00 C ATOM 678 CD LYS A 48 -6.470 11.428 10.114 1.00 0.00 C ATOM 679 CE LYS A 48 -7.307 12.533 10.747 1.00 0.00 C ATOM 680 NZ LYS A 48 -6.964 13.882 10.214 1.00 0.00 N ATOM 0 H LYS A 48 -5.124 10.888 6.229 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.763 12.093 6.208 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.280 12.550 7.903 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.829 13.323 8.177 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -7.872 11.087 8.523 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.311 10.329 8.276 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.640 10.494 10.649 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.412 11.668 10.221 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -8.363 12.333 10.568 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.159 12.524 11.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.985 14.577 10.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -6.012 13.858 9.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.655 14.154 9.486 1.00 0.00 H new ATOM 694 N GLU A 49 -6.286 13.461 4.234 1.00 0.00 N ATOM 695 CA GLU A 49 -5.964 14.612 3.398 1.00 0.00 C ATOM 696 C GLU A 49 -6.909 15.769 3.698 1.00 0.00 C ATOM 697 O GLU A 49 -6.483 16.918 3.821 1.00 0.00 O ATOM 698 CB GLU A 49 -6.053 14.233 1.917 1.00 0.00 C ATOM 699 CG GLU A 49 -5.699 15.370 0.972 1.00 0.00 C ATOM 700 CD GLU A 49 -5.806 14.971 -0.487 1.00 0.00 C ATOM 701 OE1 GLU A 49 -6.162 13.804 -0.760 1.00 0.00 O ATOM 702 OE2 GLU A 49 -5.534 15.824 -1.357 1.00 0.00 O ATOM 0 H GLU A 49 -6.458 12.599 3.716 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.945 14.926 3.621 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.386 13.392 1.726 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -7.065 13.893 1.699 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.360 16.215 1.163 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.683 15.707 1.179 1.00 0.00 H new ATOM 709 N ASN A 50 -8.194 15.452 3.821 1.00 0.00 N ATOM 710 CA ASN A 50 -9.204 16.462 4.116 1.00 0.00 C ATOM 711 C ASN A 50 -9.064 16.968 5.553 1.00 0.00 C ATOM 712 O ASN A 50 -7.953 17.080 6.072 1.00 0.00 O ATOM 713 CB ASN A 50 -10.605 15.888 3.884 1.00 0.00 C ATOM 714 CG ASN A 50 -10.859 14.628 4.689 1.00 0.00 C ATOM 715 OD1 ASN A 50 -10.788 14.636 5.917 1.00 0.00 O ATOM 716 ND2 ASN A 50 -11.160 13.534 3.998 1.00 0.00 N ATOM 0 H ASN A 50 -8.560 14.505 3.721 1.00 0.00 H new ATOM 0 HA ASN A 50 -9.054 17.307 3.444 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -11.350 16.639 4.147 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -10.733 15.670 2.824 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.343 12.657 4.486 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -11.208 13.571 2.980 1.00 0.00 H new ATOM 723 N ASP A 51 -10.194 17.267 6.194 1.00 0.00 N ATOM 724 CA ASP A 51 -10.190 17.753 7.571 1.00 0.00 C ATOM 725 C ASP A 51 -9.303 18.997 7.702 1.00 0.00 C ATOM 726 O ASP A 51 -9.532 19.997 7.021 1.00 0.00 O ATOM 727 CB ASP A 51 -9.725 16.643 8.523 1.00 0.00 C ATOM 728 CG ASP A 51 -10.079 16.926 9.972 1.00 0.00 C ATOM 729 OD1 ASP A 51 -9.612 17.950 10.513 1.00 0.00 O ATOM 730 OD2 ASP A 51 -10.826 16.120 10.566 1.00 0.00 O ATOM 0 H ASP A 51 -11.123 17.181 5.781 1.00 0.00 H new ATOM 0 HA ASP A 51 -11.206 18.036 7.845 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -10.177 15.698 8.221 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.645 16.523 8.434 1.00 0.00 H new ATOM 735 N ASP A 52 -8.297 18.930 8.578 1.00 0.00 N ATOM 736 CA ASP A 52 -7.380 20.047 8.802 1.00 0.00 C ATOM 737 C ASP A 52 -8.116 21.260 9.364 1.00 0.00 C ATOM 738 O ASP A 52 -9.033 21.792 8.738 1.00 0.00 O ATOM 739 CB ASP A 52 -6.664 20.426 7.503 1.00 0.00 C ATOM 740 CG ASP A 52 -5.702 21.583 7.689 1.00 0.00 C ATOM 741 OD1 ASP A 52 -4.763 21.450 8.503 1.00 0.00 O ATOM 742 OD2 ASP A 52 -5.887 22.623 7.022 1.00 0.00 O ATOM 0 H ASP A 52 -8.097 18.107 9.147 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.639 19.725 9.534 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -6.119 19.561 7.126 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -7.404 20.690 6.747 1.00 0.00 H new ATOM 747 N LYS A 53 -7.702 21.698 10.549 1.00 0.00 N ATOM 748 CA LYS A 53 -8.318 22.850 11.196 1.00 0.00 C ATOM 749 C LYS A 53 -7.550 24.130 10.878 1.00 0.00 C ATOM 750 O LYS A 53 -6.319 24.147 10.893 1.00 0.00 O ATOM 751 CB LYS A 53 -8.383 22.640 12.710 1.00 0.00 C ATOM 752 CG LYS A 53 -9.200 21.424 13.117 1.00 0.00 C ATOM 753 CD LYS A 53 -9.282 21.278 14.630 1.00 0.00 C ATOM 754 CE LYS A 53 -10.045 22.432 15.264 1.00 0.00 C ATOM 755 NZ LYS A 53 -11.432 22.542 14.733 1.00 0.00 N ATOM 0 H LYS A 53 -6.942 21.272 11.080 1.00 0.00 H new ATOM 0 HA LYS A 53 -9.332 22.952 10.809 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -7.370 22.534 13.098 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -8.811 23.528 13.174 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -10.206 21.507 12.705 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -8.754 20.526 12.689 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -9.772 20.337 14.879 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -8.276 21.234 15.047 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -10.080 22.293 16.345 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -9.511 23.364 15.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -11.998 23.145 15.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -11.407 22.962 13.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -11.860 21.596 14.682 1.00 0.00 H new ATOM 769 N SER A 54 -8.287 25.198 10.591 1.00 0.00 N ATOM 770 CA SER A 54 -7.679 26.485 10.268 1.00 0.00 C ATOM 771 C SER A 54 -6.835 26.996 11.432 1.00 0.00 C ATOM 772 O SER A 54 -5.634 27.269 11.217 1.00 0.00 O ATOM 773 CB SER A 54 -8.761 27.510 9.922 1.00 0.00 C ATOM 774 OG SER A 54 -9.647 27.705 11.011 1.00 0.00 O ATOM 775 OXT SER A 54 -7.380 27.118 12.549 1.00 0.00 O ATOM 0 H SER A 54 -9.307 25.198 10.575 1.00 0.00 H new ATOM 0 HA SER A 54 -7.029 26.345 9.404 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.295 28.458 9.654 1.00 0.00 H new ATOM 0 HB3 SER A 54 -9.321 27.172 9.050 1.00 0.00 H new ATOM 0 HG SER A 54 -9.155 27.615 11.854 1.00 0.00 H new TER 781 SER A 54 ATOM 782 N MET B 1 -16.261 -10.844 -12.217 1.00 0.00 N ATOM 783 CA MET B 1 -15.684 -9.657 -11.531 1.00 0.00 C ATOM 784 C MET B 1 -14.797 -10.070 -10.359 1.00 0.00 C ATOM 785 O MET B 1 -15.135 -10.979 -9.601 1.00 0.00 O ATOM 786 CB MET B 1 -16.830 -8.773 -11.039 1.00 0.00 C ATOM 787 CG MET B 1 -16.359 -7.533 -10.295 1.00 0.00 C ATOM 788 SD MET B 1 -17.724 -6.506 -9.719 1.00 0.00 S ATOM 789 CE MET B 1 -16.828 -5.211 -8.868 1.00 0.00 C ATOM 0 H1 MET B 1 -17.263 -10.668 -12.431 1.00 0.00 H new ATOM 0 H2 MET B 1 -15.744 -11.019 -13.102 1.00 0.00 H new ATOM 0 H3 MET B 1 -16.180 -11.676 -11.598 1.00 0.00 H new ATOM 0 HA MET B 1 -15.060 -9.107 -12.236 1.00 0.00 H new ATOM 0 HB2 MET B 1 -17.436 -8.468 -11.892 1.00 0.00 H new ATOM 0 HB3 MET B 1 -17.475 -9.358 -10.383 1.00 0.00 H new ATOM 0 HG2 MET B 1 -15.752 -7.835 -9.442 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.717 -6.943 -10.950 1.00 0.00 H new ATOM 0 HE1 MET B 1 -17.340 -4.260 -9.011 1.00 0.00 H new ATOM 0 HE2 MET B 1 -16.780 -5.441 -7.804 1.00 0.00 H new ATOM 0 HE3 MET B 1 -15.817 -5.143 -9.270 1.00 0.00 H new ATOM 801 N GLN B 2 -13.663 -9.389 -10.218 1.00 0.00 N ATOM 802 CA GLN B 2 -12.722 -9.677 -9.139 1.00 0.00 C ATOM 803 C GLN B 2 -12.029 -8.400 -8.674 1.00 0.00 C ATOM 804 O GLN B 2 -12.314 -7.314 -9.175 1.00 0.00 O ATOM 805 CB GLN B 2 -11.675 -10.696 -9.599 1.00 0.00 C ATOM 806 CG GLN B 2 -12.270 -12.005 -10.095 1.00 0.00 C ATOM 807 CD GLN B 2 -11.215 -13.025 -10.471 1.00 0.00 C ATOM 808 OE1 GLN B 2 -10.417 -13.447 -9.633 1.00 0.00 O ATOM 809 NE2 GLN B 2 -11.203 -13.427 -11.736 1.00 0.00 N ATOM 0 H GLN B 2 -13.373 -8.633 -10.838 1.00 0.00 H new ATOM 0 HA GLN B 2 -13.283 -10.097 -8.304 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -11.077 -10.254 -10.396 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -10.998 -10.906 -8.771 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -12.913 -12.423 -9.320 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -12.902 -11.807 -10.961 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -11.883 -13.051 -12.397 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -10.514 -14.112 -12.047 1.00 0.00 H new ATOM 818 N ILE B 3 -11.120 -8.538 -7.712 1.00 0.00 N ATOM 819 CA ILE B 3 -10.387 -7.393 -7.177 1.00 0.00 C ATOM 820 C ILE B 3 -8.979 -7.798 -6.749 1.00 0.00 C ATOM 821 O ILE B 3 -8.795 -8.786 -6.037 1.00 0.00 O ATOM 822 CB ILE B 3 -11.118 -6.768 -5.970 1.00 0.00 C ATOM 823 CG1 ILE B 3 -11.375 -7.828 -4.893 1.00 0.00 C ATOM 824 CG2 ILE B 3 -12.423 -6.121 -6.413 1.00 0.00 C ATOM 825 CD1 ILE B 3 -12.049 -7.285 -3.650 1.00 0.00 C ATOM 0 H ILE B 3 -10.873 -9.432 -7.287 1.00 0.00 H new ATOM 0 HA ILE B 3 -10.326 -6.654 -7.976 1.00 0.00 H new ATOM 0 HB ILE B 3 -10.482 -5.993 -5.542 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -11.995 -8.619 -5.315 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -10.426 -8.284 -4.611 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -12.925 -5.686 -5.549 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -12.212 -5.339 -7.142 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -13.068 -6.875 -6.865 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -12.198 -8.093 -2.934 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -11.421 -6.515 -3.202 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -13.014 -6.855 -3.918 1.00 0.00 H new ATOM 837 N PHE B 4 -7.986 -7.032 -7.195 1.00 0.00 N ATOM 838 CA PHE B 4 -6.593 -7.319 -6.860 1.00 0.00 C ATOM 839 C PHE B 4 -6.185 -6.648 -5.552 1.00 0.00 C ATOM 840 O PHE B 4 -6.190 -5.422 -5.447 1.00 0.00 O ATOM 841 CB PHE B 4 -5.664 -6.852 -7.987 1.00 0.00 C ATOM 842 CG PHE B 4 -5.816 -7.617 -9.273 1.00 0.00 C ATOM 843 CD1 PHE B 4 -7.057 -7.764 -9.877 1.00 0.00 C ATOM 844 CD2 PHE B 4 -4.709 -8.187 -9.883 1.00 0.00 C ATOM 845 CE1 PHE B 4 -7.188 -8.463 -11.061 1.00 0.00 C ATOM 846 CE2 PHE B 4 -4.836 -8.887 -11.067 1.00 0.00 C ATOM 847 CZ PHE B 4 -6.076 -9.026 -11.657 1.00 0.00 C ATOM 0 H PHE B 4 -8.119 -6.212 -7.786 1.00 0.00 H new ATOM 0 HA PHE B 4 -6.501 -8.398 -6.737 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -5.851 -5.796 -8.182 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -4.631 -6.935 -7.648 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -7.930 -7.327 -9.416 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -3.736 -8.082 -9.427 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -8.159 -8.569 -11.521 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -3.965 -9.326 -11.531 1.00 0.00 H new ATOM 0 HZ PHE B 4 -6.177 -9.574 -12.582 1.00 0.00 H new ATOM 857 N VAL B 5 -5.813 -7.457 -4.564 1.00 0.00 N ATOM 858 CA VAL B 5 -5.380 -6.936 -3.271 1.00 0.00 C ATOM 859 C VAL B 5 -3.864 -6.766 -3.251 1.00 0.00 C ATOM 860 O VAL B 5 -3.127 -7.719 -2.998 1.00 0.00 O ATOM 861 CB VAL B 5 -5.805 -7.862 -2.115 1.00 0.00 C ATOM 862 CG1 VAL B 5 -5.387 -7.277 -0.773 1.00 0.00 C ATOM 863 CG2 VAL B 5 -7.306 -8.103 -2.147 1.00 0.00 C ATOM 0 H VAL B 5 -5.803 -8.475 -4.634 1.00 0.00 H new ATOM 0 HA VAL B 5 -5.862 -5.968 -3.131 1.00 0.00 H new ATOM 0 HB VAL B 5 -5.299 -8.819 -2.243 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -5.697 -7.947 0.029 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -4.304 -7.159 -0.749 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -5.861 -6.305 -0.637 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -7.587 -8.759 -1.323 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -7.829 -7.152 -2.048 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -7.579 -8.571 -3.093 1.00 0.00 H new ATOM 873 N LYS B 6 -3.403 -5.550 -3.532 1.00 0.00 N ATOM 874 CA LYS B 6 -1.972 -5.265 -3.560 1.00 0.00 C ATOM 875 C LYS B 6 -1.463 -4.799 -2.200 1.00 0.00 C ATOM 876 O LYS B 6 -2.023 -3.886 -1.594 1.00 0.00 O ATOM 877 CB LYS B 6 -1.662 -4.207 -4.621 1.00 0.00 C ATOM 878 CG LYS B 6 -0.185 -3.856 -4.715 1.00 0.00 C ATOM 879 CD LYS B 6 0.074 -2.827 -5.803 1.00 0.00 C ATOM 880 CE LYS B 6 1.551 -2.475 -5.894 1.00 0.00 C ATOM 881 NZ LYS B 6 1.811 -1.453 -6.945 1.00 0.00 N ATOM 0 H LYS B 6 -3.998 -4.749 -3.743 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.458 -6.193 -3.812 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.004 -4.566 -5.592 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.229 -3.303 -4.398 1.00 0.00 H new ATOM 0 HG2 LYS B 6 0.160 -3.468 -3.756 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.392 -4.758 -4.920 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.269 -3.215 -6.762 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.504 -1.926 -5.599 1.00 0.00 H new ATOM 0 HE2 LYS B 6 1.896 -2.101 -4.930 1.00 0.00 H new ATOM 0 HE3 LYS B 6 2.127 -3.375 -6.111 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 2.828 -1.239 -6.977 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 1.505 -1.820 -7.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 1.282 -0.586 -6.724 1.00 0.00 H new ATOM 895 N THR B 7 -0.383 -5.421 -1.741 1.00 0.00 N ATOM 896 CA THR B 7 0.231 -5.069 -0.467 1.00 0.00 C ATOM 897 C THR B 7 1.345 -4.052 -0.681 1.00 0.00 C ATOM 898 O THR B 7 2.007 -4.061 -1.720 1.00 0.00 O ATOM 899 CB THR B 7 0.808 -6.306 0.247 1.00 0.00 C ATOM 900 OG1 THR B 7 1.814 -6.915 -0.572 1.00 0.00 O ATOM 901 CG2 THR B 7 -0.288 -7.316 0.549 1.00 0.00 C ATOM 0 H THR B 7 0.088 -6.177 -2.237 1.00 0.00 H new ATOM 0 HA THR B 7 -0.549 -4.639 0.161 1.00 0.00 H new ATOM 0 HB THR B 7 1.251 -5.984 1.189 1.00 0.00 H new ATOM 0 HG1 THR B 7 2.674 -6.896 -0.102 1.00 0.00 H new ATOM 0 HG21 THR B 7 0.143 -8.181 1.053 1.00 0.00 H new ATOM 0 HG22 THR B 7 -1.038 -6.857 1.193 1.00 0.00 H new ATOM 0 HG23 THR B 7 -0.756 -7.635 -0.383 1.00 0.00 H new ATOM 909 N LEU B 8 1.547 -3.173 0.296 1.00 0.00 N ATOM 910 CA LEU B 8 2.584 -2.151 0.197 1.00 0.00 C ATOM 911 C LEU B 8 3.927 -2.765 -0.188 1.00 0.00 C ATOM 912 O LEU B 8 4.687 -2.181 -0.961 1.00 0.00 O ATOM 913 CB LEU B 8 2.727 -1.394 1.520 1.00 0.00 C ATOM 914 CG LEU B 8 1.464 -0.684 2.015 1.00 0.00 C ATOM 915 CD1 LEU B 8 1.782 0.155 3.245 1.00 0.00 C ATOM 916 CD2 LEU B 8 0.861 0.181 0.918 1.00 0.00 C ATOM 0 H LEU B 8 1.009 -3.148 1.162 1.00 0.00 H new ATOM 0 HA LEU B 8 2.282 -1.453 -0.584 1.00 0.00 H new ATOM 0 HB2 LEU B 8 3.051 -2.097 2.287 1.00 0.00 H new ATOM 0 HB3 LEU B 8 3.519 -0.654 1.411 1.00 0.00 H new ATOM 0 HG LEU B 8 0.728 -1.441 2.288 1.00 0.00 H new ATOM 0 HD11 LEU B 8 0.876 0.655 3.588 1.00 0.00 H new ATOM 0 HD12 LEU B 8 2.163 -0.490 4.037 1.00 0.00 H new ATOM 0 HD13 LEU B 8 2.535 0.901 2.992 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -0.035 0.674 1.295 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.586 0.933 0.608 1.00 0.00 H new ATOM 0 HD23 LEU B 8 0.599 -0.444 0.064 1.00 0.00 H new ATOM 928 N THR B 9 4.215 -3.943 0.360 1.00 0.00 N ATOM 929 CA THR B 9 5.469 -4.630 0.075 1.00 0.00 C ATOM 930 C THR B 9 5.605 -4.947 -1.412 1.00 0.00 C ATOM 931 O THR B 9 6.564 -4.526 -2.059 1.00 0.00 O ATOM 932 CB THR B 9 5.583 -5.941 0.875 1.00 0.00 C ATOM 933 OG1 THR B 9 4.514 -6.827 0.523 1.00 0.00 O ATOM 934 CG2 THR B 9 5.547 -5.667 2.370 1.00 0.00 C ATOM 0 H THR B 9 3.598 -4.440 1.002 1.00 0.00 H new ATOM 0 HA THR B 9 6.271 -3.954 0.373 1.00 0.00 H new ATOM 0 HB THR B 9 6.537 -6.408 0.629 1.00 0.00 H new ATOM 0 HG1 THR B 9 4.596 -7.658 1.036 1.00 0.00 H new ATOM 0 HG21 THR B 9 5.629 -6.608 2.914 1.00 0.00 H new ATOM 0 HG22 THR B 9 6.379 -5.017 2.641 1.00 0.00 H new ATOM 0 HG23 THR B 9 4.607 -5.179 2.628 1.00 0.00 H new ATOM 942 N GLY B 10 4.640 -5.689 -1.948 1.00 0.00 N ATOM 943 CA GLY B 10 4.676 -6.046 -3.354 1.00 0.00 C ATOM 944 C GLY B 10 4.052 -7.401 -3.627 1.00 0.00 C ATOM 945 O GLY B 10 4.679 -8.265 -4.243 1.00 0.00 O ATOM 0 H GLY B 10 3.835 -6.048 -1.434 1.00 0.00 H new ATOM 0 HA2 GLY B 10 4.151 -5.285 -3.932 1.00 0.00 H new ATOM 0 HA3 GLY B 10 5.710 -6.050 -3.698 1.00 0.00 H new ATOM 949 N LYS B 11 2.820 -7.594 -3.167 1.00 0.00 N ATOM 950 CA LYS B 11 2.123 -8.860 -3.367 1.00 0.00 C ATOM 951 C LYS B 11 0.659 -8.628 -3.727 1.00 0.00 C ATOM 952 O LYS B 11 -0.065 -7.934 -3.014 1.00 0.00 O ATOM 953 CB LYS B 11 2.218 -9.719 -2.103 1.00 0.00 C ATOM 954 CG LYS B 11 1.479 -11.045 -2.208 1.00 0.00 C ATOM 955 CD LYS B 11 1.571 -11.838 -0.914 1.00 0.00 C ATOM 956 CE LYS B 11 0.806 -13.149 -1.010 1.00 0.00 C ATOM 957 NZ LYS B 11 0.881 -13.931 0.255 1.00 0.00 N ATOM 0 H LYS B 11 2.285 -6.893 -2.655 1.00 0.00 H new ATOM 0 HA LYS B 11 2.602 -9.383 -4.195 1.00 0.00 H new ATOM 0 HB2 LYS B 11 3.268 -9.915 -1.885 1.00 0.00 H new ATOM 0 HB3 LYS B 11 1.817 -9.155 -1.260 1.00 0.00 H new ATOM 0 HG2 LYS B 11 0.432 -10.861 -2.450 1.00 0.00 H new ATOM 0 HG3 LYS B 11 1.897 -11.632 -3.026 1.00 0.00 H new ATOM 0 HD2 LYS B 11 2.617 -12.041 -0.684 1.00 0.00 H new ATOM 0 HD3 LYS B 11 1.174 -11.243 -0.092 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -0.238 -12.943 -1.248 1.00 0.00 H new ATOM 0 HE3 LYS B 11 1.208 -13.745 -1.829 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 0.347 -14.817 0.148 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 1.875 -14.150 0.470 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 0.474 -13.373 1.033 1.00 0.00 H new ATOM 971 N THR B 12 0.231 -9.220 -4.838 1.00 0.00 N ATOM 972 CA THR B 12 -1.145 -9.085 -5.298 1.00 0.00 C ATOM 973 C THR B 12 -1.954 -10.343 -5.000 1.00 0.00 C ATOM 974 O THR B 12 -1.473 -11.461 -5.186 1.00 0.00 O ATOM 975 CB THR B 12 -1.208 -8.798 -6.810 1.00 0.00 C ATOM 976 OG1 THR B 12 -0.567 -9.855 -7.537 1.00 0.00 O ATOM 977 CG2 THR B 12 -0.538 -7.472 -7.139 1.00 0.00 C ATOM 0 H THR B 12 0.820 -9.799 -5.437 1.00 0.00 H new ATOM 0 HA THR B 12 -1.575 -8.243 -4.756 1.00 0.00 H new ATOM 0 HB THR B 12 -2.257 -8.739 -7.102 1.00 0.00 H new ATOM 0 HG1 THR B 12 -0.613 -9.666 -8.498 1.00 0.00 H new ATOM 0 HG21 THR B 12 -0.595 -7.292 -8.212 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.045 -6.666 -6.608 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.507 -7.507 -6.832 1.00 0.00 H new ATOM 985 N ILE B 13 -3.188 -10.151 -4.548 1.00 0.00 N ATOM 986 CA ILE B 13 -4.070 -11.269 -4.235 1.00 0.00 C ATOM 987 C ILE B 13 -5.469 -11.015 -4.782 1.00 0.00 C ATOM 988 O ILE B 13 -6.302 -10.388 -4.126 1.00 0.00 O ATOM 989 CB ILE B 13 -4.151 -11.523 -2.715 1.00 0.00 C ATOM 990 CG1 ILE B 13 -2.768 -11.886 -2.168 1.00 0.00 C ATOM 991 CG2 ILE B 13 -5.158 -12.627 -2.412 1.00 0.00 C ATOM 992 CD1 ILE B 13 -2.739 -12.099 -0.668 1.00 0.00 C ATOM 0 H ILE B 13 -3.600 -9.232 -4.390 1.00 0.00 H new ATOM 0 HA ILE B 13 -3.648 -12.155 -4.709 1.00 0.00 H new ATOM 0 HB ILE B 13 -4.489 -10.611 -2.224 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -2.420 -12.794 -2.661 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -2.066 -11.093 -2.426 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -5.203 -12.793 -1.336 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -6.142 -12.331 -2.775 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -4.850 -13.547 -2.909 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -1.726 -12.353 -0.356 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.056 -11.186 -0.165 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.415 -12.912 -0.403 1.00 0.00 H new ATOM 1004 N THR B 14 -5.715 -11.502 -5.994 1.00 0.00 N ATOM 1005 CA THR B 14 -7.008 -11.325 -6.639 1.00 0.00 C ATOM 1006 C THR B 14 -8.073 -12.208 -6.002 1.00 0.00 C ATOM 1007 O THR B 14 -7.799 -13.338 -5.596 1.00 0.00 O ATOM 1008 CB THR B 14 -6.942 -11.635 -8.144 1.00 0.00 C ATOM 1009 OG1 THR B 14 -5.964 -10.801 -8.776 1.00 0.00 O ATOM 1010 CG2 THR B 14 -8.300 -11.411 -8.789 1.00 0.00 C ATOM 0 H THR B 14 -5.035 -12.022 -6.548 1.00 0.00 H new ATOM 0 HA THR B 14 -7.277 -10.278 -6.503 1.00 0.00 H new ATOM 0 HB THR B 14 -6.658 -12.680 -8.271 1.00 0.00 H new ATOM 0 HG1 THR B 14 -6.320 -9.893 -8.871 1.00 0.00 H new ATOM 0 HG21 THR B 14 -8.238 -11.634 -9.854 1.00 0.00 H new ATOM 0 HG22 THR B 14 -9.037 -12.066 -8.323 1.00 0.00 H new ATOM 0 HG23 THR B 14 -8.601 -10.372 -8.653 1.00 0.00 H new ATOM 1018 N LEU B 15 -9.290 -11.681 -5.921 1.00 0.00 N ATOM 1019 CA LEU B 15 -10.408 -12.409 -5.338 1.00 0.00 C ATOM 1020 C LEU B 15 -11.702 -12.056 -6.062 1.00 0.00 C ATOM 1021 O LEU B 15 -11.960 -10.890 -6.360 1.00 0.00 O ATOM 1022 CB LEU B 15 -10.530 -12.066 -3.858 1.00 0.00 C ATOM 1023 CG LEU B 15 -9.237 -12.215 -3.057 1.00 0.00 C ATOM 1024 CD1 LEU B 15 -9.273 -11.332 -1.827 1.00 0.00 C ATOM 1025 CD2 LEU B 15 -9.014 -13.667 -2.662 1.00 0.00 C ATOM 0 H LEU B 15 -9.527 -10.747 -6.254 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.228 -13.479 -5.445 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -10.882 -11.039 -3.765 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.292 -12.705 -3.413 1.00 0.00 H new ATOM 0 HG LEU B 15 -8.405 -11.900 -3.687 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -8.345 -11.450 -1.267 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.385 -10.291 -2.130 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -10.115 -11.619 -1.197 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -8.088 -13.751 -2.093 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -9.849 -14.010 -2.051 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -8.945 -14.282 -3.559 1.00 0.00 H new ATOM 1037 N GLU B 16 -12.506 -13.070 -6.351 1.00 0.00 N ATOM 1038 CA GLU B 16 -13.771 -12.868 -7.052 1.00 0.00 C ATOM 1039 C GLU B 16 -14.826 -12.277 -6.125 1.00 0.00 C ATOM 1040 O GLU B 16 -15.031 -12.764 -5.013 1.00 0.00 O ATOM 1041 CB GLU B 16 -14.270 -14.190 -7.635 1.00 0.00 C ATOM 1042 CG GLU B 16 -15.571 -14.060 -8.410 1.00 0.00 C ATOM 1043 CD GLU B 16 -16.034 -15.379 -8.997 1.00 0.00 C ATOM 1044 OE1 GLU B 16 -16.271 -16.325 -8.217 1.00 0.00 O ATOM 1045 OE2 GLU B 16 -16.159 -15.465 -10.236 1.00 0.00 O ATOM 0 H GLU B 16 -12.307 -14.041 -6.112 1.00 0.00 H new ATOM 0 HA GLU B 16 -13.596 -12.162 -7.864 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -13.504 -14.599 -8.293 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -14.409 -14.905 -6.825 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -16.345 -13.668 -7.750 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -15.440 -13.335 -9.213 1.00 0.00 H new ATOM 1052 N VAL B 17 -15.498 -11.226 -6.594 1.00 0.00 N ATOM 1053 CA VAL B 17 -16.538 -10.567 -5.809 1.00 0.00 C ATOM 1054 C VAL B 17 -17.588 -9.921 -6.708 1.00 0.00 C ATOM 1055 O VAL B 17 -17.260 -9.267 -7.698 1.00 0.00 O ATOM 1056 CB VAL B 17 -15.954 -9.483 -4.877 1.00 0.00 C ATOM 1057 CG1 VAL B 17 -15.076 -10.104 -3.802 1.00 0.00 C ATOM 1058 CG2 VAL B 17 -15.175 -8.451 -5.678 1.00 0.00 C ATOM 0 H VAL B 17 -15.340 -10.814 -7.513 1.00 0.00 H new ATOM 0 HA VAL B 17 -17.003 -11.346 -5.204 1.00 0.00 H new ATOM 0 HB VAL B 17 -16.785 -8.979 -4.383 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -14.677 -9.319 -3.159 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -15.668 -10.797 -3.204 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -14.252 -10.642 -4.271 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -14.772 -7.696 -5.003 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -14.357 -8.942 -6.205 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -15.838 -7.975 -6.401 1.00 0.00 H new ATOM 1068 N GLU B 18 -18.853 -10.106 -6.347 1.00 0.00 N ATOM 1069 CA GLU B 18 -19.961 -9.542 -7.108 1.00 0.00 C ATOM 1070 C GLU B 18 -20.011 -8.028 -6.939 1.00 0.00 C ATOM 1071 O GLU B 18 -19.633 -7.500 -5.893 1.00 0.00 O ATOM 1072 CB GLU B 18 -21.286 -10.157 -6.651 1.00 0.00 C ATOM 1073 CG GLU B 18 -22.496 -9.663 -7.430 1.00 0.00 C ATOM 1074 CD GLU B 18 -22.459 -10.055 -8.897 1.00 0.00 C ATOM 1075 OE1 GLU B 18 -21.508 -10.755 -9.305 1.00 0.00 O ATOM 1076 OE2 GLU B 18 -23.385 -9.663 -9.638 1.00 0.00 O ATOM 0 H GLU B 18 -19.137 -10.645 -5.529 1.00 0.00 H new ATOM 0 HA GLU B 18 -19.804 -9.773 -8.162 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -21.224 -11.241 -6.745 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -21.432 -9.936 -5.594 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -23.402 -10.064 -6.975 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -22.553 -8.577 -7.351 1.00 0.00 H new ATOM 1083 N SER B 19 -20.482 -7.334 -7.970 1.00 0.00 N ATOM 1084 CA SER B 19 -20.586 -5.880 -7.926 1.00 0.00 C ATOM 1085 C SER B 19 -21.381 -5.437 -6.702 1.00 0.00 C ATOM 1086 O SER B 19 -21.031 -4.459 -6.041 1.00 0.00 O ATOM 1087 CB SER B 19 -21.253 -5.356 -9.199 1.00 0.00 C ATOM 1088 OG SER B 19 -22.558 -5.891 -9.348 1.00 0.00 O ATOM 0 H SER B 19 -20.797 -7.754 -8.844 1.00 0.00 H new ATOM 0 HA SER B 19 -19.580 -5.467 -7.858 1.00 0.00 H new ATOM 0 HB2 SER B 19 -21.304 -4.268 -9.165 1.00 0.00 H new ATOM 0 HB3 SER B 19 -20.647 -5.620 -10.066 1.00 0.00 H new ATOM 0 HG SER B 19 -22.964 -5.540 -10.168 1.00 0.00 H new ATOM 1094 N SER B 20 -22.453 -6.166 -6.407 1.00 0.00 N ATOM 1095 CA SER B 20 -23.304 -5.858 -5.262 1.00 0.00 C ATOM 1096 C SER B 20 -22.718 -6.428 -3.971 1.00 0.00 C ATOM 1097 O SER B 20 -23.413 -7.093 -3.203 1.00 0.00 O ATOM 1098 CB SER B 20 -24.713 -6.410 -5.489 1.00 0.00 C ATOM 1099 OG SER B 20 -25.301 -5.842 -6.646 1.00 0.00 O ATOM 0 H SER B 20 -22.754 -6.977 -6.947 1.00 0.00 H new ATOM 0 HA SER B 20 -23.357 -4.774 -5.161 1.00 0.00 H new ATOM 0 HB2 SER B 20 -24.670 -7.494 -5.594 1.00 0.00 H new ATOM 0 HB3 SER B 20 -25.335 -6.198 -4.619 1.00 0.00 H new ATOM 0 HG SER B 20 -26.200 -6.211 -6.771 1.00 0.00 H new ATOM 1105 N ASP B 21 -21.437 -6.157 -3.735 1.00 0.00 N ATOM 1106 CA ASP B 21 -20.762 -6.635 -2.536 1.00 0.00 C ATOM 1107 C ASP B 21 -20.239 -5.458 -1.725 1.00 0.00 C ATOM 1108 O ASP B 21 -19.494 -4.621 -2.233 1.00 0.00 O ATOM 1109 CB ASP B 21 -19.611 -7.575 -2.908 1.00 0.00 C ATOM 1110 CG ASP B 21 -18.935 -8.180 -1.692 1.00 0.00 C ATOM 1111 OD1 ASP B 21 -18.368 -7.416 -0.883 1.00 0.00 O ATOM 1112 OD2 ASP B 21 -18.974 -9.420 -1.548 1.00 0.00 O ATOM 0 H ASP B 21 -20.847 -5.608 -4.360 1.00 0.00 H new ATOM 0 HA ASP B 21 -21.479 -7.189 -1.931 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -19.991 -8.375 -3.543 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -18.873 -7.026 -3.494 1.00 0.00 H new ATOM 1117 N THR B 22 -20.645 -5.396 -0.465 1.00 0.00 N ATOM 1118 CA THR B 22 -20.233 -4.316 0.420 1.00 0.00 C ATOM 1119 C THR B 22 -18.761 -4.427 0.804 1.00 0.00 C ATOM 1120 O THR B 22 -18.238 -5.526 0.993 1.00 0.00 O ATOM 1121 CB THR B 22 -21.095 -4.292 1.692 1.00 0.00 C ATOM 1122 OG1 THR B 22 -20.664 -3.236 2.557 1.00 0.00 O ATOM 1123 CG2 THR B 22 -21.022 -5.621 2.430 1.00 0.00 C ATOM 0 H THR B 22 -21.261 -6.083 -0.031 1.00 0.00 H new ATOM 0 HA THR B 22 -20.374 -3.385 -0.129 1.00 0.00 H new ATOM 0 HB THR B 22 -22.130 -4.120 1.395 1.00 0.00 H new ATOM 0 HG1 THR B 22 -20.382 -3.612 3.417 1.00 0.00 H new ATOM 0 HG21 THR B 22 -21.642 -5.574 3.326 1.00 0.00 H new ATOM 0 HG22 THR B 22 -21.383 -6.418 1.780 1.00 0.00 H new ATOM 0 HG23 THR B 22 -19.989 -5.823 2.714 1.00 0.00 H new ATOM 1131 N ILE B 23 -18.100 -3.276 0.918 1.00 0.00 N ATOM 1132 CA ILE B 23 -16.688 -3.231 1.280 1.00 0.00 C ATOM 1133 C ILE B 23 -16.431 -4.042 2.545 1.00 0.00 C ATOM 1134 O ILE B 23 -15.440 -4.767 2.639 1.00 0.00 O ATOM 1135 CB ILE B 23 -16.205 -1.783 1.512 1.00 0.00 C ATOM 1136 CG1 ILE B 23 -16.482 -0.907 0.282 1.00 0.00 C ATOM 1137 CG2 ILE B 23 -14.721 -1.768 1.855 1.00 0.00 C ATOM 1138 CD1 ILE B 23 -15.805 -1.385 -0.984 1.00 0.00 C ATOM 0 H ILE B 23 -18.523 -2.361 0.764 1.00 0.00 H new ATOM 0 HA ILE B 23 -16.133 -3.659 0.445 1.00 0.00 H new ATOM 0 HB ILE B 23 -16.762 -1.369 2.353 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -17.558 -0.867 0.113 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -16.155 0.111 0.494 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -14.395 -0.740 2.016 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -14.551 -2.349 2.762 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -14.153 -2.204 1.033 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -16.052 -0.712 -1.805 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -14.725 -1.397 -0.837 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -16.150 -2.391 -1.224 1.00 0.00 H new ATOM 1150 N ASP B 24 -17.334 -3.915 3.514 1.00 0.00 N ATOM 1151 CA ASP B 24 -17.211 -4.637 4.777 1.00 0.00 C ATOM 1152 C ASP B 24 -17.070 -6.136 4.523 1.00 0.00 C ATOM 1153 O ASP B 24 -16.205 -6.798 5.103 1.00 0.00 O ATOM 1154 CB ASP B 24 -18.430 -4.368 5.661 1.00 0.00 C ATOM 1155 CG ASP B 24 -18.309 -4.997 7.036 1.00 0.00 C ATOM 1156 OD1 ASP B 24 -17.255 -5.604 7.325 1.00 0.00 O ATOM 1157 OD2 ASP B 24 -19.268 -4.880 7.828 1.00 0.00 O ATOM 0 H ASP B 24 -18.159 -3.319 3.449 1.00 0.00 H new ATOM 0 HA ASP B 24 -16.317 -4.284 5.291 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -18.564 -3.292 5.769 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -19.323 -4.752 5.168 1.00 0.00 H new ATOM 1162 N ASN B 25 -17.915 -6.663 3.639 1.00 0.00 N ATOM 1163 CA ASN B 25 -17.874 -8.080 3.297 1.00 0.00 C ATOM 1164 C ASN B 25 -16.486 -8.446 2.785 1.00 0.00 C ATOM 1165 O ASN B 25 -15.921 -9.474 3.162 1.00 0.00 O ATOM 1166 CB ASN B 25 -18.931 -8.403 2.234 1.00 0.00 C ATOM 1167 CG ASN B 25 -19.054 -9.890 1.943 1.00 0.00 C ATOM 1168 OD1 ASN B 25 -19.811 -10.295 1.061 1.00 0.00 O ATOM 1169 ND2 ASN B 25 -18.322 -10.714 2.687 1.00 0.00 N ATOM 0 H ASN B 25 -18.634 -6.130 3.149 1.00 0.00 H new ATOM 0 HA ASN B 25 -18.091 -8.666 4.190 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -19.898 -8.023 2.565 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -18.681 -7.878 1.312 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -18.376 -11.721 2.536 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -17.706 -10.339 3.408 1.00 0.00 H new ATOM 1176 N VAL B 26 -15.937 -7.580 1.938 1.00 0.00 N ATOM 1177 CA VAL B 26 -14.607 -7.791 1.388 1.00 0.00 C ATOM 1178 C VAL B 26 -13.584 -7.877 2.512 1.00 0.00 C ATOM 1179 O VAL B 26 -12.658 -8.686 2.464 1.00 0.00 O ATOM 1180 CB VAL B 26 -14.208 -6.659 0.420 1.00 0.00 C ATOM 1181 CG1 VAL B 26 -12.830 -6.917 -0.172 1.00 0.00 C ATOM 1182 CG2 VAL B 26 -15.247 -6.505 -0.681 1.00 0.00 C ATOM 0 H VAL B 26 -16.395 -6.726 1.619 1.00 0.00 H new ATOM 0 HA VAL B 26 -14.626 -8.728 0.831 1.00 0.00 H new ATOM 0 HB VAL B 26 -14.166 -5.727 0.983 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -12.568 -6.106 -0.852 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -12.094 -6.970 0.630 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -12.840 -7.860 -0.719 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -14.948 -5.701 -1.354 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -15.325 -7.437 -1.241 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -16.214 -6.266 -0.238 1.00 0.00 H new ATOM 1192 N LYS B 27 -13.771 -7.043 3.532 1.00 0.00 N ATOM 1193 CA LYS B 27 -12.877 -7.030 4.683 1.00 0.00 C ATOM 1194 C LYS B 27 -12.876 -8.394 5.360 1.00 0.00 C ATOM 1195 O LYS B 27 -11.823 -8.925 5.712 1.00 0.00 O ATOM 1196 CB LYS B 27 -13.308 -5.954 5.683 1.00 0.00 C ATOM 1197 CG LYS B 27 -13.370 -4.554 5.093 1.00 0.00 C ATOM 1198 CD LYS B 27 -12.005 -4.081 4.620 1.00 0.00 C ATOM 1199 CE LYS B 27 -12.075 -2.686 4.022 1.00 0.00 C ATOM 1200 NZ LYS B 27 -12.573 -1.684 5.004 1.00 0.00 N ATOM 0 H LYS B 27 -14.534 -6.368 3.583 1.00 0.00 H new ATOM 0 HA LYS B 27 -11.869 -6.803 4.336 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -14.289 -6.214 6.081 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -12.613 -5.953 6.523 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -14.069 -4.542 4.257 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -13.756 -3.861 5.841 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -11.307 -4.084 5.458 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -11.615 -4.777 3.877 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -11.086 -2.391 3.673 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -12.730 -2.697 3.151 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -12.416 -0.726 4.632 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -13.590 -1.831 5.165 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -12.061 -1.794 5.903 1.00 0.00 H new ATOM 1214 N SER B 28 -14.070 -8.958 5.529 1.00 0.00 N ATOM 1215 CA SER B 28 -14.217 -10.266 6.157 1.00 0.00 C ATOM 1216 C SER B 28 -13.459 -11.331 5.370 1.00 0.00 C ATOM 1217 O SER B 28 -12.732 -12.142 5.946 1.00 0.00 O ATOM 1218 CB SER B 28 -15.693 -10.643 6.259 1.00 0.00 C ATOM 1219 OG SER B 28 -16.410 -9.694 7.029 1.00 0.00 O ATOM 0 H SER B 28 -14.949 -8.529 5.239 1.00 0.00 H new ATOM 0 HA SER B 28 -13.796 -10.211 7.161 1.00 0.00 H new ATOM 0 HB2 SER B 28 -16.125 -10.707 5.260 1.00 0.00 H new ATOM 0 HB3 SER B 28 -15.789 -11.630 6.711 1.00 0.00 H new ATOM 0 HG SER B 28 -17.353 -9.957 7.078 1.00 0.00 H new ATOM 1225 N LYS B 29 -13.627 -11.320 4.049 1.00 0.00 N ATOM 1226 CA LYS B 29 -12.948 -12.283 3.189 1.00 0.00 C ATOM 1227 C LYS B 29 -11.437 -12.160 3.341 1.00 0.00 C ATOM 1228 O LYS B 29 -10.735 -13.165 3.450 1.00 0.00 O ATOM 1229 CB LYS B 29 -13.350 -12.076 1.728 1.00 0.00 C ATOM 1230 CG LYS B 29 -14.837 -12.274 1.474 1.00 0.00 C ATOM 1231 CD LYS B 29 -15.182 -12.114 0.000 1.00 0.00 C ATOM 1232 CE LYS B 29 -14.487 -13.162 -0.855 1.00 0.00 C ATOM 1233 NZ LYS B 29 -14.833 -13.023 -2.296 1.00 0.00 N ATOM 0 H LYS B 29 -14.225 -10.658 3.554 1.00 0.00 H new ATOM 0 HA LYS B 29 -13.249 -13.285 3.493 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -13.068 -11.069 1.421 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -12.787 -12.769 1.103 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -15.135 -13.267 1.812 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -15.406 -11.553 2.061 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -16.261 -12.193 -0.132 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -14.892 -11.119 -0.336 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -13.408 -13.074 -0.731 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -14.767 -14.157 -0.509 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -14.780 -13.954 -2.757 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -15.798 -12.646 -2.387 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -14.163 -12.372 -2.753 1.00 0.00 H new ATOM 1247 N ILE B 30 -10.941 -10.924 3.368 1.00 0.00 N ATOM 1248 CA ILE B 30 -9.511 -10.685 3.530 1.00 0.00 C ATOM 1249 C ILE B 30 -9.028 -11.316 4.829 1.00 0.00 C ATOM 1250 O ILE B 30 -7.960 -11.926 4.878 1.00 0.00 O ATOM 1251 CB ILE B 30 -9.173 -9.178 3.535 1.00 0.00 C ATOM 1252 CG1 ILE B 30 -9.553 -8.542 2.193 1.00 0.00 C ATOM 1253 CG2 ILE B 30 -7.691 -8.966 3.829 1.00 0.00 C ATOM 1254 CD1 ILE B 30 -9.265 -7.057 2.116 1.00 0.00 C ATOM 0 H ILE B 30 -11.505 -10.079 3.280 1.00 0.00 H new ATOM 0 HA ILE B 30 -9.004 -11.139 2.679 1.00 0.00 H new ATOM 0 HB ILE B 30 -9.752 -8.694 4.322 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -9.011 -9.049 1.395 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -10.615 -8.706 2.012 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -7.469 -7.899 3.829 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -7.450 -9.387 4.805 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -7.094 -9.461 3.063 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -9.561 -6.679 1.137 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -9.828 -6.537 2.891 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -8.199 -6.885 2.264 1.00 0.00 H new ATOM 1266 N GLN B 31 -9.838 -11.177 5.876 1.00 0.00 N ATOM 1267 CA GLN B 31 -9.513 -11.748 7.175 1.00 0.00 C ATOM 1268 C GLN B 31 -9.330 -13.255 7.044 1.00 0.00 C ATOM 1269 O GLN B 31 -8.362 -13.822 7.542 1.00 0.00 O ATOM 1270 CB GLN B 31 -10.627 -11.445 8.180 1.00 0.00 C ATOM 1271 CG GLN B 31 -10.379 -12.026 9.563 1.00 0.00 C ATOM 1272 CD GLN B 31 -9.233 -11.348 10.286 1.00 0.00 C ATOM 1273 OE1 GLN B 31 -9.298 -10.157 10.592 1.00 0.00 O ATOM 1274 NE2 GLN B 31 -8.176 -12.102 10.561 1.00 0.00 N ATOM 0 H GLN B 31 -10.724 -10.673 5.847 1.00 0.00 H new ATOM 0 HA GLN B 31 -8.585 -11.303 7.534 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -10.743 -10.365 8.265 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -11.568 -11.837 7.795 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -11.286 -11.932 10.160 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -10.166 -13.091 9.472 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -8.166 -13.085 10.288 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -7.374 -11.699 11.045 1.00 0.00 H new ATOM 1283 N ASP B 32 -10.270 -13.892 6.359 1.00 0.00 N ATOM 1284 CA ASP B 32 -10.226 -15.329 6.144 1.00 0.00 C ATOM 1285 C ASP B 32 -8.997 -15.726 5.328 1.00 0.00 C ATOM 1286 O ASP B 32 -8.410 -16.787 5.544 1.00 0.00 O ATOM 1287 CB ASP B 32 -11.500 -15.777 5.428 1.00 0.00 C ATOM 1288 CG ASP B 32 -12.748 -15.504 6.245 1.00 0.00 C ATOM 1289 OD1 ASP B 32 -12.848 -16.036 7.371 1.00 0.00 O ATOM 1290 OD2 ASP B 32 -13.625 -14.759 5.759 1.00 0.00 O ATOM 0 H ASP B 32 -11.078 -13.430 5.940 1.00 0.00 H new ATOM 0 HA ASP B 32 -10.159 -15.823 7.113 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -11.576 -15.262 4.470 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -11.436 -16.843 5.212 1.00 0.00 H new ATOM 1295 N LYS B 33 -8.628 -14.872 4.379 1.00 0.00 N ATOM 1296 CA LYS B 33 -7.484 -15.127 3.507 1.00 0.00 C ATOM 1297 C LYS B 33 -6.155 -15.058 4.263 1.00 0.00 C ATOM 1298 O LYS B 33 -5.504 -16.078 4.487 1.00 0.00 O ATOM 1299 CB LYS B 33 -7.474 -14.111 2.360 1.00 0.00 C ATOM 1300 CG LYS B 33 -6.363 -14.334 1.346 1.00 0.00 C ATOM 1301 CD LYS B 33 -6.594 -15.599 0.536 1.00 0.00 C ATOM 1302 CE LYS B 33 -5.495 -15.805 -0.495 1.00 0.00 C ATOM 1303 NZ LYS B 33 -5.718 -17.034 -1.304 1.00 0.00 N ATOM 0 H LYS B 33 -9.107 -13.991 4.193 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.589 -16.139 3.115 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -8.434 -14.150 1.846 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -7.376 -13.109 2.777 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -6.304 -13.477 0.675 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -5.406 -14.401 1.863 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.634 -16.459 1.205 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -7.560 -15.540 0.034 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.449 -14.939 -1.155 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.531 -15.872 0.010 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.948 -17.139 -1.995 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -5.736 -17.864 -0.677 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -6.626 -16.959 -1.806 1.00 0.00 H new ATOM 1317 N GLU B 34 -5.749 -13.845 4.628 1.00 0.00 N ATOM 1318 CA GLU B 34 -4.483 -13.629 5.328 1.00 0.00 C ATOM 1319 C GLU B 34 -4.586 -13.908 6.827 1.00 0.00 C ATOM 1320 O GLU B 34 -3.651 -14.438 7.427 1.00 0.00 O ATOM 1321 CB GLU B 34 -4.001 -12.196 5.103 1.00 0.00 C ATOM 1322 CG GLU B 34 -3.703 -11.878 3.648 1.00 0.00 C ATOM 1323 CD GLU B 34 -2.581 -12.729 3.085 1.00 0.00 C ATOM 1324 OE1 GLU B 34 -1.449 -12.638 3.606 1.00 0.00 O ATOM 1325 OE2 GLU B 34 -2.836 -13.489 2.127 1.00 0.00 O ATOM 0 H GLU B 34 -6.280 -12.992 4.450 1.00 0.00 H new ATOM 0 HA GLU B 34 -3.764 -14.336 4.915 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -4.759 -11.504 5.470 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -3.102 -12.026 5.695 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -4.604 -12.031 3.054 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -3.437 -10.825 3.557 1.00 0.00 H new ATOM 1332 N GLY B 35 -5.708 -13.532 7.431 1.00 0.00 N ATOM 1333 CA GLY B 35 -5.881 -13.736 8.858 1.00 0.00 C ATOM 1334 C GLY B 35 -5.261 -12.617 9.671 1.00 0.00 C ATOM 1335 O GLY B 35 -4.691 -12.853 10.736 1.00 0.00 O ATOM 0 H GLY B 35 -6.498 -13.091 6.960 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -6.944 -13.805 9.088 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -5.430 -14.686 9.146 1.00 0.00 H new ATOM 1339 N ILE B 36 -5.377 -11.395 9.160 1.00 0.00 N ATOM 1340 CA ILE B 36 -4.830 -10.222 9.832 1.00 0.00 C ATOM 1341 C ILE B 36 -5.929 -9.446 10.561 1.00 0.00 C ATOM 1342 O ILE B 36 -6.992 -9.192 9.996 1.00 0.00 O ATOM 1343 CB ILE B 36 -4.125 -9.283 8.828 1.00 0.00 C ATOM 1344 CG1 ILE B 36 -2.978 -10.017 8.124 1.00 0.00 C ATOM 1345 CG2 ILE B 36 -3.611 -8.033 9.530 1.00 0.00 C ATOM 1346 CD1 ILE B 36 -1.903 -10.522 9.064 1.00 0.00 C ATOM 0 H ILE B 36 -5.847 -11.191 8.278 1.00 0.00 H new ATOM 0 HA ILE B 36 -4.100 -10.578 10.559 1.00 0.00 H new ATOM 0 HB ILE B 36 -4.852 -8.976 8.076 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -3.387 -10.861 7.569 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.523 -9.346 7.395 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -3.118 -7.385 8.805 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.447 -7.500 9.983 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.899 -8.318 10.305 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -1.127 -11.030 8.491 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -1.465 -9.681 9.601 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -2.342 -11.220 9.777 1.00 0.00 H new ATOM 1358 N PRO B 37 -5.686 -9.056 11.829 1.00 0.00 N ATOM 1359 CA PRO B 37 -6.662 -8.305 12.629 1.00 0.00 C ATOM 1360 C PRO B 37 -7.172 -7.063 11.899 1.00 0.00 C ATOM 1361 O PRO B 37 -6.413 -6.390 11.204 1.00 0.00 O ATOM 1362 CB PRO B 37 -5.880 -7.905 13.891 1.00 0.00 C ATOM 1363 CG PRO B 37 -4.447 -8.199 13.591 1.00 0.00 C ATOM 1364 CD PRO B 37 -4.451 -9.310 12.582 1.00 0.00 C ATOM 0 HA PRO B 37 -7.551 -8.899 12.842 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -6.023 -6.849 14.121 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -6.222 -8.470 14.758 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -3.943 -7.317 13.197 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -3.913 -8.495 14.494 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -3.571 -9.277 11.940 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.461 -10.290 13.059 1.00 0.00 H new ATOM 1372 N PRO B 38 -8.474 -6.749 12.042 1.00 0.00 N ATOM 1373 CA PRO B 38 -9.090 -5.587 11.387 1.00 0.00 C ATOM 1374 C PRO B 38 -8.390 -4.275 11.728 1.00 0.00 C ATOM 1375 O PRO B 38 -8.173 -3.435 10.856 1.00 0.00 O ATOM 1376 CB PRO B 38 -10.530 -5.579 11.921 1.00 0.00 C ATOM 1377 CG PRO B 38 -10.519 -6.480 13.110 1.00 0.00 C ATOM 1378 CD PRO B 38 -9.451 -7.499 12.847 1.00 0.00 C ATOM 0 HA PRO B 38 -9.026 -5.666 10.302 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -10.841 -4.571 12.195 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -11.231 -5.935 11.166 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -10.308 -5.921 14.021 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -11.489 -6.958 13.246 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -9.011 -7.872 13.772 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -9.840 -8.363 12.308 1.00 0.00 H new ATOM 1386 N ASP B 39 -8.042 -4.101 12.999 1.00 0.00 N ATOM 1387 CA ASP B 39 -7.369 -2.886 13.446 1.00 0.00 C ATOM 1388 C ASP B 39 -6.040 -2.703 12.716 1.00 0.00 C ATOM 1389 O ASP B 39 -5.704 -1.603 12.278 1.00 0.00 O ATOM 1390 CB ASP B 39 -7.132 -2.939 14.958 1.00 0.00 C ATOM 1391 CG ASP B 39 -6.516 -1.662 15.503 1.00 0.00 C ATOM 1392 OD1 ASP B 39 -6.315 -0.710 14.718 1.00 0.00 O ATOM 1393 OD2 ASP B 39 -6.240 -1.613 16.720 1.00 0.00 O ATOM 0 H ASP B 39 -8.214 -4.784 13.736 1.00 0.00 H new ATOM 0 HA ASP B 39 -8.010 -2.035 13.215 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -8.080 -3.124 15.463 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -6.478 -3.780 15.189 1.00 0.00 H new ATOM 1398 N GLN B 40 -5.289 -3.791 12.596 1.00 0.00 N ATOM 1399 CA GLN B 40 -3.993 -3.763 11.928 1.00 0.00 C ATOM 1400 C GLN B 40 -4.142 -3.495 10.431 1.00 0.00 C ATOM 1401 O GLN B 40 -3.588 -2.530 9.906 1.00 0.00 O ATOM 1402 CB GLN B 40 -3.275 -5.100 12.144 1.00 0.00 C ATOM 1403 CG GLN B 40 -1.896 -5.176 11.508 1.00 0.00 C ATOM 1404 CD GLN B 40 -0.884 -4.287 12.201 1.00 0.00 C ATOM 1405 OE1 GLN B 40 -1.068 -3.077 12.300 1.00 0.00 O ATOM 1406 NE2 GLN B 40 0.197 -4.889 12.686 1.00 0.00 N ATOM 0 H GLN B 40 -5.557 -4.708 12.954 1.00 0.00 H new ATOM 0 HA GLN B 40 -3.406 -2.952 12.359 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -3.179 -5.280 13.215 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -3.894 -5.901 11.740 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -1.545 -6.208 11.533 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -1.968 -4.889 10.459 1.00 0.00 H new ATOM 0 HE21 GLN B 40 0.309 -5.897 12.581 1.00 0.00 H new ATOM 0 HE22 GLN B 40 0.914 -4.343 13.163 1.00 0.00 H new ATOM 1415 N GLN B 41 -4.881 -4.361 9.747 1.00 0.00 N ATOM 1416 CA GLN B 41 -5.088 -4.227 8.309 1.00 0.00 C ATOM 1417 C GLN B 41 -5.961 -3.021 7.972 1.00 0.00 C ATOM 1418 O GLN B 41 -6.950 -2.746 8.651 1.00 0.00 O ATOM 1419 CB GLN B 41 -5.722 -5.501 7.744 1.00 0.00 C ATOM 1420 CG GLN B 41 -7.119 -5.782 8.279 1.00 0.00 C ATOM 1421 CD GLN B 41 -7.717 -7.073 7.739 1.00 0.00 C ATOM 1422 OE1 GLN B 41 -8.853 -7.420 8.060 1.00 0.00 O ATOM 1423 NE2 GLN B 41 -6.958 -7.794 6.917 1.00 0.00 N ATOM 0 H GLN B 41 -5.348 -5.165 10.166 1.00 0.00 H new ATOM 0 HA GLN B 41 -4.111 -4.072 7.851 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -5.768 -5.422 6.658 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -5.077 -6.349 7.974 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -7.081 -5.833 9.367 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -7.774 -4.950 8.022 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -6.021 -7.473 6.675 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -7.314 -8.668 6.529 1.00 0.00 H new ATOM 1432 N ARG B 42 -5.589 -2.313 6.909 1.00 0.00 N ATOM 1433 CA ARG B 42 -6.339 -1.146 6.465 1.00 0.00 C ATOM 1434 C ARG B 42 -6.321 -1.054 4.942 1.00 0.00 C ATOM 1435 O ARG B 42 -5.280 -0.795 4.339 1.00 0.00 O ATOM 1436 CB ARG B 42 -5.753 0.130 7.076 1.00 0.00 C ATOM 1437 CG ARG B 42 -6.513 1.391 6.698 1.00 0.00 C ATOM 1438 CD ARG B 42 -5.894 2.629 7.327 1.00 0.00 C ATOM 1439 NE ARG B 42 -5.875 2.553 8.786 1.00 0.00 N ATOM 1440 CZ ARG B 42 -5.429 3.531 9.570 1.00 0.00 C ATOM 1441 NH1 ARG B 42 -4.977 4.657 9.038 1.00 0.00 N ATOM 1442 NH2 ARG B 42 -5.437 3.382 10.887 1.00 0.00 N ATOM 0 H ARG B 42 -4.771 -2.529 6.339 1.00 0.00 H new ATOM 0 HA ARG B 42 -7.371 -1.251 6.799 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -5.745 0.032 8.162 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -4.716 0.232 6.758 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -6.522 1.499 5.613 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -7.551 1.300 7.018 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -4.876 2.752 6.958 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -6.454 3.511 7.018 1.00 0.00 H new ATOM 0 HE ARG B 42 -6.223 1.702 9.228 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -4.970 4.776 8.025 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -4.636 5.405 9.641 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -5.785 2.517 11.300 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -5.095 4.132 11.487 1.00 0.00 H new ATOM 1456 N LEU B 43 -7.480 -1.281 4.326 1.00 0.00 N ATOM 1457 CA LEU B 43 -7.594 -1.235 2.871 1.00 0.00 C ATOM 1458 C LEU B 43 -7.797 0.190 2.373 1.00 0.00 C ATOM 1459 O LEU B 43 -8.855 0.786 2.576 1.00 0.00 O ATOM 1460 CB LEU B 43 -8.750 -2.121 2.391 1.00 0.00 C ATOM 1461 CG LEU B 43 -8.563 -3.628 2.598 1.00 0.00 C ATOM 1462 CD1 LEU B 43 -7.291 -4.103 1.920 1.00 0.00 C ATOM 1463 CD2 LEU B 43 -8.542 -3.976 4.081 1.00 0.00 C ATOM 0 H LEU B 43 -8.351 -1.498 4.811 1.00 0.00 H new ATOM 0 HA LEU B 43 -6.658 -1.612 2.459 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.659 -1.812 2.907 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -8.908 -1.936 1.329 1.00 0.00 H new ATOM 0 HG LEU B 43 -9.410 -4.141 2.143 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -7.174 -5.175 2.077 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.350 -3.897 0.851 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -6.435 -3.578 2.344 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -8.408 -5.051 4.201 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -7.719 -3.452 4.566 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -9.484 -3.675 4.539 1.00 0.00 H new ATOM 1475 N ILE B 44 -6.776 0.719 1.708 1.00 0.00 N ATOM 1476 CA ILE B 44 -6.826 2.069 1.161 1.00 0.00 C ATOM 1477 C ILE B 44 -7.178 2.044 -0.324 1.00 0.00 C ATOM 1478 O ILE B 44 -6.745 1.154 -1.061 1.00 0.00 O ATOM 1479 CB ILE B 44 -5.482 2.800 1.355 1.00 0.00 C ATOM 1480 CG1 ILE B 44 -5.194 2.988 2.844 1.00 0.00 C ATOM 1481 CG2 ILE B 44 -5.499 4.145 0.643 1.00 0.00 C ATOM 1482 CD1 ILE B 44 -3.752 3.329 3.141 1.00 0.00 C ATOM 0 H ILE B 44 -5.898 0.229 1.534 1.00 0.00 H new ATOM 0 HA ILE B 44 -7.603 2.608 1.704 1.00 0.00 H new ATOM 0 HB ILE B 44 -4.689 2.191 0.920 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -5.834 3.780 3.232 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -5.460 2.074 3.376 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -4.543 4.647 0.791 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -5.667 3.990 -0.423 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -6.300 4.762 1.051 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -3.620 3.448 4.216 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.107 2.526 2.783 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -3.487 4.259 2.638 1.00 0.00 H new ATOM 1494 N PHE B 45 -7.966 3.025 -0.753 1.00 0.00 N ATOM 1495 CA PHE B 45 -8.381 3.122 -2.147 1.00 0.00 C ATOM 1496 C PHE B 45 -8.913 4.518 -2.450 1.00 0.00 C ATOM 1497 O PHE B 45 -9.517 5.161 -1.585 1.00 0.00 O ATOM 1498 CB PHE B 45 -9.454 2.076 -2.454 1.00 0.00 C ATOM 1499 CG PHE B 45 -9.823 1.992 -3.910 1.00 0.00 C ATOM 1500 CD1 PHE B 45 -8.860 1.724 -4.871 1.00 0.00 C ATOM 1501 CD2 PHE B 45 -11.135 2.174 -4.317 1.00 0.00 C ATOM 1502 CE1 PHE B 45 -9.199 1.642 -6.207 1.00 0.00 C ATOM 1503 CE2 PHE B 45 -11.480 2.094 -5.653 1.00 0.00 C ATOM 1504 CZ PHE B 45 -10.510 1.827 -6.599 1.00 0.00 C ATOM 0 H PHE B 45 -8.330 3.765 -0.153 1.00 0.00 H new ATOM 0 HA PHE B 45 -7.513 2.934 -2.778 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -9.102 1.100 -2.121 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -10.348 2.306 -1.875 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -7.833 1.578 -4.571 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -11.898 2.381 -3.581 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -8.439 1.433 -6.945 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -12.506 2.240 -5.957 1.00 0.00 H new ATOM 0 HZ PHE B 45 -10.776 1.763 -7.644 1.00 0.00 H new ATOM 1514 N ALA B 46 -8.675 4.981 -3.680 1.00 0.00 N ATOM 1515 CA ALA B 46 -9.119 6.305 -4.119 1.00 0.00 C ATOM 1516 C ALA B 46 -8.327 7.420 -3.441 1.00 0.00 C ATOM 1517 O ALA B 46 -8.097 8.477 -4.031 1.00 0.00 O ATOM 1518 CB ALA B 46 -10.610 6.483 -3.859 1.00 0.00 C ATOM 0 H ALA B 46 -8.173 4.453 -4.394 1.00 0.00 H new ATOM 0 HA ALA B 46 -8.936 6.372 -5.191 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -10.922 7.473 -4.192 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -11.168 5.724 -4.407 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -10.808 6.380 -2.792 1.00 0.00 H new ATOM 1524 N GLY B 47 -7.922 7.183 -2.199 1.00 0.00 N ATOM 1525 CA GLY B 47 -7.173 8.172 -1.455 1.00 0.00 C ATOM 1526 C GLY B 47 -7.148 7.869 0.030 1.00 0.00 C ATOM 1527 O GLY B 47 -6.322 8.411 0.765 1.00 0.00 O ATOM 0 H GLY B 47 -8.102 6.316 -1.693 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -6.152 8.213 -1.834 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -7.613 9.156 -1.617 1.00 0.00 H new ATOM 1531 N LYS B 48 -8.061 7.007 0.476 1.00 0.00 N ATOM 1532 CA LYS B 48 -8.141 6.649 1.888 1.00 0.00 C ATOM 1533 C LYS B 48 -8.865 5.323 2.085 1.00 0.00 C ATOM 1534 O LYS B 48 -9.522 4.820 1.172 1.00 0.00 O ATOM 1535 CB LYS B 48 -8.855 7.751 2.671 1.00 0.00 C ATOM 1536 CG LYS B 48 -10.214 8.115 2.098 1.00 0.00 C ATOM 1537 CD LYS B 48 -10.916 9.156 2.952 1.00 0.00 C ATOM 1538 CE LYS B 48 -12.243 9.577 2.340 1.00 0.00 C ATOM 1539 NZ LYS B 48 -12.064 10.230 1.013 1.00 0.00 N ATOM 0 H LYS B 48 -8.751 6.547 -0.118 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.123 6.539 2.262 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -8.979 7.429 3.705 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -8.226 8.641 2.687 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -10.093 8.496 1.084 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -10.833 7.220 2.030 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.086 8.754 3.951 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.273 10.029 3.065 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -12.885 8.703 2.230 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.752 10.264 3.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.946 10.709 0.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.295 10.927 1.070 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -11.826 9.510 0.301 1.00 0.00 H new ATOM 1553 N GLN B 49 -8.732 4.759 3.283 1.00 0.00 N ATOM 1554 CA GLN B 49 -9.365 3.486 3.609 1.00 0.00 C ATOM 1555 C GLN B 49 -10.860 3.525 3.313 1.00 0.00 C ATOM 1556 O GLN B 49 -11.548 4.489 3.653 1.00 0.00 O ATOM 1557 CB GLN B 49 -9.131 3.132 5.079 1.00 0.00 C ATOM 1558 CG GLN B 49 -9.687 4.160 6.052 1.00 0.00 C ATOM 1559 CD GLN B 49 -9.507 3.750 7.501 1.00 0.00 C ATOM 1560 OE1 GLN B 49 -9.985 2.697 7.923 1.00 0.00 O ATOM 1561 NE2 GLN B 49 -8.818 4.585 8.271 1.00 0.00 N ATOM 0 H GLN B 49 -8.190 5.166 4.045 1.00 0.00 H new ATOM 0 HA GLN B 49 -8.911 2.717 2.983 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -9.587 2.164 5.287 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -8.060 3.024 5.251 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -9.193 5.117 5.885 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -10.748 4.310 5.850 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -8.440 5.447 7.878 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -8.667 4.364 9.255 1.00 0.00 H new ATOM 1570 N LEU B 50 -11.356 2.473 2.669 1.00 0.00 N ATOM 1571 CA LEU B 50 -12.769 2.386 2.318 1.00 0.00 C ATOM 1572 C LEU B 50 -13.635 2.185 3.556 1.00 0.00 C ATOM 1573 O LEU B 50 -13.314 1.376 4.426 1.00 0.00 O ATOM 1574 CB LEU B 50 -13.004 1.240 1.336 1.00 0.00 C ATOM 1575 CG LEU B 50 -12.156 1.295 0.063 1.00 0.00 C ATOM 1576 CD1 LEU B 50 -12.445 0.095 -0.824 1.00 0.00 C ATOM 1577 CD2 LEU B 50 -12.412 2.590 -0.695 1.00 0.00 C ATOM 0 H LEU B 50 -10.800 1.668 2.380 1.00 0.00 H new ATOM 0 HA LEU B 50 -13.052 3.328 1.848 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -12.805 0.298 1.846 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -14.057 1.234 1.053 1.00 0.00 H new ATOM 0 HG LEU B 50 -11.105 1.266 0.351 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -11.833 0.152 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -12.211 -0.822 -0.283 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -13.499 0.093 -1.102 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -11.800 2.611 -1.597 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -13.465 2.649 -0.970 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -12.154 3.439 -0.062 1.00 0.00 H new ATOM 1589 N GLU B 51 -14.738 2.923 3.623 1.00 0.00 N ATOM 1590 CA GLU B 51 -15.656 2.823 4.748 1.00 0.00 C ATOM 1591 C GLU B 51 -16.403 1.492 4.720 1.00 0.00 C ATOM 1592 O GLU B 51 -16.929 1.087 3.683 1.00 0.00 O ATOM 1593 CB GLU B 51 -16.654 3.984 4.726 1.00 0.00 C ATOM 1594 CG GLU B 51 -15.999 5.353 4.812 1.00 0.00 C ATOM 1595 CD GLU B 51 -17.008 6.485 4.778 1.00 0.00 C ATOM 1596 OE1 GLU B 51 -17.874 6.535 5.677 1.00 0.00 O ATOM 1597 OE2 GLU B 51 -16.933 7.319 3.852 1.00 0.00 O ATOM 0 H GLU B 51 -15.017 3.597 2.910 1.00 0.00 H new ATOM 0 HA GLU B 51 -15.073 2.874 5.668 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -17.242 3.929 3.810 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -17.349 3.870 5.558 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -15.418 5.417 5.732 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -15.299 5.470 3.984 1.00 0.00 H new ATOM 1604 N ASP B 52 -16.445 0.819 5.864 1.00 0.00 N ATOM 1605 CA ASP B 52 -17.126 -0.467 5.973 1.00 0.00 C ATOM 1606 C ASP B 52 -18.632 -0.305 5.789 1.00 0.00 C ATOM 1607 O ASP B 52 -19.220 0.675 6.246 1.00 0.00 O ATOM 1608 CB ASP B 52 -16.829 -1.111 7.330 1.00 0.00 C ATOM 1609 CG ASP B 52 -15.345 -1.346 7.546 1.00 0.00 C ATOM 1610 OD1 ASP B 52 -14.581 -0.358 7.542 1.00 0.00 O ATOM 1611 OD2 ASP B 52 -14.949 -2.517 7.719 1.00 0.00 O ATOM 0 H ASP B 52 -16.015 1.142 6.731 1.00 0.00 H new ATOM 0 HA ASP B 52 -16.752 -1.116 5.181 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -17.212 -0.471 8.125 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -17.359 -2.061 7.402 1.00 0.00 H new ATOM 1616 N GLY B 53 -19.252 -1.274 5.120 1.00 0.00 N ATOM 1617 CA GLY B 53 -20.685 -1.218 4.892 1.00 0.00 C ATOM 1618 C GLY B 53 -21.048 -0.590 3.558 1.00 0.00 C ATOM 1619 O GLY B 53 -22.059 -0.948 2.953 1.00 0.00 O ATOM 0 H GLY B 53 -18.788 -2.096 4.733 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -21.094 -2.227 4.936 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -21.153 -0.649 5.695 1.00 0.00 H new ATOM 1623 N ARG B 54 -20.228 0.351 3.103 1.00 0.00 N ATOM 1624 CA ARG B 54 -20.475 1.032 1.834 1.00 0.00 C ATOM 1625 C ARG B 54 -20.385 0.064 0.656 1.00 0.00 C ATOM 1626 O ARG B 54 -19.463 -0.744 0.574 1.00 0.00 O ATOM 1627 CB ARG B 54 -19.475 2.176 1.645 1.00 0.00 C ATOM 1628 CG ARG B 54 -19.549 3.251 2.723 1.00 0.00 C ATOM 1629 CD ARG B 54 -20.864 4.022 2.678 1.00 0.00 C ATOM 1630 NE ARG B 54 -22.017 3.188 3.011 1.00 0.00 N ATOM 1631 CZ ARG B 54 -22.199 2.610 4.195 1.00 0.00 C ATOM 1632 NH1 ARG B 54 -21.315 2.786 5.169 1.00 0.00 N ATOM 1633 NH2 ARG B 54 -23.270 1.856 4.407 1.00 0.00 N ATOM 0 H ARG B 54 -19.388 0.660 3.592 1.00 0.00 H new ATOM 0 HA ARG B 54 -21.487 1.437 1.864 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -18.466 1.763 1.627 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -19.648 2.638 0.673 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -19.434 2.789 3.703 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -18.718 3.945 2.599 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -20.813 4.860 3.373 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -21.000 4.443 1.682 1.00 0.00 H new ATOM 0 HE ARG B 54 -22.725 3.040 2.292 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -20.491 3.367 5.011 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -21.459 2.341 6.075 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -23.953 1.720 3.662 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -23.410 1.413 5.315 1.00 0.00 H new ATOM 1647 N THR B 55 -21.351 0.154 -0.255 1.00 0.00 N ATOM 1648 CA THR B 55 -21.383 -0.709 -1.433 1.00 0.00 C ATOM 1649 C THR B 55 -20.359 -0.269 -2.477 1.00 0.00 C ATOM 1650 O THR B 55 -20.018 0.911 -2.562 1.00 0.00 O ATOM 1651 CB THR B 55 -22.779 -0.723 -2.086 1.00 0.00 C ATOM 1652 OG1 THR B 55 -23.154 0.605 -2.471 1.00 0.00 O ATOM 1653 CG2 THR B 55 -23.820 -1.294 -1.134 1.00 0.00 C ATOM 0 H THR B 55 -22.124 0.818 -0.200 1.00 0.00 H new ATOM 0 HA THR B 55 -21.137 -1.713 -1.086 1.00 0.00 H new ATOM 0 HB THR B 55 -22.734 -1.359 -2.970 1.00 0.00 H new ATOM 0 HG1 THR B 55 -23.243 0.650 -3.446 1.00 0.00 H new ATOM 0 HG21 THR B 55 -24.796 -1.293 -1.619 1.00 0.00 H new ATOM 0 HG22 THR B 55 -23.548 -2.316 -0.868 1.00 0.00 H new ATOM 0 HG23 THR B 55 -23.862 -0.683 -0.232 1.00 0.00 H new ATOM 1661 N LEU B 56 -19.879 -1.223 -3.272 1.00 0.00 N ATOM 1662 CA LEU B 56 -18.900 -0.934 -4.318 1.00 0.00 C ATOM 1663 C LEU B 56 -19.391 0.186 -5.230 1.00 0.00 C ATOM 1664 O LEU B 56 -18.618 1.054 -5.637 1.00 0.00 O ATOM 1665 CB LEU B 56 -18.622 -2.188 -5.153 1.00 0.00 C ATOM 1666 CG LEU B 56 -17.828 -3.288 -4.444 1.00 0.00 C ATOM 1667 CD1 LEU B 56 -17.810 -4.555 -5.284 1.00 0.00 C ATOM 1668 CD2 LEU B 56 -16.407 -2.818 -4.166 1.00 0.00 C ATOM 0 H LEU B 56 -20.152 -2.204 -3.212 1.00 0.00 H new ATOM 0 HA LEU B 56 -17.979 -0.613 -3.832 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -19.575 -2.605 -5.480 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -18.079 -1.893 -6.051 1.00 0.00 H new ATOM 0 HG LEU B 56 -18.314 -3.509 -3.494 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -17.241 -5.327 -4.766 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -18.831 -4.901 -5.442 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -17.344 -4.346 -6.247 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -15.854 -3.610 -3.662 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.914 -2.574 -5.107 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -16.434 -1.933 -3.530 1.00 0.00 H new ATOM 1680 N SER B 57 -20.682 0.154 -5.547 1.00 0.00 N ATOM 1681 CA SER B 57 -21.288 1.160 -6.414 1.00 0.00 C ATOM 1682 C SER B 57 -21.047 2.570 -5.879 1.00 0.00 C ATOM 1683 O SER B 57 -20.918 3.520 -6.650 1.00 0.00 O ATOM 1684 CB SER B 57 -22.790 0.906 -6.546 1.00 0.00 C ATOM 1685 OG SER B 57 -23.433 0.977 -5.284 1.00 0.00 O ATOM 0 H SER B 57 -21.331 -0.560 -5.215 1.00 0.00 H new ATOM 0 HA SER B 57 -20.820 1.082 -7.395 1.00 0.00 H new ATOM 0 HB2 SER B 57 -23.228 1.640 -7.222 1.00 0.00 H new ATOM 0 HB3 SER B 57 -22.958 -0.076 -6.989 1.00 0.00 H new ATOM 0 HG SER B 57 -24.393 0.813 -5.396 1.00 0.00 H new ATOM 1691 N ASP B 58 -20.997 2.698 -4.556 1.00 0.00 N ATOM 1692 CA ASP B 58 -20.783 3.994 -3.919 1.00 0.00 C ATOM 1693 C ASP B 58 -19.502 4.655 -4.421 1.00 0.00 C ATOM 1694 O ASP B 58 -19.525 5.796 -4.882 1.00 0.00 O ATOM 1695 CB ASP B 58 -20.722 3.834 -2.399 1.00 0.00 C ATOM 1696 CG ASP B 58 -20.524 5.156 -1.685 1.00 0.00 C ATOM 1697 OD1 ASP B 58 -21.387 6.046 -1.834 1.00 0.00 O ATOM 1698 OD2 ASP B 58 -19.507 5.302 -0.975 1.00 0.00 O ATOM 0 H ASP B 58 -21.102 1.920 -3.904 1.00 0.00 H new ATOM 0 HA ASP B 58 -21.624 4.636 -4.181 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -21.644 3.370 -2.048 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -19.906 3.159 -2.140 1.00 0.00 H new ATOM 1703 N TYR B 59 -18.386 3.935 -4.332 1.00 0.00 N ATOM 1704 CA TYR B 59 -17.103 4.466 -4.784 1.00 0.00 C ATOM 1705 C TYR B 59 -16.932 4.277 -6.287 1.00 0.00 C ATOM 1706 O TYR B 59 -15.820 4.375 -6.808 1.00 0.00 O ATOM 1707 CB TYR B 59 -15.943 3.791 -4.045 1.00 0.00 C ATOM 1708 CG TYR B 59 -15.956 4.009 -2.548 1.00 0.00 C ATOM 1709 CD1 TYR B 59 -16.908 3.397 -1.741 1.00 0.00 C ATOM 1710 CD2 TYR B 59 -15.006 4.819 -1.939 1.00 0.00 C ATOM 1711 CE1 TYR B 59 -16.917 3.592 -0.374 1.00 0.00 C ATOM 1712 CE2 TYR B 59 -15.008 5.019 -0.572 1.00 0.00 C ATOM 1713 CZ TYR B 59 -15.965 4.404 0.205 1.00 0.00 C ATOM 1714 OH TYR B 59 -15.971 4.601 1.566 1.00 0.00 O ATOM 0 H TYR B 59 -18.344 2.989 -3.954 1.00 0.00 H new ATOM 0 HA TYR B 59 -17.092 5.533 -4.561 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -15.972 2.720 -4.246 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -15.002 4.166 -4.448 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -17.653 2.758 -2.191 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -14.253 5.301 -2.545 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -17.666 3.111 0.238 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -14.263 5.654 -0.115 1.00 0.00 H new ATOM 0 HH TYR B 59 -15.234 5.198 1.813 1.00 0.00 H new ATOM 1724 N ASN B 60 -18.037 4.005 -6.976 1.00 0.00 N ATOM 1725 CA ASN B 60 -18.011 3.798 -8.421 1.00 0.00 C ATOM 1726 C ASN B 60 -16.919 2.806 -8.809 1.00 0.00 C ATOM 1727 O ASN B 60 -16.301 2.929 -9.867 1.00 0.00 O ATOM 1728 CB ASN B 60 -17.790 5.129 -9.146 1.00 0.00 C ATOM 1729 CG ASN B 60 -18.904 6.134 -8.902 1.00 0.00 C ATOM 1730 OD1 ASN B 60 -18.849 7.263 -9.389 1.00 0.00 O ATOM 1731 ND2 ASN B 60 -19.925 5.732 -8.150 1.00 0.00 N ATOM 0 H ASN B 60 -18.963 3.923 -6.556 1.00 0.00 H new ATOM 0 HA ASN B 60 -18.974 3.386 -8.721 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -16.843 5.560 -8.821 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -17.705 4.943 -10.217 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -20.699 6.368 -7.959 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -19.934 4.788 -7.764 1.00 0.00 H new ATOM 1738 N ILE B 61 -16.686 1.824 -7.944 1.00 0.00 N ATOM 1739 CA ILE B 61 -15.666 0.812 -8.193 1.00 0.00 C ATOM 1740 C ILE B 61 -16.102 -0.141 -9.301 1.00 0.00 C ATOM 1741 O ILE B 61 -17.155 -0.772 -9.210 1.00 0.00 O ATOM 1742 CB ILE B 61 -15.364 0.000 -6.916 1.00 0.00 C ATOM 1743 CG1 ILE B 61 -14.902 0.932 -5.792 1.00 0.00 C ATOM 1744 CG2 ILE B 61 -14.311 -1.064 -7.196 1.00 0.00 C ATOM 1745 CD1 ILE B 61 -14.646 0.221 -4.480 1.00 0.00 C ATOM 0 H ILE B 61 -17.190 1.708 -7.065 1.00 0.00 H new ATOM 0 HA ILE B 61 -14.762 1.335 -8.504 1.00 0.00 H new ATOM 0 HB ILE B 61 -16.279 -0.500 -6.598 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -13.989 1.439 -6.105 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -15.658 1.702 -5.637 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -14.111 -1.627 -6.284 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -14.675 -1.742 -7.968 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -13.392 -0.586 -7.536 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -14.322 0.944 -3.731 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -15.563 -0.263 -4.144 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -13.869 -0.530 -4.619 1.00 0.00 H new ATOM 1757 N GLN B 62 -15.285 -0.241 -10.345 1.00 0.00 N ATOM 1758 CA GLN B 62 -15.593 -1.122 -11.466 1.00 0.00 C ATOM 1759 C GLN B 62 -15.142 -2.552 -11.174 1.00 0.00 C ATOM 1760 O GLN B 62 -15.027 -2.950 -10.014 1.00 0.00 O ATOM 1761 CB GLN B 62 -14.940 -0.614 -12.757 1.00 0.00 C ATOM 1762 CG GLN B 62 -13.419 -0.555 -12.710 1.00 0.00 C ATOM 1763 CD GLN B 62 -12.898 0.555 -11.819 1.00 0.00 C ATOM 1764 OE1 GLN B 62 -13.207 1.729 -12.025 1.00 0.00 O ATOM 1765 NE2 GLN B 62 -12.098 0.191 -10.823 1.00 0.00 N ATOM 0 H GLN B 62 -14.409 0.274 -10.438 1.00 0.00 H new ATOM 0 HA GLN B 62 -16.674 -1.121 -11.603 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -15.241 -1.260 -13.581 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -15.324 0.382 -12.977 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -13.034 -1.511 -12.354 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -13.035 -0.414 -13.720 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -11.867 -0.793 -10.688 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -11.714 0.896 -10.193 1.00 0.00 H new ATOM 1774 N LYS B 63 -14.893 -3.319 -12.232 1.00 0.00 N ATOM 1775 CA LYS B 63 -14.461 -4.706 -12.090 1.00 0.00 C ATOM 1776 C LYS B 63 -12.943 -4.828 -12.195 1.00 0.00 C ATOM 1777 O LYS B 63 -12.295 -4.062 -12.911 1.00 0.00 O ATOM 1778 CB LYS B 63 -15.128 -5.582 -13.153 1.00 0.00 C ATOM 1779 CG LYS B 63 -14.770 -5.190 -14.580 1.00 0.00 C ATOM 1780 CD LYS B 63 -15.505 -6.046 -15.602 1.00 0.00 C ATOM 1781 CE LYS B 63 -15.138 -7.516 -15.474 1.00 0.00 C ATOM 1782 NZ LYS B 63 -15.838 -8.356 -16.485 1.00 0.00 N ATOM 0 H LYS B 63 -14.983 -3.003 -13.198 1.00 0.00 H new ATOM 0 HA LYS B 63 -14.763 -5.049 -11.100 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -14.841 -6.621 -12.988 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -16.210 -5.527 -13.031 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -15.015 -4.140 -14.741 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -13.695 -5.292 -14.726 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -16.580 -5.927 -15.470 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -15.267 -5.698 -16.607 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -14.060 -7.632 -15.590 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -15.391 -7.867 -14.473 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -15.560 -9.351 -16.363 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -16.866 -8.266 -16.359 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -15.577 -8.039 -17.440 1.00 0.00 H new ATOM 1796 N GLU B 64 -12.387 -5.804 -11.481 1.00 0.00 N ATOM 1797 CA GLU B 64 -10.947 -6.048 -11.488 1.00 0.00 C ATOM 1798 C GLU B 64 -10.174 -4.829 -10.993 1.00 0.00 C ATOM 1799 O GLU B 64 -9.144 -4.462 -11.559 1.00 0.00 O ATOM 1800 CB GLU B 64 -10.480 -6.432 -12.895 1.00 0.00 C ATOM 1801 CG GLU B 64 -11.135 -7.696 -13.428 1.00 0.00 C ATOM 1802 CD GLU B 64 -10.655 -8.065 -14.818 1.00 0.00 C ATOM 1803 OE1 GLU B 64 -9.800 -7.335 -15.365 1.00 0.00 O ATOM 1804 OE2 GLU B 64 -11.133 -9.083 -15.360 1.00 0.00 O ATOM 0 H GLU B 64 -12.916 -6.442 -10.887 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.745 -6.875 -10.807 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -10.691 -5.608 -13.577 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -9.399 -6.569 -12.885 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -10.929 -8.521 -12.746 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -12.216 -7.560 -13.446 1.00 0.00 H new ATOM 1811 N SER B 65 -10.675 -4.209 -9.928 1.00 0.00 N ATOM 1812 CA SER B 65 -10.026 -3.036 -9.355 1.00 0.00 C ATOM 1813 C SER B 65 -8.759 -3.434 -8.601 1.00 0.00 C ATOM 1814 O SER B 65 -8.137 -4.452 -8.911 1.00 0.00 O ATOM 1815 CB SER B 65 -10.989 -2.307 -8.418 1.00 0.00 C ATOM 1816 OG SER B 65 -12.171 -1.928 -9.101 1.00 0.00 O ATOM 0 H SER B 65 -11.526 -4.499 -9.446 1.00 0.00 H new ATOM 0 HA SER B 65 -9.746 -2.366 -10.168 1.00 0.00 H new ATOM 0 HB2 SER B 65 -11.242 -2.952 -7.576 1.00 0.00 H new ATOM 0 HB3 SER B 65 -10.503 -1.422 -8.007 1.00 0.00 H new ATOM 0 HG SER B 65 -12.884 -2.570 -8.901 1.00 0.00 H new ATOM 1822 N THR B 66 -8.387 -2.633 -7.605 1.00 0.00 N ATOM 1823 CA THR B 66 -7.197 -2.906 -6.807 1.00 0.00 C ATOM 1824 C THR B 66 -7.221 -2.120 -5.500 1.00 0.00 C ATOM 1825 O THR B 66 -7.470 -0.914 -5.492 1.00 0.00 O ATOM 1826 CB THR B 66 -5.906 -2.557 -7.577 1.00 0.00 C ATOM 1827 OG1 THR B 66 -5.842 -3.301 -8.800 1.00 0.00 O ATOM 1828 CG2 THR B 66 -4.673 -2.859 -6.736 1.00 0.00 C ATOM 0 H THR B 66 -8.893 -1.790 -7.332 1.00 0.00 H new ATOM 0 HA THR B 66 -7.203 -3.974 -6.589 1.00 0.00 H new ATOM 0 HB THR B 66 -5.926 -1.490 -7.801 1.00 0.00 H new ATOM 0 HG1 THR B 66 -6.515 -4.013 -8.785 1.00 0.00 H new ATOM 0 HG21 THR B 66 -3.776 -2.605 -7.301 1.00 0.00 H new ATOM 0 HG22 THR B 66 -4.704 -2.270 -5.820 1.00 0.00 H new ATOM 0 HG23 THR B 66 -4.655 -3.919 -6.485 1.00 0.00 H new ATOM 1836 N LEU B 67 -6.954 -2.813 -4.398 1.00 0.00 N ATOM 1837 CA LEU B 67 -6.939 -2.189 -3.081 1.00 0.00 C ATOM 1838 C LEU B 67 -5.572 -2.363 -2.428 1.00 0.00 C ATOM 1839 O LEU B 67 -5.007 -3.458 -2.438 1.00 0.00 O ATOM 1840 CB LEU B 67 -8.020 -2.809 -2.193 1.00 0.00 C ATOM 1841 CG LEU B 67 -9.440 -2.742 -2.756 1.00 0.00 C ATOM 1842 CD1 LEU B 67 -10.396 -3.544 -1.886 1.00 0.00 C ATOM 1843 CD2 LEU B 67 -9.907 -1.300 -2.861 1.00 0.00 C ATOM 0 H LEU B 67 -6.744 -3.811 -4.392 1.00 0.00 H new ATOM 0 HA LEU B 67 -7.141 -1.124 -3.199 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -7.766 -3.854 -2.014 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -8.005 -2.307 -1.226 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.432 -3.176 -3.756 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -11.402 -3.485 -2.301 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -10.075 -4.585 -1.857 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.397 -3.137 -0.875 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -10.920 -1.274 -3.264 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -9.898 -0.842 -1.872 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -9.239 -0.749 -3.523 1.00 0.00 H new ATOM 1855 N HIS B 68 -5.040 -1.284 -1.863 1.00 0.00 N ATOM 1856 CA HIS B 68 -3.736 -1.340 -1.213 1.00 0.00 C ATOM 1857 C HIS B 68 -3.869 -1.602 0.281 1.00 0.00 C ATOM 1858 O HIS B 68 -4.307 -0.737 1.039 1.00 0.00 O ATOM 1859 CB HIS B 68 -2.954 -0.050 -1.452 1.00 0.00 C ATOM 1860 CG HIS B 68 -2.492 0.116 -2.868 1.00 0.00 C ATOM 1861 ND1 HIS B 68 -1.615 1.102 -3.261 1.00 0.00 N ATOM 1862 CD2 HIS B 68 -2.790 -0.586 -3.986 1.00 0.00 C ATOM 1863 CE1 HIS B 68 -1.392 1.000 -4.559 1.00 0.00 C ATOM 1864 NE2 HIS B 68 -2.093 -0.018 -5.023 1.00 0.00 N ATOM 0 H HIS B 68 -5.487 -0.368 -1.842 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.187 -2.171 -1.656 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -3.580 0.800 -1.180 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -2.087 -0.032 -0.791 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -3.453 -1.436 -4.050 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -0.746 1.640 -5.141 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -2.113 -0.331 -5.994 1.00 0.00 H new ATOM 1873 N LEU B 69 -3.470 -2.800 0.698 1.00 0.00 N ATOM 1874 CA LEU B 69 -3.525 -3.180 2.103 1.00 0.00 C ATOM 1875 C LEU B 69 -2.388 -2.520 2.871 1.00 0.00 C ATOM 1876 O LEU B 69 -1.256 -2.465 2.390 1.00 0.00 O ATOM 1877 CB LEU B 69 -3.444 -4.703 2.247 1.00 0.00 C ATOM 1878 CG LEU B 69 -3.462 -5.224 3.687 1.00 0.00 C ATOM 1879 CD1 LEU B 69 -4.755 -4.833 4.385 1.00 0.00 C ATOM 1880 CD2 LEU B 69 -3.280 -6.735 3.706 1.00 0.00 C ATOM 0 H LEU B 69 -3.105 -3.525 0.080 1.00 0.00 H new ATOM 0 HA LEU B 69 -4.474 -2.840 2.518 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -4.279 -5.148 1.706 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -2.531 -5.049 1.764 1.00 0.00 H new ATOM 0 HG LEU B 69 -2.633 -4.768 4.228 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -4.746 -5.213 5.406 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -4.845 -3.747 4.403 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -5.602 -5.258 3.847 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -3.295 -7.090 4.736 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -4.089 -7.206 3.148 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -2.325 -6.992 3.247 1.00 0.00 H new ATOM 1892 N VAL B 70 -2.692 -2.011 4.059 1.00 0.00 N ATOM 1893 CA VAL B 70 -1.685 -1.347 4.878 1.00 0.00 C ATOM 1894 C VAL B 70 -1.855 -1.694 6.355 1.00 0.00 C ATOM 1895 O VAL B 70 -2.952 -1.591 6.908 1.00 0.00 O ATOM 1896 CB VAL B 70 -1.747 0.184 4.705 1.00 0.00 C ATOM 1897 CG1 VAL B 70 -0.684 0.868 5.553 1.00 0.00 C ATOM 1898 CG2 VAL B 70 -1.594 0.565 3.238 1.00 0.00 C ATOM 0 H VAL B 70 -3.623 -2.045 4.475 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.713 -1.705 4.539 1.00 0.00 H new ATOM 0 HB VAL B 70 -2.724 0.526 5.047 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.747 1.947 5.415 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.846 0.627 6.604 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.303 0.520 5.249 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -1.640 1.649 3.137 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -0.634 0.207 2.867 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -2.398 0.112 2.659 1.00 0.00 H new ATOM 1908 N LEU B 71 -0.756 -2.104 6.986 1.00 0.00 N ATOM 1909 CA LEU B 71 -0.765 -2.466 8.399 1.00 0.00 C ATOM 1910 C LEU B 71 -0.565 -1.235 9.276 1.00 0.00 C ATOM 1911 O LEU B 71 0.215 -0.341 8.943 1.00 0.00 O ATOM 1912 CB LEU B 71 0.320 -3.505 8.705 1.00 0.00 C ATOM 1913 CG LEU B 71 0.071 -4.908 8.138 1.00 0.00 C ATOM 1914 CD1 LEU B 71 0.074 -4.891 6.618 1.00 0.00 C ATOM 1915 CD2 LEU B 71 1.114 -5.884 8.662 1.00 0.00 C ATOM 0 H LEU B 71 0.155 -2.193 6.537 1.00 0.00 H new ATOM 0 HA LEU B 71 -1.739 -2.901 8.622 1.00 0.00 H new ATOM 0 HB2 LEU B 71 1.270 -3.138 8.315 1.00 0.00 H new ATOM 0 HB3 LEU B 71 0.428 -3.583 9.787 1.00 0.00 H new ATOM 0 HG LEU B 71 -0.914 -5.238 8.469 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -0.105 -5.899 6.243 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -0.712 -4.226 6.260 1.00 0.00 H new ATOM 0 HD13 LEU B 71 1.041 -4.537 6.260 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.924 -6.875 8.251 1.00 0.00 H new ATOM 0 HD22 LEU B 71 2.107 -5.551 8.362 1.00 0.00 H new ATOM 0 HD23 LEU B 71 1.059 -5.926 9.750 1.00 0.00 H new ATOM 1927 N ARG B 72 -1.274 -1.196 10.399 1.00 0.00 N ATOM 1928 CA ARG B 72 -1.178 -0.080 11.329 1.00 0.00 C ATOM 1929 C ARG B 72 0.233 0.021 11.898 1.00 0.00 C ATOM 1930 O ARG B 72 1.001 0.914 11.535 1.00 0.00 O ATOM 1931 CB ARG B 72 -2.180 -0.265 12.469 1.00 0.00 C ATOM 1932 CG ARG B 72 -2.356 0.968 13.337 1.00 0.00 C ATOM 1933 CD ARG B 72 -3.322 0.712 14.482 1.00 0.00 C ATOM 1934 NE ARG B 72 -3.481 1.886 15.335 1.00 0.00 N ATOM 1935 CZ ARG B 72 -4.244 1.910 16.424 1.00 0.00 C ATOM 1936 NH1 ARG B 72 -4.911 0.825 16.797 1.00 0.00 N ATOM 1937 NH2 ARG B 72 -4.337 3.020 17.145 1.00 0.00 N ATOM 0 H ARG B 72 -1.923 -1.928 10.687 1.00 0.00 H new ATOM 0 HA ARG B 72 -1.407 0.840 10.791 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -3.147 -0.543 12.049 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -1.854 -1.095 13.095 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -1.389 1.273 13.737 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -2.724 1.793 12.727 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -4.293 0.422 14.080 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -2.962 -0.125 15.080 1.00 0.00 H new ATOM 0 HE ARG B 72 -2.978 2.736 15.081 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -4.840 -0.032 16.248 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -5.495 0.848 17.633 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -3.823 3.855 16.864 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -4.922 3.038 17.980 1.00 0.00 H new ATOM 1951 N LEU B 73 0.566 -0.910 12.783 1.00 0.00 N ATOM 1952 CA LEU B 73 1.885 -0.947 13.402 1.00 0.00 C ATOM 1953 C LEU B 73 2.892 -1.626 12.479 1.00 0.00 C ATOM 1954 O LEU B 73 2.585 -2.644 11.857 1.00 0.00 O ATOM 1955 CB LEU B 73 1.834 -1.681 14.749 1.00 0.00 C ATOM 1956 CG LEU B 73 1.004 -1.001 15.843 1.00 0.00 C ATOM 1957 CD1 LEU B 73 -0.475 -1.008 15.490 1.00 0.00 C ATOM 1958 CD2 LEU B 73 1.234 -1.683 17.184 1.00 0.00 C ATOM 0 H LEU B 73 -0.062 -1.653 13.089 1.00 0.00 H new ATOM 0 HA LEU B 73 2.203 0.081 13.576 1.00 0.00 H new ATOM 0 HB2 LEU B 73 1.433 -2.681 14.583 1.00 0.00 H new ATOM 0 HB3 LEU B 73 2.854 -1.803 15.115 1.00 0.00 H new ATOM 0 HG LEU B 73 1.328 0.037 15.918 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -1.041 -0.519 16.283 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -0.628 -0.473 14.553 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -0.818 -2.037 15.381 1.00 0.00 H new ATOM 0 HD21 LEU B 73 0.638 -1.189 17.951 1.00 0.00 H new ATOM 0 HD22 LEU B 73 0.940 -2.730 17.115 1.00 0.00 H new ATOM 0 HD23 LEU B 73 2.290 -1.619 17.448 1.00 0.00 H new ATOM 1970 N ARG B 74 4.092 -1.059 12.395 1.00 0.00 N ATOM 1971 CA ARG B 74 5.143 -1.613 11.548 1.00 0.00 C ATOM 1972 C ARG B 74 4.678 -1.698 10.091 1.00 0.00 C ATOM 1973 O ARG B 74 4.479 -0.671 9.440 1.00 0.00 O ATOM 1974 CB ARG B 74 5.573 -2.990 12.069 1.00 0.00 C ATOM 1975 CG ARG B 74 6.770 -3.579 11.338 1.00 0.00 C ATOM 1976 CD ARG B 74 7.124 -4.958 11.873 1.00 0.00 C ATOM 1977 NE ARG B 74 5.994 -5.881 11.803 1.00 0.00 N ATOM 1978 CZ ARG B 74 5.412 -6.265 10.668 1.00 0.00 C ATOM 1979 NH1 ARG B 74 5.868 -5.828 9.500 1.00 0.00 N ATOM 1980 NH2 ARG B 74 4.378 -7.092 10.701 1.00 0.00 N ATOM 0 H ARG B 74 4.361 -0.216 12.903 1.00 0.00 H new ATOM 0 HA ARG B 74 6.006 -0.948 11.584 1.00 0.00 H new ATOM 0 HB2 ARG B 74 5.811 -2.908 13.129 1.00 0.00 H new ATOM 0 HB3 ARG B 74 4.732 -3.679 11.984 1.00 0.00 H new ATOM 0 HG2 ARG B 74 6.551 -3.646 10.272 1.00 0.00 H new ATOM 0 HG3 ARG B 74 7.627 -2.914 11.446 1.00 0.00 H new ATOM 0 HD2 ARG B 74 7.959 -5.364 11.303 1.00 0.00 H new ATOM 0 HD3 ARG B 74 7.457 -4.871 12.907 1.00 0.00 H new ATOM 0 HE ARG B 74 5.628 -6.255 12.678 1.00 0.00 H new ATOM 0 HH11 ARG B 74 6.667 -5.195 9.469 1.00 0.00 H new ATOM 0 HH12 ARG B 74 5.419 -6.125 8.634 1.00 0.00 H new ATOM 0 HH21 ARG B 74 4.027 -7.435 11.595 1.00 0.00 H new ATOM 0 HH22 ARG B 74 3.932 -7.386 9.832 1.00 0.00 H new ATOM 1994 N GLY B 75 4.509 -2.918 9.581 1.00 0.00 N ATOM 1995 CA GLY B 75 4.075 -3.094 8.208 1.00 0.00 C ATOM 1996 C GLY B 75 5.116 -2.631 7.208 1.00 0.00 C ATOM 1997 O GLY B 75 4.793 -1.951 6.234 1.00 0.00 O ATOM 0 H GLY B 75 4.665 -3.785 10.096 1.00 0.00 H new ATOM 0 HA2 GLY B 75 3.850 -4.146 8.033 1.00 0.00 H new ATOM 0 HA3 GLY B 75 3.150 -2.540 8.048 1.00 0.00 H new ATOM 2001 N GLY B 76 6.370 -3.001 7.452 1.00 0.00 N ATOM 2002 CA GLY B 76 7.448 -2.616 6.559 1.00 0.00 C ATOM 2003 C GLY B 76 8.799 -3.108 7.038 1.00 0.00 C ATOM 2004 O GLY B 76 9.237 -2.678 8.126 1.00 0.00 O ATOM 2005 OXT GLY B 76 9.420 -3.923 6.324 1.00 0.00 O ATOM 0 H GLY B 76 6.659 -3.562 8.254 1.00 0.00 H new ATOM 0 HA2 GLY B 76 7.251 -3.014 5.564 1.00 0.00 H new ATOM 0 HA3 GLY B 76 7.471 -1.530 6.469 1.00 0.00 H new TER 2009 GLY B 76