USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1229 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 33 THR OG1 : rot 87:sc= -3.24 USER MOD Set 1.2: B 84 SER OG : rot 163:sc= 0.428 USER MOD Set 2.1: A 43 GLN : amide:sc= -2.01 K(o=-6,f=-14!) USER MOD Set 2.2: A 49 ASN : amide:sc= -4.01 K(o=-6,f=-12!) USER MOD Set 3.1: A 35 THR OG1 : rot 106:sc= 1.21 USER MOD Set 3.2: B 1 MET CE :methyl 138:sc= -0.0556 (180deg=-1.99!) USER MOD Set 4.1: A 1 MET CE :methyl 162:sc= -5.97! (180deg=-6.98!) USER MOD Set 4.2: B 35 THR OG1 : rot 71:sc= -0.257 USER MOD Single : A 1 MET N :NH3+ -173:sc= 0.048 (180deg=0.0416) USER MOD Single : A 2 ASN : amide:sc= -2.9 K(o=-2.9,f=-8!) USER MOD Single : A 3 LYS NZ :NH3+ -133:sc= -3.07! (180deg=-5.23!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -165:sc= 0.466 (180deg=0.0517) USER MOD Single : A 12 GLN : amide:sc= -0.17 K(o=-0.17,f=-1.9) USER MOD Single : A 14 THR OG1 : rot -57:sc= -7.59! USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot -12:sc= -9.39! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -140:sc= -9.04! (180deg=-15.9!) USER MOD Single : A 27 SER OG : rot -76:sc= -2.17! USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.597 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 83:sc= 0.522 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0654) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 153:sc= 0.0145 (180deg=0) USER MOD Single : B 2 ASN : amide:sc= -3.32! C(o=-3.3!,f=-4.5!) USER MOD Single : B 3 LYS NZ :NH3+ -149:sc= -0.0404 (180deg=-1.24) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= -0.65 X(o=-0.65,f=-0.17) USER MOD Single : B 14 THR OG1 : rot -58:sc= -7.12! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 20 SER OG : rot -179:sc= -12.4! USER MOD Single : B 22 SER OG : rot 180:sc= -0.015 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl 149:sc= -17.3! (180deg=-20.4!) USER MOD Single : B 27 SER OG : rot 91:sc= 0.11 USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 83:sc= -0.795! USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= -0.85 K(o=-0.85,f=-2.6!) USER MOD Single : B 45 THR OG1 : rot -176:sc= 0.557 USER MOD Single : B 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.928 3.747 11.113 1.00 0.00 N ATOM 2 CA MET A 1 5.162 5.010 10.908 1.00 0.00 C ATOM 3 C MET A 1 3.659 4.714 10.871 1.00 0.00 C ATOM 4 O MET A 1 3.225 3.649 11.257 1.00 0.00 O ATOM 5 CB MET A 1 5.643 5.547 9.560 1.00 0.00 C ATOM 6 CG MET A 1 6.769 6.559 9.786 1.00 0.00 C ATOM 7 SD MET A 1 7.842 6.602 8.332 1.00 0.00 S ATOM 8 CE MET A 1 6.570 7.089 7.141 1.00 0.00 C ATOM 0 H1 MET A 1 6.934 3.970 11.255 1.00 0.00 H new ATOM 0 H2 MET A 1 5.562 3.251 11.950 1.00 0.00 H new ATOM 0 H3 MET A 1 5.823 3.138 10.277 1.00 0.00 H new ATOM 0 HA MET A 1 5.321 5.730 11.711 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.997 4.727 8.935 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.817 6.019 9.029 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.351 7.548 9.972 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.346 6.285 10.669 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.045 7.485 6.243 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.965 6.221 6.879 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.933 7.855 7.582 1.00 0.00 H new ATOM 20 N ASN A 2 2.861 5.648 10.412 1.00 0.00 N ATOM 21 CA ASN A 2 1.382 5.420 10.351 1.00 0.00 C ATOM 22 C ASN A 2 0.681 6.643 9.763 1.00 0.00 C ATOM 23 O ASN A 2 1.314 7.620 9.424 1.00 0.00 O ATOM 24 CB ASN A 2 0.935 5.203 11.802 1.00 0.00 C ATOM 25 CG ASN A 2 -0.211 4.191 11.841 1.00 0.00 C ATOM 26 OD1 ASN A 2 -0.917 4.017 10.868 1.00 0.00 O ATOM 27 ND2 ASN A 2 -0.428 3.512 12.934 1.00 0.00 N ATOM 0 H ASN A 2 3.170 6.560 10.076 1.00 0.00 H new ATOM 0 HA ASN A 2 1.133 4.568 9.719 1.00 0.00 H new ATOM 0 HB2 ASN A 2 1.772 4.843 12.401 1.00 0.00 H new ATOM 0 HB3 ASN A 2 0.614 6.148 12.239 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -1.190 2.835 12.971 1.00 0.00 H new ATOM 0 HD22 ASN A 2 0.165 3.658 13.751 1.00 0.00 H new ATOM 34 N LYS A 3 -0.626 6.606 9.643 1.00 0.00 N ATOM 35 CA LYS A 3 -1.351 7.788 9.078 1.00 0.00 C ATOM 36 C LYS A 3 -0.952 9.059 9.839 1.00 0.00 C ATOM 37 O LYS A 3 -1.092 10.155 9.343 1.00 0.00 O ATOM 38 CB LYS A 3 -2.848 7.492 9.246 1.00 0.00 C ATOM 39 CG LYS A 3 -3.500 7.385 7.860 1.00 0.00 C ATOM 40 CD LYS A 3 -4.865 8.094 7.855 1.00 0.00 C ATOM 41 CE LYS A 3 -5.597 7.825 6.523 1.00 0.00 C ATOM 42 NZ LYS A 3 -4.537 7.861 5.475 1.00 0.00 N ATOM 0 H LYS A 3 -1.216 5.817 9.909 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.105 7.952 8.029 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.987 6.563 9.799 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -3.325 8.283 9.825 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -2.848 7.831 7.109 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.626 6.337 7.590 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -5.470 7.740 8.690 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.727 9.166 7.993 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.101 6.858 6.540 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.361 8.579 6.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -4.856 8.448 4.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -3.666 8.265 5.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -4.348 6.895 5.139 1.00 0.00 H new ATOM 56 N THR A 4 -0.429 8.916 11.029 1.00 0.00 N ATOM 57 CA THR A 4 0.012 10.116 11.804 1.00 0.00 C ATOM 58 C THR A 4 1.517 10.285 11.612 1.00 0.00 C ATOM 59 O THR A 4 2.010 11.362 11.324 1.00 0.00 O ATOM 60 CB THR A 4 -0.320 9.802 13.266 1.00 0.00 C ATOM 61 OG1 THR A 4 -1.728 9.854 13.450 1.00 0.00 O ATOM 62 CG2 THR A 4 0.355 10.826 14.183 1.00 0.00 C ATOM 0 H THR A 4 -0.288 8.021 11.498 1.00 0.00 H new ATOM 0 HA THR A 4 -0.475 11.038 11.485 1.00 0.00 H new ATOM 0 HB THR A 4 0.045 8.805 13.514 1.00 0.00 H new ATOM 0 HG1 THR A 4 -1.943 9.652 14.384 1.00 0.00 H new ATOM 0 HG21 THR A 4 0.115 10.598 15.222 1.00 0.00 H new ATOM 0 HG22 THR A 4 1.435 10.784 14.042 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.004 11.826 13.939 1.00 0.00 H new ATOM 70 N GLU A 5 2.247 9.214 11.746 1.00 0.00 N ATOM 71 CA GLU A 5 3.716 9.291 11.545 1.00 0.00 C ATOM 72 C GLU A 5 3.981 9.706 10.098 1.00 0.00 C ATOM 73 O GLU A 5 4.751 10.607 9.830 1.00 0.00 O ATOM 74 CB GLU A 5 4.242 7.883 11.832 1.00 0.00 C ATOM 75 CG GLU A 5 5.101 7.897 13.100 1.00 0.00 C ATOM 76 CD GLU A 5 6.580 7.777 12.724 1.00 0.00 C ATOM 77 OE1 GLU A 5 7.000 8.475 11.816 1.00 0.00 O ATOM 78 OE2 GLU A 5 7.269 6.990 13.352 1.00 0.00 O ATOM 0 H GLU A 5 1.888 8.290 11.986 1.00 0.00 H new ATOM 0 HA GLU A 5 4.206 10.018 12.192 1.00 0.00 H new ATOM 0 HB2 GLU A 5 3.408 7.192 11.954 1.00 0.00 H new ATOM 0 HB3 GLU A 5 4.831 7.526 10.987 1.00 0.00 H new ATOM 0 HG2 GLU A 5 4.931 8.819 13.656 1.00 0.00 H new ATOM 0 HG3 GLU A 5 4.814 7.073 13.754 1.00 0.00 H new ATOM 85 N LEU A 6 3.314 9.076 9.166 1.00 0.00 N ATOM 86 CA LEU A 6 3.494 9.463 7.737 1.00 0.00 C ATOM 87 C LEU A 6 2.967 10.877 7.531 1.00 0.00 C ATOM 88 O LEU A 6 3.460 11.616 6.701 1.00 0.00 O ATOM 89 CB LEU A 6 2.669 8.462 6.925 1.00 0.00 C ATOM 90 CG LEU A 6 3.418 7.134 6.827 1.00 0.00 C ATOM 91 CD1 LEU A 6 2.433 5.974 6.995 1.00 0.00 C ATOM 92 CD2 LEU A 6 4.095 7.033 5.456 1.00 0.00 C ATOM 0 H LEU A 6 2.656 8.314 9.332 1.00 0.00 H new ATOM 0 HA LEU A 6 4.541 9.448 7.433 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.699 8.309 7.397 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.479 8.858 5.927 1.00 0.00 H new ATOM 0 HG LEU A 6 4.172 7.084 7.613 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.970 5.028 6.925 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.950 6.045 7.969 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.678 6.022 6.211 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.630 6.086 5.383 1.00 0.00 H new ATOM 0 HD22 LEU A 6 3.339 7.084 4.672 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.798 7.857 5.336 1.00 0.00 H new ATOM 104 N ILE A 7 1.986 11.278 8.302 1.00 0.00 N ATOM 105 CA ILE A 7 1.465 12.664 8.158 1.00 0.00 C ATOM 106 C ILE A 7 2.642 13.612 8.346 1.00 0.00 C ATOM 107 O ILE A 7 2.989 14.373 7.469 1.00 0.00 O ATOM 108 CB ILE A 7 0.413 12.830 9.269 1.00 0.00 C ATOM 109 CG1 ILE A 7 -0.981 12.787 8.648 1.00 0.00 C ATOM 110 CG2 ILE A 7 0.597 14.176 9.975 1.00 0.00 C ATOM 111 CD1 ILE A 7 -2.040 13.022 9.730 1.00 0.00 C ATOM 0 H ILE A 7 1.531 10.710 9.016 1.00 0.00 H new ATOM 0 HA ILE A 7 1.013 12.871 7.188 1.00 0.00 H new ATOM 0 HB ILE A 7 0.532 12.024 9.993 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -1.067 13.547 7.872 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -1.146 11.822 8.169 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -0.153 14.281 10.759 1.00 0.00 H new ATOM 0 HG22 ILE A 7 1.592 14.222 10.417 1.00 0.00 H new ATOM 0 HG23 ILE A 7 0.483 14.984 9.253 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -3.033 12.990 9.281 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -1.961 12.246 10.491 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.881 13.998 10.189 1.00 0.00 H new ATOM 123 N LYS A 8 3.275 13.534 9.481 1.00 0.00 N ATOM 124 CA LYS A 8 4.454 14.398 9.734 1.00 0.00 C ATOM 125 C LYS A 8 5.549 14.051 8.723 1.00 0.00 C ATOM 126 O LYS A 8 6.357 14.884 8.366 1.00 0.00 O ATOM 127 CB LYS A 8 4.884 14.093 11.179 1.00 0.00 C ATOM 128 CG LYS A 8 6.096 13.154 11.197 1.00 0.00 C ATOM 129 CD LYS A 8 6.265 12.556 12.596 1.00 0.00 C ATOM 130 CE LYS A 8 6.449 11.040 12.487 1.00 0.00 C ATOM 131 NZ LYS A 8 7.808 10.773 13.038 1.00 0.00 N ATOM 0 H LYS A 8 3.024 12.907 10.245 1.00 0.00 H new ATOM 0 HA LYS A 8 4.243 15.461 9.620 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.129 15.022 11.694 1.00 0.00 H new ATOM 0 HB3 LYS A 8 4.056 13.637 11.721 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.962 12.358 10.465 1.00 0.00 H new ATOM 0 HG3 LYS A 8 6.996 13.700 10.913 1.00 0.00 H new ATOM 0 HD2 LYS A 8 7.127 13.002 13.092 1.00 0.00 H new ATOM 0 HD3 LYS A 8 5.392 12.784 13.208 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.683 10.508 13.052 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.371 10.707 11.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 8.109 9.814 12.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 8.481 11.467 12.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.784 10.851 14.075 1.00 0.00 H new ATOM 145 N ALA A 9 5.570 12.832 8.238 1.00 0.00 N ATOM 146 CA ALA A 9 6.600 12.460 7.231 1.00 0.00 C ATOM 147 C ALA A 9 6.419 13.335 6.003 1.00 0.00 C ATOM 148 O ALA A 9 7.368 13.702 5.337 1.00 0.00 O ATOM 149 CB ALA A 9 6.314 11.007 6.889 1.00 0.00 C ATOM 0 H ALA A 9 4.922 12.088 8.496 1.00 0.00 H new ATOM 0 HA ALA A 9 7.619 12.592 7.595 1.00 0.00 H new ATOM 0 HB1 ALA A 9 7.035 10.659 6.149 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.396 10.398 7.790 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.306 10.920 6.483 1.00 0.00 H new ATOM 155 N ILE A 10 5.200 13.707 5.720 1.00 0.00 N ATOM 156 CA ILE A 10 4.946 14.585 4.577 1.00 0.00 C ATOM 157 C ILE A 10 4.871 15.988 5.129 1.00 0.00 C ATOM 158 O ILE A 10 5.370 16.910 4.546 1.00 0.00 O ATOM 159 CB ILE A 10 3.603 14.104 3.997 1.00 0.00 C ATOM 160 CG1 ILE A 10 3.763 13.874 2.497 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.493 15.133 4.243 1.00 0.00 C ATOM 162 CD1 ILE A 10 4.702 12.691 2.271 1.00 0.00 C ATOM 0 H ILE A 10 4.371 13.430 6.246 1.00 0.00 H new ATOM 0 HA ILE A 10 5.706 14.568 3.795 1.00 0.00 H new ATOM 0 HB ILE A 10 3.321 13.176 4.494 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.793 13.677 2.041 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.163 14.769 2.020 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.557 14.766 3.822 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.373 15.289 5.315 1.00 0.00 H new ATOM 0 HG23 ILE A 10 2.759 16.076 3.767 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.821 12.520 1.201 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.674 12.908 2.714 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.282 11.799 2.736 1.00 0.00 H new ATOM 174 N ALA A 11 4.296 16.136 6.291 1.00 0.00 N ATOM 175 CA ALA A 11 4.229 17.485 6.917 1.00 0.00 C ATOM 176 C ALA A 11 5.654 18.003 7.108 1.00 0.00 C ATOM 177 O ALA A 11 5.899 19.192 7.157 1.00 0.00 O ATOM 178 CB ALA A 11 3.536 17.273 8.255 1.00 0.00 C ATOM 0 H ALA A 11 3.871 15.383 6.832 1.00 0.00 H new ATOM 0 HA ALA A 11 3.690 18.215 6.314 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.450 18.227 8.776 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.541 16.860 8.088 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.119 16.580 8.861 1.00 0.00 H new ATOM 184 N GLN A 12 6.596 17.100 7.187 1.00 0.00 N ATOM 185 CA GLN A 12 8.015 17.506 7.341 1.00 0.00 C ATOM 186 C GLN A 12 8.639 17.605 5.954 1.00 0.00 C ATOM 187 O GLN A 12 9.295 18.577 5.629 1.00 0.00 O ATOM 188 CB GLN A 12 8.658 16.391 8.175 1.00 0.00 C ATOM 189 CG GLN A 12 10.184 16.503 8.128 1.00 0.00 C ATOM 190 CD GLN A 12 10.623 17.836 8.740 1.00 0.00 C ATOM 191 OE1 GLN A 12 9.902 18.426 9.520 1.00 0.00 O ATOM 192 NE2 GLN A 12 11.784 18.336 8.418 1.00 0.00 N ATOM 0 H GLN A 12 6.437 16.093 7.151 1.00 0.00 H new ATOM 0 HA GLN A 12 8.147 18.473 7.827 1.00 0.00 H new ATOM 0 HB2 GLN A 12 8.314 16.455 9.207 1.00 0.00 H new ATOM 0 HB3 GLN A 12 8.346 15.418 7.795 1.00 0.00 H new ATOM 0 HG2 GLN A 12 10.636 15.675 8.674 1.00 0.00 H new ATOM 0 HG3 GLN A 12 10.532 16.433 7.097 1.00 0.00 H new ATOM 0 HE21 GLN A 12 12.389 17.840 7.763 1.00 0.00 H new ATOM 0 HE22 GLN A 12 12.087 19.223 8.821 1.00 0.00 H new ATOM 201 N ASP A 13 8.396 16.636 5.109 1.00 0.00 N ATOM 202 CA ASP A 13 8.936 16.728 3.726 1.00 0.00 C ATOM 203 C ASP A 13 8.270 17.934 3.075 1.00 0.00 C ATOM 204 O ASP A 13 8.853 18.643 2.280 1.00 0.00 O ATOM 205 CB ASP A 13 8.528 15.429 3.033 1.00 0.00 C ATOM 206 CG ASP A 13 9.376 14.274 3.573 1.00 0.00 C ATOM 207 OD1 ASP A 13 9.708 14.307 4.746 1.00 0.00 O ATOM 208 OD2 ASP A 13 9.676 13.376 2.804 1.00 0.00 O ATOM 0 H ASP A 13 7.854 15.797 5.316 1.00 0.00 H new ATOM 0 HA ASP A 13 10.018 16.850 3.676 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.470 15.229 3.205 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.664 15.521 1.955 1.00 0.00 H new ATOM 213 N THR A 14 7.049 18.188 3.468 1.00 0.00 N ATOM 214 CA THR A 14 6.311 19.363 2.956 1.00 0.00 C ATOM 215 C THR A 14 6.743 20.572 3.772 1.00 0.00 C ATOM 216 O THR A 14 7.483 21.419 3.311 1.00 0.00 O ATOM 217 CB THR A 14 4.827 19.070 3.223 1.00 0.00 C ATOM 218 OG1 THR A 14 4.657 18.693 4.572 1.00 0.00 O ATOM 219 CG2 THR A 14 4.325 17.959 2.302 1.00 0.00 C ATOM 0 H THR A 14 6.530 17.616 4.134 1.00 0.00 H new ATOM 0 HA THR A 14 6.494 19.554 1.899 1.00 0.00 H new ATOM 0 HB THR A 14 4.247 19.971 3.022 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.217 17.913 4.767 1.00 0.00 H new ATOM 0 HG21 THR A 14 3.272 17.765 2.506 1.00 0.00 H new ATOM 0 HG22 THR A 14 4.443 18.267 1.263 1.00 0.00 H new ATOM 0 HG23 THR A 14 4.902 17.051 2.479 1.00 0.00 H new ATOM 227 N GLY A 15 6.280 20.652 4.994 1.00 0.00 N ATOM 228 CA GLY A 15 6.659 21.806 5.859 1.00 0.00 C ATOM 229 C GLY A 15 6.222 23.109 5.186 1.00 0.00 C ATOM 230 O GLY A 15 6.637 24.187 5.567 1.00 0.00 O ATOM 0 H GLY A 15 5.658 19.970 5.427 1.00 0.00 H new ATOM 0 HA2 GLY A 15 6.187 21.712 6.837 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.736 21.813 6.025 1.00 0.00 H new ATOM 234 N LEU A 16 5.374 23.014 4.197 1.00 0.00 N ATOM 235 CA LEU A 16 4.891 24.243 3.505 1.00 0.00 C ATOM 236 C LEU A 16 3.852 24.914 4.380 1.00 0.00 C ATOM 237 O LEU A 16 3.870 26.110 4.596 1.00 0.00 O ATOM 238 CB LEU A 16 4.231 23.766 2.207 1.00 0.00 C ATOM 239 CG LEU A 16 5.265 23.081 1.317 1.00 0.00 C ATOM 240 CD1 LEU A 16 5.060 21.570 1.363 1.00 0.00 C ATOM 241 CD2 LEU A 16 5.100 23.552 -0.132 1.00 0.00 C ATOM 0 H LEU A 16 4.995 22.138 3.839 1.00 0.00 H new ATOM 0 HA LEU A 16 5.698 24.948 3.307 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.420 23.075 2.435 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.790 24.613 1.681 1.00 0.00 H new ATOM 0 HG LEU A 16 6.262 23.335 1.677 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.799 21.083 0.727 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.175 21.218 2.388 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.059 21.328 1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.841 23.059 -0.761 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.100 23.301 -0.485 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.242 24.632 -0.182 1.00 0.00 H new ATOM 253 N THR A 17 2.934 24.137 4.867 1.00 0.00 N ATOM 254 CA THR A 17 1.864 24.700 5.718 1.00 0.00 C ATOM 255 C THR A 17 1.194 23.607 6.554 1.00 0.00 C ATOM 256 O THR A 17 0.188 23.847 7.192 1.00 0.00 O ATOM 257 CB THR A 17 0.874 25.289 4.704 1.00 0.00 C ATOM 258 OG1 THR A 17 0.463 26.578 5.137 1.00 0.00 O ATOM 259 CG2 THR A 17 -0.354 24.381 4.552 1.00 0.00 C ATOM 0 H THR A 17 2.880 23.131 4.710 1.00 0.00 H new ATOM 0 HA THR A 17 2.235 25.435 6.432 1.00 0.00 H new ATOM 0 HB THR A 17 1.370 25.365 3.736 1.00 0.00 H new ATOM 0 HG1 THR A 17 -0.168 26.955 4.489 1.00 0.00 H new ATOM 0 HG21 THR A 17 -1.042 24.818 3.829 1.00 0.00 H new ATOM 0 HG22 THR A 17 -0.038 23.397 4.204 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.855 24.282 5.515 1.00 0.00 H new ATOM 267 N GLN A 18 1.689 22.393 6.513 1.00 0.00 N ATOM 268 CA GLN A 18 0.992 21.303 7.255 1.00 0.00 C ATOM 269 C GLN A 18 -0.428 21.232 6.687 1.00 0.00 C ATOM 270 O GLN A 18 -1.363 20.821 7.344 1.00 0.00 O ATOM 271 CB GLN A 18 0.976 21.719 8.733 1.00 0.00 C ATOM 272 CG GLN A 18 2.339 22.296 9.124 1.00 0.00 C ATOM 273 CD GLN A 18 2.492 22.261 10.646 1.00 0.00 C ATOM 274 OE1 GLN A 18 3.129 21.377 11.184 1.00 0.00 O ATOM 275 NE2 GLN A 18 1.931 23.192 11.368 1.00 0.00 N ATOM 0 H GLN A 18 2.530 22.116 6.007 1.00 0.00 H new ATOM 0 HA GLN A 18 1.472 20.329 7.159 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.195 22.460 8.903 1.00 0.00 H new ATOM 0 HB3 GLN A 18 0.742 20.859 9.360 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.137 21.721 8.655 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.429 23.320 8.763 1.00 0.00 H new ATOM 0 HE21 GLN A 18 1.396 23.934 10.917 1.00 0.00 H new ATOM 0 HE22 GLN A 18 2.027 23.177 12.383 1.00 0.00 H new ATOM 284 N VAL A 19 -0.559 21.673 5.448 1.00 0.00 N ATOM 285 CA VAL A 19 -1.871 21.712 4.720 1.00 0.00 C ATOM 286 C VAL A 19 -2.995 21.072 5.534 1.00 0.00 C ATOM 287 O VAL A 19 -3.617 21.706 6.361 1.00 0.00 O ATOM 288 CB VAL A 19 -1.593 20.981 3.378 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.801 19.687 3.608 1.00 0.00 C ATOM 290 CG2 VAL A 19 -2.892 20.638 2.627 1.00 0.00 C ATOM 0 H VAL A 19 0.225 22.020 4.895 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.224 22.729 4.549 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.007 21.670 2.770 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.621 19.196 2.652 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.153 19.923 4.080 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.372 19.021 4.256 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.649 20.128 1.695 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.510 19.988 3.246 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.438 21.555 2.407 1.00 0.00 H new ATOM 300 N SER A 20 -3.242 19.835 5.313 1.00 0.00 N ATOM 301 CA SER A 20 -4.287 19.119 6.035 1.00 0.00 C ATOM 302 C SER A 20 -3.675 17.845 6.550 1.00 0.00 C ATOM 303 O SER A 20 -4.362 16.873 6.720 1.00 0.00 O ATOM 304 CB SER A 20 -5.362 18.826 4.995 1.00 0.00 C ATOM 305 OG SER A 20 -6.508 19.612 5.268 1.00 0.00 O ATOM 0 H SER A 20 -2.739 19.268 4.631 1.00 0.00 H new ATOM 0 HA SER A 20 -4.708 19.671 6.876 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.986 19.046 3.996 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.621 17.767 5.012 1.00 0.00 H new ATOM 0 HG SER A 20 -6.425 20.013 6.158 1.00 0.00 H new ATOM 311 N VAL A 21 -2.372 17.814 6.744 1.00 0.00 N ATOM 312 CA VAL A 21 -1.694 16.571 7.215 1.00 0.00 C ATOM 313 C VAL A 21 -2.712 15.647 7.845 1.00 0.00 C ATOM 314 O VAL A 21 -2.743 14.454 7.615 1.00 0.00 O ATOM 315 CB VAL A 21 -0.674 17.036 8.256 1.00 0.00 C ATOM 316 CG1 VAL A 21 0.476 17.763 7.558 1.00 0.00 C ATOM 317 CG2 VAL A 21 -1.334 17.983 9.266 1.00 0.00 C ATOM 0 H VAL A 21 -1.750 18.608 6.593 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.215 16.024 6.403 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.292 16.163 8.785 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.202 18.094 8.301 1.00 0.00 H new ATOM 0 HG12 VAL A 21 0.960 17.086 6.854 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.087 18.628 7.021 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.595 18.305 10.000 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.730 18.854 8.743 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -2.147 17.464 9.774 1.00 0.00 H new ATOM 327 N SER A 22 -3.591 16.229 8.586 1.00 0.00 N ATOM 328 CA SER A 22 -4.669 15.428 9.228 1.00 0.00 C ATOM 329 C SER A 22 -5.776 15.141 8.220 1.00 0.00 C ATOM 330 O SER A 22 -6.371 14.084 8.221 1.00 0.00 O ATOM 331 CB SER A 22 -5.187 16.293 10.378 1.00 0.00 C ATOM 332 OG SER A 22 -6.339 15.681 10.942 1.00 0.00 O ATOM 0 H SER A 22 -3.618 17.230 8.782 1.00 0.00 H new ATOM 0 HA SER A 22 -4.310 14.463 9.587 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.414 16.410 11.138 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.432 17.292 10.016 1.00 0.00 H new ATOM 0 HG SER A 22 -6.673 16.231 11.681 1.00 0.00 H new ATOM 338 N LYS A 23 -6.047 16.073 7.352 1.00 0.00 N ATOM 339 CA LYS A 23 -7.103 15.857 6.339 1.00 0.00 C ATOM 340 C LYS A 23 -6.519 15.245 5.064 1.00 0.00 C ATOM 341 O LYS A 23 -7.157 14.422 4.444 1.00 0.00 O ATOM 342 CB LYS A 23 -7.692 17.237 6.070 1.00 0.00 C ATOM 343 CG LYS A 23 -9.110 17.306 6.645 1.00 0.00 C ATOM 344 CD LYS A 23 -9.850 18.511 6.055 1.00 0.00 C ATOM 345 CE LYS A 23 -9.000 19.772 6.231 1.00 0.00 C ATOM 346 NZ LYS A 23 -9.903 20.761 6.884 1.00 0.00 N ATOM 0 H LYS A 23 -5.578 16.978 7.304 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.864 15.158 6.687 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -7.066 18.006 6.523 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.712 17.433 4.998 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.651 16.388 6.416 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.068 17.389 7.731 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.055 18.343 4.998 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.813 18.637 6.550 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -8.122 19.573 6.846 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -8.639 20.141 5.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -9.389 21.652 7.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -10.726 20.936 6.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -10.225 20.386 7.799 1.00 0.00 H new ATOM 360 N MET A 24 -5.323 15.602 4.652 1.00 0.00 N ATOM 361 CA MET A 24 -4.800 14.963 3.409 1.00 0.00 C ATOM 362 C MET A 24 -4.547 13.484 3.680 1.00 0.00 C ATOM 363 O MET A 24 -4.826 12.657 2.839 1.00 0.00 O ATOM 364 CB MET A 24 -3.504 15.665 2.944 1.00 0.00 C ATOM 365 CG MET A 24 -2.957 16.638 3.983 1.00 0.00 C ATOM 366 SD MET A 24 -1.161 16.572 3.935 1.00 0.00 S ATOM 367 CE MET A 24 -1.077 14.892 4.575 1.00 0.00 C ATOM 0 H MET A 24 -4.710 16.281 5.104 1.00 0.00 H new ATOM 0 HA MET A 24 -5.536 15.061 2.611 1.00 0.00 H new ATOM 0 HB2 MET A 24 -2.747 14.912 2.723 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.700 16.203 2.016 1.00 0.00 H new ATOM 0 HG2 MET A 24 -3.305 17.650 3.775 1.00 0.00 H new ATOM 0 HG3 MET A 24 -3.319 16.375 4.977 1.00 0.00 H new ATOM 0 HE1 MET A 24 -0.249 14.812 5.280 1.00 0.00 H new ATOM 0 HE2 MET A 24 -2.010 14.649 5.083 1.00 0.00 H new ATOM 0 HE3 MET A 24 -0.920 14.196 3.751 1.00 0.00 H new ATOM 377 N LEU A 25 -4.050 13.114 4.845 1.00 0.00 N ATOM 378 CA LEU A 25 -3.850 11.660 5.085 1.00 0.00 C ATOM 379 C LEU A 25 -5.192 11.021 5.426 1.00 0.00 C ATOM 380 O LEU A 25 -5.571 10.025 4.847 1.00 0.00 O ATOM 381 CB LEU A 25 -2.853 11.548 6.235 1.00 0.00 C ATOM 382 CG LEU A 25 -1.417 11.825 5.739 1.00 0.00 C ATOM 383 CD1 LEU A 25 -0.484 10.718 6.242 1.00 0.00 C ATOM 384 CD2 LEU A 25 -1.341 11.856 4.205 1.00 0.00 C ATOM 0 H LEU A 25 -3.786 13.737 5.608 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.462 11.139 4.209 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.115 12.257 7.021 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.906 10.552 6.674 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.117 12.799 6.125 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.531 10.911 5.893 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.496 10.699 7.332 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.822 9.755 5.859 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.315 12.054 3.895 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.662 10.894 3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.993 12.643 3.824 1.00 0.00 H new ATOM 396 N ALA A 26 -5.947 11.601 6.324 1.00 0.00 N ATOM 397 CA ALA A 26 -7.284 11.016 6.628 1.00 0.00 C ATOM 398 C ALA A 26 -8.057 10.906 5.313 1.00 0.00 C ATOM 399 O ALA A 26 -8.763 9.945 5.050 1.00 0.00 O ATOM 400 CB ALA A 26 -7.961 12.009 7.572 1.00 0.00 C ATOM 0 H ALA A 26 -5.700 12.439 6.851 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.231 10.027 7.083 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.952 11.641 7.837 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -7.361 12.119 8.475 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.054 12.976 7.077 1.00 0.00 H new ATOM 406 N SER A 27 -7.884 11.879 4.458 1.00 0.00 N ATOM 407 CA SER A 27 -8.568 11.833 3.144 1.00 0.00 C ATOM 408 C SER A 27 -7.749 10.977 2.184 1.00 0.00 C ATOM 409 O SER A 27 -8.287 10.350 1.302 1.00 0.00 O ATOM 410 CB SER A 27 -8.652 13.274 2.654 1.00 0.00 C ATOM 411 OG SER A 27 -9.575 13.343 1.578 1.00 0.00 O ATOM 0 H SER A 27 -7.299 12.699 4.617 1.00 0.00 H new ATOM 0 HA SER A 27 -9.564 11.395 3.212 1.00 0.00 H new ATOM 0 HB2 SER A 27 -8.969 13.930 3.465 1.00 0.00 H new ATOM 0 HB3 SER A 27 -7.670 13.620 2.331 1.00 0.00 H new ATOM 0 HG SER A 27 -9.159 12.984 0.767 1.00 0.00 H new ATOM 417 N PHE A 28 -6.449 10.926 2.372 1.00 0.00 N ATOM 418 CA PHE A 28 -5.591 10.078 1.485 1.00 0.00 C ATOM 419 C PHE A 28 -6.180 8.684 1.460 1.00 0.00 C ATOM 420 O PHE A 28 -6.430 8.126 0.417 1.00 0.00 O ATOM 421 CB PHE A 28 -4.214 10.085 2.152 1.00 0.00 C ATOM 422 CG PHE A 28 -3.353 8.930 1.680 1.00 0.00 C ATOM 423 CD1 PHE A 28 -3.517 7.644 2.222 1.00 0.00 C ATOM 424 CD2 PHE A 28 -2.349 9.161 0.739 1.00 0.00 C ATOM 425 CE1 PHE A 28 -2.682 6.607 1.811 1.00 0.00 C ATOM 426 CE2 PHE A 28 -1.509 8.127 0.338 1.00 0.00 C ATOM 427 CZ PHE A 28 -1.672 6.846 0.873 1.00 0.00 C ATOM 0 H PHE A 28 -5.948 11.435 3.100 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.528 10.434 0.457 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.710 11.027 1.935 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.334 10.030 3.234 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -4.288 7.460 2.955 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -2.223 10.148 0.319 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -2.815 5.615 2.218 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.731 8.314 -0.387 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.020 6.043 0.563 1.00 0.00 H new ATOM 437 N GLU A 29 -6.468 8.137 2.600 1.00 0.00 N ATOM 438 CA GLU A 29 -7.106 6.809 2.599 1.00 0.00 C ATOM 439 C GLU A 29 -8.490 6.986 2.010 1.00 0.00 C ATOM 440 O GLU A 29 -8.990 6.150 1.283 1.00 0.00 O ATOM 441 CB GLU A 29 -7.197 6.369 4.047 1.00 0.00 C ATOM 442 CG GLU A 29 -7.569 4.896 4.054 1.00 0.00 C ATOM 443 CD GLU A 29 -8.559 4.611 5.186 1.00 0.00 C ATOM 444 OE1 GLU A 29 -8.179 4.769 6.335 1.00 0.00 O ATOM 445 OE2 GLU A 29 -9.682 4.239 4.885 1.00 0.00 O ATOM 0 H GLU A 29 -6.291 8.547 3.517 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.555 6.067 2.021 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -6.246 6.527 4.556 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -7.945 6.956 4.580 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -8.010 4.619 3.096 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.674 4.287 4.181 1.00 0.00 H new ATOM 452 N LYS A 30 -9.098 8.106 2.297 1.00 0.00 N ATOM 453 CA LYS A 30 -10.433 8.375 1.729 1.00 0.00 C ATOM 454 C LYS A 30 -10.307 8.523 0.216 1.00 0.00 C ATOM 455 O LYS A 30 -11.256 8.401 -0.496 1.00 0.00 O ATOM 456 CB LYS A 30 -10.905 9.681 2.357 1.00 0.00 C ATOM 457 CG LYS A 30 -12.427 9.769 2.238 1.00 0.00 C ATOM 458 CD LYS A 30 -12.952 10.858 3.175 1.00 0.00 C ATOM 459 CE LYS A 30 -14.425 11.132 2.864 1.00 0.00 C ATOM 460 NZ LYS A 30 -15.012 11.583 4.156 1.00 0.00 N ATOM 0 H LYS A 30 -8.722 8.839 2.899 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.140 7.570 1.932 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.606 9.725 3.404 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.439 10.530 1.857 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.709 9.993 1.209 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.878 8.809 2.490 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.841 10.544 4.213 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.368 11.770 3.053 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -14.531 11.896 2.094 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -14.924 10.236 2.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.023 11.791 4.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.903 10.833 4.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.521 12.441 4.479 1.00 0.00 H new ATOM 474 N ILE A 31 -9.140 8.754 -0.300 1.00 0.00 N ATOM 475 CA ILE A 31 -9.021 8.862 -1.778 1.00 0.00 C ATOM 476 C ILE A 31 -8.291 7.649 -2.312 1.00 0.00 C ATOM 477 O ILE A 31 -8.499 7.224 -3.428 1.00 0.00 O ATOM 478 CB ILE A 31 -8.284 10.154 -2.087 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.107 10.389 -1.150 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.276 11.306 -1.983 1.00 0.00 C ATOM 481 CD1 ILE A 31 -5.819 10.030 -1.890 1.00 0.00 C ATOM 0 H ILE A 31 -8.274 8.872 0.225 1.00 0.00 H new ATOM 0 HA ILE A 31 -9.998 8.888 -2.260 1.00 0.00 H new ATOM 0 HB ILE A 31 -7.872 10.086 -3.094 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.081 11.430 -0.828 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.210 9.780 -0.252 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -8.767 12.245 -2.201 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.084 11.156 -2.699 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.687 11.342 -0.974 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.965 10.193 -1.233 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.852 8.983 -2.190 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.721 10.658 -2.775 1.00 0.00 H new ATOM 493 N ILE A 32 -7.480 7.060 -1.496 1.00 0.00 N ATOM 494 CA ILE A 32 -6.777 5.831 -1.924 1.00 0.00 C ATOM 495 C ILE A 32 -7.765 4.697 -1.865 1.00 0.00 C ATOM 496 O ILE A 32 -7.989 3.991 -2.826 1.00 0.00 O ATOM 497 CB ILE A 32 -5.670 5.572 -0.914 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.726 6.779 -0.857 1.00 0.00 C ATOM 499 CG2 ILE A 32 -4.906 4.318 -1.353 1.00 0.00 C ATOM 500 CD1 ILE A 32 -3.389 6.442 -1.513 1.00 0.00 C ATOM 0 H ILE A 32 -7.272 7.375 -0.549 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.368 5.925 -2.930 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.090 5.420 0.080 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.182 7.630 -1.363 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.565 7.074 0.180 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.106 4.112 -0.642 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.589 3.469 -1.386 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.480 4.480 -2.343 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.731 7.309 -1.464 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.927 5.606 -0.988 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.554 6.170 -2.556 1.00 0.00 H new ATOM 512 N THR A 33 -8.361 4.530 -0.723 1.00 0.00 N ATOM 513 CA THR A 33 -9.344 3.454 -0.562 1.00 0.00 C ATOM 514 C THR A 33 -10.675 3.898 -1.172 1.00 0.00 C ATOM 515 O THR A 33 -11.439 3.084 -1.656 1.00 0.00 O ATOM 516 CB THR A 33 -9.419 3.220 0.958 1.00 0.00 C ATOM 517 OG1 THR A 33 -8.883 1.942 1.261 1.00 0.00 O ATOM 518 CG2 THR A 33 -10.862 3.289 1.448 1.00 0.00 C ATOM 0 H THR A 33 -8.202 5.102 0.107 1.00 0.00 H new ATOM 0 HA THR A 33 -9.080 2.527 -1.071 1.00 0.00 H new ATOM 0 HB THR A 33 -8.844 3.999 1.459 1.00 0.00 H new ATOM 0 HG1 THR A 33 -7.913 2.014 1.381 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.889 3.121 2.525 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.276 4.272 1.224 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.454 2.523 0.946 1.00 0.00 H new ATOM 526 N GLU A 34 -10.963 5.178 -1.177 1.00 0.00 N ATOM 527 CA GLU A 34 -12.236 5.620 -1.783 1.00 0.00 C ATOM 528 C GLU A 34 -12.115 5.646 -3.310 1.00 0.00 C ATOM 529 O GLU A 34 -13.087 5.409 -3.992 1.00 0.00 O ATOM 530 CB GLU A 34 -12.472 7.000 -1.210 1.00 0.00 C ATOM 531 CG GLU A 34 -12.769 6.861 0.297 1.00 0.00 C ATOM 532 CD GLU A 34 -14.118 6.163 0.489 1.00 0.00 C ATOM 533 OE1 GLU A 34 -15.130 6.795 0.234 1.00 0.00 O ATOM 534 OE2 GLU A 34 -14.115 5.010 0.889 1.00 0.00 O ATOM 0 H GLU A 34 -10.375 5.917 -0.792 1.00 0.00 H new ATOM 0 HA GLU A 34 -13.068 4.952 -1.563 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.596 7.630 -1.367 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -13.307 7.483 -1.718 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -11.979 6.289 0.783 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -12.786 7.844 0.767 1.00 0.00 H new ATOM 541 N THR A 35 -10.939 5.890 -3.874 1.00 0.00 N ATOM 542 CA THR A 35 -10.864 5.860 -5.370 1.00 0.00 C ATOM 543 C THR A 35 -10.934 4.413 -5.811 1.00 0.00 C ATOM 544 O THR A 35 -11.813 4.016 -6.544 1.00 0.00 O ATOM 545 CB THR A 35 -9.523 6.437 -5.802 1.00 0.00 C ATOM 546 OG1 THR A 35 -9.532 7.849 -5.639 1.00 0.00 O ATOM 547 CG2 THR A 35 -9.321 6.077 -7.281 1.00 0.00 C ATOM 0 H THR A 35 -10.070 6.099 -3.382 1.00 0.00 H new ATOM 0 HA THR A 35 -11.678 6.437 -5.809 1.00 0.00 H new ATOM 0 HB THR A 35 -8.713 6.030 -5.197 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.987 8.092 -4.862 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.367 6.476 -7.626 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.324 4.993 -7.395 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.129 6.506 -7.874 1.00 0.00 H new ATOM 555 N VAL A 36 -10.005 3.622 -5.348 1.00 0.00 N ATOM 556 CA VAL A 36 -10.003 2.177 -5.699 1.00 0.00 C ATOM 557 C VAL A 36 -11.433 1.666 -5.596 1.00 0.00 C ATOM 558 O VAL A 36 -11.913 0.920 -6.428 1.00 0.00 O ATOM 559 CB VAL A 36 -9.113 1.530 -4.634 1.00 0.00 C ATOM 560 CG1 VAL A 36 -7.675 2.017 -4.806 1.00 0.00 C ATOM 561 CG2 VAL A 36 -9.619 1.919 -3.250 1.00 0.00 C ATOM 0 H VAL A 36 -9.243 3.918 -4.738 1.00 0.00 H new ATOM 0 HA VAL A 36 -9.641 1.962 -6.704 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.143 0.446 -4.743 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -7.042 1.556 -4.048 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -7.314 1.742 -5.797 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -7.642 3.101 -4.696 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.987 1.460 -2.489 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -9.587 3.003 -3.142 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -10.645 1.572 -3.127 1.00 0.00 H new ATOM 571 N ALA A 37 -12.125 2.104 -4.588 1.00 0.00 N ATOM 572 CA ALA A 37 -13.532 1.692 -4.427 1.00 0.00 C ATOM 573 C ALA A 37 -14.402 2.516 -5.370 1.00 0.00 C ATOM 574 O ALA A 37 -15.358 2.023 -5.930 1.00 0.00 O ATOM 575 CB ALA A 37 -13.864 1.986 -2.972 1.00 0.00 C ATOM 0 H ALA A 37 -11.771 2.733 -3.867 1.00 0.00 H new ATOM 0 HA ALA A 37 -13.703 0.642 -4.664 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -14.898 1.706 -2.771 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -13.200 1.413 -2.324 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -13.732 3.050 -2.776 1.00 0.00 H new ATOM 581 N LYS A 38 -14.029 3.746 -5.621 1.00 0.00 N ATOM 582 CA LYS A 38 -14.807 4.562 -6.594 1.00 0.00 C ATOM 583 C LYS A 38 -14.720 3.813 -7.891 1.00 0.00 C ATOM 584 O LYS A 38 -15.609 3.832 -8.720 1.00 0.00 O ATOM 585 CB LYS A 38 -14.107 5.920 -6.688 1.00 0.00 C ATOM 586 CG LYS A 38 -15.155 7.035 -6.718 1.00 0.00 C ATOM 587 CD LYS A 38 -14.685 8.203 -5.848 1.00 0.00 C ATOM 588 CE LYS A 38 -14.760 7.804 -4.371 1.00 0.00 C ATOM 589 NZ LYS A 38 -15.972 8.497 -3.848 1.00 0.00 N ATOM 0 H LYS A 38 -13.228 4.214 -5.198 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.850 4.723 -6.320 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.440 6.057 -5.837 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.491 5.962 -7.586 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -15.313 7.372 -7.742 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -16.111 6.659 -6.355 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.663 8.477 -6.110 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.307 9.079 -6.031 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -14.843 6.723 -4.257 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -13.864 8.113 -3.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -16.092 8.273 -2.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -15.861 9.525 -3.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -16.809 8.177 -4.376 1.00 0.00 H new ATOM 603 N GLY A 39 -13.652 3.089 -8.020 1.00 0.00 N ATOM 604 CA GLY A 39 -13.473 2.255 -9.190 1.00 0.00 C ATOM 605 C GLY A 39 -12.262 2.702 -10.000 1.00 0.00 C ATOM 606 O GLY A 39 -12.194 2.487 -11.194 1.00 0.00 O ATOM 0 H GLY A 39 -12.891 3.051 -7.342 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.347 1.216 -8.885 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.367 2.298 -9.812 1.00 0.00 H new ATOM 610 N ASP A 40 -11.296 3.308 -9.365 1.00 0.00 N ATOM 611 CA ASP A 40 -10.087 3.743 -10.127 1.00 0.00 C ATOM 612 C ASP A 40 -8.831 3.101 -9.531 1.00 0.00 C ATOM 613 O ASP A 40 -8.670 3.018 -8.330 1.00 0.00 O ATOM 614 CB ASP A 40 -10.046 5.266 -10.004 1.00 0.00 C ATOM 615 CG ASP A 40 -10.271 5.899 -11.380 1.00 0.00 C ATOM 616 OD1 ASP A 40 -9.576 5.517 -12.306 1.00 0.00 O ATOM 617 OD2 ASP A 40 -11.136 6.754 -11.482 1.00 0.00 O ATOM 0 H ASP A 40 -11.288 3.519 -8.367 1.00 0.00 H new ATOM 0 HA ASP A 40 -10.127 3.438 -11.173 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.812 5.605 -9.307 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -9.084 5.582 -9.600 1.00 0.00 H new ATOM 622 N LYS A 41 -7.950 2.634 -10.371 1.00 0.00 N ATOM 623 CA LYS A 41 -6.706 1.972 -9.879 1.00 0.00 C ATOM 624 C LYS A 41 -5.650 3.012 -9.512 1.00 0.00 C ATOM 625 O LYS A 41 -4.813 3.375 -10.316 1.00 0.00 O ATOM 626 CB LYS A 41 -6.225 1.114 -11.051 1.00 0.00 C ATOM 627 CG LYS A 41 -7.215 -0.026 -11.293 1.00 0.00 C ATOM 628 CD LYS A 41 -7.217 -0.394 -12.778 1.00 0.00 C ATOM 629 CE LYS A 41 -7.552 -1.879 -12.940 1.00 0.00 C ATOM 630 NZ LYS A 41 -6.239 -2.583 -12.887 1.00 0.00 N ATOM 0 H LYS A 41 -8.038 2.682 -11.386 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.887 1.380 -8.982 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.133 1.726 -11.949 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.235 0.710 -10.837 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.941 -0.894 -10.693 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.215 0.274 -10.981 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -7.947 0.214 -13.312 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -6.242 -0.181 -13.217 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -8.215 -2.222 -12.146 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.062 -2.067 -13.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -6.390 -3.607 -12.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -5.631 -2.242 -13.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -5.779 -2.392 -11.974 1.00 0.00 H new ATOM 644 N VAL A 42 -5.677 3.485 -8.299 1.00 0.00 N ATOM 645 CA VAL A 42 -4.669 4.496 -7.865 1.00 0.00 C ATOM 646 C VAL A 42 -3.271 3.869 -7.874 1.00 0.00 C ATOM 647 O VAL A 42 -3.094 2.726 -7.500 1.00 0.00 O ATOM 648 CB VAL A 42 -5.079 4.888 -6.443 1.00 0.00 C ATOM 649 CG1 VAL A 42 -6.491 5.478 -6.460 1.00 0.00 C ATOM 650 CG2 VAL A 42 -5.054 3.651 -5.538 1.00 0.00 C ATOM 0 H VAL A 42 -6.355 3.216 -7.586 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.637 5.363 -8.525 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.379 5.631 -6.060 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.781 5.756 -5.447 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -6.509 6.361 -7.098 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -7.190 4.737 -6.847 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.346 3.934 -4.527 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -5.750 2.905 -5.922 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -4.048 3.233 -5.521 1.00 0.00 H new ATOM 660 N GLN A 43 -2.278 4.601 -8.305 1.00 0.00 N ATOM 661 CA GLN A 43 -0.897 4.035 -8.341 1.00 0.00 C ATOM 662 C GLN A 43 0.105 5.049 -7.789 1.00 0.00 C ATOM 663 O GLN A 43 -0.231 6.186 -7.530 1.00 0.00 O ATOM 664 CB GLN A 43 -0.615 3.760 -9.822 1.00 0.00 C ATOM 665 CG GLN A 43 -1.768 2.955 -10.428 1.00 0.00 C ATOM 666 CD GLN A 43 -1.218 1.955 -11.446 1.00 0.00 C ATOM 667 OE1 GLN A 43 -0.896 0.835 -11.103 1.00 0.00 O ATOM 668 NE2 GLN A 43 -1.096 2.313 -12.696 1.00 0.00 N ATOM 0 H GLN A 43 -2.362 5.563 -8.633 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.808 3.134 -7.734 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.494 4.701 -10.359 1.00 0.00 H new ATOM 0 HB3 GLN A 43 0.320 3.210 -9.928 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -2.309 2.428 -9.642 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.479 3.626 -10.910 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -1.366 3.253 -12.986 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -0.731 1.653 -13.382 1.00 0.00 H new ATOM 677 N LEU A 44 1.338 4.648 -7.608 1.00 0.00 N ATOM 678 CA LEU A 44 2.355 5.599 -7.078 1.00 0.00 C ATOM 679 C LEU A 44 3.621 5.551 -7.930 1.00 0.00 C ATOM 680 O LEU A 44 4.301 4.546 -7.978 1.00 0.00 O ATOM 681 CB LEU A 44 2.674 5.127 -5.661 1.00 0.00 C ATOM 682 CG LEU A 44 1.405 5.096 -4.815 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.580 4.083 -3.684 1.00 0.00 C ATOM 684 CD2 LEU A 44 1.163 6.483 -4.221 1.00 0.00 C ATOM 0 H LEU A 44 1.681 3.708 -7.804 1.00 0.00 H new ATOM 0 HA LEU A 44 1.983 6.623 -7.093 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.122 4.134 -5.693 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.407 5.793 -5.205 1.00 0.00 H new ATOM 0 HG LEU A 44 0.555 4.810 -5.434 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.676 4.057 -3.076 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.763 3.095 -4.106 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.427 4.374 -3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.257 6.466 -3.615 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.011 6.765 -3.597 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.048 7.209 -5.026 1.00 0.00 H new ATOM 696 N THR A 45 3.949 6.642 -8.582 1.00 0.00 N ATOM 697 CA THR A 45 5.191 6.707 -9.430 1.00 0.00 C ATOM 698 C THR A 45 5.597 5.317 -9.961 1.00 0.00 C ATOM 699 O THR A 45 5.128 4.886 -10.995 1.00 0.00 O ATOM 700 CB THR A 45 6.277 7.301 -8.513 1.00 0.00 C ATOM 701 OG1 THR A 45 7.558 6.865 -8.948 1.00 0.00 O ATOM 702 CG2 THR A 45 6.056 6.863 -7.060 1.00 0.00 C ATOM 0 H THR A 45 3.403 7.504 -8.564 1.00 0.00 H new ATOM 0 HA THR A 45 5.035 7.317 -10.319 1.00 0.00 H new ATOM 0 HB THR A 45 6.219 8.388 -8.564 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.248 7.245 -8.365 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.833 7.293 -6.428 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.080 7.209 -6.720 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.098 5.776 -6.997 1.00 0.00 H new ATOM 710 N GLY A 46 6.464 4.616 -9.269 1.00 0.00 N ATOM 711 CA GLY A 46 6.885 3.270 -9.751 1.00 0.00 C ATOM 712 C GLY A 46 7.320 2.399 -8.568 1.00 0.00 C ATOM 713 O GLY A 46 8.208 1.579 -8.690 1.00 0.00 O ATOM 0 H GLY A 46 6.894 4.920 -8.395 1.00 0.00 H new ATOM 0 HA2 GLY A 46 6.062 2.791 -10.282 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.706 3.370 -10.460 1.00 0.00 H new ATOM 717 N PHE A 47 6.699 2.563 -7.428 1.00 0.00 N ATOM 718 CA PHE A 47 7.080 1.730 -6.246 1.00 0.00 C ATOM 719 C PHE A 47 5.854 1.129 -5.581 1.00 0.00 C ATOM 720 O PHE A 47 5.976 0.229 -4.776 1.00 0.00 O ATOM 721 CB PHE A 47 7.825 2.667 -5.291 1.00 0.00 C ATOM 722 CG PHE A 47 6.828 3.356 -4.407 1.00 0.00 C ATOM 723 CD1 PHE A 47 6.398 2.752 -3.226 1.00 0.00 C ATOM 724 CD2 PHE A 47 6.317 4.584 -4.788 1.00 0.00 C ATOM 725 CE1 PHE A 47 5.452 3.388 -2.429 1.00 0.00 C ATOM 726 CE2 PHE A 47 5.369 5.226 -3.996 1.00 0.00 C ATOM 727 CZ PHE A 47 4.934 4.627 -2.816 1.00 0.00 C ATOM 0 H PHE A 47 5.948 3.234 -7.264 1.00 0.00 H new ATOM 0 HA PHE A 47 7.707 0.888 -6.541 1.00 0.00 H new ATOM 0 HB2 PHE A 47 8.536 2.102 -4.688 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.399 3.402 -5.856 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.798 1.793 -2.931 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.655 5.046 -5.704 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.118 2.925 -1.512 1.00 0.00 H new ATOM 0 HE2 PHE A 47 4.972 6.185 -4.295 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.196 5.120 -2.200 1.00 0.00 H new ATOM 737 N LEU A 48 4.679 1.605 -5.869 1.00 0.00 N ATOM 738 CA LEU A 48 3.514 1.018 -5.210 1.00 0.00 C ATOM 739 C LEU A 48 2.229 1.342 -5.973 1.00 0.00 C ATOM 740 O LEU A 48 1.889 2.484 -6.202 1.00 0.00 O ATOM 741 CB LEU A 48 3.563 1.632 -3.831 1.00 0.00 C ATOM 742 CG LEU A 48 2.397 1.129 -3.037 1.00 0.00 C ATOM 743 CD1 LEU A 48 2.418 -0.406 -3.006 1.00 0.00 C ATOM 744 CD2 LEU A 48 2.485 1.694 -1.627 1.00 0.00 C ATOM 0 H LEU A 48 4.488 2.364 -6.524 1.00 0.00 H new ATOM 0 HA LEU A 48 3.526 -0.071 -5.171 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.498 1.371 -3.335 1.00 0.00 H new ATOM 0 HB3 LEU A 48 3.531 2.719 -3.901 1.00 0.00 H new ATOM 0 HG LEU A 48 1.462 1.451 -3.495 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.569 -0.770 -2.428 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.356 -0.791 -4.024 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.344 -0.748 -2.545 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.641 1.335 -1.038 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.416 1.369 -1.162 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.461 2.783 -1.669 1.00 0.00 H new ATOM 756 N ASN A 49 1.528 0.321 -6.389 1.00 0.00 N ATOM 757 CA ASN A 49 0.275 0.527 -7.165 1.00 0.00 C ATOM 758 C ASN A 49 -0.870 -0.321 -6.602 1.00 0.00 C ATOM 759 O ASN A 49 -0.818 -1.534 -6.599 1.00 0.00 O ATOM 760 CB ASN A 49 0.617 0.071 -8.583 1.00 0.00 C ATOM 761 CG ASN A 49 1.488 1.126 -9.271 1.00 0.00 C ATOM 762 OD1 ASN A 49 2.048 1.988 -8.624 1.00 0.00 O ATOM 763 ND2 ASN A 49 1.627 1.092 -10.568 1.00 0.00 N ATOM 0 H ASN A 49 1.774 -0.655 -6.222 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.058 1.564 -7.124 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.143 -0.883 -8.551 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.298 -0.088 -9.154 1.00 0.00 H new ATOM 0 HD21 ASN A 49 2.205 1.789 -11.037 1.00 0.00 H new ATOM 0 HD22 ASN A 49 1.157 0.369 -11.112 1.00 0.00 H new ATOM 770 N ILE A 50 -1.907 0.320 -6.145 1.00 0.00 N ATOM 771 CA ILE A 50 -3.088 -0.422 -5.591 1.00 0.00 C ATOM 772 C ILE A 50 -4.143 -0.605 -6.692 1.00 0.00 C ATOM 773 O ILE A 50 -4.236 0.205 -7.595 1.00 0.00 O ATOM 774 CB ILE A 50 -3.660 0.469 -4.474 1.00 0.00 C ATOM 775 CG1 ILE A 50 -2.538 1.191 -3.716 1.00 0.00 C ATOM 776 CG2 ILE A 50 -4.454 -0.396 -3.493 1.00 0.00 C ATOM 777 CD1 ILE A 50 -1.549 0.170 -3.162 1.00 0.00 C ATOM 0 H ILE A 50 -1.994 1.336 -6.128 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.807 -1.407 -5.219 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.309 1.218 -4.929 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.024 1.884 -4.382 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.958 1.782 -2.903 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.860 0.232 -2.700 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.271 -0.888 -4.021 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.797 -1.149 -3.058 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.754 0.688 -2.625 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.067 -0.506 -2.481 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.118 -0.402 -3.984 1.00 0.00 H new ATOM 789 N LYS A 51 -4.947 -1.646 -6.638 1.00 0.00 N ATOM 790 CA LYS A 51 -5.981 -1.818 -7.711 1.00 0.00 C ATOM 791 C LYS A 51 -7.033 -2.857 -7.295 1.00 0.00 C ATOM 792 O LYS A 51 -6.715 -4.017 -7.132 1.00 0.00 O ATOM 793 CB LYS A 51 -5.210 -2.295 -8.949 1.00 0.00 C ATOM 794 CG LYS A 51 -4.186 -3.364 -8.551 1.00 0.00 C ATOM 795 CD LYS A 51 -3.860 -4.238 -9.764 1.00 0.00 C ATOM 796 CE LYS A 51 -5.055 -5.140 -10.082 1.00 0.00 C ATOM 797 NZ LYS A 51 -4.589 -6.015 -11.193 1.00 0.00 N ATOM 0 H LYS A 51 -4.933 -2.366 -5.916 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.520 -0.890 -7.902 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -5.904 -2.701 -9.685 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.704 -1.452 -9.419 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.278 -2.891 -8.176 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.582 -3.979 -7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.625 -3.611 -10.624 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -2.977 -4.844 -9.561 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.349 -5.728 -9.212 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.925 -4.554 -10.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.354 -6.664 -11.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.323 -5.428 -12.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -3.765 -6.566 -10.879 1.00 0.00 H new ATOM 811 N PRO A 52 -8.258 -2.410 -7.129 1.00 0.00 N ATOM 812 CA PRO A 52 -9.348 -3.321 -6.719 1.00 0.00 C ATOM 813 C PRO A 52 -9.934 -4.080 -7.903 1.00 0.00 C ATOM 814 O PRO A 52 -9.861 -3.651 -9.038 1.00 0.00 O ATOM 815 CB PRO A 52 -10.384 -2.387 -6.109 1.00 0.00 C ATOM 816 CG PRO A 52 -10.141 -1.048 -6.723 1.00 0.00 C ATOM 817 CD PRO A 52 -8.741 -1.034 -7.299 1.00 0.00 C ATOM 0 HA PRO A 52 -9.002 -4.092 -6.030 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.395 -2.735 -6.319 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.281 -2.344 -5.025 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.875 -0.850 -7.504 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.252 -0.262 -5.976 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.747 -0.743 -8.349 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -8.103 -0.322 -6.775 1.00 0.00 H new ATOM 825 N VAL A 53 -10.520 -5.215 -7.630 1.00 0.00 N ATOM 826 CA VAL A 53 -11.123 -6.028 -8.717 1.00 0.00 C ATOM 827 C VAL A 53 -12.347 -6.785 -8.209 1.00 0.00 C ATOM 828 O VAL A 53 -12.266 -7.599 -7.312 1.00 0.00 O ATOM 829 CB VAL A 53 -10.023 -6.988 -9.155 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.817 -6.185 -9.651 1.00 0.00 C ATOM 831 CG2 VAL A 53 -9.599 -7.854 -7.965 1.00 0.00 C ATOM 0 H VAL A 53 -10.606 -5.613 -6.695 1.00 0.00 H new ATOM 0 HA VAL A 53 -11.470 -5.411 -9.546 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.394 -7.626 -9.957 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -8.029 -6.869 -9.965 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.116 -5.564 -10.495 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.447 -5.550 -8.846 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.812 -8.541 -8.277 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.226 -7.215 -7.164 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.456 -8.423 -7.605 1.00 0.00 H new ATOM 841 N ALA A 54 -13.483 -6.506 -8.776 1.00 0.00 N ATOM 842 CA ALA A 54 -14.737 -7.180 -8.330 1.00 0.00 C ATOM 843 C ALA A 54 -14.832 -8.604 -8.880 1.00 0.00 C ATOM 844 O ALA A 54 -14.891 -8.816 -10.074 1.00 0.00 O ATOM 845 CB ALA A 54 -15.869 -6.320 -8.885 1.00 0.00 C ATOM 0 H ALA A 54 -13.601 -5.835 -9.535 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.776 -7.269 -7.244 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.828 -6.752 -8.599 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -15.790 -5.311 -8.481 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -15.798 -6.283 -9.972 1.00 0.00 H new ATOM 1164 N VAL A 75 -15.173 -6.597 -3.651 1.00 0.00 N ATOM 1165 CA VAL A 75 -14.029 -6.177 -4.519 1.00 0.00 C ATOM 1166 C VAL A 75 -12.743 -6.914 -4.143 1.00 0.00 C ATOM 1167 O VAL A 75 -12.614 -7.451 -3.060 1.00 0.00 O ATOM 1168 CB VAL A 75 -13.875 -4.682 -4.256 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -13.603 -4.448 -2.766 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -12.705 -4.142 -5.080 1.00 0.00 C ATOM 0 HA VAL A 75 -14.215 -6.405 -5.568 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.792 -4.165 -4.540 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -13.493 -3.380 -2.580 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -14.436 -4.835 -2.179 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -12.686 -4.963 -2.478 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -12.592 -3.074 -4.895 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -11.789 -4.659 -4.794 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -12.899 -4.308 -6.140 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.783 -6.928 -5.032 1.00 0.00 N ATOM 1181 CA GLY A 76 -10.499 -7.613 -4.725 1.00 0.00 C ATOM 1182 C GLY A 76 -9.378 -6.577 -4.725 1.00 0.00 C ATOM 1183 O GLY A 76 -8.531 -6.569 -5.592 1.00 0.00 O ATOM 0 H GLY A 76 -11.836 -6.495 -5.954 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.557 -8.107 -3.755 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.298 -8.387 -5.465 1.00 0.00 H new ATOM 1187 N VAL A 77 -9.385 -5.699 -3.756 1.00 0.00 N ATOM 1188 CA VAL A 77 -8.337 -4.634 -3.668 1.00 0.00 C ATOM 1189 C VAL A 77 -6.942 -5.204 -3.861 1.00 0.00 C ATOM 1190 O VAL A 77 -6.204 -5.413 -2.917 1.00 0.00 O ATOM 1191 CB VAL A 77 -8.482 -4.042 -2.262 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -8.371 -5.154 -1.216 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -7.372 -3.013 -2.024 1.00 0.00 C ATOM 0 H VAL A 77 -10.081 -5.673 -3.011 1.00 0.00 H new ATOM 0 HA VAL A 77 -8.469 -3.886 -4.450 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.456 -3.560 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -8.475 -4.727 -0.219 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.160 -5.888 -1.380 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.399 -5.640 -1.303 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.475 -2.592 -1.024 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.400 -3.498 -2.115 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.450 -2.216 -2.763 1.00 0.00 H new ATOM 1203 N SER A 78 -6.557 -5.420 -5.080 1.00 0.00 N ATOM 1204 CA SER A 78 -5.191 -5.926 -5.317 1.00 0.00 C ATOM 1205 C SER A 78 -4.236 -4.749 -5.156 1.00 0.00 C ATOM 1206 O SER A 78 -4.652 -3.627 -4.936 1.00 0.00 O ATOM 1207 CB SER A 78 -5.178 -6.460 -6.753 1.00 0.00 C ATOM 1208 OG SER A 78 -6.500 -6.474 -7.276 1.00 0.00 O ATOM 0 H SER A 78 -7.124 -5.269 -5.914 1.00 0.00 H new ATOM 0 HA SER A 78 -4.892 -6.715 -4.627 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.538 -5.836 -7.376 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.759 -7.466 -6.772 1.00 0.00 H new ATOM 0 HG SER A 78 -6.730 -5.581 -7.607 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.971 -4.988 -5.258 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.975 -3.890 -5.107 1.00 0.00 C ATOM 1216 C VAL A 79 -0.574 -4.486 -5.215 1.00 0.00 C ATOM 1217 O VAL A 79 -0.405 -5.689 -5.239 1.00 0.00 O ATOM 1218 CB VAL A 79 -2.213 -3.307 -3.681 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -2.718 -4.402 -2.733 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -0.916 -2.733 -3.096 1.00 0.00 C ATOM 0 H VAL A 79 -2.571 -5.908 -5.442 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.074 -3.117 -5.869 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.956 -2.515 -3.775 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.879 -3.979 -1.742 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.656 -4.807 -3.112 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.978 -5.200 -2.671 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -1.111 -2.333 -2.101 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.167 -3.522 -3.029 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.547 -1.936 -3.741 1.00 0.00 H new ATOM 1230 N LYS A 80 0.428 -3.659 -5.208 1.00 0.00 N ATOM 1231 CA LYS A 80 1.811 -4.170 -5.229 1.00 0.00 C ATOM 1232 C LYS A 80 2.788 -3.001 -5.169 1.00 0.00 C ATOM 1233 O LYS A 80 2.408 -1.858 -5.318 1.00 0.00 O ATOM 1234 CB LYS A 80 1.959 -4.917 -6.562 1.00 0.00 C ATOM 1235 CG LYS A 80 1.560 -3.995 -7.718 1.00 0.00 C ATOM 1236 CD LYS A 80 1.972 -4.635 -9.046 1.00 0.00 C ATOM 1237 CE LYS A 80 0.801 -5.442 -9.611 1.00 0.00 C ATOM 1238 NZ LYS A 80 0.937 -5.332 -11.091 1.00 0.00 N ATOM 0 H LYS A 80 0.342 -2.643 -5.188 1.00 0.00 H new ATOM 0 HA LYS A 80 2.020 -4.822 -4.381 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.988 -5.252 -6.690 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.332 -5.808 -6.562 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.484 -3.821 -7.704 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.041 -3.024 -7.605 1.00 0.00 H new ATOM 0 HD2 LYS A 80 2.272 -3.864 -9.756 1.00 0.00 H new ATOM 0 HD3 LYS A 80 2.835 -5.283 -8.897 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.845 -6.482 -9.287 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.154 -5.042 -9.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.168 -5.861 -11.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.885 -4.332 -11.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.853 -5.727 -11.386 1.00 0.00 H new ATOM 1252 N PRO A 81 4.019 -3.344 -4.982 1.00 0.00 N ATOM 1253 CA PRO A 81 5.107 -2.371 -4.924 1.00 0.00 C ATOM 1254 C PRO A 81 5.865 -2.320 -6.249 1.00 0.00 C ATOM 1255 O PRO A 81 5.629 -3.093 -7.157 1.00 0.00 O ATOM 1256 CB PRO A 81 6.012 -2.972 -3.856 1.00 0.00 C ATOM 1257 CG PRO A 81 5.728 -4.452 -3.882 1.00 0.00 C ATOM 1258 CD PRO A 81 4.518 -4.676 -4.759 1.00 0.00 C ATOM 0 HA PRO A 81 4.766 -1.356 -4.720 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.061 -2.769 -4.070 1.00 0.00 H new ATOM 0 HB3 PRO A 81 5.799 -2.548 -2.875 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.587 -4.999 -4.270 1.00 0.00 H new ATOM 0 HG3 PRO A 81 5.543 -4.823 -2.874 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.785 -5.167 -5.695 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.777 -5.306 -4.268 1.00 0.00 H new ATOM 1266 N GLY A 82 6.805 -1.433 -6.329 1.00 0.00 N ATOM 1267 CA GLY A 82 7.652 -1.310 -7.543 1.00 0.00 C ATOM 1268 C GLY A 82 9.108 -1.393 -7.085 1.00 0.00 C ATOM 1269 O GLY A 82 9.394 -1.245 -5.912 1.00 0.00 O ATOM 0 H GLY A 82 7.030 -0.770 -5.587 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.426 -2.105 -8.253 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.461 -0.365 -8.052 1.00 0.00 H new ATOM 1273 N GLU A 83 10.032 -1.642 -7.970 1.00 0.00 N ATOM 1274 CA GLU A 83 11.454 -1.742 -7.527 1.00 0.00 C ATOM 1275 C GLU A 83 11.903 -0.453 -6.840 1.00 0.00 C ATOM 1276 O GLU A 83 12.833 -0.458 -6.060 1.00 0.00 O ATOM 1277 CB GLU A 83 12.269 -1.992 -8.787 1.00 0.00 C ATOM 1278 CG GLU A 83 12.056 -0.848 -9.783 1.00 0.00 C ATOM 1279 CD GLU A 83 11.902 -1.419 -11.194 1.00 0.00 C ATOM 1280 OE1 GLU A 83 10.840 -1.945 -11.487 1.00 0.00 O ATOM 1281 OE2 GLU A 83 12.848 -1.319 -11.959 1.00 0.00 O ATOM 0 H GLU A 83 9.870 -1.779 -8.968 1.00 0.00 H new ATOM 0 HA GLU A 83 11.586 -2.544 -6.801 1.00 0.00 H new ATOM 0 HB2 GLU A 83 13.326 -2.075 -8.536 1.00 0.00 H new ATOM 0 HB3 GLU A 83 11.974 -2.939 -9.239 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.168 -0.277 -9.512 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.901 -0.160 -9.748 1.00 0.00 H new ATOM 1288 N SER A 84 11.252 0.650 -7.105 1.00 0.00 N ATOM 1289 CA SER A 84 11.656 1.923 -6.435 1.00 0.00 C ATOM 1290 C SER A 84 11.677 1.701 -4.920 1.00 0.00 C ATOM 1291 O SER A 84 12.512 2.225 -4.208 1.00 0.00 O ATOM 1292 CB SER A 84 10.584 2.940 -6.820 1.00 0.00 C ATOM 1293 OG SER A 84 11.053 3.731 -7.903 1.00 0.00 O ATOM 0 H SER A 84 10.465 0.725 -7.750 1.00 0.00 H new ATOM 0 HA SER A 84 12.647 2.265 -6.734 1.00 0.00 H new ATOM 0 HB2 SER A 84 9.664 2.427 -7.101 1.00 0.00 H new ATOM 0 HB3 SER A 84 10.346 3.576 -5.967 1.00 0.00 H new ATOM 0 HG SER A 84 10.366 4.383 -8.153 1.00 0.00 H new ATOM 1299 N LEU A 85 10.768 0.896 -4.436 1.00 0.00 N ATOM 1300 CA LEU A 85 10.723 0.593 -2.979 1.00 0.00 C ATOM 1301 C LEU A 85 11.735 -0.506 -2.658 1.00 0.00 C ATOM 1302 O LEU A 85 12.224 -0.609 -1.550 1.00 0.00 O ATOM 1303 CB LEU A 85 9.288 0.108 -2.724 1.00 0.00 C ATOM 1304 CG LEU A 85 8.738 0.750 -1.447 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.304 0.271 -1.199 1.00 0.00 C ATOM 1306 CD2 LEU A 85 9.619 0.364 -0.255 1.00 0.00 C ATOM 0 H LEU A 85 10.050 0.433 -4.994 1.00 0.00 H new ATOM 0 HA LEU A 85 10.973 1.452 -2.356 1.00 0.00 H new ATOM 0 HB2 LEU A 85 8.653 0.363 -3.572 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.273 -0.978 -2.630 1.00 0.00 H new ATOM 0 HG LEU A 85 8.740 1.834 -1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.919 0.731 -0.289 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.675 0.554 -2.043 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.297 -0.813 -1.088 1.00 0.00 H new ATOM 0 HD21 LEU A 85 9.225 0.822 0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 85 9.623 -0.720 -0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 85 10.637 0.715 -0.426 1.00 0.00 H new ATOM 1318 N LYS A 86 12.059 -1.327 -3.624 1.00 0.00 N ATOM 1319 CA LYS A 86 13.047 -2.413 -3.373 1.00 0.00 C ATOM 1320 C LYS A 86 14.461 -1.880 -3.551 1.00 0.00 C ATOM 1321 O LYS A 86 15.387 -2.315 -2.894 1.00 0.00 O ATOM 1322 CB LYS A 86 12.745 -3.498 -4.411 1.00 0.00 C ATOM 1323 CG LYS A 86 11.312 -4.006 -4.232 1.00 0.00 C ATOM 1324 CD LYS A 86 10.787 -4.543 -5.566 1.00 0.00 C ATOM 1325 CE LYS A 86 9.943 -5.795 -5.317 1.00 0.00 C ATOM 1326 NZ LYS A 86 9.293 -6.087 -6.625 1.00 0.00 N ATOM 0 H LYS A 86 11.683 -1.291 -4.571 1.00 0.00 H new ATOM 0 HA LYS A 86 12.974 -2.804 -2.358 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.875 -3.098 -5.417 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.449 -4.323 -4.303 1.00 0.00 H new ATOM 0 HG2 LYS A 86 11.286 -4.791 -3.477 1.00 0.00 H new ATOM 0 HG3 LYS A 86 10.671 -3.199 -3.876 1.00 0.00 H new ATOM 0 HD2 LYS A 86 10.188 -3.782 -6.066 1.00 0.00 H new ATOM 0 HD3 LYS A 86 11.620 -4.779 -6.228 1.00 0.00 H new ATOM 0 HE2 LYS A 86 10.562 -6.630 -4.989 1.00 0.00 H new ATOM 0 HE3 LYS A 86 9.201 -5.622 -4.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 8.696 -6.934 -6.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.705 -5.278 -6.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.024 -6.254 -7.346 1.00 0.00 H new ATOM 1340 N LYS A 87 14.630 -0.922 -4.411 1.00 0.00 N ATOM 1341 CA LYS A 87 15.976 -0.338 -4.603 1.00 0.00 C ATOM 1342 C LYS A 87 16.271 0.519 -3.386 1.00 0.00 C ATOM 1343 O LYS A 87 17.367 0.514 -2.834 1.00 0.00 O ATOM 1344 CB LYS A 87 15.877 0.504 -5.880 1.00 0.00 C ATOM 1345 CG LYS A 87 17.188 1.265 -6.099 1.00 0.00 C ATOM 1346 CD LYS A 87 17.019 2.260 -7.252 1.00 0.00 C ATOM 1347 CE LYS A 87 17.921 1.852 -8.419 1.00 0.00 C ATOM 1348 NZ LYS A 87 17.177 0.769 -9.121 1.00 0.00 N ATOM 0 H LYS A 87 13.893 -0.519 -4.989 1.00 0.00 H new ATOM 0 HA LYS A 87 16.774 -1.074 -4.704 1.00 0.00 H new ATOM 0 HB2 LYS A 87 15.671 -0.139 -6.736 1.00 0.00 H new ATOM 0 HB3 LYS A 87 15.047 1.206 -5.801 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.470 1.793 -5.188 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.993 0.565 -6.324 1.00 0.00 H new ATOM 0 HD2 LYS A 87 15.978 2.284 -7.575 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.273 3.266 -6.918 1.00 0.00 H new ATOM 0 HE2 LYS A 87 18.112 2.695 -9.084 1.00 0.00 H new ATOM 0 HE3 LYS A 87 18.890 1.500 -8.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 17.733 0.437 -9.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 17.016 -0.022 -8.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 16.262 1.135 -9.453 1.00 0.00 H new ATOM 1362 N ALA A 88 15.271 1.201 -2.903 1.00 0.00 N ATOM 1363 CA ALA A 88 15.480 1.992 -1.678 1.00 0.00 C ATOM 1364 C ALA A 88 15.805 0.997 -0.578 1.00 0.00 C ATOM 1365 O ALA A 88 16.631 1.234 0.286 1.00 0.00 O ATOM 1366 CB ALA A 88 14.147 2.694 -1.408 1.00 0.00 C ATOM 0 H ALA A 88 14.333 1.240 -3.303 1.00 0.00 H new ATOM 0 HA ALA A 88 16.281 2.728 -1.747 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.232 3.302 -0.507 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.894 3.333 -2.254 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.364 1.948 -1.270 1.00 0.00 H new ATOM 1372 N ALA A 89 15.155 -0.137 -0.621 1.00 0.00 N ATOM 1373 CA ALA A 89 15.407 -1.183 0.411 1.00 0.00 C ATOM 1374 C ALA A 89 16.892 -1.505 0.450 1.00 0.00 C ATOM 1375 O ALA A 89 17.491 -1.568 1.506 1.00 0.00 O ATOM 1376 CB ALA A 89 14.582 -2.392 -0.024 1.00 0.00 C ATOM 0 H ALA A 89 14.461 -0.383 -1.327 1.00 0.00 H new ATOM 0 HA ALA A 89 15.125 -0.864 1.414 1.00 0.00 H new ATOM 0 HB1 ALA A 89 14.719 -3.203 0.691 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.528 -2.118 -0.064 1.00 0.00 H new ATOM 0 HB3 ALA A 89 14.909 -2.720 -1.011 1.00 0.00 H new ATOM 1382 N GLU A 90 17.505 -1.657 -0.691 1.00 0.00 N ATOM 1383 CA GLU A 90 18.972 -1.912 -0.700 1.00 0.00 C ATOM 1384 C GLU A 90 19.626 -0.784 0.100 1.00 0.00 C ATOM 1385 O GLU A 90 20.657 -0.948 0.721 1.00 0.00 O ATOM 1386 CB GLU A 90 19.381 -1.888 -2.185 1.00 0.00 C ATOM 1387 CG GLU A 90 20.355 -0.736 -2.465 1.00 0.00 C ATOM 1388 CD GLU A 90 20.698 -0.707 -3.955 1.00 0.00 C ATOM 1389 OE1 GLU A 90 19.791 -0.515 -4.747 1.00 0.00 O ATOM 1390 OE2 GLU A 90 21.861 -0.877 -4.278 1.00 0.00 O ATOM 0 H GLU A 90 17.060 -1.616 -1.608 1.00 0.00 H new ATOM 0 HA GLU A 90 19.272 -2.860 -0.254 1.00 0.00 H new ATOM 0 HB2 GLU A 90 19.846 -2.836 -2.454 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.494 -1.780 -2.809 1.00 0.00 H new ATOM 0 HG2 GLU A 90 19.909 0.212 -2.165 1.00 0.00 H new ATOM 0 HG3 GLU A 90 21.263 -0.862 -1.875 1.00 0.00 H new ATOM 1397 N GLY A 91 18.997 0.364 0.085 1.00 0.00 N ATOM 1398 CA GLY A 91 19.527 1.532 0.839 1.00 0.00 C ATOM 1399 C GLY A 91 19.441 1.302 2.362 1.00 0.00 C ATOM 1400 O GLY A 91 20.350 1.666 3.082 1.00 0.00 O ATOM 0 H GLY A 91 18.131 0.540 -0.424 1.00 0.00 H new ATOM 0 HA2 GLY A 91 20.564 1.711 0.554 1.00 0.00 H new ATOM 0 HA3 GLY A 91 18.964 2.426 0.572 1.00 0.00 H new ATOM 1404 N LEU A 92 18.368 0.728 2.883 1.00 0.00 N ATOM 1405 CA LEU A 92 18.297 0.537 4.365 1.00 0.00 C ATOM 1406 C LEU A 92 19.294 -0.542 4.818 1.00 0.00 C ATOM 1407 O LEU A 92 20.045 -0.346 5.751 1.00 0.00 O ATOM 1408 CB LEU A 92 16.823 0.166 4.638 1.00 0.00 C ATOM 1409 CG LEU A 92 16.634 -1.330 4.874 1.00 0.00 C ATOM 1410 CD1 LEU A 92 17.080 -1.689 6.292 1.00 0.00 C ATOM 1411 CD2 LEU A 92 15.152 -1.680 4.710 1.00 0.00 C ATOM 0 H LEU A 92 17.562 0.394 2.355 1.00 0.00 H new ATOM 0 HA LEU A 92 18.579 1.425 4.931 1.00 0.00 H new ATOM 0 HB2 LEU A 92 16.468 0.716 5.509 1.00 0.00 H new ATOM 0 HB3 LEU A 92 16.210 0.478 3.792 1.00 0.00 H new ATOM 0 HG LEU A 92 17.231 -1.889 4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 92 16.944 -2.758 6.457 1.00 0.00 H new ATOM 0 HD12 LEU A 92 18.132 -1.434 6.418 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.483 -1.132 7.013 1.00 0.00 H new ATOM 0 HD21 LEU A 92 15.010 -2.748 4.877 1.00 0.00 H new ATOM 0 HD22 LEU A 92 14.563 -1.117 5.434 1.00 0.00 H new ATOM 0 HD23 LEU A 92 14.827 -1.424 3.701 1.00 0.00 H new ATOM 1423 N LYS A 93 19.307 -1.659 4.146 1.00 0.00 N ATOM 1424 CA LYS A 93 20.246 -2.781 4.478 1.00 0.00 C ATOM 1425 C LYS A 93 19.707 -4.068 3.875 1.00 0.00 C ATOM 1426 O LYS A 93 19.501 -5.048 4.569 1.00 0.00 O ATOM 1427 CB LYS A 93 20.313 -2.929 6.011 1.00 0.00 C ATOM 1428 CG LYS A 93 20.974 -4.279 6.374 1.00 0.00 C ATOM 1429 CD LYS A 93 22.039 -4.062 7.456 1.00 0.00 C ATOM 1430 CE LYS A 93 21.556 -4.653 8.784 1.00 0.00 C ATOM 1431 NZ LYS A 93 20.495 -3.721 9.263 1.00 0.00 N ATOM 0 H LYS A 93 18.690 -1.851 3.357 1.00 0.00 H new ATOM 0 HA LYS A 93 21.239 -2.575 4.079 1.00 0.00 H new ATOM 0 HB2 LYS A 93 20.884 -2.106 6.441 1.00 0.00 H new ATOM 0 HB3 LYS A 93 19.310 -2.878 6.435 1.00 0.00 H new ATOM 0 HG2 LYS A 93 20.219 -4.980 6.730 1.00 0.00 H new ATOM 0 HG3 LYS A 93 21.428 -4.722 5.488 1.00 0.00 H new ATOM 0 HD2 LYS A 93 22.976 -4.533 7.157 1.00 0.00 H new ATOM 0 HD3 LYS A 93 22.240 -2.997 7.573 1.00 0.00 H new ATOM 0 HE2 LYS A 93 21.163 -5.660 8.647 1.00 0.00 H new ATOM 0 HE3 LYS A 93 22.372 -4.724 9.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 20.272 -3.930 10.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 20.832 -2.740 9.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 19.640 -3.842 8.684 1.00 0.00 H new ATOM 1445 N TYR A 94 19.492 -4.105 2.595 1.00 0.00 N ATOM 1446 CA TYR A 94 19.005 -5.371 2.003 1.00 0.00 C ATOM 1447 C TYR A 94 19.971 -6.434 2.447 1.00 0.00 C ATOM 1448 O TYR A 94 19.627 -7.261 3.282 1.00 0.00 O ATOM 1449 CB TYR A 94 19.000 -5.134 0.493 1.00 0.00 C ATOM 1450 CG TYR A 94 18.840 -6.419 -0.294 1.00 0.00 C ATOM 1451 CD1 TYR A 94 19.968 -7.202 -0.594 1.00 0.00 C ATOM 1452 CD2 TYR A 94 17.579 -6.795 -0.794 1.00 0.00 C ATOM 1453 CE1 TYR A 94 19.839 -8.347 -1.378 1.00 0.00 C ATOM 1454 CE2 TYR A 94 17.463 -7.925 -1.603 1.00 0.00 C ATOM 1455 CZ TYR A 94 18.585 -8.700 -1.896 1.00 0.00 C ATOM 1456 OH TYR A 94 18.452 -9.799 -2.711 1.00 0.00 O ATOM 0 H TYR A 94 19.629 -3.331 1.946 1.00 0.00 H new ATOM 0 HA TYR A 94 18.006 -5.684 2.305 1.00 0.00 H new ATOM 0 HB2 TYR A 94 18.189 -4.452 0.238 1.00 0.00 H new ATOM 0 HB3 TYR A 94 19.930 -4.646 0.202 1.00 0.00 H new ATOM 0 HD1 TYR A 94 20.938 -6.915 -0.216 1.00 0.00 H new ATOM 0 HD2 TYR A 94 16.704 -6.210 -0.552 1.00 0.00 H new ATOM 0 HE1 TYR A 94 20.703 -8.961 -1.586 1.00 0.00 H new ATOM 0 HE2 TYR A 94 16.499 -8.201 -2.005 1.00 0.00 H new ATOM 0 HH TYR A 94 17.514 -9.897 -2.978 1.00 0.00 H new ATOM 1466 N GLU A 95 21.211 -6.394 2.032 1.00 0.00 N ATOM 1467 CA GLU A 95 22.133 -7.417 2.583 1.00 0.00 C ATOM 1468 C GLU A 95 21.229 -8.291 3.393 1.00 0.00 C ATOM 1469 O GLU A 95 21.499 -8.600 4.543 1.00 0.00 O ATOM 1470 CB GLU A 95 23.136 -6.663 3.459 1.00 0.00 C ATOM 1471 CG GLU A 95 24.438 -6.453 2.681 1.00 0.00 C ATOM 1472 CD GLU A 95 25.108 -5.159 3.145 1.00 0.00 C ATOM 1473 OE1 GLU A 95 24.462 -4.126 3.086 1.00 0.00 O ATOM 1474 OE2 GLU A 95 26.257 -5.224 3.552 1.00 0.00 O ATOM 0 H GLU A 95 21.607 -5.729 1.367 1.00 0.00 H new ATOM 0 HA GLU A 95 22.693 -8.004 1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 95 22.721 -5.701 3.760 1.00 0.00 H new ATOM 0 HB3 GLU A 95 23.332 -7.225 4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 95 25.108 -7.298 2.838 1.00 0.00 H new ATOM 0 HG3 GLU A 95 24.231 -6.405 1.612 1.00 0.00 H new ATOM 1547 N MET B 1 -4.956 7.081 -11.209 1.00 0.00 N ATOM 1548 CA MET B 1 -4.340 8.168 -10.394 1.00 0.00 C ATOM 1549 C MET B 1 -2.890 7.823 -10.062 1.00 0.00 C ATOM 1550 O MET B 1 -2.542 6.667 -9.911 1.00 0.00 O ATOM 1551 CB MET B 1 -5.167 8.221 -9.112 1.00 0.00 C ATOM 1552 CG MET B 1 -6.174 9.366 -9.194 1.00 0.00 C ATOM 1553 SD MET B 1 -7.540 9.050 -8.052 1.00 0.00 S ATOM 1554 CE MET B 1 -6.649 9.467 -6.533 1.00 0.00 C ATOM 0 H1 MET B 1 -5.984 7.070 -11.052 1.00 0.00 H new ATOM 0 H2 MET B 1 -4.761 7.250 -12.217 1.00 0.00 H new ATOM 0 H3 MET B 1 -4.553 6.165 -10.927 1.00 0.00 H new ATOM 0 HA MET B 1 -4.335 9.121 -10.923 1.00 0.00 H new ATOM 0 HB2 MET B 1 -5.689 7.275 -8.965 1.00 0.00 H new ATOM 0 HB3 MET B 1 -4.513 8.361 -8.252 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.689 10.310 -8.945 1.00 0.00 H new ATOM 0 HG3 MET B 1 -6.551 9.460 -10.212 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.298 10.050 -5.879 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.349 8.551 -6.024 1.00 0.00 H new ATOM 0 HE3 MET B 1 -5.763 10.052 -6.780 1.00 0.00 H new ATOM 1566 N ASN B 2 -2.037 8.807 -9.936 1.00 0.00 N ATOM 1567 CA ASN B 2 -0.617 8.501 -9.601 1.00 0.00 C ATOM 1568 C ASN B 2 -0.001 9.612 -8.747 1.00 0.00 C ATOM 1569 O ASN B 2 -0.696 10.344 -8.074 1.00 0.00 O ATOM 1570 CB ASN B 2 0.118 8.391 -10.944 1.00 0.00 C ATOM 1571 CG ASN B 2 -0.636 7.452 -11.890 1.00 0.00 C ATOM 1572 OD1 ASN B 2 -0.415 6.257 -11.885 1.00 0.00 O ATOM 1573 ND2 ASN B 2 -1.522 7.946 -12.711 1.00 0.00 N ATOM 0 H ASN B 2 -2.259 9.796 -10.049 1.00 0.00 H new ATOM 0 HA ASN B 2 -0.541 7.581 -9.021 1.00 0.00 H new ATOM 0 HB2 ASN B 2 0.209 9.378 -11.398 1.00 0.00 H new ATOM 0 HB3 ASN B 2 1.130 8.019 -10.783 1.00 0.00 H new ATOM 0 HD21 ASN B 2 -2.028 7.329 -13.347 1.00 0.00 H new ATOM 0 HD22 ASN B 2 -1.709 8.949 -12.717 1.00 0.00 H new ATOM 1580 N LYS B 3 1.306 9.745 -8.774 1.00 0.00 N ATOM 1581 CA LYS B 3 1.970 10.816 -7.965 1.00 0.00 C ATOM 1582 C LYS B 3 1.482 12.205 -8.409 1.00 0.00 C ATOM 1583 O LYS B 3 1.924 13.212 -7.899 1.00 0.00 O ATOM 1584 CB LYS B 3 3.474 10.657 -8.224 1.00 0.00 C ATOM 1585 CG LYS B 3 4.108 9.793 -7.119 1.00 0.00 C ATOM 1586 CD LYS B 3 4.957 10.671 -6.187 1.00 0.00 C ATOM 1587 CE LYS B 3 6.259 9.939 -5.807 1.00 0.00 C ATOM 1588 NZ LYS B 3 7.202 10.227 -6.924 1.00 0.00 N ATOM 0 H LYS B 3 1.938 9.160 -9.320 1.00 0.00 H new ATOM 0 HA LYS B 3 1.737 10.726 -6.904 1.00 0.00 H new ATOM 0 HB2 LYS B 3 3.637 10.195 -9.198 1.00 0.00 H new ATOM 0 HB3 LYS B 3 3.953 11.636 -8.252 1.00 0.00 H new ATOM 0 HG2 LYS B 3 3.328 9.290 -6.547 1.00 0.00 H new ATOM 0 HG3 LYS B 3 4.729 9.016 -7.565 1.00 0.00 H new ATOM 0 HD2 LYS B 3 5.192 11.615 -6.679 1.00 0.00 H new ATOM 0 HD3 LYS B 3 4.391 10.913 -5.287 1.00 0.00 H new ATOM 0 HE2 LYS B 3 6.651 10.299 -4.856 1.00 0.00 H new ATOM 0 HE3 LYS B 3 6.092 8.867 -5.697 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 7.853 9.425 -7.044 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 6.665 10.372 -7.803 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 7.747 11.086 -6.706 1.00 0.00 H new ATOM 1602 N THR B 4 0.569 12.263 -9.350 1.00 0.00 N ATOM 1603 CA THR B 4 0.033 13.573 -9.817 1.00 0.00 C ATOM 1604 C THR B 4 -1.460 13.644 -9.487 1.00 0.00 C ATOM 1605 O THR B 4 -1.914 14.463 -8.703 1.00 0.00 O ATOM 1606 CB THR B 4 0.245 13.570 -11.335 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.617 13.801 -11.622 1.00 0.00 O ATOM 1608 CG2 THR B 4 -0.606 14.668 -11.984 1.00 0.00 C ATOM 0 H THR B 4 0.171 11.448 -9.816 1.00 0.00 H new ATOM 0 HA THR B 4 0.521 14.426 -9.345 1.00 0.00 H new ATOM 0 HB THR B 4 -0.055 12.602 -11.736 1.00 0.00 H new ATOM 0 HG1 THR B 4 1.753 13.797 -12.592 1.00 0.00 H new ATOM 0 HG21 THR B 4 -0.450 14.659 -13.063 1.00 0.00 H new ATOM 0 HG22 THR B 4 -1.659 14.487 -11.768 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.315 15.639 -11.583 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.230 12.771 -10.073 1.00 0.00 N ATOM 1617 CA GLU B 5 -3.689 12.772 -9.790 1.00 0.00 C ATOM 1618 C GLU B 5 -3.889 12.732 -8.280 1.00 0.00 C ATOM 1619 O GLU B 5 -4.632 13.513 -7.721 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.252 11.514 -10.452 1.00 0.00 C ATOM 1621 CG GLU B 5 -3.887 11.487 -11.944 1.00 0.00 C ATOM 1622 CD GLU B 5 -4.470 12.718 -12.642 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -3.908 13.788 -12.480 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -5.469 12.567 -13.325 1.00 0.00 O ATOM 0 H GLU B 5 -1.913 12.060 -10.732 1.00 0.00 H new ATOM 0 HA GLU B 5 -4.193 13.659 -10.174 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -3.856 10.627 -9.958 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -5.335 11.487 -10.335 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -2.804 11.469 -12.063 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -4.273 10.578 -12.406 1.00 0.00 H new ATOM 1631 N LEU B 6 -3.204 11.846 -7.606 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.345 11.795 -6.122 1.00 0.00 C ATOM 1633 C LEU B 6 -3.006 13.160 -5.509 1.00 0.00 C ATOM 1634 O LEU B 6 -3.588 13.546 -4.512 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.358 10.727 -5.648 1.00 0.00 C ATOM 1636 CG LEU B 6 -2.899 9.340 -5.998 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -1.733 8.391 -6.294 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -3.711 8.798 -4.819 1.00 0.00 C ATOM 0 H LEU B 6 -2.562 11.165 -8.012 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.364 11.556 -5.819 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.387 10.880 -6.119 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -2.207 10.809 -4.572 1.00 0.00 H new ATOM 0 HG LEU B 6 -3.537 9.413 -6.879 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.122 7.404 -6.543 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -1.155 8.776 -7.134 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.092 8.318 -5.416 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.097 7.809 -5.067 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.072 8.728 -3.939 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.543 9.471 -4.610 1.00 0.00 H new ATOM 1650 N ILE B 7 -2.089 13.915 -6.085 1.00 0.00 N ATOM 1651 CA ILE B 7 -1.786 15.250 -5.481 1.00 0.00 C ATOM 1652 C ILE B 7 -3.059 16.075 -5.510 1.00 0.00 C ATOM 1653 O ILE B 7 -3.409 16.726 -4.552 1.00 0.00 O ATOM 1654 CB ILE B 7 -0.653 15.925 -6.292 1.00 0.00 C ATOM 1655 CG1 ILE B 7 -1.188 16.639 -7.544 1.00 0.00 C ATOM 1656 CG2 ILE B 7 0.401 14.902 -6.704 1.00 0.00 C ATOM 1657 CD1 ILE B 7 -1.474 18.106 -7.211 1.00 0.00 C ATOM 0 H ILE B 7 -1.556 13.671 -6.920 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.448 15.155 -4.449 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.201 16.672 -5.640 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -0.460 16.574 -8.352 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -2.097 16.150 -7.894 1.00 0.00 H new ATOM 0 HG21 ILE B 7 1.187 15.399 -7.273 1.00 0.00 H new ATOM 0 HG22 ILE B 7 0.831 14.444 -5.813 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -0.061 14.131 -7.321 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -1.853 18.613 -8.098 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.218 18.160 -6.416 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -0.555 18.590 -6.882 1.00 0.00 H new ATOM 1669 N LYS B 8 -3.773 16.017 -6.598 1.00 0.00 N ATOM 1670 CA LYS B 8 -5.049 16.769 -6.679 1.00 0.00 C ATOM 1671 C LYS B 8 -6.080 16.078 -5.787 1.00 0.00 C ATOM 1672 O LYS B 8 -6.988 16.700 -5.270 1.00 0.00 O ATOM 1673 CB LYS B 8 -5.446 16.750 -8.167 1.00 0.00 C ATOM 1674 CG LYS B 8 -6.540 15.705 -8.433 1.00 0.00 C ATOM 1675 CD LYS B 8 -6.528 15.312 -9.913 1.00 0.00 C ATOM 1676 CE LYS B 8 -6.609 13.788 -10.038 1.00 0.00 C ATOM 1677 NZ LYS B 8 -8.040 13.500 -10.337 1.00 0.00 N ATOM 0 H LYS B 8 -3.527 15.482 -7.431 1.00 0.00 H new ATOM 0 HA LYS B 8 -4.973 17.799 -6.331 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -5.801 17.737 -8.465 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -4.571 16.528 -8.778 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -6.375 14.825 -7.812 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -7.516 16.108 -8.162 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -7.369 15.775 -10.430 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -5.619 15.679 -10.390 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -5.959 13.422 -10.833 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -6.292 13.299 -9.117 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -8.174 12.474 -10.437 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.635 13.853 -9.560 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -8.311 13.972 -11.223 1.00 0.00 H new ATOM 1691 N ALA B 9 -5.930 14.794 -5.586 1.00 0.00 N ATOM 1692 CA ALA B 9 -6.878 14.065 -4.708 1.00 0.00 C ATOM 1693 C ALA B 9 -6.780 14.632 -3.299 1.00 0.00 C ATOM 1694 O ALA B 9 -7.764 14.764 -2.596 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.399 12.619 -4.728 1.00 0.00 C ATOM 0 H ALA B 9 -5.190 14.223 -5.995 1.00 0.00 H new ATOM 0 HA ALA B 9 -7.914 14.152 -5.035 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -7.050 12.011 -4.100 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.425 12.241 -5.750 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.378 12.568 -4.348 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.595 14.999 -2.892 1.00 0.00 N ATOM 1702 CA ILE B 10 -5.419 15.580 -1.557 1.00 0.00 C ATOM 1703 C ILE B 10 -5.451 17.083 -1.716 1.00 0.00 C ATOM 1704 O ILE B 10 -5.974 17.780 -0.887 1.00 0.00 O ATOM 1705 CB ILE B 10 -4.043 15.075 -1.096 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -4.180 14.382 0.258 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -3.050 16.237 -0.969 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -4.855 13.020 0.073 1.00 0.00 C ATOM 0 H ILE B 10 -4.741 14.915 -3.443 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.185 15.307 -0.831 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.668 14.372 -1.840 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -3.198 14.253 0.713 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.767 15.001 0.937 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -2.083 15.855 -0.641 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -2.938 16.727 -1.936 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.422 16.956 -0.239 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -4.952 12.527 1.041 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -5.844 13.160 -0.363 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.250 12.401 -0.590 1.00 0.00 H new ATOM 1720 N ALA B 11 -4.924 17.581 -2.805 1.00 0.00 N ATOM 1721 CA ALA B 11 -4.951 19.051 -3.034 1.00 0.00 C ATOM 1722 C ALA B 11 -6.395 19.532 -2.973 1.00 0.00 C ATOM 1723 O ALA B 11 -6.673 20.672 -2.655 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.374 19.240 -4.425 1.00 0.00 C ATOM 0 H ALA B 11 -4.478 17.033 -3.541 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.386 19.614 -2.291 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.359 20.302 -4.672 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.358 18.846 -4.454 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.990 18.708 -5.150 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.318 18.652 -3.253 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.750 19.031 -3.187 1.00 0.00 C ATOM 1732 C GLN B 12 -9.272 18.699 -1.799 1.00 0.00 C ATOM 1733 O GLN B 12 -9.895 19.518 -1.151 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.446 18.192 -4.260 1.00 0.00 C ATOM 1735 CG GLN B 12 -9.114 18.749 -5.645 1.00 0.00 C ATOM 1736 CD GLN B 12 -9.953 20.002 -5.906 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -11.017 19.925 -6.485 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -9.515 21.163 -5.498 1.00 0.00 N ATOM 0 H GLN B 12 -7.137 17.686 -3.525 1.00 0.00 H new ATOM 0 HA GLN B 12 -8.924 20.093 -3.361 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -9.124 17.153 -4.188 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -10.524 18.203 -4.102 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -8.053 18.990 -5.707 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -9.316 17.998 -6.409 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -8.621 21.228 -5.011 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -10.067 22.004 -5.666 1.00 0.00 H new ATOM 1747 N ASP B 13 -8.980 17.523 -1.308 1.00 0.00 N ATOM 1748 CA ASP B 13 -9.421 17.188 0.073 1.00 0.00 C ATOM 1749 C ASP B 13 -8.743 18.181 1.012 1.00 0.00 C ATOM 1750 O ASP B 13 -9.228 18.495 2.082 1.00 0.00 O ATOM 1751 CB ASP B 13 -8.934 15.764 0.325 1.00 0.00 C ATOM 1752 CG ASP B 13 -9.651 14.806 -0.630 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.700 15.171 -1.134 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -9.137 13.720 -0.838 1.00 0.00 O ATOM 0 H ASP B 13 -8.463 16.792 -1.796 1.00 0.00 H new ATOM 0 HA ASP B 13 -10.499 17.246 0.223 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -7.856 15.705 0.176 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -9.129 15.479 1.359 1.00 0.00 H new ATOM 1759 N THR B 14 -7.627 18.706 0.574 1.00 0.00 N ATOM 1760 CA THR B 14 -6.892 19.715 1.365 1.00 0.00 C ATOM 1761 C THR B 14 -7.339 21.097 0.904 1.00 0.00 C ATOM 1762 O THR B 14 -8.133 21.756 1.546 1.00 0.00 O ATOM 1763 CB THR B 14 -5.413 19.505 1.025 1.00 0.00 C ATOM 1764 OG1 THR B 14 -5.262 19.395 -0.375 1.00 0.00 O ATOM 1765 CG2 THR B 14 -4.898 18.241 1.709 1.00 0.00 C ATOM 0 H THR B 14 -7.193 18.467 -0.318 1.00 0.00 H new ATOM 0 HA THR B 14 -7.069 19.627 2.437 1.00 0.00 H new ATOM 0 HB THR B 14 -4.835 20.358 1.381 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.808 18.651 -0.705 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.846 18.097 1.463 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.008 18.341 2.789 1.00 0.00 H new ATOM 0 HG23 THR B 14 -5.472 17.381 1.364 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.831 21.537 -0.220 1.00 0.00 N ATOM 1774 CA GLY B 15 -7.226 22.881 -0.741 1.00 0.00 C ATOM 1775 C GLY B 15 -6.819 23.964 0.262 1.00 0.00 C ATOM 1776 O GLY B 15 -7.173 25.118 0.120 1.00 0.00 O ATOM 0 H GLY B 15 -6.163 21.026 -0.797 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -6.747 23.064 -1.703 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -8.302 22.914 -0.910 1.00 0.00 H new ATOM 1780 N LEU B 16 -6.064 23.603 1.264 1.00 0.00 N ATOM 1781 CA LEU B 16 -5.611 24.612 2.269 1.00 0.00 C ATOM 1782 C LEU B 16 -4.557 25.487 1.624 1.00 0.00 C ATOM 1783 O LEU B 16 -4.698 26.688 1.499 1.00 0.00 O ATOM 1784 CB LEU B 16 -4.977 23.820 3.419 1.00 0.00 C ATOM 1785 CG LEU B 16 -5.981 22.819 3.982 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -5.656 21.424 3.460 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.898 22.803 5.513 1.00 0.00 C ATOM 0 H LEU B 16 -5.740 22.651 1.432 1.00 0.00 H new ATOM 0 HA LEU B 16 -6.431 25.236 2.624 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.089 23.296 3.064 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -4.652 24.502 4.205 1.00 0.00 H new ATOM 0 HG LEU B 16 -6.984 23.111 3.671 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -6.373 20.709 3.862 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -5.712 21.421 2.371 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -4.650 21.144 3.773 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.617 22.086 5.909 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.892 22.515 5.820 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -6.125 23.796 5.900 1.00 0.00 H new ATOM 1799 N THR B 17 -3.499 24.867 1.210 1.00 0.00 N ATOM 1800 CA THR B 17 -2.399 25.603 0.556 1.00 0.00 C ATOM 1801 C THR B 17 -1.801 24.747 -0.557 1.00 0.00 C ATOM 1802 O THR B 17 -0.803 25.102 -1.152 1.00 0.00 O ATOM 1803 CB THR B 17 -1.376 25.830 1.677 1.00 0.00 C ATOM 1804 OG1 THR B 17 -0.826 27.133 1.561 1.00 0.00 O ATOM 1805 CG2 THR B 17 -0.254 24.788 1.597 1.00 0.00 C ATOM 0 H THR B 17 -3.348 23.862 1.299 1.00 0.00 H new ATOM 0 HA THR B 17 -2.721 26.539 0.100 1.00 0.00 H new ATOM 0 HB THR B 17 -1.879 25.729 2.638 1.00 0.00 H new ATOM 0 HG1 THR B 17 -0.174 27.278 2.278 1.00 0.00 H new ATOM 0 HG21 THR B 17 0.463 24.963 2.399 1.00 0.00 H new ATOM 0 HG22 THR B 17 -0.677 23.789 1.700 1.00 0.00 H new ATOM 0 HG23 THR B 17 0.251 24.870 0.635 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.361 23.588 -0.804 1.00 0.00 N ATOM 1814 CA GLN B 18 -1.761 22.691 -1.824 1.00 0.00 C ATOM 1815 C GLN B 18 -0.333 22.402 -1.364 1.00 0.00 C ATOM 1816 O GLN B 18 0.541 22.114 -2.157 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.770 23.468 -3.147 1.00 0.00 C ATOM 1818 CG GLN B 18 -3.099 24.212 -3.299 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.467 24.306 -4.781 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -2.823 25.009 -5.536 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -4.483 23.623 -5.233 1.00 0.00 N ATOM 0 H GLN B 18 -3.200 23.232 -0.345 1.00 0.00 H new ATOM 0 HA GLN B 18 -2.297 21.750 -1.952 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -0.941 24.176 -3.170 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.628 22.783 -3.983 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -3.884 23.691 -2.751 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -3.020 25.211 -2.869 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -5.023 23.033 -4.600 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -4.737 23.679 -6.219 1.00 0.00 H new ATOM 1830 N VAL B 19 -0.114 22.505 -0.060 1.00 0.00 N ATOM 1831 CA VAL B 19 1.238 22.271 0.553 1.00 0.00 C ATOM 1832 C VAL B 19 2.251 21.979 -0.547 1.00 0.00 C ATOM 1833 O VAL B 19 2.722 22.871 -1.225 1.00 0.00 O ATOM 1834 CB VAL B 19 1.017 21.090 1.533 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.220 19.966 0.865 1.00 0.00 C ATOM 1836 CG2 VAL B 19 2.342 20.519 2.053 1.00 0.00 C ATOM 0 H VAL B 19 -0.839 22.748 0.615 1.00 0.00 H new ATOM 0 HA VAL B 19 1.644 23.129 1.089 1.00 0.00 H new ATOM 0 HB VAL B 19 0.454 21.489 2.377 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.079 19.150 1.573 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.752 20.346 0.551 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.765 19.601 -0.005 1.00 0.00 H new ATOM 0 HG21 VAL B 19 2.140 19.694 2.736 1.00 0.00 H new ATOM 0 HG22 VAL B 19 2.937 20.158 1.214 1.00 0.00 H new ATOM 0 HG23 VAL B 19 2.893 21.299 2.579 1.00 0.00 H new ATOM 1846 N SER B 20 2.518 20.751 -0.779 1.00 0.00 N ATOM 1847 CA SER B 20 3.404 20.362 -1.867 1.00 0.00 C ATOM 1848 C SER B 20 2.681 19.271 -2.609 1.00 0.00 C ATOM 1849 O SER B 20 3.294 18.479 -3.262 1.00 0.00 O ATOM 1850 CB SER B 20 4.690 19.835 -1.236 1.00 0.00 C ATOM 1851 OG SER B 20 4.421 19.309 0.045 1.00 0.00 O ATOM 0 H SER B 20 2.144 19.972 -0.238 1.00 0.00 H new ATOM 0 HA SER B 20 3.654 21.178 -2.545 1.00 0.00 H new ATOM 0 HB2 SER B 20 5.126 19.063 -1.870 1.00 0.00 H new ATOM 0 HB3 SER B 20 5.423 20.638 -1.161 1.00 0.00 H new ATOM 0 HG SER B 20 5.254 18.986 0.448 1.00 0.00 H new ATOM 1857 N VAL B 21 1.368 19.199 -2.479 1.00 0.00 N ATOM 1858 CA VAL B 21 0.573 18.131 -3.153 1.00 0.00 C ATOM 1859 C VAL B 21 1.419 17.473 -4.226 1.00 0.00 C ATOM 1860 O VAL B 21 1.447 16.265 -4.387 1.00 0.00 O ATOM 1861 CB VAL B 21 -0.628 18.854 -3.767 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -1.531 19.389 -2.654 1.00 0.00 C ATOM 1863 CG2 VAL B 21 -0.153 20.020 -4.640 1.00 0.00 C ATOM 0 H VAL B 21 0.814 19.850 -1.923 1.00 0.00 H new ATOM 0 HA VAL B 21 0.254 17.345 -2.468 1.00 0.00 H new ATOM 0 HB VAL B 21 -1.185 18.149 -4.384 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -2.385 19.903 -3.094 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.883 18.559 -2.041 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.969 20.086 -2.033 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -1.016 20.527 -5.071 1.00 0.00 H new ATOM 0 HG22 VAL B 21 0.414 20.724 -4.030 1.00 0.00 H new ATOM 0 HG23 VAL B 21 0.482 19.640 -5.440 1.00 0.00 H new ATOM 1873 N SER B 22 2.161 18.283 -4.905 1.00 0.00 N ATOM 1874 CA SER B 22 3.080 17.761 -5.951 1.00 0.00 C ATOM 1875 C SER B 22 4.313 17.164 -5.276 1.00 0.00 C ATOM 1876 O SER B 22 4.744 16.076 -5.599 1.00 0.00 O ATOM 1877 CB SER B 22 3.454 18.972 -6.805 1.00 0.00 C ATOM 1878 OG SER B 22 2.269 19.630 -7.231 1.00 0.00 O ATOM 0 H SER B 22 2.175 19.296 -4.784 1.00 0.00 H new ATOM 0 HA SER B 22 2.629 16.979 -6.561 1.00 0.00 H new ATOM 0 HB2 SER B 22 4.078 19.657 -6.231 1.00 0.00 H new ATOM 0 HB3 SER B 22 4.039 18.656 -7.669 1.00 0.00 H new ATOM 0 HG SER B 22 2.505 20.408 -7.778 1.00 0.00 H new ATOM 1884 N LYS B 23 4.861 17.857 -4.311 1.00 0.00 N ATOM 1885 CA LYS B 23 6.038 17.319 -3.588 1.00 0.00 C ATOM 1886 C LYS B 23 5.582 16.639 -2.290 1.00 0.00 C ATOM 1887 O LYS B 23 6.325 15.879 -1.701 1.00 0.00 O ATOM 1888 CB LYS B 23 6.944 18.521 -3.307 1.00 0.00 C ATOM 1889 CG LYS B 23 7.540 19.031 -4.620 1.00 0.00 C ATOM 1890 CD LYS B 23 7.877 20.518 -4.485 1.00 0.00 C ATOM 1891 CE LYS B 23 6.595 21.318 -4.233 1.00 0.00 C ATOM 1892 NZ LYS B 23 6.717 22.524 -5.098 1.00 0.00 N ATOM 0 H LYS B 23 4.539 18.773 -3.997 1.00 0.00 H new ATOM 0 HA LYS B 23 6.572 16.565 -4.167 1.00 0.00 H new ATOM 0 HB2 LYS B 23 6.374 19.314 -2.822 1.00 0.00 H new ATOM 0 HB3 LYS B 23 7.741 18.236 -2.620 1.00 0.00 H new ATOM 0 HG2 LYS B 23 8.438 18.465 -4.868 1.00 0.00 H new ATOM 0 HG3 LYS B 23 6.833 18.880 -5.435 1.00 0.00 H new ATOM 0 HD2 LYS B 23 8.578 20.669 -3.664 1.00 0.00 H new ATOM 0 HD3 LYS B 23 8.366 20.873 -5.392 1.00 0.00 H new ATOM 0 HE2 LYS B 23 5.710 20.736 -4.490 1.00 0.00 H new ATOM 0 HE3 LYS B 23 6.502 21.594 -3.183 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 5.875 23.122 -4.980 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 7.565 23.062 -4.826 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 6.797 22.231 -6.093 1.00 0.00 H new ATOM 1906 N MET B 24 4.354 16.859 -1.850 1.00 0.00 N ATOM 1907 CA MET B 24 3.878 16.189 -0.650 1.00 0.00 C ATOM 1908 C MET B 24 3.675 14.724 -1.028 1.00 0.00 C ATOM 1909 O MET B 24 3.971 13.827 -0.263 1.00 0.00 O ATOM 1910 CB MET B 24 2.571 16.918 -0.343 1.00 0.00 C ATOM 1911 CG MET B 24 1.962 16.354 0.922 1.00 0.00 C ATOM 1912 SD MET B 24 0.192 16.053 0.692 1.00 0.00 S ATOM 1913 CE MET B 24 0.303 15.404 -0.989 1.00 0.00 C ATOM 0 H MET B 24 3.680 17.483 -2.294 1.00 0.00 H new ATOM 0 HA MET B 24 4.537 16.211 0.218 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.757 17.985 -0.225 1.00 0.00 H new ATOM 0 HB3 MET B 24 1.876 16.806 -1.175 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.463 15.424 1.191 1.00 0.00 H new ATOM 0 HG3 MET B 24 2.115 17.049 1.748 1.00 0.00 H new ATOM 0 HE1 MET B 24 -0.490 14.674 -1.150 1.00 0.00 H new ATOM 0 HE2 MET B 24 0.195 16.221 -1.702 1.00 0.00 H new ATOM 0 HE3 MET B 24 1.272 14.925 -1.131 1.00 0.00 H new ATOM 1923 N LEU B 25 3.229 14.474 -2.245 1.00 0.00 N ATOM 1924 CA LEU B 25 3.083 13.063 -2.692 1.00 0.00 C ATOM 1925 C LEU B 25 4.439 12.587 -3.212 1.00 0.00 C ATOM 1926 O LEU B 25 4.834 11.458 -3.003 1.00 0.00 O ATOM 1927 CB LEU B 25 2.035 13.069 -3.808 1.00 0.00 C ATOM 1928 CG LEU B 25 0.617 13.180 -3.224 1.00 0.00 C ATOM 1929 CD1 LEU B 25 -0.376 12.520 -4.178 1.00 0.00 C ATOM 1930 CD2 LEU B 25 0.523 12.474 -1.864 1.00 0.00 C ATOM 0 H LEU B 25 2.966 15.182 -2.931 1.00 0.00 H new ATOM 0 HA LEU B 25 2.769 12.394 -1.890 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.221 13.904 -4.484 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.120 12.156 -4.398 1.00 0.00 H new ATOM 0 HG LEU B 25 0.386 14.237 -3.094 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -1.382 12.597 -3.766 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -0.340 13.022 -5.145 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.115 11.469 -4.305 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -0.491 12.568 -1.474 1.00 0.00 H new ATOM 0 HD22 LEU B 25 0.769 11.419 -1.984 1.00 0.00 H new ATOM 0 HD23 LEU B 25 1.224 12.933 -1.167 1.00 0.00 H new ATOM 1942 N ALA B 26 5.183 13.457 -3.857 1.00 0.00 N ATOM 1943 CA ALA B 26 6.535 13.048 -4.334 1.00 0.00 C ATOM 1944 C ALA B 26 7.364 12.674 -3.108 1.00 0.00 C ATOM 1945 O ALA B 26 8.170 11.764 -3.131 1.00 0.00 O ATOM 1946 CB ALA B 26 7.126 14.275 -5.028 1.00 0.00 C ATOM 0 H ALA B 26 4.914 14.418 -4.069 1.00 0.00 H new ATOM 0 HA ALA B 26 6.512 12.199 -5.017 1.00 0.00 H new ATOM 0 HB1 ALA B 26 8.122 14.037 -5.401 1.00 0.00 H new ATOM 0 HB2 ALA B 26 6.486 14.565 -5.861 1.00 0.00 H new ATOM 0 HB3 ALA B 26 7.192 15.099 -4.317 1.00 0.00 H new ATOM 1952 N SER B 27 7.128 13.361 -2.021 1.00 0.00 N ATOM 1953 CA SER B 27 7.853 13.049 -0.763 1.00 0.00 C ATOM 1954 C SER B 27 7.228 11.804 -0.147 1.00 0.00 C ATOM 1955 O SER B 27 7.903 10.979 0.431 1.00 0.00 O ATOM 1956 CB SER B 27 7.642 14.260 0.140 1.00 0.00 C ATOM 1957 OG SER B 27 8.512 15.309 -0.266 1.00 0.00 O ATOM 0 H SER B 27 6.459 14.128 -1.955 1.00 0.00 H new ATOM 0 HA SER B 27 8.915 12.858 -0.916 1.00 0.00 H new ATOM 0 HB2 SER B 27 6.605 14.591 0.086 1.00 0.00 H new ATOM 0 HB3 SER B 27 7.837 13.992 1.178 1.00 0.00 H new ATOM 0 HG SER B 27 8.059 15.872 -0.928 1.00 0.00 H new ATOM 1963 N PHE B 28 5.935 11.657 -0.296 1.00 0.00 N ATOM 1964 CA PHE B 28 5.239 10.453 0.250 1.00 0.00 C ATOM 1965 C PHE B 28 5.960 9.224 -0.255 1.00 0.00 C ATOM 1966 O PHE B 28 6.283 8.339 0.497 1.00 0.00 O ATOM 1967 CB PHE B 28 3.803 10.569 -0.289 1.00 0.00 C ATOM 1968 CG PHE B 28 3.155 9.216 -0.531 1.00 0.00 C ATOM 1969 CD1 PHE B 28 3.491 8.449 -1.659 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.169 8.754 0.348 1.00 0.00 C ATOM 1971 CE1 PHE B 28 2.853 7.235 -1.890 1.00 0.00 C ATOM 1972 CE2 PHE B 28 1.527 7.544 0.109 1.00 0.00 C ATOM 1973 CZ PHE B 28 1.867 6.779 -1.008 1.00 0.00 C ATOM 0 H PHE B 28 5.329 12.323 -0.775 1.00 0.00 H new ATOM 0 HA PHE B 28 5.229 10.382 1.338 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.198 11.135 0.419 1.00 0.00 H new ATOM 0 HB3 PHE B 28 3.814 11.134 -1.221 1.00 0.00 H new ATOM 0 HD1 PHE B 28 4.245 8.802 -2.347 1.00 0.00 H new ATOM 0 HD2 PHE B 28 1.905 9.340 1.216 1.00 0.00 H new ATOM 0 HE1 PHE B 28 3.119 6.642 -2.753 1.00 0.00 H new ATOM 0 HE2 PHE B 28 0.764 7.195 0.789 1.00 0.00 H new ATOM 0 HZ PHE B 28 1.370 5.838 -1.191 1.00 0.00 H new ATOM 1983 N GLU B 29 6.278 9.186 -1.507 1.00 0.00 N ATOM 1984 CA GLU B 29 7.035 8.031 -2.001 1.00 0.00 C ATOM 1985 C GLU B 29 8.423 8.103 -1.400 1.00 0.00 C ATOM 1986 O GLU B 29 9.022 7.107 -1.048 1.00 0.00 O ATOM 1987 CB GLU B 29 7.110 8.193 -3.501 1.00 0.00 C ATOM 1988 CG GLU B 29 7.814 6.972 -4.052 1.00 0.00 C ATOM 1989 CD GLU B 29 9.161 7.370 -4.658 1.00 0.00 C ATOM 1990 OE1 GLU B 29 9.828 8.206 -4.071 1.00 0.00 O ATOM 1991 OE2 GLU B 29 9.503 6.833 -5.699 1.00 0.00 O ATOM 0 H GLU B 29 6.048 9.898 -2.200 1.00 0.00 H new ATOM 0 HA GLU B 29 6.579 7.076 -1.738 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.111 8.286 -3.928 1.00 0.00 H new ATOM 0 HB3 GLU B 29 7.654 9.101 -3.763 1.00 0.00 H new ATOM 0 HG2 GLU B 29 7.966 6.241 -3.258 1.00 0.00 H new ATOM 0 HG3 GLU B 29 7.192 6.495 -4.810 1.00 0.00 H new ATOM 1998 N LYS B 30 8.926 9.298 -1.256 1.00 0.00 N ATOM 1999 CA LYS B 30 10.260 9.455 -0.650 1.00 0.00 C ATOM 2000 C LYS B 30 10.196 8.965 0.786 1.00 0.00 C ATOM 2001 O LYS B 30 11.171 8.571 1.346 1.00 0.00 O ATOM 2002 CB LYS B 30 10.583 10.946 -0.701 1.00 0.00 C ATOM 2003 CG LYS B 30 12.036 11.148 -0.273 1.00 0.00 C ATOM 2004 CD LYS B 30 12.589 12.421 -0.915 1.00 0.00 C ATOM 2005 CE LYS B 30 12.774 12.197 -2.418 1.00 0.00 C ATOM 2006 NZ LYS B 30 13.513 13.397 -2.898 1.00 0.00 N ATOM 0 H LYS B 30 8.466 10.165 -1.534 1.00 0.00 H new ATOM 0 HA LYS B 30 11.027 8.884 -1.172 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.429 11.332 -1.709 1.00 0.00 H new ATOM 0 HB3 LYS B 30 9.915 11.500 -0.042 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.099 11.220 0.813 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.636 10.288 -0.571 1.00 0.00 H new ATOM 0 HD2 LYS B 30 11.907 13.254 -0.742 1.00 0.00 H new ATOM 0 HD3 LYS B 30 13.541 12.688 -0.457 1.00 0.00 H new ATOM 0 HE2 LYS B 30 13.335 11.283 -2.615 1.00 0.00 H new ATOM 0 HE3 LYS B 30 11.813 12.097 -2.923 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 13.678 13.317 -3.922 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 12.952 14.251 -2.703 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 14.426 13.463 -2.405 1.00 0.00 H new ATOM 2020 N ILE B 31 9.043 8.936 1.382 1.00 0.00 N ATOM 2021 CA ILE B 31 8.969 8.414 2.772 1.00 0.00 C ATOM 2022 C ILE B 31 8.355 7.028 2.745 1.00 0.00 C ATOM 2023 O ILE B 31 8.657 6.187 3.562 1.00 0.00 O ATOM 2024 CB ILE B 31 8.149 9.388 3.607 1.00 0.00 C ATOM 2025 CG1 ILE B 31 7.024 10.035 2.815 1.00 0.00 C ATOM 2026 CG2 ILE B 31 9.082 10.463 4.157 1.00 0.00 C ATOM 2027 CD1 ILE B 31 5.714 9.679 3.503 1.00 0.00 C ATOM 0 H ILE B 31 8.160 9.245 0.977 1.00 0.00 H new ATOM 0 HA ILE B 31 9.959 8.329 3.220 1.00 0.00 H new ATOM 0 HB ILE B 31 7.681 8.828 4.417 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.155 11.116 2.777 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.025 9.677 1.785 1.00 0.00 H new ATOM 0 HG21 ILE B 31 8.509 11.169 4.758 1.00 0.00 H new ATOM 0 HG22 ILE B 31 9.848 9.997 4.777 1.00 0.00 H new ATOM 0 HG23 ILE B 31 9.556 10.991 3.330 1.00 0.00 H new ATOM 0 HD11 ILE B 31 4.883 10.129 2.959 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.594 8.596 3.518 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.725 10.057 4.525 1.00 0.00 H new ATOM 2039 N ILE B 32 7.537 6.768 1.777 1.00 0.00 N ATOM 2040 CA ILE B 32 6.951 5.413 1.661 1.00 0.00 C ATOM 2041 C ILE B 32 8.040 4.478 1.192 1.00 0.00 C ATOM 2042 O ILE B 32 8.385 3.512 1.849 1.00 0.00 O ATOM 2043 CB ILE B 32 5.857 5.486 0.596 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.774 6.490 1.022 1.00 0.00 C ATOM 2045 CG2 ILE B 32 5.244 4.092 0.436 1.00 0.00 C ATOM 2046 CD1 ILE B 32 3.499 5.755 1.422 1.00 0.00 C ATOM 0 H ILE B 32 7.247 7.433 1.060 1.00 0.00 H new ATOM 0 HA ILE B 32 6.542 5.063 2.609 1.00 0.00 H new ATOM 0 HB ILE B 32 6.281 5.818 -0.351 1.00 0.00 H new ATOM 0 HG12 ILE B 32 5.133 7.090 1.858 1.00 0.00 H new ATOM 0 HG13 ILE B 32 4.564 7.178 0.203 1.00 0.00 H new ATOM 0 HG21 ILE B 32 4.460 4.124 -0.321 1.00 0.00 H new ATOM 0 HG22 ILE B 32 6.017 3.388 0.128 1.00 0.00 H new ATOM 0 HG23 ILE B 32 4.818 3.771 1.386 1.00 0.00 H new ATOM 0 HD11 ILE B 32 2.741 6.478 1.721 1.00 0.00 H new ATOM 0 HD12 ILE B 32 3.133 5.175 0.575 1.00 0.00 H new ATOM 0 HD13 ILE B 32 3.711 5.086 2.256 1.00 0.00 H new ATOM 2058 N THR B 33 8.597 4.774 0.055 1.00 0.00 N ATOM 2059 CA THR B 33 9.671 3.922 -0.465 1.00 0.00 C ATOM 2060 C THR B 33 10.902 4.093 0.425 1.00 0.00 C ATOM 2061 O THR B 33 11.635 3.154 0.671 1.00 0.00 O ATOM 2062 CB THR B 33 9.903 4.399 -1.911 1.00 0.00 C ATOM 2063 OG1 THR B 33 9.551 3.358 -2.811 1.00 0.00 O ATOM 2064 CG2 THR B 33 11.366 4.773 -2.131 1.00 0.00 C ATOM 0 H THR B 33 8.348 5.572 -0.530 1.00 0.00 H new ATOM 0 HA THR B 33 9.434 2.858 -0.463 1.00 0.00 H new ATOM 0 HB THR B 33 9.285 5.279 -2.089 1.00 0.00 H new ATOM 0 HG1 THR B 33 8.582 3.366 -2.958 1.00 0.00 H new ATOM 0 HG21 THR B 33 11.506 5.107 -3.159 1.00 0.00 H new ATOM 0 HG22 THR B 33 11.643 5.576 -1.448 1.00 0.00 H new ATOM 0 HG23 THR B 33 11.996 3.904 -1.943 1.00 0.00 H new ATOM 2072 N GLU B 34 11.137 5.287 0.917 1.00 0.00 N ATOM 2073 CA GLU B 34 12.319 5.490 1.781 1.00 0.00 C ATOM 2074 C GLU B 34 12.106 4.910 3.184 1.00 0.00 C ATOM 2075 O GLU B 34 13.021 4.346 3.732 1.00 0.00 O ATOM 2076 CB GLU B 34 12.495 6.995 1.824 1.00 0.00 C ATOM 2077 CG GLU B 34 12.954 7.476 0.432 1.00 0.00 C ATOM 2078 CD GLU B 34 14.346 6.918 0.130 1.00 0.00 C ATOM 2079 OE1 GLU B 34 15.312 7.521 0.566 1.00 0.00 O ATOM 2080 OE2 GLU B 34 14.422 5.896 -0.532 1.00 0.00 O ATOM 0 H GLU B 34 10.563 6.114 0.754 1.00 0.00 H new ATOM 0 HA GLU B 34 13.201 4.978 1.396 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.558 7.478 2.101 1.00 0.00 H new ATOM 0 HB3 GLU B 34 13.231 7.269 2.580 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.246 7.147 -0.329 1.00 0.00 H new ATOM 0 HG3 GLU B 34 12.973 8.565 0.400 1.00 0.00 H new ATOM 2087 N THR B 35 10.932 5.019 3.786 1.00 0.00 N ATOM 2088 CA THR B 35 10.785 4.431 5.162 1.00 0.00 C ATOM 2089 C THR B 35 10.992 2.936 5.105 1.00 0.00 C ATOM 2090 O THR B 35 11.795 2.396 5.839 1.00 0.00 O ATOM 2091 CB THR B 35 9.384 4.749 5.674 1.00 0.00 C ATOM 2092 OG1 THR B 35 9.251 6.153 5.847 1.00 0.00 O ATOM 2093 CG2 THR B 35 9.189 4.041 7.023 1.00 0.00 C ATOM 0 H THR B 35 10.103 5.471 3.400 1.00 0.00 H new ATOM 0 HA THR B 35 11.530 4.856 5.834 1.00 0.00 H new ATOM 0 HB THR B 35 8.634 4.407 4.961 1.00 0.00 H new ATOM 0 HG1 THR B 35 9.219 6.589 4.970 1.00 0.00 H new ATOM 0 HG21 THR B 35 8.192 4.256 7.406 1.00 0.00 H new ATOM 0 HG22 THR B 35 9.302 2.965 6.889 1.00 0.00 H new ATOM 0 HG23 THR B 35 9.935 4.398 7.733 1.00 0.00 H new ATOM 2101 N VAL B 36 10.307 2.251 4.236 1.00 0.00 N ATOM 2102 CA VAL B 36 10.541 0.788 4.156 1.00 0.00 C ATOM 2103 C VAL B 36 12.036 0.583 3.955 1.00 0.00 C ATOM 2104 O VAL B 36 12.639 -0.322 4.498 1.00 0.00 O ATOM 2105 CB VAL B 36 9.748 0.316 2.941 1.00 0.00 C ATOM 2106 CG1 VAL B 36 10.412 -0.926 2.342 1.00 0.00 C ATOM 2107 CG2 VAL B 36 8.325 -0.017 3.379 1.00 0.00 C ATOM 0 H VAL B 36 9.612 2.630 3.593 1.00 0.00 H new ATOM 0 HA VAL B 36 10.232 0.237 5.044 1.00 0.00 H new ATOM 0 HB VAL B 36 9.725 1.102 2.186 1.00 0.00 H new ATOM 0 HG11 VAL B 36 9.843 -1.260 1.475 1.00 0.00 H new ATOM 0 HG12 VAL B 36 11.430 -0.683 2.037 1.00 0.00 H new ATOM 0 HG13 VAL B 36 10.437 -1.721 3.088 1.00 0.00 H new ATOM 0 HG21 VAL B 36 7.749 -0.356 2.518 1.00 0.00 H new ATOM 0 HG22 VAL B 36 8.351 -0.806 4.131 1.00 0.00 H new ATOM 0 HG23 VAL B 36 7.857 0.872 3.802 1.00 0.00 H new ATOM 2117 N ALA B 37 12.637 1.459 3.199 1.00 0.00 N ATOM 2118 CA ALA B 37 14.095 1.371 2.982 1.00 0.00 C ATOM 2119 C ALA B 37 14.815 2.275 3.987 1.00 0.00 C ATOM 2120 O ALA B 37 16.006 2.503 3.899 1.00 0.00 O ATOM 2121 CB ALA B 37 14.315 1.835 1.561 1.00 0.00 C ATOM 0 H ALA B 37 12.173 2.233 2.723 1.00 0.00 H new ATOM 0 HA ALA B 37 14.486 0.364 3.127 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.379 1.797 1.326 1.00 0.00 H new ATOM 0 HB2 ALA B 37 13.769 1.185 0.877 1.00 0.00 H new ATOM 0 HB3 ALA B 37 13.956 2.858 1.453 1.00 0.00 H new ATOM 2127 N LYS B 38 14.102 2.754 4.967 1.00 0.00 N ATOM 2128 CA LYS B 38 14.745 3.586 6.024 1.00 0.00 C ATOM 2129 C LYS B 38 14.814 2.721 7.261 1.00 0.00 C ATOM 2130 O LYS B 38 15.750 2.779 8.034 1.00 0.00 O ATOM 2131 CB LYS B 38 13.841 4.796 6.267 1.00 0.00 C ATOM 2132 CG LYS B 38 14.654 5.920 6.914 1.00 0.00 C ATOM 2133 CD LYS B 38 15.491 6.632 5.845 1.00 0.00 C ATOM 2134 CE LYS B 38 14.566 7.292 4.816 1.00 0.00 C ATOM 2135 NZ LYS B 38 14.814 8.753 4.954 1.00 0.00 N ATOM 0 H LYS B 38 13.100 2.606 5.083 1.00 0.00 H new ATOM 0 HA LYS B 38 15.741 3.932 5.750 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.413 5.138 5.325 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.008 4.517 6.913 1.00 0.00 H new ATOM 0 HG2 LYS B 38 13.987 6.631 7.401 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.305 5.513 7.688 1.00 0.00 H new ATOM 0 HD2 LYS B 38 16.128 7.384 6.310 1.00 0.00 H new ATOM 0 HD3 LYS B 38 16.150 5.918 5.350 1.00 0.00 H new ATOM 0 HE2 LYS B 38 14.790 6.948 3.806 1.00 0.00 H new ATOM 0 HE3 LYS B 38 13.522 7.049 5.011 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 14.215 9.272 4.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 14.586 9.054 5.923 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 15.815 8.956 4.755 1.00 0.00 H new ATOM 2149 N GLY B 39 13.831 1.881 7.424 1.00 0.00 N ATOM 2150 CA GLY B 39 13.834 0.968 8.572 1.00 0.00 C ATOM 2151 C GLY B 39 12.491 0.997 9.299 1.00 0.00 C ATOM 2152 O GLY B 39 12.444 0.928 10.512 1.00 0.00 O ATOM 0 H GLY B 39 13.027 1.796 6.802 1.00 0.00 H new ATOM 0 HA2 GLY B 39 14.046 -0.046 8.234 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.631 1.248 9.261 1.00 0.00 H new ATOM 2156 N ASP B 40 11.392 1.088 8.589 1.00 0.00 N ATOM 2157 CA ASP B 40 10.079 1.108 9.299 1.00 0.00 C ATOM 2158 C ASP B 40 8.984 0.444 8.459 1.00 0.00 C ATOM 2159 O ASP B 40 8.981 0.515 7.245 1.00 0.00 O ATOM 2160 CB ASP B 40 9.768 2.589 9.524 1.00 0.00 C ATOM 2161 CG ASP B 40 9.790 2.896 11.023 1.00 0.00 C ATOM 2162 OD1 ASP B 40 8.776 2.687 11.666 1.00 0.00 O ATOM 2163 OD2 ASP B 40 10.824 3.334 11.502 1.00 0.00 O ATOM 0 H ASP B 40 11.348 1.148 7.572 1.00 0.00 H new ATOM 0 HA ASP B 40 10.120 0.552 10.235 1.00 0.00 H new ATOM 0 HB2 ASP B 40 10.500 3.208 9.005 1.00 0.00 H new ATOM 0 HB3 ASP B 40 8.791 2.833 9.107 1.00 0.00 H new ATOM 2168 N LYS B 41 8.045 -0.187 9.112 1.00 0.00 N ATOM 2169 CA LYS B 41 6.926 -0.849 8.390 1.00 0.00 C ATOM 2170 C LYS B 41 5.777 0.145 8.258 1.00 0.00 C ATOM 2171 O LYS B 41 4.983 0.323 9.161 1.00 0.00 O ATOM 2172 CB LYS B 41 6.522 -2.031 9.273 1.00 0.00 C ATOM 2173 CG LYS B 41 7.652 -3.061 9.294 1.00 0.00 C ATOM 2174 CD LYS B 41 7.266 -4.224 10.210 1.00 0.00 C ATOM 2175 CE LYS B 41 8.259 -5.373 10.024 1.00 0.00 C ATOM 2176 NZ LYS B 41 8.113 -6.209 11.249 1.00 0.00 N ATOM 0 H LYS B 41 8.008 -0.271 10.128 1.00 0.00 H new ATOM 0 HA LYS B 41 7.198 -1.182 7.388 1.00 0.00 H new ATOM 0 HB2 LYS B 41 6.310 -1.687 10.285 1.00 0.00 H new ATOM 0 HB3 LYS B 41 5.607 -2.486 8.893 1.00 0.00 H new ATOM 0 HG2 LYS B 41 7.844 -3.427 8.285 1.00 0.00 H new ATOM 0 HG3 LYS B 41 8.574 -2.598 9.646 1.00 0.00 H new ATOM 0 HD2 LYS B 41 7.264 -3.896 11.250 1.00 0.00 H new ATOM 0 HD3 LYS B 41 6.256 -4.562 9.980 1.00 0.00 H new ATOM 0 HE2 LYS B 41 8.035 -5.947 9.125 1.00 0.00 H new ATOM 0 HE3 LYS B 41 9.278 -5.001 9.919 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 8.763 -7.019 11.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 8.339 -5.638 12.088 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 7.135 -6.554 11.319 1.00 0.00 H new ATOM 2190 N VAL B 42 5.703 0.809 7.145 1.00 0.00 N ATOM 2191 CA VAL B 42 4.626 1.825 6.944 1.00 0.00 C ATOM 2192 C VAL B 42 3.240 1.185 7.069 1.00 0.00 C ATOM 2193 O VAL B 42 2.914 0.244 6.373 1.00 0.00 O ATOM 2194 CB VAL B 42 4.845 2.359 5.527 1.00 0.00 C ATOM 2195 CG1 VAL B 42 3.810 3.443 5.222 1.00 0.00 C ATOM 2196 CG2 VAL B 42 6.251 2.956 5.417 1.00 0.00 C ATOM 0 H VAL B 42 6.342 0.696 6.358 1.00 0.00 H new ATOM 0 HA VAL B 42 4.669 2.615 7.693 1.00 0.00 H new ATOM 0 HB VAL B 42 4.738 1.542 4.813 1.00 0.00 H new ATOM 0 HG11 VAL B 42 3.967 3.822 4.212 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.808 3.021 5.299 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.916 4.259 5.937 1.00 0.00 H new ATOM 0 HG21 VAL B 42 6.407 3.336 4.407 1.00 0.00 H new ATOM 0 HG22 VAL B 42 6.357 3.772 6.132 1.00 0.00 H new ATOM 0 HG23 VAL B 42 6.991 2.186 5.633 1.00 0.00 H new ATOM 2206 N GLN B 43 2.416 1.707 7.941 1.00 0.00 N ATOM 2207 CA GLN B 43 1.039 1.150 8.102 1.00 0.00 C ATOM 2208 C GLN B 43 0.017 2.245 7.813 1.00 0.00 C ATOM 2209 O GLN B 43 -0.303 3.053 8.662 1.00 0.00 O ATOM 2210 CB GLN B 43 0.929 0.677 9.558 1.00 0.00 C ATOM 2211 CG GLN B 43 1.549 1.708 10.502 1.00 0.00 C ATOM 2212 CD GLN B 43 1.277 1.301 11.952 1.00 0.00 C ATOM 2213 OE1 GLN B 43 0.279 0.671 12.240 1.00 0.00 O ATOM 2214 NE2 GLN B 43 2.129 1.635 12.882 1.00 0.00 N ATOM 0 H GLN B 43 2.637 2.496 8.549 1.00 0.00 H new ATOM 0 HA GLN B 43 0.849 0.325 7.415 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -0.118 0.520 9.818 1.00 0.00 H new ATOM 0 HB3 GLN B 43 1.434 -0.282 9.675 1.00 0.00 H new ATOM 0 HG2 GLN B 43 2.623 1.777 10.328 1.00 0.00 H new ATOM 0 HG3 GLN B 43 1.130 2.695 10.305 1.00 0.00 H new ATOM 0 HE21 GLN B 43 2.967 2.164 12.640 1.00 0.00 H new ATOM 0 HE22 GLN B 43 1.957 1.367 13.851 1.00 0.00 H new ATOM 2223 N LEU B 44 -0.490 2.281 6.614 1.00 0.00 N ATOM 2224 CA LEU B 44 -1.485 3.326 6.255 1.00 0.00 C ATOM 2225 C LEU B 44 -2.768 3.137 7.058 1.00 0.00 C ATOM 2226 O LEU B 44 -3.477 2.170 6.871 1.00 0.00 O ATOM 2227 CB LEU B 44 -1.758 3.110 4.770 1.00 0.00 C ATOM 2228 CG LEU B 44 -0.814 3.975 3.940 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -0.918 3.579 2.463 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -1.211 5.437 4.103 1.00 0.00 C ATOM 0 H LEU B 44 -0.257 1.629 5.865 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.121 4.331 6.468 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.622 2.059 4.515 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.793 3.362 4.541 1.00 0.00 H new ATOM 0 HG LEU B 44 0.212 3.830 4.279 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.243 4.198 1.872 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.644 2.530 2.347 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.941 3.727 2.118 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -0.542 6.064 3.513 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.236 5.576 3.759 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.140 5.718 5.154 1.00 0.00 H new ATOM 2242 N THR B 45 -3.072 4.063 7.939 1.00 0.00 N ATOM 2243 CA THR B 45 -4.324 3.973 8.769 1.00 0.00 C ATOM 2244 C THR B 45 -4.732 2.510 9.012 1.00 0.00 C ATOM 2245 O THR B 45 -4.290 1.887 9.958 1.00 0.00 O ATOM 2246 CB THR B 45 -5.408 4.734 7.978 1.00 0.00 C ATOM 2247 OG1 THR B 45 -6.689 4.204 8.292 1.00 0.00 O ATOM 2248 CG2 THR B 45 -5.163 4.610 6.468 1.00 0.00 C ATOM 0 H THR B 45 -2.501 4.888 8.122 1.00 0.00 H new ATOM 0 HA THR B 45 -4.176 4.407 9.758 1.00 0.00 H new ATOM 0 HB THR B 45 -5.365 5.787 8.256 1.00 0.00 H new ATOM 0 HG1 THR B 45 -7.370 4.651 7.748 1.00 0.00 H new ATOM 0 HG21 THR B 45 -5.938 5.153 5.928 1.00 0.00 H new ATOM 0 HG22 THR B 45 -4.187 5.029 6.222 1.00 0.00 H new ATOM 0 HG23 THR B 45 -5.189 3.559 6.180 1.00 0.00 H new ATOM 2256 N GLY B 46 -5.565 1.956 8.169 1.00 0.00 N ATOM 2257 CA GLY B 46 -5.985 0.545 8.358 1.00 0.00 C ATOM 2258 C GLY B 46 -6.287 -0.093 7.001 1.00 0.00 C ATOM 2259 O GLY B 46 -7.105 -0.987 6.904 1.00 0.00 O ATOM 0 H GLY B 46 -5.970 2.424 7.359 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -5.198 -0.013 8.865 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -6.868 0.501 8.995 1.00 0.00 H new ATOM 2263 N PHE B 47 -5.636 0.346 5.949 1.00 0.00 N ATOM 2264 CA PHE B 47 -5.908 -0.268 4.616 1.00 0.00 C ATOM 2265 C PHE B 47 -4.606 -0.618 3.873 1.00 0.00 C ATOM 2266 O PHE B 47 -4.604 -1.488 3.028 1.00 0.00 O ATOM 2267 CB PHE B 47 -6.777 0.740 3.843 1.00 0.00 C ATOM 2268 CG PHE B 47 -5.923 1.727 3.090 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.322 2.779 3.772 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -5.741 1.598 1.708 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -4.538 3.703 3.091 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -4.952 2.522 1.024 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.349 3.575 1.720 1.00 0.00 C ATOM 0 H PHE B 47 -4.939 1.091 5.957 1.00 0.00 H new ATOM 0 HA PHE B 47 -6.433 -1.218 4.720 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -7.424 0.208 3.146 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -7.427 1.272 4.538 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -5.465 2.879 4.838 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -6.210 0.785 1.173 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.076 4.519 3.627 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -4.807 2.425 -0.042 1.00 0.00 H new ATOM 0 HZ PHE B 47 -3.736 4.290 1.191 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.500 0.023 4.168 1.00 0.00 N ATOM 2284 CA LEU B 48 -2.244 -0.346 3.443 1.00 0.00 C ATOM 2285 C LEU B 48 -1.065 -0.534 4.403 1.00 0.00 C ATOM 2286 O LEU B 48 -0.504 0.412 4.916 1.00 0.00 O ATOM 2287 CB LEU B 48 -1.983 0.795 2.466 1.00 0.00 C ATOM 2288 CG LEU B 48 -2.606 0.466 1.104 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -2.091 1.453 0.061 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -2.234 -0.961 0.677 1.00 0.00 C ATOM 0 H LEU B 48 -3.412 0.767 4.861 1.00 0.00 H new ATOM 0 HA LEU B 48 -2.355 -1.300 2.928 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -2.405 1.722 2.854 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.910 0.954 2.357 1.00 0.00 H new ATOM 0 HG LEU B 48 -3.690 0.541 1.185 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -2.532 1.221 -0.908 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -2.366 2.467 0.352 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -1.006 1.377 -0.007 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -2.684 -1.180 -0.292 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -1.150 -1.047 0.602 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -2.604 -1.670 1.417 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.679 -1.762 4.638 1.00 0.00 N ATOM 2303 CA ASN B 49 0.471 -2.027 5.556 1.00 0.00 C ATOM 2304 C ASN B 49 1.683 -2.548 4.768 1.00 0.00 C ATOM 2305 O ASN B 49 1.861 -3.738 4.604 1.00 0.00 O ATOM 2306 CB ASN B 49 -0.037 -3.098 6.523 1.00 0.00 C ATOM 2307 CG ASN B 49 0.442 -2.777 7.941 1.00 0.00 C ATOM 2308 OD1 ASN B 49 -0.351 -2.679 8.855 1.00 0.00 O ATOM 2309 ND2 ASN B 49 1.717 -2.609 8.163 1.00 0.00 N ATOM 0 H ASN B 49 -1.110 -2.593 4.234 1.00 0.00 H new ATOM 0 HA ASN B 49 0.798 -1.125 6.074 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -1.126 -3.139 6.497 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.327 -4.079 6.219 1.00 0.00 H new ATOM 0 HD21 ASN B 49 2.047 -2.395 9.104 1.00 0.00 H new ATOM 0 HD22 ASN B 49 2.384 -2.691 7.395 1.00 0.00 H new ATOM 2316 N ILE B 50 2.515 -1.661 4.285 1.00 0.00 N ATOM 2317 CA ILE B 50 3.722 -2.092 3.506 1.00 0.00 C ATOM 2318 C ILE B 50 4.808 -2.612 4.453 1.00 0.00 C ATOM 2319 O ILE B 50 4.930 -2.153 5.573 1.00 0.00 O ATOM 2320 CB ILE B 50 4.210 -0.821 2.807 1.00 0.00 C ATOM 2321 CG1 ILE B 50 3.103 -0.289 1.876 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.488 -1.125 2.016 1.00 0.00 C ATOM 2323 CD1 ILE B 50 3.501 -0.451 0.406 1.00 0.00 C ATOM 0 H ILE B 50 2.412 -0.652 4.396 1.00 0.00 H new ATOM 0 HA ILE B 50 3.492 -2.894 2.805 1.00 0.00 H new ATOM 0 HB ILE B 50 4.438 -0.056 3.549 1.00 0.00 H new ATOM 0 HG12 ILE B 50 2.173 -0.825 2.066 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.915 0.763 2.092 1.00 0.00 H new ATOM 0 HG21 ILE B 50 5.833 -0.218 1.519 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.261 -1.482 2.697 1.00 0.00 H new ATOM 0 HG23 ILE B 50 5.280 -1.891 1.269 1.00 0.00 H new ATOM 0 HD11 ILE B 50 2.704 -0.068 -0.231 1.00 0.00 H new ATOM 0 HD12 ILE B 50 4.418 0.106 0.214 1.00 0.00 H new ATOM 0 HD13 ILE B 50 3.665 -1.506 0.188 1.00 0.00 H new ATOM 2335 N LYS B 51 5.614 -3.554 4.018 1.00 0.00 N ATOM 2336 CA LYS B 51 6.694 -4.061 4.920 1.00 0.00 C ATOM 2337 C LYS B 51 7.777 -4.779 4.099 1.00 0.00 C ATOM 2338 O LYS B 51 7.476 -5.662 3.326 1.00 0.00 O ATOM 2339 CB LYS B 51 6.004 -5.033 5.885 1.00 0.00 C ATOM 2340 CG LYS B 51 5.115 -6.007 5.106 1.00 0.00 C ATOM 2341 CD LYS B 51 4.775 -7.207 5.993 1.00 0.00 C ATOM 2342 CE LYS B 51 5.841 -8.292 5.821 1.00 0.00 C ATOM 2343 NZ LYS B 51 5.090 -9.511 5.410 1.00 0.00 N ATOM 0 H LYS B 51 5.571 -3.986 3.095 1.00 0.00 H new ATOM 0 HA LYS B 51 7.190 -3.253 5.459 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.752 -5.586 6.453 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.404 -4.477 6.605 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.201 -5.506 4.787 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.627 -6.341 4.204 1.00 0.00 H new ATOM 0 HD2 LYS B 51 4.722 -6.897 7.037 1.00 0.00 H new ATOM 0 HD3 LYS B 51 3.794 -7.602 5.728 1.00 0.00 H new ATOM 0 HE2 LYS B 51 6.575 -8.008 5.067 1.00 0.00 H new ATOM 0 HE3 LYS B 51 6.387 -8.459 6.750 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 5.755 -10.299 5.273 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 4.404 -9.762 6.150 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 4.586 -9.325 4.520 1.00 0.00 H new ATOM 2357 N PRO B 52 9.008 -4.367 4.283 1.00 0.00 N ATOM 2358 CA PRO B 52 10.128 -4.981 3.532 1.00 0.00 C ATOM 2359 C PRO B 52 10.485 -6.360 4.093 1.00 0.00 C ATOM 2360 O PRO B 52 10.386 -6.610 5.278 1.00 0.00 O ATOM 2361 CB PRO B 52 11.282 -4.011 3.745 1.00 0.00 C ATOM 2362 CG PRO B 52 10.971 -3.308 5.026 1.00 0.00 C ATOM 2363 CD PRO B 52 9.471 -3.309 5.192 1.00 0.00 C ATOM 0 HA PRO B 52 9.884 -5.137 2.481 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.234 -4.539 3.806 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.361 -3.306 2.918 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.450 -3.812 5.866 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.354 -2.288 5.006 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.185 -3.516 6.223 1.00 0.00 H new ATOM 0 HD3 PRO B 52 9.041 -2.342 4.930 1.00 0.00 H new ATOM 2371 N VAL B 53 10.908 -7.250 3.238 1.00 0.00 N ATOM 2372 CA VAL B 53 11.286 -8.622 3.696 1.00 0.00 C ATOM 2373 C VAL B 53 12.441 -9.172 2.852 1.00 0.00 C ATOM 2374 O VAL B 53 12.353 -9.231 1.642 1.00 0.00 O ATOM 2375 CB VAL B 53 10.026 -9.462 3.503 1.00 0.00 C ATOM 2376 CG1 VAL B 53 8.891 -8.881 4.348 1.00 0.00 C ATOM 2377 CG2 VAL B 53 9.616 -9.442 2.026 1.00 0.00 C ATOM 0 H VAL B 53 11.009 -7.087 2.236 1.00 0.00 H new ATOM 0 HA VAL B 53 11.628 -8.631 4.731 1.00 0.00 H new ATOM 0 HB VAL B 53 10.226 -10.488 3.813 1.00 0.00 H new ATOM 0 HG11 VAL B 53 7.991 -9.481 4.210 1.00 0.00 H new ATOM 0 HG12 VAL B 53 9.178 -8.893 5.400 1.00 0.00 H new ATOM 0 HG13 VAL B 53 8.694 -7.855 4.037 1.00 0.00 H new ATOM 0 HG21 VAL B 53 8.716 -10.042 1.890 1.00 0.00 H new ATOM 0 HG22 VAL B 53 9.418 -8.416 1.717 1.00 0.00 H new ATOM 0 HG23 VAL B 53 10.422 -9.854 1.419 1.00 0.00 H new ATOM 2387 N ALA B 54 13.531 -9.557 3.470 1.00 0.00 N ATOM 2388 CA ALA B 54 14.681 -10.068 2.657 1.00 0.00 C ATOM 2389 C ALA B 54 14.336 -11.380 1.951 1.00 0.00 C ATOM 2390 O ALA B 54 14.138 -12.408 2.566 1.00 0.00 O ATOM 2391 CB ALA B 54 15.921 -10.201 3.577 1.00 0.00 C ATOM 0 H ALA B 54 13.675 -9.541 4.480 1.00 0.00 H new ATOM 0 HA ALA B 54 14.908 -9.358 1.862 1.00 0.00 H new ATOM 0 HB1 ALA B 54 16.766 -10.572 2.997 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.169 -9.226 3.996 1.00 0.00 H new ATOM 0 HB3 ALA B 54 15.701 -10.898 4.385 1.00 0.00 H new ATOM 2710 N VAL B 75 15.868 -7.929 1.479 1.00 0.00 N ATOM 2711 CA VAL B 75 14.814 -6.887 1.656 1.00 0.00 C ATOM 2712 C VAL B 75 13.991 -6.693 0.401 1.00 0.00 C ATOM 2713 O VAL B 75 14.451 -6.218 -0.619 1.00 0.00 O ATOM 2714 CB VAL B 75 15.539 -5.612 2.046 1.00 0.00 C ATOM 2715 CG1 VAL B 75 14.556 -4.437 2.082 1.00 0.00 C ATOM 2716 CG2 VAL B 75 16.145 -5.788 3.439 1.00 0.00 C ATOM 0 HA VAL B 75 14.102 -7.188 2.425 1.00 0.00 H new ATOM 0 HB VAL B 75 16.320 -5.408 1.314 1.00 0.00 H new ATOM 0 HG11 VAL B 75 15.087 -3.527 2.363 1.00 0.00 H new ATOM 0 HG12 VAL B 75 14.109 -4.307 1.097 1.00 0.00 H new ATOM 0 HG13 VAL B 75 13.773 -4.640 2.812 1.00 0.00 H new ATOM 0 HG21 VAL B 75 16.668 -4.876 3.726 1.00 0.00 H new ATOM 0 HG22 VAL B 75 15.352 -5.993 4.158 1.00 0.00 H new ATOM 0 HG23 VAL B 75 16.848 -6.621 3.427 1.00 0.00 H new ATOM 2726 N GLY B 76 12.763 -7.047 0.512 1.00 0.00 N ATOM 2727 CA GLY B 76 11.821 -6.898 -0.611 1.00 0.00 C ATOM 2728 C GLY B 76 10.870 -5.780 -0.238 1.00 0.00 C ATOM 2729 O GLY B 76 11.263 -4.810 0.380 1.00 0.00 O ATOM 0 H GLY B 76 12.356 -7.446 1.358 1.00 0.00 H new ATOM 0 HA2 GLY B 76 12.353 -6.662 -1.533 1.00 0.00 H new ATOM 0 HA3 GLY B 76 11.277 -7.826 -0.785 1.00 0.00 H new ATOM 2733 N VAL B 77 9.629 -5.896 -0.589 1.00 0.00 N ATOM 2734 CA VAL B 77 8.670 -4.817 -0.235 1.00 0.00 C ATOM 2735 C VAL B 77 7.254 -5.375 -0.168 1.00 0.00 C ATOM 2736 O VAL B 77 6.466 -5.192 -1.071 1.00 0.00 O ATOM 2737 CB VAL B 77 8.793 -3.798 -1.381 1.00 0.00 C ATOM 2738 CG1 VAL B 77 7.823 -2.641 -1.159 1.00 0.00 C ATOM 2739 CG2 VAL B 77 10.219 -3.242 -1.459 1.00 0.00 C ATOM 0 H VAL B 77 9.235 -6.684 -1.102 1.00 0.00 H new ATOM 0 HA VAL B 77 8.882 -4.372 0.737 1.00 0.00 H new ATOM 0 HB VAL B 77 8.554 -4.308 -2.314 1.00 0.00 H new ATOM 0 HG11 VAL B 77 7.918 -1.925 -1.975 1.00 0.00 H new ATOM 0 HG12 VAL B 77 6.802 -3.023 -1.128 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.055 -2.148 -0.215 1.00 0.00 H new ATOM 0 HG21 VAL B 77 10.285 -2.523 -2.276 1.00 0.00 H new ATOM 0 HG22 VAL B 77 10.469 -2.748 -0.520 1.00 0.00 H new ATOM 0 HG23 VAL B 77 10.919 -4.059 -1.637 1.00 0.00 H new ATOM 2749 N SER B 78 6.918 -6.054 0.892 1.00 0.00 N ATOM 2750 CA SER B 78 5.539 -6.604 0.983 1.00 0.00 C ATOM 2751 C SER B 78 4.541 -5.480 1.291 1.00 0.00 C ATOM 2752 O SER B 78 4.910 -4.343 1.507 1.00 0.00 O ATOM 2753 CB SER B 78 5.583 -7.620 2.125 1.00 0.00 C ATOM 2754 OG SER B 78 5.464 -8.931 1.590 1.00 0.00 O ATOM 0 H SER B 78 7.527 -6.250 1.687 1.00 0.00 H new ATOM 0 HA SER B 78 5.217 -7.065 0.049 1.00 0.00 H new ATOM 0 HB2 SER B 78 6.518 -7.523 2.678 1.00 0.00 H new ATOM 0 HB3 SER B 78 4.774 -7.427 2.830 1.00 0.00 H new ATOM 0 HG SER B 78 5.493 -9.586 2.319 1.00 0.00 H new ATOM 2760 N VAL B 79 3.283 -5.812 1.317 1.00 0.00 N ATOM 2761 CA VAL B 79 2.205 -4.814 1.609 1.00 0.00 C ATOM 2762 C VAL B 79 0.846 -5.513 1.468 1.00 0.00 C ATOM 2763 O VAL B 79 0.783 -6.664 1.080 1.00 0.00 O ATOM 2764 CB VAL B 79 2.360 -3.716 0.541 1.00 0.00 C ATOM 2765 CG1 VAL B 79 2.319 -4.343 -0.854 1.00 0.00 C ATOM 2766 CG2 VAL B 79 1.226 -2.695 0.665 1.00 0.00 C ATOM 0 H VAL B 79 2.943 -6.758 1.144 1.00 0.00 H new ATOM 0 HA VAL B 79 2.272 -4.396 2.613 1.00 0.00 H new ATOM 0 HB VAL B 79 3.316 -3.214 0.692 1.00 0.00 H new ATOM 0 HG11 VAL B 79 2.429 -3.563 -1.607 1.00 0.00 H new ATOM 0 HG12 VAL B 79 3.133 -5.061 -0.954 1.00 0.00 H new ATOM 0 HG13 VAL B 79 1.366 -4.852 -0.996 1.00 0.00 H new ATOM 0 HG21 VAL B 79 1.346 -1.923 -0.095 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.268 -3.196 0.525 1.00 0.00 H new ATOM 0 HG23 VAL B 79 1.255 -2.237 1.654 1.00 0.00 H new ATOM 2776 N LYS B 80 -0.242 -4.832 1.733 1.00 0.00 N ATOM 2777 CA LYS B 80 -1.575 -5.471 1.563 1.00 0.00 C ATOM 2778 C LYS B 80 -2.698 -4.468 1.867 1.00 0.00 C ATOM 2779 O LYS B 80 -2.449 -3.368 2.317 1.00 0.00 O ATOM 2780 CB LYS B 80 -1.595 -6.621 2.581 1.00 0.00 C ATOM 2781 CG LYS B 80 -1.387 -6.066 3.995 1.00 0.00 C ATOM 2782 CD LYS B 80 -2.441 -6.656 4.937 1.00 0.00 C ATOM 2783 CE LYS B 80 -1.875 -7.903 5.621 1.00 0.00 C ATOM 2784 NZ LYS B 80 -1.479 -7.447 6.983 1.00 0.00 N ATOM 0 H LYS B 80 -0.261 -3.865 2.058 1.00 0.00 H new ATOM 0 HA LYS B 80 -1.734 -5.820 0.543 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -2.545 -7.152 2.525 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -0.812 -7.342 2.345 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -0.387 -6.314 4.351 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -1.461 -4.979 3.985 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -2.730 -5.918 5.685 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -3.341 -6.912 4.378 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -2.619 -8.698 5.671 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -1.020 -8.300 5.073 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -1.081 -8.247 7.515 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -0.765 -6.695 6.903 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -2.314 -7.080 7.483 1.00 0.00 H new ATOM 2798 N PRO B 81 -3.903 -4.910 1.630 1.00 0.00 N ATOM 2799 CA PRO B 81 -5.103 -4.098 1.891 1.00 0.00 C ATOM 2800 C PRO B 81 -5.613 -4.353 3.311 1.00 0.00 C ATOM 2801 O PRO B 81 -5.539 -5.455 3.818 1.00 0.00 O ATOM 2802 CB PRO B 81 -6.102 -4.626 0.870 1.00 0.00 C ATOM 2803 CG PRO B 81 -5.663 -6.031 0.566 1.00 0.00 C ATOM 2804 CD PRO B 81 -4.250 -6.202 1.069 1.00 0.00 C ATOM 0 HA PRO B 81 -4.928 -3.025 1.810 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -7.116 -4.610 1.269 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -6.104 -4.012 -0.031 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -6.327 -6.749 1.047 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -5.711 -6.221 -0.506 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -4.189 -6.990 1.820 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -3.572 -6.479 0.261 1.00 0.00 H new ATOM 2812 N GLY B 82 -6.125 -3.345 3.955 1.00 0.00 N ATOM 2813 CA GLY B 82 -6.638 -3.530 5.348 1.00 0.00 C ATOM 2814 C GLY B 82 -8.171 -3.522 5.364 1.00 0.00 C ATOM 2815 O GLY B 82 -8.780 -2.946 6.242 1.00 0.00 O ATOM 0 H GLY B 82 -6.213 -2.400 3.582 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -6.270 -4.472 5.755 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -6.258 -2.735 5.990 1.00 0.00 H new ATOM 2819 N GLU B 83 -8.796 -4.163 4.406 1.00 0.00 N ATOM 2820 CA GLU B 83 -10.300 -4.210 4.353 1.00 0.00 C ATOM 2821 C GLU B 83 -10.897 -2.829 4.085 1.00 0.00 C ATOM 2822 O GLU B 83 -11.750 -2.675 3.237 1.00 0.00 O ATOM 2823 CB GLU B 83 -10.769 -4.713 5.720 1.00 0.00 C ATOM 2824 CG GLU B 83 -12.201 -5.243 5.605 1.00 0.00 C ATOM 2825 CD GLU B 83 -12.224 -6.742 5.913 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -11.752 -7.504 5.086 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -12.713 -7.101 6.971 1.00 0.00 O ATOM 0 H GLU B 83 -8.328 -4.662 3.649 1.00 0.00 H new ATOM 0 HA GLU B 83 -10.625 -4.862 3.542 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -10.106 -5.501 6.077 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -10.726 -3.905 6.451 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -12.853 -4.710 6.297 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -12.586 -5.062 4.601 1.00 0.00 H new ATOM 2834 N SER B 84 -10.470 -1.827 4.804 1.00 0.00 N ATOM 2835 CA SER B 84 -11.025 -0.454 4.591 1.00 0.00 C ATOM 2836 C SER B 84 -11.070 -0.149 3.095 1.00 0.00 C ATOM 2837 O SER B 84 -11.944 0.545 2.610 1.00 0.00 O ATOM 2838 CB SER B 84 -10.052 0.480 5.307 1.00 0.00 C ATOM 2839 OG SER B 84 -10.211 1.801 4.805 1.00 0.00 O ATOM 0 H SER B 84 -9.759 -1.897 5.532 1.00 0.00 H new ATOM 0 HA SER B 84 -12.040 -0.344 4.973 1.00 0.00 H new ATOM 0 HB2 SER B 84 -10.237 0.462 6.381 1.00 0.00 H new ATOM 0 HB3 SER B 84 -9.027 0.142 5.155 1.00 0.00 H new ATOM 0 HG SER B 84 -9.810 2.439 5.431 1.00 0.00 H new ATOM 2845 N LEU B 85 -10.140 -0.691 2.366 1.00 0.00 N ATOM 2846 CA LEU B 85 -10.111 -0.476 0.897 1.00 0.00 C ATOM 2847 C LEU B 85 -11.003 -1.509 0.215 1.00 0.00 C ATOM 2848 O LEU B 85 -11.616 -1.245 -0.802 1.00 0.00 O ATOM 2849 CB LEU B 85 -8.648 -0.685 0.507 1.00 0.00 C ATOM 2850 CG LEU B 85 -8.372 0.000 -0.829 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -6.877 -0.073 -1.153 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -9.175 -0.694 -1.931 1.00 0.00 C ATOM 0 H LEU B 85 -9.391 -1.280 2.729 1.00 0.00 H new ATOM 0 HA LEU B 85 -10.474 0.509 0.602 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -7.994 -0.278 1.278 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -8.429 -1.750 0.433 1.00 0.00 H new ATOM 0 HG LEU B 85 -8.670 1.047 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -6.687 0.418 -2.108 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -6.310 0.428 -0.368 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -6.568 -1.117 -1.214 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -8.979 -0.206 -2.886 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -8.880 -1.742 -1.991 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -10.239 -0.629 -1.702 1.00 0.00 H new ATOM 2864 N LYS B 86 -11.083 -2.686 0.772 1.00 0.00 N ATOM 2865 CA LYS B 86 -11.939 -3.742 0.161 1.00 0.00 C ATOM 2866 C LYS B 86 -13.385 -3.550 0.571 1.00 0.00 C ATOM 2867 O LYS B 86 -14.298 -4.012 -0.085 1.00 0.00 O ATOM 2868 CB LYS B 86 -11.421 -5.061 0.729 1.00 0.00 C ATOM 2869 CG LYS B 86 -11.275 -6.090 -0.391 1.00 0.00 C ATOM 2870 CD LYS B 86 -10.416 -7.255 0.105 1.00 0.00 C ATOM 2871 CE LYS B 86 -10.518 -8.422 -0.880 1.00 0.00 C ATOM 2872 NZ LYS B 86 -9.803 -9.549 -0.218 1.00 0.00 N ATOM 0 H LYS B 86 -10.593 -2.962 1.623 1.00 0.00 H new ATOM 0 HA LYS B 86 -11.897 -3.712 -0.928 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -10.459 -4.904 1.217 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -12.107 -5.434 1.489 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -12.256 -6.451 -0.699 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -10.815 -5.630 -1.266 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -9.378 -6.939 0.204 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -10.748 -7.570 1.094 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -11.558 -8.679 -1.082 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -10.060 -8.172 -1.837 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -9.830 -10.387 -0.834 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -8.814 -9.279 -0.045 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -10.265 -9.770 0.687 1.00 0.00 H new ATOM 2886 N LYS B 87 -13.595 -2.870 1.648 1.00 0.00 N ATOM 2887 CA LYS B 87 -14.972 -2.639 2.109 1.00 0.00 C ATOM 2888 C LYS B 87 -15.466 -1.338 1.495 1.00 0.00 C ATOM 2889 O LYS B 87 -16.638 -1.171 1.197 1.00 0.00 O ATOM 2890 CB LYS B 87 -14.867 -2.554 3.637 1.00 0.00 C ATOM 2891 CG LYS B 87 -16.214 -2.127 4.232 1.00 0.00 C ATOM 2892 CD LYS B 87 -16.772 -3.252 5.106 1.00 0.00 C ATOM 2893 CE LYS B 87 -17.207 -4.420 4.219 1.00 0.00 C ATOM 2894 NZ LYS B 87 -16.947 -5.640 5.033 1.00 0.00 N ATOM 0 H LYS B 87 -12.865 -2.462 2.232 1.00 0.00 H new ATOM 0 HA LYS B 87 -15.676 -3.419 1.820 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -14.571 -3.521 4.044 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -14.093 -1.839 3.917 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -16.090 -1.221 4.825 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -16.917 -1.891 3.433 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -16.015 -3.584 5.817 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -17.619 -2.889 5.688 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -18.261 -4.341 3.951 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -16.642 -4.440 3.287 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -17.221 -6.484 4.491 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -15.935 -5.692 5.267 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -17.503 -5.597 5.911 1.00 0.00 H new ATOM 2908 N ALA B 88 -14.563 -0.430 1.248 1.00 0.00 N ATOM 2909 CA ALA B 88 -14.970 0.840 0.608 1.00 0.00 C ATOM 2910 C ALA B 88 -15.336 0.531 -0.833 1.00 0.00 C ATOM 2911 O ALA B 88 -16.263 1.083 -1.394 1.00 0.00 O ATOM 2912 CB ALA B 88 -13.739 1.743 0.676 1.00 0.00 C ATOM 0 H ALA B 88 -13.569 -0.516 1.462 1.00 0.00 H new ATOM 0 HA ALA B 88 -15.824 1.319 1.088 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -13.968 2.705 0.218 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -13.456 1.895 1.718 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -12.914 1.274 0.141 1.00 0.00 H new ATOM 2918 N ALA B 89 -14.620 -0.384 -1.428 1.00 0.00 N ATOM 2919 CA ALA B 89 -14.919 -0.760 -2.834 1.00 0.00 C ATOM 2920 C ALA B 89 -16.190 -1.584 -2.877 1.00 0.00 C ATOM 2921 O ALA B 89 -17.036 -1.392 -3.729 1.00 0.00 O ATOM 2922 CB ALA B 89 -13.714 -1.560 -3.301 1.00 0.00 C ATOM 0 H ALA B 89 -13.842 -0.886 -0.999 1.00 0.00 H new ATOM 0 HA ALA B 89 -15.083 0.103 -3.479 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -13.863 -1.873 -4.334 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -12.819 -0.942 -3.235 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -13.594 -2.440 -2.669 1.00 0.00 H new ATOM 2928 N GLU B 90 -16.358 -2.467 -1.937 1.00 0.00 N ATOM 2929 CA GLU B 90 -17.611 -3.260 -1.902 1.00 0.00 C ATOM 2930 C GLU B 90 -18.787 -2.286 -1.821 1.00 0.00 C ATOM 2931 O GLU B 90 -19.910 -2.617 -2.149 1.00 0.00 O ATOM 2932 CB GLU B 90 -17.520 -4.099 -0.624 1.00 0.00 C ATOM 2933 CG GLU B 90 -17.827 -5.562 -0.945 1.00 0.00 C ATOM 2934 CD GLU B 90 -18.738 -6.146 0.138 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -19.944 -6.057 -0.020 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -18.214 -6.673 1.104 1.00 0.00 O ATOM 0 H GLU B 90 -15.687 -2.672 -1.197 1.00 0.00 H new ATOM 0 HA GLU B 90 -17.748 -3.893 -2.779 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -16.523 -4.013 -0.191 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -18.224 -3.724 0.119 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -18.309 -5.637 -1.920 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -16.901 -6.134 -1.003 1.00 0.00 H new ATOM 2943 N GLY B 91 -18.532 -1.085 -1.354 1.00 0.00 N ATOM 2944 CA GLY B 91 -19.628 -0.093 -1.214 1.00 0.00 C ATOM 2945 C GLY B 91 -19.650 0.953 -2.350 1.00 0.00 C ATOM 2946 O GLY B 91 -20.620 1.679 -2.461 1.00 0.00 O ATOM 0 H GLY B 91 -17.610 -0.757 -1.066 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -20.583 -0.617 -1.193 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -19.525 0.420 -0.258 1.00 0.00 H new ATOM 2950 N LEU B 92 -18.634 1.092 -3.190 1.00 0.00 N ATOM 2951 CA LEU B 92 -18.750 2.148 -4.237 1.00 0.00 C ATOM 2952 C LEU B 92 -19.296 1.574 -5.547 1.00 0.00 C ATOM 2953 O LEU B 92 -20.407 1.873 -5.942 1.00 0.00 O ATOM 2954 CB LEU B 92 -17.336 2.693 -4.412 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.850 3.389 -3.126 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -15.907 4.537 -3.491 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -18.028 3.957 -2.326 1.00 0.00 C ATOM 0 H LEU B 92 -17.774 0.544 -3.191 1.00 0.00 H new ATOM 0 HA LEU B 92 -19.450 2.932 -3.947 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.658 1.879 -4.668 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -17.315 3.399 -5.242 1.00 0.00 H new ATOM 0 HG LEU B 92 -16.333 2.648 -2.516 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -15.564 5.029 -2.581 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -15.049 4.144 -4.037 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -16.435 5.257 -4.116 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -17.655 4.442 -1.424 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -18.564 4.685 -2.935 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -18.704 3.148 -2.050 1.00 0.00 H new ATOM 2969 N LYS B 93 -18.537 0.766 -6.229 1.00 0.00 N ATOM 2970 CA LYS B 93 -19.039 0.197 -7.517 1.00 0.00 C ATOM 2971 C LYS B 93 -18.468 -1.203 -7.765 1.00 0.00 C ATOM 2972 O LYS B 93 -17.976 -1.498 -8.839 1.00 0.00 O ATOM 2973 CB LYS B 93 -18.556 1.176 -8.593 1.00 0.00 C ATOM 2974 CG LYS B 93 -19.743 1.983 -9.129 1.00 0.00 C ATOM 2975 CD LYS B 93 -19.773 3.359 -8.458 1.00 0.00 C ATOM 2976 CE LYS B 93 -20.202 4.418 -9.478 1.00 0.00 C ATOM 2977 NZ LYS B 93 -21.443 5.020 -8.913 1.00 0.00 N ATOM 0 H LYS B 93 -17.598 0.474 -5.957 1.00 0.00 H new ATOM 0 HA LYS B 93 -20.123 0.085 -7.515 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -17.806 1.848 -8.176 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -18.078 0.630 -9.407 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -19.661 2.096 -10.210 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -20.675 1.452 -8.934 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -20.465 3.349 -7.616 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -18.788 3.602 -8.059 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -19.426 5.171 -9.615 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -20.389 3.972 -10.455 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -21.797 5.756 -9.558 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -22.167 4.282 -8.800 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -21.233 5.443 -7.987 1.00 0.00 H new ATOM 2991 N TYR B 94 -18.542 -2.074 -6.793 1.00 0.00 N ATOM 2992 CA TYR B 94 -18.011 -3.457 -6.991 1.00 0.00 C ATOM 2993 C TYR B 94 -18.639 -4.082 -8.242 1.00 0.00 C ATOM 2994 O TYR B 94 -17.957 -4.622 -9.089 1.00 0.00 O ATOM 2995 CB TYR B 94 -18.420 -4.231 -5.731 1.00 0.00 C ATOM 2996 CG TYR B 94 -18.206 -5.713 -5.950 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -16.931 -6.269 -5.805 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -19.283 -6.528 -6.309 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -16.736 -7.642 -6.018 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -19.088 -7.898 -6.525 1.00 0.00 C ATOM 3001 CZ TYR B 94 -17.815 -8.454 -6.378 1.00 0.00 C ATOM 3002 OH TYR B 94 -17.622 -9.804 -6.589 1.00 0.00 O ATOM 0 H TYR B 94 -18.945 -1.890 -5.874 1.00 0.00 H new ATOM 0 HA TYR B 94 -16.931 -3.471 -7.135 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -17.833 -3.891 -4.878 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -19.466 -4.036 -5.496 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -16.096 -5.641 -5.529 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -20.268 -6.100 -6.420 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -15.752 -8.072 -5.904 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -19.922 -8.525 -6.805 1.00 0.00 H new ATOM 0 HH TYR B 94 -18.474 -10.222 -6.831 1.00 0.00 H new ATOM 3012 N GLU B 95 -19.934 -4.004 -8.360 1.00 0.00 N ATOM 3013 CA GLU B 95 -20.613 -4.586 -9.554 1.00 0.00 C ATOM 3014 C GLU B 95 -20.172 -3.844 -10.815 1.00 0.00 C ATOM 3015 O GLU B 95 -19.962 -4.436 -11.856 1.00 0.00 O ATOM 3016 CB GLU B 95 -22.112 -4.394 -9.303 1.00 0.00 C ATOM 3017 CG GLU B 95 -22.440 -2.901 -9.205 1.00 0.00 C ATOM 3018 CD GLU B 95 -23.889 -2.724 -8.751 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -24.771 -2.851 -9.585 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -24.095 -2.467 -7.576 1.00 0.00 O ATOM 0 H GLU B 95 -20.554 -3.562 -7.681 1.00 0.00 H new ATOM 0 HA GLU B 95 -20.366 -5.638 -9.700 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -22.685 -4.848 -10.111 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -22.403 -4.900 -8.382 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -21.765 -2.415 -8.500 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -22.290 -2.421 -10.172 1.00 0.00 H new ATOM 3027 N ASP B 96 -20.018 -2.551 -10.722 1.00 0.00 N ATOM 3028 CA ASP B 96 -19.576 -1.764 -11.909 1.00 0.00 C ATOM 3029 C ASP B 96 -18.251 -2.323 -12.429 1.00 0.00 C ATOM 3030 O ASP B 96 -17.941 -2.230 -13.601 1.00 0.00 O ATOM 3031 CB ASP B 96 -19.394 -0.333 -11.400 1.00 0.00 C ATOM 3032 CG ASP B 96 -19.897 0.654 -12.455 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -19.153 0.932 -13.381 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -21.018 1.114 -12.318 1.00 0.00 O ATOM 0 H ASP B 96 -20.179 -2.005 -9.875 1.00 0.00 H new ATOM 0 HA ASP B 96 -20.293 -1.808 -12.729 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -19.942 -0.195 -10.468 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -18.343 -0.144 -11.183 1.00 0.00 H new ATOM 3039 N PHE B 97 -17.471 -2.912 -11.561 1.00 0.00 N ATOM 3040 CA PHE B 97 -16.167 -3.490 -12.001 1.00 0.00 C ATOM 3041 C PHE B 97 -16.369 -4.944 -12.432 1.00 0.00 C ATOM 3042 O PHE B 97 -15.649 -5.461 -13.266 1.00 0.00 O ATOM 3043 CB PHE B 97 -15.242 -3.423 -10.777 1.00 0.00 C ATOM 3044 CG PHE B 97 -15.396 -2.097 -10.062 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -15.610 -0.919 -10.792 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -15.323 -2.049 -8.665 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -15.752 0.302 -10.124 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -15.466 -0.828 -7.998 1.00 0.00 C ATOM 3049 CZ PHE B 97 -15.681 0.347 -8.726 1.00 0.00 C ATOM 0 H PHE B 97 -17.680 -3.018 -10.568 1.00 0.00 H new ATOM 0 HA PHE B 97 -15.746 -2.947 -12.847 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -15.475 -4.240 -10.094 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -14.206 -3.555 -11.090 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -15.665 -0.954 -11.870 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -15.156 -2.955 -8.102 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -15.916 1.209 -10.686 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -15.410 -0.792 -6.920 1.00 0.00 H new ATOM 0 HZ PHE B 97 -15.792 1.289 -8.210 1.00 0.00 H new