USER MOD reduce.3.24.130724 H: found=0, std=0, add=1474, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1470 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 89 LYS NZ :NH3+ -153:sc= -0.0963 (180deg=-0.637) USER MOD Set 1.2: B 27 HIS : no HE2:sc= 0.478 K(o=0.38,f=-4.6) USER MOD Set 2.1: A 71 GLN : amide:sc= -0.213 X(o=0.8,f=0.7) USER MOD Set 2.2: A 75 THR OG1 : rot 36:sc= 1.01 USER MOD Set 3.1: A 17 HIS : no HE2:sc= 1.87 K(o=3.1,f=-8.7!) USER MOD Set 3.2: A 27 HIS : no HE2:sc= 1.21 K(o=3.1,f=-9!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 136:sc= 0.0441 (180deg=-0.212) USER MOD Single : A 3 SER OG : rot -82:sc= 1.79 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00478) USER MOD Single : A 19 TYR OH : rot 180:sc= -0.0128 USER MOD Single : A 20 SER OG : rot 77:sc= 1.12 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 167:sc= 0.667 (180deg=0.45) USER MOD Single : A 28 THR OG1 : rot 169:sc= 1.05 USER MOD Single : A 30 SER OG : rot -71:sc= 0.742 USER MOD Single : A 31 LYS NZ :NH3+ -165:sc= 0.887 (180deg=0.705) USER MOD Single : A 32 LYS NZ :NH3+ 146:sc= 0.366 (180deg=-0.0442) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0.0069 X(o=0.0069,f=-0.002) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 7:sc= 1.11 USER MOD Single : A 46 SER OG : rot -74:sc= 0.659 USER MOD Single : A 47 LYS NZ :NH3+ -151:sc= 1.07 (180deg=0.398) USER MOD Single : A 49 GLN : amide:sc= 0.655 K(o=0.65,f=-0.74) USER MOD Single : A 55 LYS NZ :NH3+ -120:sc= -0.8 (180deg=-1.21) USER MOD Single : A 57 MET CE :methyl 173:sc= 0 (180deg=-0.061) USER MOD Single : A 63 ASN : amide:sc= 0.0208 X(o=0.021,f=-0.046) USER MOD Single : A 64 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0581) USER MOD Single : A 66 GLN : amide:sc= -1.93! C(o=-1.9!,f=-6.7!) USER MOD Single : A 69 ASN : amide:sc= 0.802 K(o=0.8,f=-3.9!) USER MOD Single : A 73 TYR OH : rot 130:sc=-0.000763 USER MOD Single : A 82 MET CE :methyl 174:sc= 0 (180deg=-0.0496) USER MOD Single : A 84 TYR OH : rot 175:sc= 1.19 USER MOD Single : A 85 ASN : amide:sc= -0.265 K(o=-0.26,f=-1.5) USER MOD Single : B 1 MET CE :methyl -179:sc= 0 (180deg=-0.00137) USER MOD Single : B 1 MET N :NH3+ -147:sc= 0.00777 (180deg=-0.162) USER MOD Single : B 3 SER OG : rot 180:sc= 0.0915 USER MOD Single : B 7 GLN : amide:sc= -0.749 K(o=-0.75,f=-2.7!) USER MOD Single : B 17 HIS : no HE2:sc= 0.62 K(o=0.62,f=-3.6!) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 59:sc= 1.01 USER MOD Single : B 22 LYS NZ :NH3+ -178:sc= 0.807 (180deg=0.8) USER MOD Single : B 26 LYS NZ :NH3+ -167:sc= 0.332 (180deg=0.209) USER MOD Single : B 28 THR OG1 : rot -102:sc= 1.21 USER MOD Single : B 30 SER OG : rot -77:sc= 1.24 USER MOD Single : B 31 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0327) USER MOD Single : B 32 LYS NZ :NH3+ -166:sc= 0.818 (180deg=0.688) USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 GLN : amide:sc= 0.649 K(o=0.65,f=0) USER MOD Single : B 40 LYS NZ :NH3+ -170:sc= 0.362 (180deg=0.338) USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.481 USER MOD Single : B 46 SER OG : rot -49:sc= 1.13 USER MOD Single : B 47 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.143) USER MOD Single : B 49 GLN : amide:sc= 1.37 K(o=1.4,f=-2.2!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 63 ASN : amide:sc= 0.224 X(o=0.22,f=-0.0084) USER MOD Single : B 64 LYS NZ :NH3+ 134:sc= 0.107 (180deg=-0.0214) USER MOD Single : B 66 GLN : amide:sc= -1.77! C(o=-1.8!,f=-2.1!) USER MOD Single : B 69 ASN : amide:sc= 0.835 K(o=0.84,f=-4.5!) USER MOD Single : B 71 GLN : amide:sc= 0.795 K(o=0.8,f=-0.086) USER MOD Single : B 73 TYR OH : rot 180:sc= 0 USER MOD Single : B 75 THR OG1 : rot 73:sc= 1.14 USER MOD Single : B 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 TYR OH : rot 30:sc= 0 USER MOD Single : B 85 ASN : amide:sc= -0.207 X(o=-0.21,f=-0.1) USER MOD Single : B 89 LYS NZ :NH3+ -171:sc= 0.466 (180deg=0.346) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.885 6.773 13.357 1.00 0.00 N ATOM 2 CA MET A 1 -12.318 6.914 13.685 1.00 0.00 C ATOM 3 C MET A 1 -13.195 6.440 12.525 1.00 0.00 C ATOM 4 O MET A 1 -12.738 6.392 11.383 1.00 0.00 O ATOM 5 CB MET A 1 -12.654 8.361 14.078 1.00 0.00 C ATOM 6 CG MET A 1 -12.548 9.328 12.889 1.00 0.00 C ATOM 7 SD MET A 1 -12.523 11.084 13.322 1.00 0.00 S ATOM 8 CE MET A 1 -12.181 11.777 11.689 1.00 0.00 C ATOM 0 H1 MET A 1 -10.375 7.629 13.654 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.494 5.948 13.855 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.775 6.642 12.331 1.00 0.00 H new ATOM 0 HA MET A 1 -12.529 6.278 14.545 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.664 8.399 14.485 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.979 8.686 14.869 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.641 9.095 12.332 1.00 0.00 H new ATOM 0 HG3 MET A 1 -13.389 9.148 12.219 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.129 12.864 11.758 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.230 11.391 11.322 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.977 11.495 11.000 1.00 0.00 H new ATOM 20 N ALA A 2 -14.463 6.125 12.809 1.00 0.00 N ATOM 21 CA ALA A 2 -15.444 5.812 11.779 1.00 0.00 C ATOM 22 C ALA A 2 -15.463 6.943 10.749 1.00 0.00 C ATOM 23 O ALA A 2 -15.672 8.101 11.105 1.00 0.00 O ATOM 24 CB ALA A 2 -16.823 5.621 12.416 1.00 0.00 C ATOM 0 H ALA A 2 -14.832 6.081 13.759 1.00 0.00 H new ATOM 0 HA ALA A 2 -15.176 4.883 11.275 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -17.553 5.387 11.641 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -16.782 4.802 13.134 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -17.118 6.538 12.927 1.00 0.00 H new ATOM 30 N SER A 3 -15.181 6.627 9.485 1.00 0.00 N ATOM 31 CA SER A 3 -14.952 7.611 8.443 1.00 0.00 C ATOM 32 C SER A 3 -14.934 6.881 7.100 1.00 0.00 C ATOM 33 O SER A 3 -14.736 5.665 7.090 1.00 0.00 O ATOM 34 CB SER A 3 -13.595 8.290 8.687 1.00 0.00 C ATOM 35 OG SER A 3 -12.567 7.318 8.756 1.00 0.00 O ATOM 0 H SER A 3 -15.106 5.664 9.158 1.00 0.00 H new ATOM 0 HA SER A 3 -15.735 8.369 8.445 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.384 8.997 7.884 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.628 8.862 9.614 1.00 0.00 H new ATOM 0 HG SER A 3 -12.545 6.929 9.655 1.00 0.00 H new ATOM 41 N PRO A 4 -15.099 7.590 5.972 1.00 0.00 N ATOM 42 CA PRO A 4 -14.867 7.031 4.650 1.00 0.00 C ATOM 43 C PRO A 4 -13.486 6.371 4.561 1.00 0.00 C ATOM 44 O PRO A 4 -13.363 5.252 4.073 1.00 0.00 O ATOM 45 CB PRO A 4 -15.015 8.210 3.682 1.00 0.00 C ATOM 46 CG PRO A 4 -15.986 9.134 4.412 1.00 0.00 C ATOM 47 CD PRO A 4 -15.567 8.964 5.871 1.00 0.00 C ATOM 0 HA PRO A 4 -15.574 6.237 4.409 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -14.059 8.698 3.492 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -15.409 7.892 2.716 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -15.890 10.168 4.080 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -17.024 8.842 4.251 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -14.781 9.669 6.140 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -16.404 9.146 6.545 1.00 0.00 H new ATOM 55 N LEU A 5 -12.449 7.053 5.066 1.00 0.00 N ATOM 56 CA LEU A 5 -11.098 6.511 5.159 1.00 0.00 C ATOM 57 C LEU A 5 -11.123 5.149 5.854 1.00 0.00 C ATOM 58 O LEU A 5 -10.699 4.146 5.276 1.00 0.00 O ATOM 59 CB LEU A 5 -10.190 7.513 5.892 1.00 0.00 C ATOM 60 CG LEU A 5 -8.769 6.992 6.182 1.00 0.00 C ATOM 61 CD1 LEU A 5 -7.984 6.684 4.901 1.00 0.00 C ATOM 62 CD2 LEU A 5 -8.003 8.040 6.998 1.00 0.00 C ATOM 0 H LEU A 5 -12.531 8.005 5.423 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.692 6.358 4.159 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -10.116 8.422 5.294 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -10.662 7.789 6.835 1.00 0.00 H new ATOM 0 HG LEU A 5 -8.870 6.061 6.739 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -6.990 6.320 5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.510 5.922 4.326 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -7.893 7.591 4.303 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -6.997 7.675 7.205 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -7.943 8.969 6.431 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.524 8.221 7.938 1.00 0.00 H new ATOM 74 N ASP A 6 -11.625 5.113 7.093 1.00 0.00 N ATOM 75 CA ASP A 6 -11.664 3.888 7.877 1.00 0.00 C ATOM 76 C ASP A 6 -12.435 2.787 7.155 1.00 0.00 C ATOM 77 O ASP A 6 -11.957 1.659 7.055 1.00 0.00 O ATOM 78 CB ASP A 6 -12.235 4.170 9.266 1.00 0.00 C ATOM 79 CG ASP A 6 -12.432 2.891 10.070 1.00 0.00 C ATOM 80 OD1 ASP A 6 -11.404 2.314 10.482 1.00 0.00 O ATOM 81 OD2 ASP A 6 -13.611 2.517 10.253 1.00 0.00 O ATOM 0 H ASP A 6 -12.011 5.927 7.571 1.00 0.00 H new ATOM 0 HA ASP A 6 -10.644 3.523 8.000 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.564 4.838 9.806 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -13.189 4.688 9.168 1.00 0.00 H new ATOM 86 N GLN A 7 -13.613 3.118 6.627 1.00 0.00 N ATOM 87 CA GLN A 7 -14.406 2.195 5.834 1.00 0.00 C ATOM 88 C GLN A 7 -13.573 1.643 4.672 1.00 0.00 C ATOM 89 O GLN A 7 -13.592 0.441 4.415 1.00 0.00 O ATOM 90 CB GLN A 7 -15.671 2.912 5.344 1.00 0.00 C ATOM 91 CG GLN A 7 -16.629 1.962 4.616 1.00 0.00 C ATOM 92 CD GLN A 7 -17.860 2.699 4.099 1.00 0.00 C ATOM 93 OE1 GLN A 7 -18.067 2.810 2.896 1.00 0.00 O ATOM 94 NE2 GLN A 7 -18.689 3.214 5.002 1.00 0.00 N ATOM 0 H GLN A 7 -14.040 4.037 6.741 1.00 0.00 H new ATOM 0 HA GLN A 7 -14.710 1.344 6.443 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -16.184 3.362 6.194 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -15.390 3.725 4.675 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -16.110 1.488 3.782 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -16.938 1.166 5.293 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -18.491 3.106 5.997 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -19.523 3.717 4.700 1.00 0.00 H new ATOM 103 N ALA A 8 -12.845 2.515 3.970 1.00 0.00 N ATOM 104 CA ALA A 8 -12.114 2.138 2.770 1.00 0.00 C ATOM 105 C ALA A 8 -10.994 1.163 3.125 1.00 0.00 C ATOM 106 O ALA A 8 -10.936 0.053 2.591 1.00 0.00 O ATOM 107 CB ALA A 8 -11.578 3.383 2.056 1.00 0.00 C ATOM 0 H ALA A 8 -12.749 3.499 4.221 1.00 0.00 H new ATOM 0 HA ALA A 8 -12.791 1.633 2.081 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -11.034 3.083 1.161 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -12.410 4.028 1.775 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -10.908 3.925 2.723 1.00 0.00 H new ATOM 113 N ILE A 9 -10.106 1.567 4.039 1.00 0.00 N ATOM 114 CA ILE A 9 -9.007 0.698 4.443 1.00 0.00 C ATOM 115 C ILE A 9 -9.562 -0.589 5.059 1.00 0.00 C ATOM 116 O ILE A 9 -9.067 -1.669 4.754 1.00 0.00 O ATOM 117 CB ILE A 9 -7.978 1.420 5.334 1.00 0.00 C ATOM 118 CG1 ILE A 9 -8.539 1.771 6.720 1.00 0.00 C ATOM 119 CG2 ILE A 9 -7.445 2.662 4.603 1.00 0.00 C ATOM 120 CD1 ILE A 9 -7.543 2.528 7.601 1.00 0.00 C ATOM 0 H ILE A 9 -10.128 2.475 4.504 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.441 0.415 3.555 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.150 0.735 5.517 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.438 2.375 6.598 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -8.838 0.853 7.227 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -6.717 3.172 5.235 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -6.968 2.359 3.671 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.272 3.338 4.384 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -8.002 2.745 8.565 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -6.653 1.917 7.752 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.263 3.462 7.114 1.00 0.00 H new ATOM 132 N GLY A 10 -10.614 -0.481 5.878 1.00 0.00 N ATOM 133 CA GLY A 10 -11.299 -1.611 6.483 1.00 0.00 C ATOM 134 C GLY A 10 -11.726 -2.624 5.425 1.00 0.00 C ATOM 135 O GLY A 10 -11.334 -3.789 5.487 1.00 0.00 O ATOM 0 H GLY A 10 -11.016 0.419 6.140 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.643 -2.092 7.208 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.174 -1.260 7.029 1.00 0.00 H new ATOM 139 N LEU A 11 -12.512 -2.179 4.438 1.00 0.00 N ATOM 140 CA LEU A 11 -12.917 -3.017 3.317 1.00 0.00 C ATOM 141 C LEU A 11 -11.694 -3.644 2.660 1.00 0.00 C ATOM 142 O LEU A 11 -11.679 -4.846 2.416 1.00 0.00 O ATOM 143 CB LEU A 11 -13.710 -2.206 2.281 1.00 0.00 C ATOM 144 CG LEU A 11 -15.159 -1.946 2.716 1.00 0.00 C ATOM 145 CD1 LEU A 11 -15.754 -0.804 1.891 1.00 0.00 C ATOM 146 CD2 LEU A 11 -16.038 -3.192 2.544 1.00 0.00 C ATOM 0 H LEU A 11 -12.882 -1.229 4.399 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.562 -3.807 3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.209 -1.253 2.111 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -13.710 -2.740 1.331 1.00 0.00 H new ATOM 0 HG LEU A 11 -15.139 -1.681 3.773 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -16.782 -0.625 2.205 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -15.165 0.101 2.044 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -15.739 -1.072 0.835 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -17.056 -2.966 2.863 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -16.044 -3.491 1.496 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -15.640 -4.005 3.151 1.00 0.00 H new ATOM 158 N LEU A 12 -10.674 -2.839 2.363 1.00 0.00 N ATOM 159 CA LEU A 12 -9.501 -3.315 1.649 1.00 0.00 C ATOM 160 C LEU A 12 -8.792 -4.438 2.420 1.00 0.00 C ATOM 161 O LEU A 12 -8.623 -5.544 1.901 1.00 0.00 O ATOM 162 CB LEU A 12 -8.601 -2.115 1.323 1.00 0.00 C ATOM 163 CG LEU A 12 -7.598 -2.415 0.199 1.00 0.00 C ATOM 164 CD1 LEU A 12 -7.348 -1.139 -0.613 1.00 0.00 C ATOM 165 CD2 LEU A 12 -6.276 -2.937 0.769 1.00 0.00 C ATOM 0 H LEU A 12 -10.642 -1.850 2.610 1.00 0.00 H new ATOM 0 HA LEU A 12 -9.793 -3.773 0.704 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.223 -1.268 1.033 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -8.057 -1.819 2.220 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.018 -3.187 -0.446 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -6.636 -1.349 -1.411 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.287 -0.793 -1.046 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -6.943 -0.366 0.040 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -5.583 -3.142 -0.047 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.844 -2.187 1.432 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.458 -3.854 1.329 1.00 0.00 H new ATOM 177 N ILE A 13 -8.380 -4.180 3.664 1.00 0.00 N ATOM 178 CA ILE A 13 -7.672 -5.183 4.451 1.00 0.00 C ATOM 179 C ILE A 13 -8.581 -6.381 4.741 1.00 0.00 C ATOM 180 O ILE A 13 -8.125 -7.521 4.694 1.00 0.00 O ATOM 181 CB ILE A 13 -7.014 -4.588 5.712 1.00 0.00 C ATOM 182 CG1 ILE A 13 -8.035 -4.182 6.790 1.00 0.00 C ATOM 183 CG2 ILE A 13 -6.085 -3.433 5.311 1.00 0.00 C ATOM 184 CD1 ILE A 13 -7.390 -3.467 7.981 1.00 0.00 C ATOM 0 H ILE A 13 -8.525 -3.291 4.142 1.00 0.00 H new ATOM 0 HA ILE A 13 -6.839 -5.555 3.854 1.00 0.00 H new ATOM 0 HB ILE A 13 -6.414 -5.368 6.181 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -8.787 -3.530 6.345 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -8.555 -5.072 7.145 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -5.620 -3.013 6.203 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -5.311 -3.805 4.640 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -6.663 -2.660 4.805 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -8.159 -3.205 8.708 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.658 -4.126 8.448 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.893 -2.560 7.636 1.00 0.00 H new ATOM 196 N GLY A 14 -9.868 -6.140 5.006 1.00 0.00 N ATOM 197 CA GLY A 14 -10.838 -7.196 5.243 1.00 0.00 C ATOM 198 C GLY A 14 -10.945 -8.124 4.035 1.00 0.00 C ATOM 199 O GLY A 14 -10.706 -9.327 4.143 1.00 0.00 O ATOM 0 H GLY A 14 -10.261 -5.201 5.061 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -10.547 -7.771 6.122 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.813 -6.758 5.456 1.00 0.00 H new ATOM 203 N ILE A 15 -11.299 -7.574 2.870 1.00 0.00 N ATOM 204 CA ILE A 15 -11.467 -8.365 1.660 1.00 0.00 C ATOM 205 C ILE A 15 -10.148 -9.069 1.333 1.00 0.00 C ATOM 206 O ILE A 15 -10.159 -10.251 1.006 1.00 0.00 O ATOM 207 CB ILE A 15 -12.070 -7.521 0.514 1.00 0.00 C ATOM 208 CG1 ILE A 15 -13.031 -8.322 -0.385 1.00 0.00 C ATOM 209 CG2 ILE A 15 -11.035 -6.765 -0.329 1.00 0.00 C ATOM 210 CD1 ILE A 15 -12.420 -9.528 -1.107 1.00 0.00 C ATOM 0 H ILE A 15 -11.474 -6.577 2.745 1.00 0.00 H new ATOM 0 HA ILE A 15 -12.203 -9.154 1.815 1.00 0.00 H new ATOM 0 HB ILE A 15 -12.654 -6.761 1.033 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -13.863 -8.672 0.226 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -13.446 -7.647 -1.133 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -11.544 -6.199 -1.109 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -10.476 -6.081 0.309 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -10.348 -7.477 -0.787 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -13.185 -10.017 -1.710 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.608 -9.193 -1.752 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.032 -10.233 -0.372 1.00 0.00 H new ATOM 222 N PHE A 16 -9.004 -8.391 1.497 1.00 0.00 N ATOM 223 CA PHE A 16 -7.707 -9.050 1.391 1.00 0.00 C ATOM 224 C PHE A 16 -7.618 -10.268 2.314 1.00 0.00 C ATOM 225 O PHE A 16 -7.273 -11.358 1.862 1.00 0.00 O ATOM 226 CB PHE A 16 -6.563 -8.066 1.666 1.00 0.00 C ATOM 227 CG PHE A 16 -5.219 -8.746 1.857 1.00 0.00 C ATOM 228 CD1 PHE A 16 -4.568 -9.323 0.752 1.00 0.00 C ATOM 229 CD2 PHE A 16 -4.745 -9.010 3.157 1.00 0.00 C ATOM 230 CE1 PHE A 16 -3.406 -10.091 0.938 1.00 0.00 C ATOM 231 CE2 PHE A 16 -3.615 -9.826 3.347 1.00 0.00 C ATOM 232 CZ PHE A 16 -2.927 -10.341 2.235 1.00 0.00 C ATOM 0 H PHE A 16 -8.956 -7.393 1.702 1.00 0.00 H new ATOM 0 HA PHE A 16 -7.605 -9.407 0.366 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -6.492 -7.362 0.837 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -6.799 -7.486 2.558 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.962 -9.175 -0.243 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -5.251 -8.584 4.011 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.880 -10.490 0.083 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -3.277 -10.056 4.346 1.00 0.00 H new ATOM 0 HZ PHE A 16 -2.032 -10.928 2.377 1.00 0.00 H new ATOM 242 N HIS A 17 -7.915 -10.096 3.603 1.00 0.00 N ATOM 243 CA HIS A 17 -7.828 -11.167 4.586 1.00 0.00 C ATOM 244 C HIS A 17 -8.743 -12.335 4.211 1.00 0.00 C ATOM 245 O HIS A 17 -8.407 -13.486 4.485 1.00 0.00 O ATOM 246 CB HIS A 17 -8.153 -10.615 5.979 1.00 0.00 C ATOM 247 CG HIS A 17 -7.825 -11.540 7.127 1.00 0.00 C ATOM 248 ND1 HIS A 17 -7.471 -12.872 7.055 1.00 0.00 N ATOM 249 CD2 HIS A 17 -7.751 -11.164 8.441 1.00 0.00 C ATOM 250 CE1 HIS A 17 -7.198 -13.281 8.307 1.00 0.00 C ATOM 251 NE2 HIS A 17 -7.329 -12.271 9.183 1.00 0.00 N ATOM 0 H HIS A 17 -8.223 -9.205 3.992 1.00 0.00 H new ATOM 0 HA HIS A 17 -6.810 -11.556 4.599 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -7.609 -9.681 6.119 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -9.215 -10.374 6.019 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -7.425 -13.441 6.209 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -7.979 -10.185 8.835 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -6.911 -14.288 8.573 1.00 0.00 H new ATOM 259 N LYS A 18 -9.890 -12.062 3.582 1.00 0.00 N ATOM 260 CA LYS A 18 -10.741 -13.132 3.080 1.00 0.00 C ATOM 261 C LYS A 18 -10.075 -13.791 1.869 1.00 0.00 C ATOM 262 O LYS A 18 -9.762 -14.979 1.903 1.00 0.00 O ATOM 263 CB LYS A 18 -12.150 -12.616 2.754 1.00 0.00 C ATOM 264 CG LYS A 18 -12.893 -12.034 3.968 1.00 0.00 C ATOM 265 CD LYS A 18 -13.046 -12.988 5.163 1.00 0.00 C ATOM 266 CE LYS A 18 -13.751 -14.298 4.790 1.00 0.00 C ATOM 267 NZ LYS A 18 -14.051 -15.106 5.986 1.00 0.00 N ATOM 0 H LYS A 18 -10.243 -11.120 3.412 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.861 -13.887 3.857 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.077 -11.849 1.983 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.739 -13.433 2.337 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.365 -11.141 4.302 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -13.885 -11.717 3.648 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.061 -13.214 5.570 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.610 -12.489 5.951 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -14.676 -14.077 4.257 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -13.121 -14.871 4.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -14.497 -16.000 5.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -13.169 -15.308 6.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -14.699 -14.580 6.606 1.00 0.00 H new ATOM 281 N TYR A 19 -9.852 -13.016 0.803 1.00 0.00 N ATOM 282 CA TYR A 19 -9.237 -13.446 -0.449 1.00 0.00 C ATOM 283 C TYR A 19 -8.017 -14.335 -0.201 1.00 0.00 C ATOM 284 O TYR A 19 -7.898 -15.395 -0.810 1.00 0.00 O ATOM 285 CB TYR A 19 -8.870 -12.211 -1.285 1.00 0.00 C ATOM 286 CG TYR A 19 -7.894 -12.468 -2.419 1.00 0.00 C ATOM 287 CD1 TYR A 19 -8.135 -13.496 -3.353 1.00 0.00 C ATOM 288 CD2 TYR A 19 -6.688 -11.743 -2.475 1.00 0.00 C ATOM 289 CE1 TYR A 19 -7.162 -13.814 -4.316 1.00 0.00 C ATOM 290 CE2 TYR A 19 -5.722 -12.056 -3.444 1.00 0.00 C ATOM 291 CZ TYR A 19 -5.946 -13.111 -4.343 1.00 0.00 C ATOM 292 OH TYR A 19 -4.976 -13.462 -5.230 1.00 0.00 O ATOM 0 H TYR A 19 -10.108 -12.029 0.793 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.955 -14.050 -1.004 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -9.784 -11.789 -1.702 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -8.444 -11.457 -0.623 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -9.068 -14.040 -3.329 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.506 -10.945 -1.771 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.349 -14.598 -5.035 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -4.807 -11.485 -3.498 1.00 0.00 H new ATOM 0 HH TYR A 19 -4.200 -12.874 -5.116 1.00 0.00 H new ATOM 302 N SER A 20 -7.141 -13.901 0.708 1.00 0.00 N ATOM 303 CA SER A 20 -5.953 -14.609 1.167 1.00 0.00 C ATOM 304 C SER A 20 -6.164 -16.117 1.335 1.00 0.00 C ATOM 305 O SER A 20 -5.270 -16.914 1.023 1.00 0.00 O ATOM 306 CB SER A 20 -5.501 -13.990 2.490 1.00 0.00 C ATOM 307 OG SER A 20 -4.917 -12.727 2.254 1.00 0.00 O ATOM 0 H SER A 20 -7.251 -12.996 1.166 1.00 0.00 H new ATOM 0 HA SER A 20 -5.188 -14.500 0.399 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.352 -13.887 3.163 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.783 -14.646 2.982 1.00 0.00 H new ATOM 0 HG SER A 20 -5.622 -12.068 2.083 1.00 0.00 H new ATOM 313 N GLY A 21 -7.347 -16.490 1.830 1.00 0.00 N ATOM 314 CA GLY A 21 -7.792 -17.858 1.974 1.00 0.00 C ATOM 315 C GLY A 21 -9.311 -17.905 1.844 1.00 0.00 C ATOM 316 O GLY A 21 -10.001 -18.053 2.845 1.00 0.00 O ATOM 0 H GLY A 21 -8.040 -15.813 2.151 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -7.330 -18.486 1.212 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -7.485 -18.253 2.942 1.00 0.00 H new ATOM 320 N LYS A 22 -9.860 -17.830 0.628 1.00 0.00 N ATOM 321 CA LYS A 22 -11.288 -18.084 0.418 1.00 0.00 C ATOM 322 C LYS A 22 -11.678 -19.435 1.039 1.00 0.00 C ATOM 323 O LYS A 22 -12.735 -19.566 1.650 1.00 0.00 O ATOM 324 CB LYS A 22 -11.649 -18.059 -1.077 1.00 0.00 C ATOM 325 CG LYS A 22 -11.266 -16.769 -1.823 1.00 0.00 C ATOM 326 CD LYS A 22 -12.371 -15.703 -1.860 1.00 0.00 C ATOM 327 CE LYS A 22 -12.804 -15.229 -0.469 1.00 0.00 C ATOM 328 NZ LYS A 22 -13.598 -13.991 -0.547 1.00 0.00 N ATOM 0 H LYS A 22 -9.342 -17.597 -0.219 1.00 0.00 H new ATOM 0 HA LYS A 22 -11.849 -17.288 0.908 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -11.160 -18.901 -1.566 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.724 -18.212 -1.177 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -10.381 -16.341 -1.352 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.990 -17.024 -2.846 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -12.020 -14.846 -2.435 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -13.237 -16.106 -2.385 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -13.390 -16.009 0.017 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.923 -15.060 0.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.876 -13.696 0.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.029 -13.241 -0.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -14.451 -14.161 -1.118 1.00 0.00 H new ATOM 342 N GLU A 23 -10.783 -20.421 0.908 1.00 0.00 N ATOM 343 CA GLU A 23 -10.841 -21.718 1.576 1.00 0.00 C ATOM 344 C GLU A 23 -11.124 -21.606 3.087 1.00 0.00 C ATOM 345 O GLU A 23 -11.824 -22.438 3.657 1.00 0.00 O ATOM 346 CB GLU A 23 -9.490 -22.404 1.326 1.00 0.00 C ATOM 347 CG GLU A 23 -9.421 -23.846 1.842 1.00 0.00 C ATOM 348 CD GLU A 23 -8.052 -24.452 1.549 1.00 0.00 C ATOM 349 OE1 GLU A 23 -7.073 -23.947 2.142 1.00 0.00 O ATOM 350 OE2 GLU A 23 -8.005 -25.388 0.722 1.00 0.00 O ATOM 0 H GLU A 23 -9.965 -20.329 0.306 1.00 0.00 H new ATOM 0 HA GLU A 23 -11.670 -22.298 1.170 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -9.285 -22.401 0.255 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -8.703 -21.820 1.803 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -9.611 -23.864 2.915 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.199 -24.445 1.370 1.00 0.00 H new ATOM 357 N GLY A 24 -10.521 -20.610 3.737 1.00 0.00 N ATOM 358 CA GLY A 24 -10.514 -20.377 5.172 1.00 0.00 C ATOM 359 C GLY A 24 -9.571 -19.194 5.366 1.00 0.00 C ATOM 360 O GLY A 24 -8.415 -19.291 4.963 1.00 0.00 O ATOM 0 H GLY A 24 -9.989 -19.899 3.235 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.514 -20.151 5.542 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.164 -21.255 5.714 1.00 0.00 H new ATOM 364 N ASP A 25 -10.069 -18.068 5.889 1.00 0.00 N ATOM 365 CA ASP A 25 -9.382 -16.777 5.874 1.00 0.00 C ATOM 366 C ASP A 25 -8.001 -16.762 6.538 1.00 0.00 C ATOM 367 O ASP A 25 -7.854 -16.373 7.693 1.00 0.00 O ATOM 368 CB ASP A 25 -10.301 -15.663 6.399 1.00 0.00 C ATOM 369 CG ASP A 25 -10.779 -15.877 7.831 1.00 0.00 C ATOM 370 OD1 ASP A 25 -11.531 -16.857 8.029 1.00 0.00 O ATOM 371 OD2 ASP A 25 -10.430 -15.036 8.687 1.00 0.00 O ATOM 0 H ASP A 25 -10.981 -18.031 6.344 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.159 -16.579 4.825 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -9.771 -14.712 6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -11.169 -15.584 5.745 1.00 0.00 H new ATOM 376 N LYS A 26 -6.976 -17.136 5.773 1.00 0.00 N ATOM 377 CA LYS A 26 -5.576 -16.966 6.129 1.00 0.00 C ATOM 378 C LYS A 26 -5.262 -15.467 6.190 1.00 0.00 C ATOM 379 O LYS A 26 -5.940 -14.660 5.556 1.00 0.00 O ATOM 380 CB LYS A 26 -4.695 -17.653 5.076 1.00 0.00 C ATOM 381 CG LYS A 26 -4.942 -19.166 5.009 1.00 0.00 C ATOM 382 CD LYS A 26 -4.236 -19.763 3.787 1.00 0.00 C ATOM 383 CE LYS A 26 -4.636 -21.227 3.554 1.00 0.00 C ATOM 384 NZ LYS A 26 -6.046 -21.354 3.140 1.00 0.00 N ATOM 0 H LYS A 26 -7.105 -17.578 4.863 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.376 -17.417 7.101 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.889 -17.212 4.099 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.646 -17.468 5.306 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.576 -19.642 5.919 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.012 -19.365 4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.481 -19.175 2.903 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -3.157 -19.699 3.924 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -3.993 -21.661 2.789 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.474 -21.797 4.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.218 -22.316 2.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.665 -21.172 3.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.251 -20.664 2.389 1.00 0.00 H new ATOM 398 N HIS A 27 -4.237 -15.082 6.954 1.00 0.00 N ATOM 399 CA HIS A 27 -3.848 -13.689 7.132 1.00 0.00 C ATOM 400 C HIS A 27 -2.756 -13.272 6.134 1.00 0.00 C ATOM 401 O HIS A 27 -2.421 -12.094 6.026 1.00 0.00 O ATOM 402 CB HIS A 27 -3.422 -13.513 8.593 1.00 0.00 C ATOM 403 CG HIS A 27 -3.498 -12.087 9.056 1.00 0.00 C ATOM 404 ND1 HIS A 27 -4.624 -11.441 9.510 1.00 0.00 N ATOM 405 CD2 HIS A 27 -2.476 -11.183 9.035 1.00 0.00 C ATOM 406 CE1 HIS A 27 -4.281 -10.168 9.763 1.00 0.00 C ATOM 407 NE2 HIS A 27 -2.982 -9.962 9.491 1.00 0.00 N ATOM 0 H HIS A 27 -3.651 -15.738 7.470 1.00 0.00 H new ATOM 0 HA HIS A 27 -4.687 -13.026 6.920 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -4.057 -14.130 9.228 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -2.401 -13.875 8.715 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -5.549 -11.853 9.632 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -1.460 -11.376 8.723 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -4.957 -9.413 10.135 1.00 0.00 H new ATOM 415 N THR A 28 -2.203 -14.240 5.402 1.00 0.00 N ATOM 416 CA THR A 28 -1.235 -14.093 4.338 1.00 0.00 C ATOM 417 C THR A 28 -1.842 -14.833 3.144 1.00 0.00 C ATOM 418 O THR A 28 -2.705 -15.694 3.322 1.00 0.00 O ATOM 419 CB THR A 28 0.093 -14.701 4.804 1.00 0.00 C ATOM 420 OG1 THR A 28 -0.160 -15.956 5.404 1.00 0.00 O ATOM 421 CG2 THR A 28 0.769 -13.799 5.842 1.00 0.00 C ATOM 0 H THR A 28 -2.445 -15.219 5.557 1.00 0.00 H new ATOM 0 HA THR A 28 -1.024 -13.059 4.065 1.00 0.00 H new ATOM 0 HB THR A 28 0.748 -14.807 3.939 1.00 0.00 H new ATOM 0 HG1 THR A 28 0.687 -16.429 5.543 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.709 -14.250 6.159 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.965 -12.821 5.402 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.114 -13.683 6.705 1.00 0.00 H new ATOM 429 N LEU A 29 -1.399 -14.515 1.932 1.00 0.00 N ATOM 430 CA LEU A 29 -2.073 -14.936 0.707 1.00 0.00 C ATOM 431 C LEU A 29 -1.499 -16.261 0.227 1.00 0.00 C ATOM 432 O LEU A 29 -0.291 -16.373 0.061 1.00 0.00 O ATOM 433 CB LEU A 29 -1.902 -13.825 -0.341 1.00 0.00 C ATOM 434 CG LEU A 29 -2.255 -14.218 -1.787 1.00 0.00 C ATOM 435 CD1 LEU A 29 -3.739 -14.553 -1.941 1.00 0.00 C ATOM 436 CD2 LEU A 29 -1.906 -13.055 -2.719 1.00 0.00 C ATOM 0 H LEU A 29 -0.561 -13.957 1.770 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.137 -15.093 0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.523 -12.978 -0.051 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.867 -13.484 -0.318 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.681 -15.108 -2.044 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -3.945 -14.825 -2.976 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -3.993 -15.389 -1.289 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -4.338 -13.685 -1.668 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.153 -13.325 -3.746 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.476 -12.172 -2.429 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.840 -12.838 -2.647 1.00 0.00 H new ATOM 448 N SER A 30 -2.352 -17.265 0.005 1.00 0.00 N ATOM 449 CA SER A 30 -1.916 -18.608 -0.358 1.00 0.00 C ATOM 450 C SER A 30 -1.897 -18.809 -1.880 1.00 0.00 C ATOM 451 O SER A 30 -2.732 -18.249 -2.598 1.00 0.00 O ATOM 452 CB SER A 30 -2.822 -19.624 0.345 1.00 0.00 C ATOM 453 OG SER A 30 -4.195 -19.355 0.114 1.00 0.00 O ATOM 0 H SER A 30 -3.365 -17.165 0.073 1.00 0.00 H new ATOM 0 HA SER A 30 -0.888 -18.757 -0.026 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.584 -20.628 -0.007 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.624 -19.607 1.417 1.00 0.00 H new ATOM 0 HG SER A 30 -4.458 -18.549 0.606 1.00 0.00 H new ATOM 459 N LYS A 31 -0.955 -19.632 -2.372 1.00 0.00 N ATOM 460 CA LYS A 31 -0.815 -19.928 -3.799 1.00 0.00 C ATOM 461 C LYS A 31 -2.152 -20.345 -4.416 1.00 0.00 C ATOM 462 O LYS A 31 -2.471 -19.934 -5.525 1.00 0.00 O ATOM 463 CB LYS A 31 0.247 -21.014 -4.048 1.00 0.00 C ATOM 464 CG LYS A 31 1.116 -20.745 -5.288 1.00 0.00 C ATOM 465 CD LYS A 31 0.310 -20.726 -6.594 1.00 0.00 C ATOM 466 CE LYS A 31 1.215 -20.756 -7.831 1.00 0.00 C ATOM 467 NZ LYS A 31 2.069 -19.558 -7.916 1.00 0.00 N ATOM 0 H LYS A 31 -0.270 -20.109 -1.786 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.484 -19.010 -4.284 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.891 -21.090 -3.172 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.249 -21.978 -4.163 1.00 0.00 H new ATOM 0 HG2 LYS A 31 1.624 -19.788 -5.168 1.00 0.00 H new ATOM 0 HG3 LYS A 31 1.889 -21.511 -5.356 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.363 -21.583 -6.617 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.312 -19.832 -6.622 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.842 -21.647 -7.801 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.601 -20.829 -8.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.472 -19.486 -8.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.500 -18.711 -7.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.838 -19.630 -7.220 1.00 0.00 H new ATOM 481 N LYS A 32 -2.939 -21.157 -3.703 1.00 0.00 N ATOM 482 CA LYS A 32 -4.276 -21.551 -4.132 1.00 0.00 C ATOM 483 C LYS A 32 -5.070 -20.330 -4.605 1.00 0.00 C ATOM 484 O LYS A 32 -5.551 -20.280 -5.737 1.00 0.00 O ATOM 485 CB LYS A 32 -4.983 -22.270 -2.970 1.00 0.00 C ATOM 486 CG LYS A 32 -6.456 -22.575 -3.282 1.00 0.00 C ATOM 487 CD LYS A 32 -7.077 -23.448 -2.184 1.00 0.00 C ATOM 488 CE LYS A 32 -8.600 -23.548 -2.340 1.00 0.00 C ATOM 489 NZ LYS A 32 -8.995 -24.036 -3.673 1.00 0.00 N ATOM 0 H LYS A 32 -2.661 -21.559 -2.808 1.00 0.00 H new ATOM 0 HA LYS A 32 -4.206 -22.236 -4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -4.460 -23.201 -2.750 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.924 -21.652 -2.074 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.014 -21.643 -3.371 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.531 -23.084 -4.243 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.640 -24.446 -2.220 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -6.837 -23.030 -1.206 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -8.998 -24.218 -1.578 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -9.046 -22.568 -2.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.856 -24.614 -3.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.181 -23.226 -4.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.228 -24.613 -4.073 1.00 0.00 H new ATOM 503 N GLU A 33 -5.212 -19.339 -3.728 1.00 0.00 N ATOM 504 CA GLU A 33 -6.058 -18.193 -3.997 1.00 0.00 C ATOM 505 C GLU A 33 -5.418 -17.292 -5.046 1.00 0.00 C ATOM 506 O GLU A 33 -6.116 -16.770 -5.912 1.00 0.00 O ATOM 507 CB GLU A 33 -6.357 -17.450 -2.698 1.00 0.00 C ATOM 508 CG GLU A 33 -6.918 -18.376 -1.607 1.00 0.00 C ATOM 509 CD GLU A 33 -8.263 -19.025 -1.920 1.00 0.00 C ATOM 510 OE1 GLU A 33 -8.908 -18.591 -2.897 1.00 0.00 O ATOM 511 OE2 GLU A 33 -8.650 -19.916 -1.128 1.00 0.00 O ATOM 0 H GLU A 33 -4.746 -19.313 -2.821 1.00 0.00 H new ATOM 0 HA GLU A 33 -7.009 -18.532 -4.407 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -5.444 -16.977 -2.335 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -7.072 -16.652 -2.896 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.190 -19.165 -1.416 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -7.017 -17.803 -0.685 1.00 0.00 H new ATOM 518 N LEU A 34 -4.091 -17.148 -5.008 1.00 0.00 N ATOM 519 CA LEU A 34 -3.366 -16.478 -6.081 1.00 0.00 C ATOM 520 C LEU A 34 -3.715 -17.110 -7.435 1.00 0.00 C ATOM 521 O LEU A 34 -4.051 -16.413 -8.388 1.00 0.00 O ATOM 522 CB LEU A 34 -1.863 -16.531 -5.786 1.00 0.00 C ATOM 523 CG LEU A 34 -0.986 -15.928 -6.894 1.00 0.00 C ATOM 524 CD1 LEU A 34 -1.257 -14.433 -7.100 1.00 0.00 C ATOM 525 CD2 LEU A 34 0.481 -16.137 -6.513 1.00 0.00 C ATOM 0 H LEU A 34 -3.502 -17.486 -4.247 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.662 -15.430 -6.134 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.667 -16.001 -4.854 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.570 -17.569 -5.630 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.223 -16.429 -7.833 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.613 -14.052 -7.893 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.301 -14.287 -7.379 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.050 -13.895 -6.175 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.122 -15.716 -7.288 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.685 -15.641 -5.564 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.683 -17.204 -6.416 1.00 0.00 H new ATOM 537 N LYS A 35 -3.651 -18.438 -7.524 1.00 0.00 N ATOM 538 CA LYS A 35 -3.923 -19.176 -8.745 1.00 0.00 C ATOM 539 C LYS A 35 -5.391 -19.015 -9.154 1.00 0.00 C ATOM 540 O LYS A 35 -5.693 -18.869 -10.341 1.00 0.00 O ATOM 541 CB LYS A 35 -3.491 -20.639 -8.556 1.00 0.00 C ATOM 542 CG LYS A 35 -3.639 -21.525 -9.801 1.00 0.00 C ATOM 543 CD LYS A 35 -2.949 -20.943 -11.042 1.00 0.00 C ATOM 544 CE LYS A 35 -2.995 -21.950 -12.195 1.00 0.00 C ATOM 545 NZ LYS A 35 -2.391 -21.391 -13.418 1.00 0.00 N ATOM 0 H LYS A 35 -3.405 -19.035 -6.735 1.00 0.00 H new ATOM 0 HA LYS A 35 -3.341 -18.773 -9.574 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.449 -20.656 -8.238 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.078 -21.074 -7.747 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.222 -22.510 -9.590 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.698 -21.666 -10.015 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -3.440 -20.017 -11.339 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.914 -20.694 -10.808 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -2.466 -22.859 -11.908 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -4.029 -22.232 -12.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -2.437 -22.096 -14.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.912 -20.537 -13.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -1.398 -21.145 -13.233 1.00 0.00 H new ATOM 559 N GLU A 36 -6.323 -19.029 -8.195 1.00 0.00 N ATOM 560 CA GLU A 36 -7.712 -18.675 -8.475 1.00 0.00 C ATOM 561 C GLU A 36 -7.793 -17.280 -9.104 1.00 0.00 C ATOM 562 O GLU A 36 -8.384 -17.129 -10.173 1.00 0.00 O ATOM 563 CB GLU A 36 -8.579 -18.773 -7.214 1.00 0.00 C ATOM 564 CG GLU A 36 -8.797 -20.234 -6.797 1.00 0.00 C ATOM 565 CD GLU A 36 -9.619 -20.345 -5.516 1.00 0.00 C ATOM 566 OE1 GLU A 36 -10.619 -19.601 -5.413 1.00 0.00 O ATOM 567 OE2 GLU A 36 -9.241 -21.188 -4.672 1.00 0.00 O ATOM 0 H GLU A 36 -6.139 -19.281 -7.224 1.00 0.00 H new ATOM 0 HA GLU A 36 -8.108 -19.393 -9.193 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -8.102 -18.228 -6.399 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -9.543 -18.297 -7.395 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -9.303 -20.769 -7.600 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.831 -20.718 -6.651 1.00 0.00 H new ATOM 574 N LEU A 37 -7.196 -16.269 -8.461 1.00 0.00 N ATOM 575 CA LEU A 37 -7.200 -14.908 -8.985 1.00 0.00 C ATOM 576 C LEU A 37 -6.657 -14.897 -10.411 1.00 0.00 C ATOM 577 O LEU A 37 -7.296 -14.342 -11.294 1.00 0.00 O ATOM 578 CB LEU A 37 -6.419 -13.935 -8.092 1.00 0.00 C ATOM 579 CG LEU A 37 -6.355 -12.507 -8.672 1.00 0.00 C ATOM 580 CD1 LEU A 37 -7.747 -11.879 -8.827 1.00 0.00 C ATOM 581 CD2 LEU A 37 -5.509 -11.611 -7.762 1.00 0.00 C ATOM 0 H LEU A 37 -6.704 -16.374 -7.574 1.00 0.00 H new ATOM 0 HA LEU A 37 -8.233 -14.560 -8.993 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.884 -13.901 -7.107 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.405 -14.311 -7.953 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.904 -12.585 -9.661 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.649 -10.874 -9.239 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.349 -12.490 -9.500 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.233 -11.826 -7.853 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.469 -10.604 -8.178 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.956 -11.575 -6.769 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.499 -12.015 -7.691 1.00 0.00 H new ATOM 593 N ILE A 38 -5.491 -15.506 -10.640 1.00 0.00 N ATOM 594 CA ILE A 38 -4.877 -15.571 -11.960 1.00 0.00 C ATOM 595 C ILE A 38 -5.862 -16.168 -12.970 1.00 0.00 C ATOM 596 O ILE A 38 -6.133 -15.551 -13.996 1.00 0.00 O ATOM 597 CB ILE A 38 -3.536 -16.330 -11.888 1.00 0.00 C ATOM 598 CG1 ILE A 38 -2.500 -15.445 -11.166 1.00 0.00 C ATOM 599 CG2 ILE A 38 -3.022 -16.707 -13.288 1.00 0.00 C ATOM 600 CD1 ILE A 38 -1.212 -16.191 -10.804 1.00 0.00 C ATOM 0 H ILE A 38 -4.948 -15.968 -9.910 1.00 0.00 H new ATOM 0 HA ILE A 38 -4.643 -14.566 -12.312 1.00 0.00 H new ATOM 0 HB ILE A 38 -3.690 -17.257 -11.336 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -2.253 -14.595 -11.802 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -2.947 -15.043 -10.256 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -2.076 -17.240 -13.197 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -3.752 -17.346 -13.784 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.873 -15.802 -13.877 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -0.527 -15.510 -10.299 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -1.448 -17.025 -10.143 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -0.743 -16.570 -11.712 1.00 0.00 H new ATOM 612 N GLN A 39 -6.413 -17.354 -12.696 1.00 0.00 N ATOM 613 CA GLN A 39 -7.359 -17.993 -13.609 1.00 0.00 C ATOM 614 C GLN A 39 -8.538 -17.068 -13.922 1.00 0.00 C ATOM 615 O GLN A 39 -8.880 -16.855 -15.087 1.00 0.00 O ATOM 616 CB GLN A 39 -7.840 -19.318 -13.016 1.00 0.00 C ATOM 617 CG GLN A 39 -6.729 -20.375 -13.069 1.00 0.00 C ATOM 618 CD GLN A 39 -7.070 -21.560 -12.176 1.00 0.00 C ATOM 619 OE1 GLN A 39 -7.318 -22.663 -12.646 1.00 0.00 O ATOM 620 NE2 GLN A 39 -7.077 -21.327 -10.870 1.00 0.00 N ATOM 0 H GLN A 39 -6.219 -17.889 -11.849 1.00 0.00 H new ATOM 0 HA GLN A 39 -6.849 -18.197 -14.551 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.155 -19.166 -11.983 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.712 -19.672 -13.566 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.592 -20.715 -14.096 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.785 -19.933 -12.751 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -6.865 -20.394 -10.517 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -7.294 -22.081 -10.219 1.00 0.00 H new ATOM 629 N LYS A 40 -9.156 -16.502 -12.884 1.00 0.00 N ATOM 630 CA LYS A 40 -10.278 -15.592 -13.058 1.00 0.00 C ATOM 631 C LYS A 40 -9.869 -14.399 -13.922 1.00 0.00 C ATOM 632 O LYS A 40 -10.525 -14.084 -14.912 1.00 0.00 O ATOM 633 CB LYS A 40 -10.796 -15.160 -11.681 1.00 0.00 C ATOM 634 CG LYS A 40 -11.438 -16.342 -10.942 1.00 0.00 C ATOM 635 CD LYS A 40 -11.616 -16.019 -9.455 1.00 0.00 C ATOM 636 CE LYS A 40 -12.183 -17.237 -8.717 1.00 0.00 C ATOM 637 NZ LYS A 40 -12.267 -17.000 -7.265 1.00 0.00 N ATOM 0 H LYS A 40 -8.893 -16.662 -11.912 1.00 0.00 H new ATOM 0 HA LYS A 40 -11.089 -16.098 -13.582 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.974 -14.759 -11.088 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -11.526 -14.359 -11.797 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -12.406 -16.573 -11.387 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -10.815 -17.229 -11.054 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -10.659 -15.733 -9.020 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -12.287 -15.168 -9.337 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.174 -17.470 -9.106 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.553 -18.105 -8.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.655 -17.844 -6.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.317 -16.802 -6.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.888 -16.186 -7.081 1.00 0.00 H new ATOM 651 N GLU A 41 -8.761 -13.757 -13.563 1.00 0.00 N ATOM 652 CA GLU A 41 -8.183 -12.641 -14.286 1.00 0.00 C ATOM 653 C GLU A 41 -7.927 -13.015 -15.750 1.00 0.00 C ATOM 654 O GLU A 41 -8.179 -12.202 -16.634 1.00 0.00 O ATOM 655 CB GLU A 41 -6.921 -12.192 -13.537 1.00 0.00 C ATOM 656 CG GLU A 41 -6.310 -10.892 -14.073 1.00 0.00 C ATOM 657 CD GLU A 41 -5.176 -10.389 -13.180 1.00 0.00 C ATOM 658 OE1 GLU A 41 -4.698 -11.185 -12.342 1.00 0.00 O ATOM 659 OE2 GLU A 41 -4.801 -9.211 -13.355 1.00 0.00 O ATOM 0 H GLU A 41 -8.227 -14.012 -12.732 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.873 -11.798 -14.323 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -7.164 -12.060 -12.483 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -6.174 -12.984 -13.596 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.933 -11.057 -15.082 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -7.084 -10.128 -14.143 1.00 0.00 H new ATOM 666 N LEU A 42 -7.465 -14.240 -16.028 1.00 0.00 N ATOM 667 CA LEU A 42 -7.282 -14.688 -17.405 1.00 0.00 C ATOM 668 C LEU A 42 -8.635 -14.716 -18.112 1.00 0.00 C ATOM 669 O LEU A 42 -8.772 -14.149 -19.201 1.00 0.00 O ATOM 670 CB LEU A 42 -6.633 -16.084 -17.493 1.00 0.00 C ATOM 671 CG LEU A 42 -5.138 -16.140 -17.146 1.00 0.00 C ATOM 672 CD1 LEU A 42 -4.691 -17.598 -16.993 1.00 0.00 C ATOM 673 CD2 LEU A 42 -4.270 -15.488 -18.229 1.00 0.00 C ATOM 0 H LEU A 42 -7.214 -14.931 -15.321 1.00 0.00 H new ATOM 0 HA LEU A 42 -6.607 -13.983 -17.889 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.169 -16.758 -16.824 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -6.768 -16.465 -18.505 1.00 0.00 H new ATOM 0 HG LEU A 42 -5.008 -15.591 -16.213 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.630 -17.629 -16.747 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -5.263 -18.072 -16.195 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.862 -18.131 -17.928 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.221 -15.551 -17.941 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.418 -16.007 -19.176 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.553 -14.441 -18.341 1.00 0.00 H new ATOM 685 N THR A 43 -9.598 -15.441 -17.533 1.00 0.00 N ATOM 686 CA THR A 43 -10.882 -15.783 -18.142 1.00 0.00 C ATOM 687 C THR A 43 -10.666 -16.667 -19.384 1.00 0.00 C ATOM 688 O THR A 43 -10.965 -17.857 -19.348 1.00 0.00 O ATOM 689 CB THR A 43 -11.737 -14.526 -18.403 1.00 0.00 C ATOM 690 OG1 THR A 43 -11.903 -13.779 -17.216 1.00 0.00 O ATOM 691 CG2 THR A 43 -13.146 -14.889 -18.879 1.00 0.00 C ATOM 0 H THR A 43 -9.498 -15.819 -16.591 1.00 0.00 H new ATOM 0 HA THR A 43 -11.465 -16.379 -17.440 1.00 0.00 H new ATOM 0 HB THR A 43 -11.209 -13.955 -19.166 1.00 0.00 H new ATOM 0 HG1 THR A 43 -11.344 -14.162 -16.508 1.00 0.00 H new ATOM 0 HG21 THR A 43 -13.718 -13.977 -19.052 1.00 0.00 H new ATOM 0 HG22 THR A 43 -13.081 -15.458 -19.806 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.644 -15.490 -18.118 1.00 0.00 H new ATOM 699 N ILE A 44 -10.117 -16.098 -20.464 1.00 0.00 N ATOM 700 CA ILE A 44 -9.660 -16.810 -21.660 1.00 0.00 C ATOM 701 C ILE A 44 -8.268 -16.332 -22.102 1.00 0.00 C ATOM 702 O ILE A 44 -7.858 -16.577 -23.233 1.00 0.00 O ATOM 703 CB ILE A 44 -10.687 -16.707 -22.811 1.00 0.00 C ATOM 704 CG1 ILE A 44 -10.803 -15.322 -23.483 1.00 0.00 C ATOM 705 CG2 ILE A 44 -12.063 -17.243 -22.396 1.00 0.00 C ATOM 706 CD1 ILE A 44 -11.096 -14.143 -22.550 1.00 0.00 C ATOM 0 H ILE A 44 -9.974 -15.090 -20.530 1.00 0.00 H new ATOM 0 HA ILE A 44 -9.574 -17.864 -21.397 1.00 0.00 H new ATOM 0 HB ILE A 44 -10.275 -17.351 -23.587 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.872 -15.118 -24.012 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -11.592 -15.370 -24.234 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -12.756 -17.153 -23.232 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -11.974 -18.291 -22.110 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -12.438 -16.667 -21.550 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.155 -13.224 -23.133 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -12.044 -14.310 -22.039 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.297 -14.055 -21.813 1.00 0.00 H new ATOM 718 N GLY A 45 -7.540 -15.634 -21.225 1.00 0.00 N ATOM 719 CA GLY A 45 -6.287 -14.983 -21.565 1.00 0.00 C ATOM 720 C GLY A 45 -6.589 -13.644 -22.227 1.00 0.00 C ATOM 721 O GLY A 45 -6.244 -13.417 -23.385 1.00 0.00 O ATOM 0 H GLY A 45 -7.814 -15.508 -20.250 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -5.685 -14.833 -20.669 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -5.705 -15.613 -22.238 1.00 0.00 H new ATOM 725 N SER A 46 -7.242 -12.744 -21.486 1.00 0.00 N ATOM 726 CA SER A 46 -7.716 -11.455 -21.976 1.00 0.00 C ATOM 727 C SER A 46 -6.585 -10.412 -22.079 1.00 0.00 C ATOM 728 O SER A 46 -6.727 -9.280 -21.623 1.00 0.00 O ATOM 729 CB SER A 46 -8.908 -11.013 -21.106 1.00 0.00 C ATOM 730 OG SER A 46 -8.760 -11.455 -19.768 1.00 0.00 O ATOM 0 H SER A 46 -7.459 -12.900 -20.502 1.00 0.00 H new ATOM 0 HA SER A 46 -8.067 -11.553 -23.003 1.00 0.00 H new ATOM 0 HB2 SER A 46 -8.992 -9.926 -21.125 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.833 -11.412 -21.523 1.00 0.00 H new ATOM 0 HG SER A 46 -8.930 -12.419 -19.721 1.00 0.00 H new ATOM 736 N LYS A 47 -5.484 -10.796 -22.736 1.00 0.00 N ATOM 737 CA LYS A 47 -4.336 -10.006 -23.185 1.00 0.00 C ATOM 738 C LYS A 47 -3.858 -8.921 -22.210 1.00 0.00 C ATOM 739 O LYS A 47 -2.845 -9.103 -21.533 1.00 0.00 O ATOM 740 CB LYS A 47 -4.594 -9.467 -24.603 1.00 0.00 C ATOM 741 CG LYS A 47 -5.140 -10.530 -25.572 1.00 0.00 C ATOM 742 CD LYS A 47 -4.217 -11.752 -25.709 1.00 0.00 C ATOM 743 CE LYS A 47 -4.779 -12.785 -26.693 1.00 0.00 C ATOM 744 NZ LYS A 47 -6.077 -13.320 -26.242 1.00 0.00 N ATOM 0 H LYS A 47 -5.365 -11.776 -22.993 1.00 0.00 H new ATOM 0 HA LYS A 47 -3.488 -10.691 -23.212 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.302 -8.640 -24.546 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.665 -9.063 -25.005 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.120 -10.859 -25.226 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.284 -10.079 -26.554 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -3.233 -11.427 -26.046 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.082 -12.217 -24.732 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.896 -12.326 -27.675 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.068 -13.603 -26.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -6.195 -14.290 -26.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.108 -13.326 -25.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.845 -12.722 -26.608 1.00 0.00 H new ATOM 758 N LEU A 48 -4.580 -7.801 -22.118 1.00 0.00 N ATOM 759 CA LEU A 48 -4.347 -6.772 -21.112 1.00 0.00 C ATOM 760 C LEU A 48 -4.244 -7.428 -19.735 1.00 0.00 C ATOM 761 O LEU A 48 -3.312 -7.168 -18.978 1.00 0.00 O ATOM 762 CB LEU A 48 -5.498 -5.756 -21.161 1.00 0.00 C ATOM 763 CG LEU A 48 -5.420 -4.668 -20.075 1.00 0.00 C ATOM 764 CD1 LEU A 48 -4.151 -3.817 -20.205 1.00 0.00 C ATOM 765 CD2 LEU A 48 -6.654 -3.765 -20.183 1.00 0.00 C ATOM 0 H LEU A 48 -5.351 -7.585 -22.750 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.413 -6.247 -21.310 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -5.505 -5.277 -22.140 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.444 -6.289 -21.060 1.00 0.00 H new ATOM 0 HG LEU A 48 -5.388 -5.161 -19.104 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -4.137 -3.062 -19.419 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.273 -4.456 -20.110 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -4.140 -3.327 -21.179 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -6.607 -2.991 -19.417 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -6.679 -3.299 -21.168 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -7.555 -4.362 -20.041 1.00 0.00 H new ATOM 777 N GLN A 49 -5.183 -8.324 -19.433 1.00 0.00 N ATOM 778 CA GLN A 49 -5.184 -9.073 -18.189 1.00 0.00 C ATOM 779 C GLN A 49 -3.933 -9.941 -18.054 1.00 0.00 C ATOM 780 O GLN A 49 -3.457 -10.149 -16.945 1.00 0.00 O ATOM 781 CB GLN A 49 -6.455 -9.916 -18.093 1.00 0.00 C ATOM 782 CG GLN A 49 -7.645 -9.125 -17.528 1.00 0.00 C ATOM 783 CD GLN A 49 -7.857 -7.778 -18.212 1.00 0.00 C ATOM 784 OE1 GLN A 49 -8.430 -7.702 -19.293 1.00 0.00 O ATOM 785 NE2 GLN A 49 -7.391 -6.692 -17.596 1.00 0.00 N ATOM 0 H GLN A 49 -5.964 -8.547 -20.050 1.00 0.00 H new ATOM 0 HA GLN A 49 -5.169 -8.364 -17.361 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -6.712 -10.295 -19.082 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.265 -10.783 -17.460 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -8.551 -9.723 -17.631 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.490 -8.962 -16.461 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -6.917 -6.779 -16.697 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -7.508 -5.773 -18.024 1.00 0.00 H new ATOM 794 N ASP A 50 -3.363 -10.445 -19.148 1.00 0.00 N ATOM 795 CA ASP A 50 -2.131 -11.210 -19.039 1.00 0.00 C ATOM 796 C ASP A 50 -0.968 -10.292 -18.691 1.00 0.00 C ATOM 797 O ASP A 50 -0.185 -10.614 -17.803 1.00 0.00 O ATOM 798 CB ASP A 50 -1.804 -11.991 -20.302 1.00 0.00 C ATOM 799 CG ASP A 50 -2.850 -13.047 -20.643 1.00 0.00 C ATOM 800 OD1 ASP A 50 -3.965 -12.643 -21.036 1.00 0.00 O ATOM 801 OD2 ASP A 50 -2.516 -14.244 -20.512 1.00 0.00 O ATOM 0 H ASP A 50 -3.726 -10.339 -20.095 1.00 0.00 H new ATOM 0 HA ASP A 50 -2.287 -11.936 -18.241 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.712 -11.297 -21.137 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.835 -12.475 -20.182 1.00 0.00 H new ATOM 806 N ALA A 51 -0.857 -9.141 -19.359 1.00 0.00 N ATOM 807 CA ALA A 51 0.125 -8.135 -18.960 1.00 0.00 C ATOM 808 C ALA A 51 -0.060 -7.800 -17.474 1.00 0.00 C ATOM 809 O ALA A 51 0.902 -7.733 -16.707 1.00 0.00 O ATOM 810 CB ALA A 51 -0.001 -6.891 -19.843 1.00 0.00 C ATOM 0 H ALA A 51 -1.426 -8.887 -20.166 1.00 0.00 H new ATOM 0 HA ALA A 51 1.132 -8.529 -19.096 1.00 0.00 H new ATOM 0 HB1 ALA A 51 0.736 -6.150 -19.535 1.00 0.00 H new ATOM 0 HB2 ALA A 51 0.173 -7.164 -20.884 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.002 -6.472 -19.740 1.00 0.00 H new ATOM 816 N GLU A 52 -1.322 -7.654 -17.065 1.00 0.00 N ATOM 817 CA GLU A 52 -1.698 -7.452 -15.678 1.00 0.00 C ATOM 818 C GLU A 52 -1.221 -8.630 -14.817 1.00 0.00 C ATOM 819 O GLU A 52 -0.748 -8.404 -13.707 1.00 0.00 O ATOM 820 CB GLU A 52 -3.213 -7.221 -15.583 1.00 0.00 C ATOM 821 CG GLU A 52 -3.638 -6.455 -14.325 1.00 0.00 C ATOM 822 CD GLU A 52 -5.157 -6.291 -14.234 1.00 0.00 C ATOM 823 OE1 GLU A 52 -5.846 -6.615 -15.231 1.00 0.00 O ATOM 824 OE2 GLU A 52 -5.606 -5.827 -13.164 1.00 0.00 O ATOM 0 H GLU A 52 -2.118 -7.674 -17.703 1.00 0.00 H new ATOM 0 HA GLU A 52 -1.207 -6.561 -15.286 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -3.544 -6.670 -16.463 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -3.721 -8.185 -15.601 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -3.278 -6.982 -13.442 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -3.167 -5.472 -14.324 1.00 0.00 H new ATOM 831 N ILE A 53 -1.301 -9.875 -15.309 1.00 0.00 N ATOM 832 CA ILE A 53 -0.840 -11.028 -14.542 1.00 0.00 C ATOM 833 C ILE A 53 0.681 -11.000 -14.410 1.00 0.00 C ATOM 834 O ILE A 53 1.200 -11.274 -13.333 1.00 0.00 O ATOM 835 CB ILE A 53 -1.376 -12.343 -15.136 1.00 0.00 C ATOM 836 CG1 ILE A 53 -2.864 -12.454 -14.770 1.00 0.00 C ATOM 837 CG2 ILE A 53 -0.620 -13.568 -14.594 1.00 0.00 C ATOM 838 CD1 ILE A 53 -3.630 -13.367 -15.722 1.00 0.00 C ATOM 0 H ILE A 53 -1.679 -10.102 -16.229 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.246 -10.972 -13.532 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.233 -12.327 -16.217 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -2.958 -12.834 -13.753 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -3.314 -11.461 -14.783 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.030 -14.475 -15.039 1.00 0.00 H new ATOM 0 HG22 ILE A 53 0.437 -13.485 -14.848 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -0.730 -13.614 -13.511 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.676 -13.412 -15.420 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -3.561 -12.974 -16.737 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -3.200 -14.368 -15.691 1.00 0.00 H new ATOM 850 N VAL A 54 1.404 -10.664 -15.482 1.00 0.00 N ATOM 851 CA VAL A 54 2.853 -10.518 -15.418 1.00 0.00 C ATOM 852 C VAL A 54 3.208 -9.488 -14.341 1.00 0.00 C ATOM 853 O VAL A 54 3.998 -9.783 -13.443 1.00 0.00 O ATOM 854 CB VAL A 54 3.428 -10.159 -16.802 1.00 0.00 C ATOM 855 CG1 VAL A 54 4.929 -9.848 -16.724 1.00 0.00 C ATOM 856 CG2 VAL A 54 3.230 -11.324 -17.782 1.00 0.00 C ATOM 0 H VAL A 54 1.005 -10.489 -16.404 1.00 0.00 H new ATOM 0 HA VAL A 54 3.311 -11.466 -15.137 1.00 0.00 H new ATOM 0 HB VAL A 54 2.895 -9.274 -17.150 1.00 0.00 H new ATOM 0 HG11 VAL A 54 5.301 -9.599 -17.718 1.00 0.00 H new ATOM 0 HG12 VAL A 54 5.091 -9.004 -16.054 1.00 0.00 H new ATOM 0 HG13 VAL A 54 5.462 -10.720 -16.345 1.00 0.00 H new ATOM 0 HG21 VAL A 54 3.641 -11.055 -18.755 1.00 0.00 H new ATOM 0 HG22 VAL A 54 3.742 -12.209 -17.404 1.00 0.00 H new ATOM 0 HG23 VAL A 54 2.166 -11.537 -17.884 1.00 0.00 H new ATOM 866 N LYS A 55 2.606 -8.293 -14.415 1.00 0.00 N ATOM 867 CA LYS A 55 2.817 -7.254 -13.415 1.00 0.00 C ATOM 868 C LYS A 55 2.521 -7.795 -12.013 1.00 0.00 C ATOM 869 O LYS A 55 3.371 -7.705 -11.129 1.00 0.00 O ATOM 870 CB LYS A 55 1.950 -6.025 -13.729 1.00 0.00 C ATOM 871 CG LYS A 55 2.174 -4.916 -12.689 1.00 0.00 C ATOM 872 CD LYS A 55 1.155 -3.783 -12.862 1.00 0.00 C ATOM 873 CE LYS A 55 1.207 -2.808 -11.678 1.00 0.00 C ATOM 874 NZ LYS A 55 0.778 -3.448 -10.421 1.00 0.00 N ATOM 0 H LYS A 55 1.967 -8.027 -15.164 1.00 0.00 H new ATOM 0 HA LYS A 55 3.862 -6.946 -13.444 1.00 0.00 H new ATOM 0 HB2 LYS A 55 2.190 -5.650 -14.724 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.898 -6.310 -13.741 1.00 0.00 H new ATOM 0 HG2 LYS A 55 2.092 -5.333 -11.685 1.00 0.00 H new ATOM 0 HG3 LYS A 55 3.184 -4.519 -12.788 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.357 -3.246 -13.789 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.152 -4.202 -12.949 1.00 0.00 H new ATOM 0 HE2 LYS A 55 2.222 -2.429 -11.564 1.00 0.00 H new ATOM 0 HE3 LYS A 55 0.567 -1.950 -11.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -0.050 -2.946 -10.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 0.527 -4.440 -10.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.554 -3.410 -9.729 1.00 0.00 H new ATOM 888 N LEU A 56 1.304 -8.311 -11.813 1.00 0.00 N ATOM 889 CA LEU A 56 0.836 -8.871 -10.553 1.00 0.00 C ATOM 890 C LEU A 56 1.889 -9.820 -10.002 1.00 0.00 C ATOM 891 O LEU A 56 2.442 -9.570 -8.937 1.00 0.00 O ATOM 892 CB LEU A 56 -0.513 -9.580 -10.774 1.00 0.00 C ATOM 893 CG LEU A 56 -1.017 -10.436 -9.598 1.00 0.00 C ATOM 894 CD1 LEU A 56 -1.378 -9.580 -8.384 1.00 0.00 C ATOM 895 CD2 LEU A 56 -2.258 -11.219 -10.041 1.00 0.00 C ATOM 0 H LEU A 56 0.600 -8.349 -12.550 1.00 0.00 H new ATOM 0 HA LEU A 56 0.680 -8.079 -9.821 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.267 -8.825 -11.000 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.428 -10.218 -11.654 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.213 -11.113 -9.308 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.729 -10.223 -7.577 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.498 -9.029 -8.052 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.165 -8.877 -8.656 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.620 -11.827 -9.212 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.038 -10.522 -10.347 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.000 -11.865 -10.880 1.00 0.00 H new ATOM 907 N MET A 57 2.169 -10.898 -10.733 1.00 0.00 N ATOM 908 CA MET A 57 3.071 -11.943 -10.294 1.00 0.00 C ATOM 909 C MET A 57 4.434 -11.351 -9.945 1.00 0.00 C ATOM 910 O MET A 57 4.932 -11.568 -8.842 1.00 0.00 O ATOM 911 CB MET A 57 3.158 -13.028 -11.374 1.00 0.00 C ATOM 912 CG MET A 57 3.984 -14.230 -10.898 1.00 0.00 C ATOM 913 SD MET A 57 3.936 -15.683 -11.980 1.00 0.00 S ATOM 914 CE MET A 57 4.620 -14.996 -13.505 1.00 0.00 C ATOM 0 H MET A 57 1.768 -11.065 -11.656 1.00 0.00 H new ATOM 0 HA MET A 57 2.690 -12.411 -9.386 1.00 0.00 H new ATOM 0 HB2 MET A 57 2.154 -13.358 -11.641 1.00 0.00 H new ATOM 0 HB3 MET A 57 3.607 -12.611 -12.275 1.00 0.00 H new ATOM 0 HG2 MET A 57 5.022 -13.915 -10.787 1.00 0.00 H new ATOM 0 HG3 MET A 57 3.632 -14.523 -9.909 1.00 0.00 H new ATOM 0 HE1 MET A 57 4.771 -15.797 -14.229 1.00 0.00 H new ATOM 0 HE2 MET A 57 3.928 -14.261 -13.916 1.00 0.00 H new ATOM 0 HE3 MET A 57 5.575 -14.515 -13.291 1.00 0.00 H new ATOM 924 N ASP A 58 5.031 -10.599 -10.878 1.00 0.00 N ATOM 925 CA ASP A 58 6.350 -10.016 -10.678 1.00 0.00 C ATOM 926 C ASP A 58 6.388 -9.158 -9.415 1.00 0.00 C ATOM 927 O ASP A 58 7.258 -9.342 -8.569 1.00 0.00 O ATOM 928 CB ASP A 58 6.763 -9.191 -11.902 1.00 0.00 C ATOM 929 CG ASP A 58 8.087 -8.468 -11.657 1.00 0.00 C ATOM 930 OD1 ASP A 58 9.071 -9.167 -11.327 1.00 0.00 O ATOM 931 OD2 ASP A 58 8.089 -7.226 -11.792 1.00 0.00 O ATOM 0 H ASP A 58 4.612 -10.383 -11.783 1.00 0.00 H new ATOM 0 HA ASP A 58 7.063 -10.831 -10.551 1.00 0.00 H new ATOM 0 HB2 ASP A 58 6.857 -9.844 -12.770 1.00 0.00 H new ATOM 0 HB3 ASP A 58 5.985 -8.463 -12.133 1.00 0.00 H new ATOM 936 N ASP A 59 5.474 -8.196 -9.296 1.00 0.00 N ATOM 937 CA ASP A 59 5.478 -7.270 -8.173 1.00 0.00 C ATOM 938 C ASP A 59 5.185 -7.999 -6.858 1.00 0.00 C ATOM 939 O ASP A 59 5.827 -7.743 -5.844 1.00 0.00 O ATOM 940 CB ASP A 59 4.456 -6.159 -8.431 1.00 0.00 C ATOM 941 CG ASP A 59 4.484 -5.120 -7.316 1.00 0.00 C ATOM 942 OD1 ASP A 59 3.872 -5.399 -6.264 1.00 0.00 O ATOM 943 OD2 ASP A 59 5.112 -4.063 -7.538 1.00 0.00 O ATOM 0 H ASP A 59 4.721 -8.040 -9.967 1.00 0.00 H new ATOM 0 HA ASP A 59 6.469 -6.825 -8.079 1.00 0.00 H new ATOM 0 HB2 ASP A 59 4.669 -5.679 -9.386 1.00 0.00 H new ATOM 0 HB3 ASP A 59 3.457 -6.589 -8.507 1.00 0.00 H new ATOM 948 N LEU A 60 4.179 -8.872 -6.871 1.00 0.00 N ATOM 949 CA LEU A 60 3.629 -9.490 -5.677 1.00 0.00 C ATOM 950 C LEU A 60 4.528 -10.620 -5.171 1.00 0.00 C ATOM 951 O LEU A 60 4.927 -10.625 -4.008 1.00 0.00 O ATOM 952 CB LEU A 60 2.206 -9.972 -6.000 1.00 0.00 C ATOM 953 CG LEU A 60 1.435 -10.614 -4.841 1.00 0.00 C ATOM 954 CD1 LEU A 60 1.414 -9.732 -3.589 1.00 0.00 C ATOM 955 CD2 LEU A 60 -0.004 -10.869 -5.300 1.00 0.00 C ATOM 0 H LEU A 60 3.718 -9.172 -7.730 1.00 0.00 H new ATOM 0 HA LEU A 60 3.582 -8.764 -4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.630 -9.122 -6.367 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.264 -10.693 -6.815 1.00 0.00 H new ATOM 0 HG LEU A 60 1.940 -11.542 -4.574 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.855 -10.234 -2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.435 -9.553 -3.253 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.936 -8.780 -3.822 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.569 -11.326 -4.488 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.470 -9.924 -5.579 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.002 -11.539 -6.160 1.00 0.00 H new ATOM 967 N ASP A 61 4.830 -11.602 -6.022 1.00 0.00 N ATOM 968 CA ASP A 61 5.489 -12.831 -5.595 1.00 0.00 C ATOM 969 C ASP A 61 7.000 -12.638 -5.538 1.00 0.00 C ATOM 970 O ASP A 61 7.738 -13.249 -6.311 1.00 0.00 O ATOM 971 CB ASP A 61 5.098 -13.992 -6.520 1.00 0.00 C ATOM 972 CG ASP A 61 3.605 -14.275 -6.453 1.00 0.00 C ATOM 973 OD1 ASP A 61 3.211 -15.021 -5.532 1.00 0.00 O ATOM 974 OD2 ASP A 61 2.877 -13.731 -7.310 1.00 0.00 O ATOM 0 H ASP A 61 4.625 -11.566 -7.020 1.00 0.00 H new ATOM 0 HA ASP A 61 5.155 -13.081 -4.588 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.379 -13.753 -7.546 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.653 -14.887 -6.238 1.00 0.00 H new ATOM 979 N ARG A 62 7.478 -11.812 -4.604 1.00 0.00 N ATOM 980 CA ARG A 62 8.908 -11.593 -4.424 1.00 0.00 C ATOM 981 C ARG A 62 9.534 -12.804 -3.730 1.00 0.00 C ATOM 982 O ARG A 62 9.910 -12.746 -2.558 1.00 0.00 O ATOM 983 CB ARG A 62 9.184 -10.280 -3.675 1.00 0.00 C ATOM 984 CG ARG A 62 8.524 -9.053 -4.325 1.00 0.00 C ATOM 985 CD ARG A 62 8.811 -8.928 -5.826 1.00 0.00 C ATOM 986 NE ARG A 62 10.251 -8.922 -6.125 1.00 0.00 N ATOM 987 CZ ARG A 62 10.765 -9.001 -7.362 1.00 0.00 C ATOM 988 NH1 ARG A 62 9.963 -9.115 -8.426 1.00 0.00 N ATOM 989 NH2 ARG A 62 12.091 -8.961 -7.528 1.00 0.00 N ATOM 0 H ARG A 62 6.889 -11.284 -3.960 1.00 0.00 H new ATOM 0 HA ARG A 62 9.377 -11.488 -5.402 1.00 0.00 H new ATOM 0 HB2 ARG A 62 8.827 -10.374 -2.649 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.261 -10.119 -3.624 1.00 0.00 H new ATOM 0 HG2 ARG A 62 7.446 -9.107 -4.172 1.00 0.00 H new ATOM 0 HG3 ARG A 62 8.873 -8.152 -3.820 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.337 -9.756 -6.354 1.00 0.00 H new ATOM 0 HD3 ARG A 62 8.361 -8.010 -6.204 1.00 0.00 H new ATOM 0 HE ARG A 62 10.901 -8.853 -5.342 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.951 -9.143 -8.301 1.00 0.00 H new ATOM 0 HH12 ARG A 62 10.363 -9.174 -9.362 1.00 0.00 H new ATOM 0 HH21 ARG A 62 12.704 -8.871 -6.718 1.00 0.00 H new ATOM 0 HH22 ARG A 62 12.490 -9.020 -8.465 1.00 0.00 H new ATOM 1003 N ASN A 63 9.660 -13.914 -4.464 1.00 0.00 N ATOM 1004 CA ASN A 63 10.195 -15.206 -4.023 1.00 0.00 C ATOM 1005 C ASN A 63 9.137 -15.947 -3.210 1.00 0.00 C ATOM 1006 O ASN A 63 8.798 -17.087 -3.517 1.00 0.00 O ATOM 1007 CB ASN A 63 11.511 -15.112 -3.228 1.00 0.00 C ATOM 1008 CG ASN A 63 12.563 -14.215 -3.871 1.00 0.00 C ATOM 1009 OD1 ASN A 63 13.375 -14.666 -4.672 1.00 0.00 O ATOM 1010 ND2 ASN A 63 12.570 -12.937 -3.504 1.00 0.00 N ATOM 0 H ASN A 63 9.373 -13.936 -5.443 1.00 0.00 H new ATOM 0 HA ASN A 63 10.442 -15.759 -4.929 1.00 0.00 H new ATOM 0 HB2 ASN A 63 11.293 -14.739 -2.227 1.00 0.00 H new ATOM 0 HB3 ASN A 63 11.925 -16.114 -3.111 1.00 0.00 H new ATOM 0 HD21 ASN A 63 13.265 -12.299 -3.891 1.00 0.00 H new ATOM 0 HD22 ASN A 63 11.880 -12.595 -2.835 1.00 0.00 H new ATOM 1017 N LYS A 64 8.613 -15.281 -2.179 1.00 0.00 N ATOM 1018 CA LYS A 64 7.469 -15.731 -1.409 1.00 0.00 C ATOM 1019 C LYS A 64 6.284 -15.888 -2.366 1.00 0.00 C ATOM 1020 O LYS A 64 5.697 -14.896 -2.789 1.00 0.00 O ATOM 1021 CB LYS A 64 7.177 -14.708 -0.304 1.00 0.00 C ATOM 1022 CG LYS A 64 8.354 -14.570 0.672 1.00 0.00 C ATOM 1023 CD LYS A 64 7.992 -13.580 1.786 1.00 0.00 C ATOM 1024 CE LYS A 64 9.171 -13.329 2.733 1.00 0.00 C ATOM 1025 NZ LYS A 64 9.591 -14.557 3.432 1.00 0.00 N ATOM 0 H LYS A 64 8.989 -14.390 -1.854 1.00 0.00 H new ATOM 0 HA LYS A 64 7.662 -16.691 -0.931 1.00 0.00 H new ATOM 0 HB2 LYS A 64 6.963 -13.739 -0.754 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.284 -15.010 0.244 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.598 -15.542 1.102 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.241 -14.225 0.140 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.674 -12.636 1.344 1.00 0.00 H new ATOM 0 HD3 LYS A 64 7.146 -13.966 2.354 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.012 -12.929 2.166 1.00 0.00 H new ATOM 0 HE3 LYS A 64 8.892 -12.572 3.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 10.321 -14.324 4.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 8.771 -14.981 3.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 9.978 -15.234 2.743 1.00 0.00 H new ATOM 1039 N ASP A 65 5.997 -17.132 -2.756 1.00 0.00 N ATOM 1040 CA ASP A 65 5.017 -17.485 -3.779 1.00 0.00 C ATOM 1041 C ASP A 65 4.007 -18.496 -3.236 1.00 0.00 C ATOM 1042 O ASP A 65 2.801 -18.271 -3.300 1.00 0.00 O ATOM 1043 CB ASP A 65 5.743 -18.024 -5.016 1.00 0.00 C ATOM 1044 CG ASP A 65 4.752 -18.419 -6.104 1.00 0.00 C ATOM 1045 OD1 ASP A 65 4.292 -19.581 -6.057 1.00 0.00 O ATOM 1046 OD2 ASP A 65 4.467 -17.557 -6.963 1.00 0.00 O ATOM 0 H ASP A 65 6.458 -17.948 -2.353 1.00 0.00 H new ATOM 0 HA ASP A 65 4.458 -16.594 -4.066 1.00 0.00 H new ATOM 0 HB2 ASP A 65 6.426 -17.266 -5.400 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.348 -18.888 -4.739 1.00 0.00 H new ATOM 1051 N GLN A 66 4.511 -19.610 -2.693 1.00 0.00 N ATOM 1052 CA GLN A 66 3.715 -20.628 -1.999 1.00 0.00 C ATOM 1053 C GLN A 66 2.705 -19.990 -1.038 1.00 0.00 C ATOM 1054 O GLN A 66 1.526 -20.349 -0.984 1.00 0.00 O ATOM 1055 CB GLN A 66 4.589 -21.694 -1.298 1.00 0.00 C ATOM 1056 CG GLN A 66 6.099 -21.413 -1.197 1.00 0.00 C ATOM 1057 CD GLN A 66 6.412 -20.060 -0.571 1.00 0.00 C ATOM 1058 OE1 GLN A 66 7.057 -19.226 -1.195 1.00 0.00 O ATOM 1059 NE2 GLN A 66 5.873 -19.795 0.612 1.00 0.00 N ATOM 0 H GLN A 66 5.506 -19.834 -2.725 1.00 0.00 H new ATOM 0 HA GLN A 66 3.149 -21.159 -2.764 1.00 0.00 H new ATOM 0 HB2 GLN A 66 4.204 -21.835 -0.288 1.00 0.00 H new ATOM 0 HB3 GLN A 66 4.456 -22.639 -1.825 1.00 0.00 H new ATOM 0 HG2 GLN A 66 6.570 -22.198 -0.606 1.00 0.00 H new ATOM 0 HG3 GLN A 66 6.539 -21.457 -2.193 1.00 0.00 H new ATOM 0 HE21 GLN A 66 5.342 -20.514 1.103 1.00 0.00 H new ATOM 0 HE22 GLN A 66 5.990 -18.872 1.030 1.00 0.00 H new ATOM 1068 N GLU A 67 3.204 -19.020 -0.285 1.00 0.00 N ATOM 1069 CA GLU A 67 2.437 -18.118 0.536 1.00 0.00 C ATOM 1070 C GLU A 67 3.147 -16.772 0.422 1.00 0.00 C ATOM 1071 O GLU A 67 4.379 -16.745 0.400 1.00 0.00 O ATOM 1072 CB GLU A 67 2.372 -18.645 1.973 1.00 0.00 C ATOM 1073 CG GLU A 67 1.374 -17.844 2.813 1.00 0.00 C ATOM 1074 CD GLU A 67 1.263 -18.417 4.220 1.00 0.00 C ATOM 1075 OE1 GLU A 67 0.628 -19.486 4.350 1.00 0.00 O ATOM 1076 OE2 GLU A 67 1.816 -17.773 5.140 1.00 0.00 O ATOM 0 H GLU A 67 4.206 -18.839 -0.234 1.00 0.00 H new ATOM 0 HA GLU A 67 1.399 -18.022 0.217 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.083 -19.696 1.965 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.361 -18.590 2.428 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.690 -16.802 2.864 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.396 -17.857 2.333 1.00 0.00 H new ATOM 1083 N VAL A 68 2.377 -15.692 0.304 1.00 0.00 N ATOM 1084 CA VAL A 68 2.841 -14.343 0.041 1.00 0.00 C ATOM 1085 C VAL A 68 2.416 -13.465 1.218 1.00 0.00 C ATOM 1086 O VAL A 68 1.327 -13.646 1.772 1.00 0.00 O ATOM 1087 CB VAL A 68 2.244 -13.828 -1.280 1.00 0.00 C ATOM 1088 CG1 VAL A 68 3.054 -12.626 -1.772 1.00 0.00 C ATOM 1089 CG2 VAL A 68 2.202 -14.897 -2.379 1.00 0.00 C ATOM 0 H VAL A 68 1.362 -15.743 0.395 1.00 0.00 H new ATOM 0 HA VAL A 68 3.926 -14.320 -0.061 1.00 0.00 H new ATOM 0 HB VAL A 68 1.213 -13.542 -1.072 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.631 -12.261 -2.708 1.00 0.00 H new ATOM 0 HG12 VAL A 68 3.019 -11.833 -1.025 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.089 -12.927 -1.934 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.770 -14.471 -3.285 1.00 0.00 H new ATOM 0 HG22 VAL A 68 3.214 -15.244 -2.588 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.592 -15.737 -2.047 1.00 0.00 H new ATOM 1099 N ASN A 69 3.274 -12.524 1.613 1.00 0.00 N ATOM 1100 CA ASN A 69 3.095 -11.759 2.835 1.00 0.00 C ATOM 1101 C ASN A 69 2.349 -10.456 2.557 1.00 0.00 C ATOM 1102 O ASN A 69 2.548 -9.811 1.528 1.00 0.00 O ATOM 1103 CB ASN A 69 4.456 -11.456 3.472 1.00 0.00 C ATOM 1104 CG ASN A 69 4.266 -10.704 4.785 1.00 0.00 C ATOM 1105 OD1 ASN A 69 4.258 -9.478 4.811 1.00 0.00 O ATOM 1106 ND2 ASN A 69 4.056 -11.426 5.881 1.00 0.00 N ATOM 0 H ASN A 69 4.113 -12.275 1.089 1.00 0.00 H new ATOM 0 HA ASN A 69 2.500 -12.356 3.527 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.997 -12.385 3.651 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.062 -10.861 2.788 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.883 -10.961 6.772 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.068 -12.445 5.831 1.00 0.00 H new ATOM 1113 N PHE A 70 1.511 -10.059 3.516 1.00 0.00 N ATOM 1114 CA PHE A 70 0.748 -8.819 3.503 1.00 0.00 C ATOM 1115 C PHE A 70 1.558 -7.606 3.024 1.00 0.00 C ATOM 1116 O PHE A 70 1.053 -6.809 2.240 1.00 0.00 O ATOM 1117 CB PHE A 70 0.183 -8.585 4.905 1.00 0.00 C ATOM 1118 CG PHE A 70 -0.515 -7.255 5.075 1.00 0.00 C ATOM 1119 CD1 PHE A 70 -1.686 -6.975 4.347 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.034 -6.275 5.921 1.00 0.00 C ATOM 1121 CE1 PHE A 70 -2.372 -5.767 4.556 1.00 0.00 C ATOM 1122 CE2 PHE A 70 -0.637 -5.058 6.112 1.00 0.00 C ATOM 1123 CZ PHE A 70 -1.855 -4.816 5.453 1.00 0.00 C ATOM 0 H PHE A 70 1.342 -10.617 4.353 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.059 -8.927 2.778 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.520 -9.385 5.140 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.996 -8.652 5.628 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.058 -7.689 3.627 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.972 -6.459 6.424 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.294 -5.569 4.029 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.218 -4.307 6.765 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.394 -3.898 5.636 1.00 0.00 H new ATOM 1133 N GLN A 71 2.812 -7.451 3.463 1.00 0.00 N ATOM 1134 CA GLN A 71 3.647 -6.342 3.011 1.00 0.00 C ATOM 1135 C GLN A 71 3.734 -6.306 1.484 1.00 0.00 C ATOM 1136 O GLN A 71 3.657 -5.232 0.883 1.00 0.00 O ATOM 1137 CB GLN A 71 5.040 -6.436 3.649 1.00 0.00 C ATOM 1138 CG GLN A 71 5.948 -5.245 3.290 1.00 0.00 C ATOM 1139 CD GLN A 71 6.860 -5.510 2.089 1.00 0.00 C ATOM 1140 OE1 GLN A 71 7.966 -6.010 2.258 1.00 0.00 O ATOM 1141 NE2 GLN A 71 6.433 -5.176 0.875 1.00 0.00 N ATOM 0 H GLN A 71 3.266 -8.078 4.127 1.00 0.00 H new ATOM 0 HA GLN A 71 3.187 -5.407 3.331 1.00 0.00 H new ATOM 0 HB2 GLN A 71 4.934 -6.492 4.732 1.00 0.00 H new ATOM 0 HB3 GLN A 71 5.519 -7.361 3.328 1.00 0.00 H new ATOM 0 HG2 GLN A 71 5.326 -4.375 3.078 1.00 0.00 H new ATOM 0 HG3 GLN A 71 6.563 -4.994 4.154 1.00 0.00 H new ATOM 0 HE21 GLN A 71 5.509 -4.761 0.756 1.00 0.00 H new ATOM 0 HE22 GLN A 71 7.029 -5.335 0.063 1.00 0.00 H new ATOM 1150 N GLU A 72 3.920 -7.471 0.858 1.00 0.00 N ATOM 1151 CA GLU A 72 4.049 -7.564 -0.586 1.00 0.00 C ATOM 1152 C GLU A 72 2.733 -7.115 -1.218 1.00 0.00 C ATOM 1153 O GLU A 72 2.731 -6.300 -2.141 1.00 0.00 O ATOM 1154 CB GLU A 72 4.418 -8.990 -1.005 1.00 0.00 C ATOM 1155 CG GLU A 72 5.750 -9.449 -0.396 1.00 0.00 C ATOM 1156 CD GLU A 72 5.994 -10.929 -0.670 1.00 0.00 C ATOM 1157 OE1 GLU A 72 5.508 -11.735 0.154 1.00 0.00 O ATOM 1158 OE2 GLU A 72 6.660 -11.228 -1.684 1.00 0.00 O ATOM 0 H GLU A 72 3.984 -8.367 1.341 1.00 0.00 H new ATOM 0 HA GLU A 72 4.853 -6.915 -0.933 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.626 -9.673 -0.698 1.00 0.00 H new ATOM 0 HB3 GLU A 72 4.481 -9.042 -2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.567 -8.859 -0.812 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.743 -9.271 0.679 1.00 0.00 H new ATOM 1165 N TYR A 73 1.615 -7.616 -0.679 1.00 0.00 N ATOM 1166 CA TYR A 73 0.284 -7.187 -1.084 1.00 0.00 C ATOM 1167 C TYR A 73 0.141 -5.664 -0.979 1.00 0.00 C ATOM 1168 O TYR A 73 -0.357 -5.036 -1.906 1.00 0.00 O ATOM 1169 CB TYR A 73 -0.796 -7.929 -0.289 1.00 0.00 C ATOM 1170 CG TYR A 73 -2.183 -7.360 -0.497 1.00 0.00 C ATOM 1171 CD1 TYR A 73 -2.886 -7.634 -1.686 1.00 0.00 C ATOM 1172 CD2 TYR A 73 -2.711 -6.448 0.436 1.00 0.00 C ATOM 1173 CE1 TYR A 73 -4.099 -6.976 -1.953 1.00 0.00 C ATOM 1174 CE2 TYR A 73 -3.933 -5.807 0.176 1.00 0.00 C ATOM 1175 CZ TYR A 73 -4.619 -6.059 -1.022 1.00 0.00 C ATOM 1176 OH TYR A 73 -5.803 -5.431 -1.263 1.00 0.00 O ATOM 0 H TYR A 73 1.615 -8.330 0.050 1.00 0.00 H new ATOM 0 HA TYR A 73 0.143 -7.447 -2.133 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.794 -8.980 -0.578 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -0.549 -7.890 0.772 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -2.493 -8.350 -2.393 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -2.177 -6.241 1.351 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -4.631 -7.174 -2.872 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -4.346 -5.119 0.899 1.00 0.00 H new ATOM 0 HH TYR A 73 -6.385 -5.518 -0.479 1.00 0.00 H new ATOM 1186 N ILE A 74 0.580 -5.056 0.124 1.00 0.00 N ATOM 1187 CA ILE A 74 0.529 -3.610 0.298 1.00 0.00 C ATOM 1188 C ILE A 74 1.311 -2.901 -0.815 1.00 0.00 C ATOM 1189 O ILE A 74 0.776 -2.024 -1.494 1.00 0.00 O ATOM 1190 CB ILE A 74 0.994 -3.233 1.719 1.00 0.00 C ATOM 1191 CG1 ILE A 74 -0.075 -3.550 2.780 1.00 0.00 C ATOM 1192 CG2 ILE A 74 1.392 -1.761 1.830 1.00 0.00 C ATOM 1193 CD1 ILE A 74 -1.302 -2.624 2.749 1.00 0.00 C ATOM 0 H ILE A 74 0.980 -5.554 0.919 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.500 -3.263 0.205 1.00 0.00 H new ATOM 0 HB ILE A 74 1.875 -3.846 1.910 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -0.409 -4.579 2.644 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.383 -3.491 3.767 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.712 -1.546 2.850 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.211 -1.553 1.142 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.537 -1.133 1.578 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -2.002 -2.921 3.530 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.985 -1.595 2.918 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.790 -2.699 1.777 1.00 0.00 H new ATOM 1205 N THR A 75 2.571 -3.266 -1.050 1.00 0.00 N ATOM 1206 CA THR A 75 3.313 -2.649 -2.143 1.00 0.00 C ATOM 1207 C THR A 75 2.612 -2.886 -3.488 1.00 0.00 C ATOM 1208 O THR A 75 2.543 -1.978 -4.314 1.00 0.00 O ATOM 1209 CB THR A 75 4.759 -3.162 -2.136 1.00 0.00 C ATOM 1210 OG1 THR A 75 4.808 -4.511 -1.715 1.00 0.00 O ATOM 1211 CG2 THR A 75 5.597 -2.346 -1.149 1.00 0.00 C ATOM 0 H THR A 75 3.085 -3.965 -0.515 1.00 0.00 H new ATOM 0 HA THR A 75 3.340 -1.569 -1.999 1.00 0.00 H new ATOM 0 HB THR A 75 5.148 -3.069 -3.150 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.018 -4.986 -2.046 1.00 0.00 H new ATOM 0 HG21 THR A 75 6.622 -2.716 -1.149 1.00 0.00 H new ATOM 0 HG22 THR A 75 5.590 -1.297 -1.446 1.00 0.00 H new ATOM 0 HG23 THR A 75 5.177 -2.443 -0.148 1.00 0.00 H new ATOM 1219 N PHE A 76 2.039 -4.076 -3.695 1.00 0.00 N ATOM 1220 CA PHE A 76 1.230 -4.355 -4.873 1.00 0.00 C ATOM 1221 C PHE A 76 0.014 -3.430 -4.944 1.00 0.00 C ATOM 1222 O PHE A 76 -0.319 -2.961 -6.027 1.00 0.00 O ATOM 1223 CB PHE A 76 0.838 -5.836 -4.936 1.00 0.00 C ATOM 1224 CG PHE A 76 -0.141 -6.145 -6.051 1.00 0.00 C ATOM 1225 CD1 PHE A 76 0.271 -6.020 -7.391 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -1.507 -6.316 -5.754 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -0.677 -6.060 -8.428 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -2.452 -6.375 -6.793 1.00 0.00 C ATOM 1229 CZ PHE A 76 -2.039 -6.236 -8.129 1.00 0.00 C ATOM 0 H PHE A 76 2.125 -4.864 -3.053 1.00 0.00 H new ATOM 0 HA PHE A 76 1.835 -4.148 -5.755 1.00 0.00 H new ATOM 0 HB2 PHE A 76 1.736 -6.438 -5.072 1.00 0.00 H new ATOM 0 HB3 PHE A 76 0.399 -6.130 -3.983 1.00 0.00 H new ATOM 0 HD1 PHE A 76 1.318 -5.893 -7.623 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.829 -6.402 -4.727 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.359 -5.955 -9.455 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.496 -6.527 -6.564 1.00 0.00 H new ATOM 0 HZ PHE A 76 -2.768 -6.264 -8.926 1.00 0.00 H new ATOM 1239 N LEU A 77 -0.630 -3.128 -3.812 1.00 0.00 N ATOM 1240 CA LEU A 77 -1.711 -2.151 -3.747 1.00 0.00 C ATOM 1241 C LEU A 77 -1.197 -0.850 -4.365 1.00 0.00 C ATOM 1242 O LEU A 77 -1.801 -0.314 -5.292 1.00 0.00 O ATOM 1243 CB LEU A 77 -2.141 -1.957 -2.282 1.00 0.00 C ATOM 1244 CG LEU A 77 -3.540 -1.374 -2.047 1.00 0.00 C ATOM 1245 CD1 LEU A 77 -3.658 -1.101 -0.543 1.00 0.00 C ATOM 1246 CD2 LEU A 77 -3.791 -0.071 -2.811 1.00 0.00 C ATOM 0 H LEU A 77 -0.412 -3.559 -2.914 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.588 -2.488 -4.300 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.086 -2.923 -1.780 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.415 -1.305 -1.798 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.279 -2.089 -2.409 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.641 -0.683 -0.325 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.530 -2.033 0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.887 -0.392 -0.240 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.799 0.286 -2.600 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.066 0.680 -2.497 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.687 -0.251 -3.881 1.00 0.00 H new ATOM 1258 N GLY A 78 -0.047 -0.376 -3.877 1.00 0.00 N ATOM 1259 CA GLY A 78 0.602 0.811 -4.416 1.00 0.00 C ATOM 1260 C GLY A 78 0.817 0.713 -5.926 1.00 0.00 C ATOM 1261 O GLY A 78 0.339 1.561 -6.679 1.00 0.00 O ATOM 0 H GLY A 78 0.455 -0.806 -3.100 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.005 1.688 -4.193 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.563 0.954 -3.922 1.00 0.00 H new ATOM 1265 N ALA A 79 1.536 -0.320 -6.370 1.00 0.00 N ATOM 1266 CA ALA A 79 1.878 -0.516 -7.772 1.00 0.00 C ATOM 1267 C ALA A 79 0.631 -0.560 -8.658 1.00 0.00 C ATOM 1268 O ALA A 79 0.610 0.021 -9.740 1.00 0.00 O ATOM 1269 CB ALA A 79 2.700 -1.799 -7.918 1.00 0.00 C ATOM 0 H ALA A 79 1.899 -1.049 -5.756 1.00 0.00 H new ATOM 0 HA ALA A 79 2.473 0.334 -8.107 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.958 -1.949 -8.966 1.00 0.00 H new ATOM 0 HB2 ALA A 79 3.613 -1.715 -7.328 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.116 -2.648 -7.563 1.00 0.00 H new ATOM 1275 N LEU A 80 -0.405 -1.275 -8.218 1.00 0.00 N ATOM 1276 CA LEU A 80 -1.671 -1.378 -8.924 1.00 0.00 C ATOM 1277 C LEU A 80 -2.305 0.006 -9.005 1.00 0.00 C ATOM 1278 O LEU A 80 -2.550 0.516 -10.096 1.00 0.00 O ATOM 1279 CB LEU A 80 -2.576 -2.393 -8.207 1.00 0.00 C ATOM 1280 CG LEU A 80 -3.998 -2.484 -8.785 1.00 0.00 C ATOM 1281 CD1 LEU A 80 -3.995 -2.866 -10.270 1.00 0.00 C ATOM 1282 CD2 LEU A 80 -4.806 -3.520 -7.997 1.00 0.00 C ATOM 0 H LEU A 80 -0.382 -1.805 -7.347 1.00 0.00 H new ATOM 0 HA LEU A 80 -1.520 -1.738 -9.942 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.111 -3.378 -8.258 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -2.640 -2.125 -7.152 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.453 -1.497 -8.696 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.021 -2.918 -10.634 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -3.446 -2.115 -10.838 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.516 -3.837 -10.395 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -5.814 -3.584 -8.407 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -4.321 -4.493 -8.072 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -4.859 -3.221 -6.950 1.00 0.00 H new ATOM 1294 N ALA A 81 -2.553 0.623 -7.849 1.00 0.00 N ATOM 1295 CA ALA A 81 -3.174 1.934 -7.757 1.00 0.00 C ATOM 1296 C ALA A 81 -2.442 2.963 -8.624 1.00 0.00 C ATOM 1297 O ALA A 81 -3.090 3.784 -9.269 1.00 0.00 O ATOM 1298 CB ALA A 81 -3.244 2.364 -6.294 1.00 0.00 C ATOM 0 H ALA A 81 -2.323 0.217 -6.942 1.00 0.00 H new ATOM 0 HA ALA A 81 -4.190 1.873 -8.146 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -3.710 3.347 -6.226 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.835 1.642 -5.731 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -2.237 2.410 -5.880 1.00 0.00 H new ATOM 1304 N MET A 82 -1.108 2.901 -8.692 1.00 0.00 N ATOM 1305 CA MET A 82 -0.319 3.773 -9.555 1.00 0.00 C ATOM 1306 C MET A 82 -0.838 3.779 -10.999 1.00 0.00 C ATOM 1307 O MET A 82 -0.851 4.829 -11.638 1.00 0.00 O ATOM 1308 CB MET A 82 1.167 3.393 -9.486 1.00 0.00 C ATOM 1309 CG MET A 82 2.072 4.422 -10.183 1.00 0.00 C ATOM 1310 SD MET A 82 1.985 6.136 -9.591 1.00 0.00 S ATOM 1311 CE MET A 82 2.532 5.927 -7.884 1.00 0.00 C ATOM 0 H MET A 82 -0.549 2.243 -8.149 1.00 0.00 H new ATOM 0 HA MET A 82 -0.427 4.793 -9.186 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.466 3.299 -8.442 1.00 0.00 H new ATOM 0 HB3 MET A 82 1.311 2.416 -9.948 1.00 0.00 H new ATOM 0 HG2 MET A 82 3.104 4.084 -10.089 1.00 0.00 H new ATOM 0 HG3 MET A 82 1.831 4.419 -11.246 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.636 6.904 -7.413 1.00 0.00 H new ATOM 0 HE2 MET A 82 1.798 5.337 -7.336 1.00 0.00 H new ATOM 0 HE3 MET A 82 3.493 5.414 -7.870 1.00 0.00 H new ATOM 1321 N ILE A 83 -1.301 2.638 -11.524 1.00 0.00 N ATOM 1322 CA ILE A 83 -1.839 2.573 -12.882 1.00 0.00 C ATOM 1323 C ILE A 83 -3.017 3.544 -13.045 1.00 0.00 C ATOM 1324 O ILE A 83 -3.183 4.152 -14.101 1.00 0.00 O ATOM 1325 CB ILE A 83 -2.227 1.127 -13.251 1.00 0.00 C ATOM 1326 CG1 ILE A 83 -1.068 0.129 -13.058 1.00 0.00 C ATOM 1327 CG2 ILE A 83 -2.756 1.044 -14.691 1.00 0.00 C ATOM 1328 CD1 ILE A 83 0.198 0.458 -13.857 1.00 0.00 C ATOM 0 H ILE A 83 -1.312 1.748 -11.026 1.00 0.00 H new ATOM 0 HA ILE A 83 -1.061 2.885 -13.579 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.021 0.842 -12.561 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.813 0.089 -11.999 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.412 -0.866 -13.341 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.021 0.012 -14.922 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -3.638 1.677 -14.792 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -1.985 1.384 -15.382 1.00 0.00 H new ATOM 0 HD11 ILE A 83 0.959 -0.297 -13.660 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -0.036 0.468 -14.922 1.00 0.00 H new ATOM 0 HD13 ILE A 83 0.572 1.437 -13.559 1.00 0.00 H new ATOM 1340 N TYR A 84 -3.796 3.761 -11.981 1.00 0.00 N ATOM 1341 CA TYR A 84 -4.936 4.668 -11.984 1.00 0.00 C ATOM 1342 C TYR A 84 -4.478 6.138 -11.948 1.00 0.00 C ATOM 1343 O TYR A 84 -5.324 7.019 -11.817 1.00 0.00 O ATOM 1344 CB TYR A 84 -5.890 4.343 -10.815 1.00 0.00 C ATOM 1345 CG TYR A 84 -6.499 2.944 -10.781 1.00 0.00 C ATOM 1346 CD1 TYR A 84 -5.687 1.813 -10.567 1.00 0.00 C ATOM 1347 CD2 TYR A 84 -7.900 2.780 -10.813 1.00 0.00 C ATOM 1348 CE1 TYR A 84 -6.256 0.537 -10.446 1.00 0.00 C ATOM 1349 CE2 TYR A 84 -8.473 1.504 -10.647 1.00 0.00 C ATOM 1350 CZ TYR A 84 -7.648 0.381 -10.467 1.00 0.00 C ATOM 1351 OH TYR A 84 -8.174 -0.861 -10.270 1.00 0.00 O ATOM 0 H TYR A 84 -3.646 3.302 -11.082 1.00 0.00 H new ATOM 0 HA TYR A 84 -5.485 4.524 -12.915 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.347 4.498 -9.883 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -6.705 5.066 -10.833 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -4.616 1.930 -10.495 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.537 3.638 -10.966 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -5.619 -0.328 -10.336 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -9.547 1.389 -10.658 1.00 0.00 H new ATOM 0 HH TYR A 84 -9.151 -0.800 -10.230 1.00 0.00 H new ATOM 1361 N ASN A 85 -3.165 6.401 -12.072 1.00 0.00 N ATOM 1362 CA ASN A 85 -2.480 7.689 -12.161 1.00 0.00 C ATOM 1363 C ASN A 85 -3.388 8.924 -12.231 1.00 0.00 C ATOM 1364 O ASN A 85 -3.416 9.707 -11.285 1.00 0.00 O ATOM 1365 CB ASN A 85 -1.406 7.665 -13.267 1.00 0.00 C ATOM 1366 CG ASN A 85 -1.953 7.753 -14.687 1.00 0.00 C ATOM 1367 OD1 ASN A 85 -1.752 8.755 -15.364 1.00 0.00 O ATOM 1368 ND2 ASN A 85 -2.678 6.737 -15.149 1.00 0.00 N ATOM 0 H ASN A 85 -2.495 5.633 -12.116 1.00 0.00 H new ATOM 0 HA ASN A 85 -1.982 7.815 -11.200 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -0.718 8.495 -13.105 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -0.826 6.747 -13.172 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.080 6.782 -16.085 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.831 5.914 -14.567 1.00 0.00 H new ATOM 1375 N GLU A 86 -4.134 9.116 -13.326 1.00 0.00 N ATOM 1376 CA GLU A 86 -4.979 10.288 -13.516 1.00 0.00 C ATOM 1377 C GLU A 86 -5.968 10.434 -12.359 1.00 0.00 C ATOM 1378 O GLU A 86 -6.057 11.491 -11.740 1.00 0.00 O ATOM 1379 CB GLU A 86 -5.726 10.195 -14.853 1.00 0.00 C ATOM 1380 CG GLU A 86 -4.769 10.137 -16.050 1.00 0.00 C ATOM 1381 CD GLU A 86 -5.529 10.224 -17.369 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -6.280 9.265 -17.651 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -5.355 11.249 -18.063 1.00 0.00 O ATOM 0 H GLU A 86 -4.164 8.457 -14.104 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.342 11.173 -13.534 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -6.358 9.307 -14.853 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.386 11.056 -14.959 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -4.052 10.956 -15.986 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.197 9.209 -16.017 1.00 0.00 H new ATOM 1390 N ALA A 87 -6.698 9.358 -12.065 1.00 0.00 N ATOM 1391 CA ALA A 87 -7.662 9.325 -10.981 1.00 0.00 C ATOM 1392 C ALA A 87 -6.940 9.362 -9.636 1.00 0.00 C ATOM 1393 O ALA A 87 -7.420 9.999 -8.707 1.00 0.00 O ATOM 1394 CB ALA A 87 -8.541 8.077 -11.102 1.00 0.00 C ATOM 0 H ALA A 87 -6.631 8.481 -12.581 1.00 0.00 H new ATOM 0 HA ALA A 87 -8.305 10.203 -11.044 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -9.262 8.059 -10.285 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -9.072 8.097 -12.054 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -7.916 7.185 -11.054 1.00 0.00 H new ATOM 1400 N LEU A 88 -5.796 8.676 -9.532 1.00 0.00 N ATOM 1401 CA LEU A 88 -5.001 8.638 -8.310 1.00 0.00 C ATOM 1402 C LEU A 88 -4.647 10.053 -7.842 1.00 0.00 C ATOM 1403 O LEU A 88 -4.918 10.395 -6.692 1.00 0.00 O ATOM 1404 CB LEU A 88 -3.760 7.752 -8.508 1.00 0.00 C ATOM 1405 CG LEU A 88 -2.764 7.778 -7.336 1.00 0.00 C ATOM 1406 CD1 LEU A 88 -3.377 7.281 -6.025 1.00 0.00 C ATOM 1407 CD2 LEU A 88 -1.565 6.888 -7.673 1.00 0.00 C ATOM 0 H LEU A 88 -5.399 8.132 -10.298 1.00 0.00 H new ATOM 0 HA LEU A 88 -5.595 8.188 -7.514 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.085 6.724 -8.669 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.244 8.069 -9.414 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.466 8.817 -7.195 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -2.628 7.322 -5.234 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.223 7.913 -5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.717 6.253 -6.149 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.856 6.903 -6.845 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.906 5.866 -7.840 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.078 7.260 -8.574 1.00 0.00 H new ATOM 1419 N LYS A 89 -4.037 10.871 -8.707 1.00 0.00 N ATOM 1420 CA LYS A 89 -3.753 12.255 -8.333 1.00 0.00 C ATOM 1421 C LYS A 89 -5.030 13.094 -8.338 1.00 0.00 C ATOM 1422 O LYS A 89 -5.271 13.855 -7.406 1.00 0.00 O ATOM 1423 CB LYS A 89 -2.605 12.874 -9.147 1.00 0.00 C ATOM 1424 CG LYS A 89 -2.853 12.991 -10.655 1.00 0.00 C ATOM 1425 CD LYS A 89 -1.544 13.358 -11.369 1.00 0.00 C ATOM 1426 CE LYS A 89 -1.591 13.014 -12.861 1.00 0.00 C ATOM 1427 NZ LYS A 89 -1.571 11.554 -13.069 1.00 0.00 N ATOM 0 H LYS A 89 -3.738 10.606 -9.646 1.00 0.00 H new ATOM 0 HA LYS A 89 -3.384 12.249 -7.307 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -2.398 13.869 -8.752 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.708 12.276 -8.989 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -3.238 12.049 -11.044 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.610 13.750 -10.851 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -1.351 14.424 -11.248 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -0.714 12.829 -10.900 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.492 13.436 -13.307 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -0.741 13.469 -13.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -1.155 11.341 -13.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -1.002 11.105 -12.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -2.543 11.185 -13.032 1.00 0.00 H new ATOM 1441 N GLY A 90 -5.858 12.964 -9.380 1.00 0.00 N ATOM 1442 CA GLY A 90 -7.033 13.808 -9.546 1.00 0.00 C ATOM 1443 C GLY A 90 -6.624 15.278 -9.674 1.00 0.00 C ATOM 1444 O GLY A 90 -7.322 16.121 -9.067 1.00 0.00 O ATOM 1445 OXT GLY A 90 -5.628 15.536 -10.390 1.00 0.00 O ATOM 0 H GLY A 90 -5.730 12.276 -10.122 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -7.587 13.500 -10.433 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -7.701 13.683 -8.694 1.00 0.00 H new TER 1449 GLY A 90 ATOM 1450 N MET B 1 -14.064 -12.979 -8.836 1.00 0.00 N ATOM 1451 CA MET B 1 -13.409 -12.018 -9.743 1.00 0.00 C ATOM 1452 C MET B 1 -12.683 -10.934 -8.940 1.00 0.00 C ATOM 1453 O MET B 1 -12.817 -10.866 -7.720 1.00 0.00 O ATOM 1454 CB MET B 1 -14.422 -11.390 -10.714 1.00 0.00 C ATOM 1455 CG MET B 1 -15.236 -12.424 -11.507 1.00 0.00 C ATOM 1456 SD MET B 1 -14.312 -13.640 -12.487 1.00 0.00 S ATOM 1457 CE MET B 1 -13.487 -12.567 -13.684 1.00 0.00 C ATOM 0 H1 MET B 1 -14.055 -13.925 -9.268 1.00 0.00 H new ATOM 0 H2 MET B 1 -13.552 -13.007 -7.931 1.00 0.00 H new ATOM 0 H3 MET B 1 -15.047 -12.684 -8.669 1.00 0.00 H new ATOM 0 HA MET B 1 -12.673 -12.561 -10.336 1.00 0.00 H new ATOM 0 HB2 MET B 1 -15.106 -10.755 -10.151 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.890 -10.745 -11.413 1.00 0.00 H new ATOM 0 HG2 MET B 1 -15.867 -12.967 -10.804 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.902 -11.884 -12.181 1.00 0.00 H new ATOM 0 HE1 MET B 1 -12.894 -13.174 -14.368 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.234 -12.009 -14.248 1.00 0.00 H new ATOM 0 HE3 MET B 1 -12.834 -11.870 -13.158 1.00 0.00 H new ATOM 1469 N ALA B 2 -11.920 -10.076 -9.623 1.00 0.00 N ATOM 1470 CA ALA B 2 -11.177 -8.992 -8.988 1.00 0.00 C ATOM 1471 C ALA B 2 -12.098 -7.902 -8.424 1.00 0.00 C ATOM 1472 O ALA B 2 -11.669 -7.106 -7.589 1.00 0.00 O ATOM 1473 CB ALA B 2 -10.195 -8.394 -9.998 1.00 0.00 C ATOM 0 H ALA B 2 -11.802 -10.117 -10.635 1.00 0.00 H new ATOM 0 HA ALA B 2 -10.633 -9.409 -8.141 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -9.638 -7.584 -9.528 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -9.501 -9.166 -10.332 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -10.746 -8.006 -10.855 1.00 0.00 H new ATOM 1479 N SER B 3 -13.351 -7.842 -8.888 1.00 0.00 N ATOM 1480 CA SER B 3 -14.298 -6.769 -8.635 1.00 0.00 C ATOM 1481 C SER B 3 -14.313 -6.226 -7.197 1.00 0.00 C ATOM 1482 O SER B 3 -14.246 -5.011 -7.037 1.00 0.00 O ATOM 1483 CB SER B 3 -15.683 -7.186 -9.145 1.00 0.00 C ATOM 1484 OG SER B 3 -15.516 -8.063 -10.249 1.00 0.00 O ATOM 0 H SER B 3 -13.743 -8.577 -9.476 1.00 0.00 H new ATOM 0 HA SER B 3 -13.954 -5.903 -9.200 1.00 0.00 H new ATOM 0 HB2 SER B 3 -16.245 -7.679 -8.352 1.00 0.00 H new ATOM 0 HB3 SER B 3 -16.256 -6.308 -9.443 1.00 0.00 H new ATOM 0 HG SER B 3 -16.395 -8.339 -10.584 1.00 0.00 H new ATOM 1490 N PRO B 4 -14.388 -7.057 -6.141 1.00 0.00 N ATOM 1491 CA PRO B 4 -14.373 -6.567 -4.766 1.00 0.00 C ATOM 1492 C PRO B 4 -13.085 -5.793 -4.455 1.00 0.00 C ATOM 1493 O PRO B 4 -13.116 -4.714 -3.857 1.00 0.00 O ATOM 1494 CB PRO B 4 -14.504 -7.814 -3.880 1.00 0.00 C ATOM 1495 CG PRO B 4 -15.130 -8.856 -4.807 1.00 0.00 C ATOM 1496 CD PRO B 4 -14.496 -8.507 -6.150 1.00 0.00 C ATOM 0 HA PRO B 4 -15.186 -5.863 -4.589 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -13.534 -8.143 -3.506 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -15.133 -7.623 -3.011 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -14.893 -9.874 -4.496 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -16.217 -8.776 -4.836 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -13.518 -8.976 -6.260 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -15.111 -8.853 -6.980 1.00 0.00 H new ATOM 1504 N LEU B 5 -11.948 -6.354 -4.876 1.00 0.00 N ATOM 1505 CA LEU B 5 -10.634 -5.765 -4.686 1.00 0.00 C ATOM 1506 C LEU B 5 -10.603 -4.436 -5.442 1.00 0.00 C ATOM 1507 O LEU B 5 -10.267 -3.399 -4.876 1.00 0.00 O ATOM 1508 CB LEU B 5 -9.564 -6.756 -5.185 1.00 0.00 C ATOM 1509 CG LEU B 5 -8.190 -6.669 -4.498 1.00 0.00 C ATOM 1510 CD1 LEU B 5 -7.562 -5.275 -4.592 1.00 0.00 C ATOM 1511 CD2 LEU B 5 -8.253 -7.140 -3.039 1.00 0.00 C ATOM 0 H LEU B 5 -11.922 -7.248 -5.367 1.00 0.00 H new ATOM 0 HA LEU B 5 -10.423 -5.566 -3.635 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -9.948 -7.768 -5.058 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -9.424 -6.600 -6.255 1.00 0.00 H new ATOM 0 HG LEU B 5 -7.539 -7.348 -5.048 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -6.595 -5.277 -4.089 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -7.426 -5.007 -5.640 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -8.218 -4.547 -4.114 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -7.263 -7.063 -2.589 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -8.953 -6.515 -2.485 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -8.587 -8.177 -3.006 1.00 0.00 H new ATOM 1523 N ASP B 6 -11.009 -4.456 -6.714 1.00 0.00 N ATOM 1524 CA ASP B 6 -11.075 -3.250 -7.528 1.00 0.00 C ATOM 1525 C ASP B 6 -11.971 -2.188 -6.895 1.00 0.00 C ATOM 1526 O ASP B 6 -11.622 -1.015 -6.900 1.00 0.00 O ATOM 1527 CB ASP B 6 -11.527 -3.581 -8.953 1.00 0.00 C ATOM 1528 CG ASP B 6 -11.746 -2.312 -9.773 1.00 0.00 C ATOM 1529 OD1 ASP B 6 -10.739 -1.620 -10.042 1.00 0.00 O ATOM 1530 OD2 ASP B 6 -12.921 -2.051 -10.109 1.00 0.00 O ATOM 0 H ASP B 6 -11.298 -5.304 -7.201 1.00 0.00 H new ATOM 0 HA ASP B 6 -10.070 -2.831 -7.579 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -10.778 -4.206 -9.439 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -12.451 -4.159 -8.919 1.00 0.00 H new ATOM 1535 N GLN B 7 -13.109 -2.587 -6.332 1.00 0.00 N ATOM 1536 CA GLN B 7 -13.967 -1.698 -5.566 1.00 0.00 C ATOM 1537 C GLN B 7 -13.177 -1.067 -4.412 1.00 0.00 C ATOM 1538 O GLN B 7 -13.253 0.143 -4.201 1.00 0.00 O ATOM 1539 CB GLN B 7 -15.232 -2.471 -5.151 1.00 0.00 C ATOM 1540 CG GLN B 7 -16.089 -1.815 -4.060 1.00 0.00 C ATOM 1541 CD GLN B 7 -15.608 -2.013 -2.618 1.00 0.00 C ATOM 1542 OE1 GLN B 7 -15.998 -1.251 -1.744 1.00 0.00 O ATOM 1543 NE2 GLN B 7 -14.786 -3.018 -2.321 1.00 0.00 N ATOM 0 H GLN B 7 -13.460 -3.542 -6.397 1.00 0.00 H new ATOM 0 HA GLN B 7 -14.308 -0.852 -6.162 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -15.852 -2.616 -6.035 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -14.933 -3.461 -4.805 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -16.141 -0.745 -4.261 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -17.104 -2.204 -4.140 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -14.466 -3.649 -3.056 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -14.477 -3.157 -1.359 1.00 0.00 H new ATOM 1552 N ALA B 8 -12.391 -1.864 -3.682 1.00 0.00 N ATOM 1553 CA ALA B 8 -11.605 -1.349 -2.568 1.00 0.00 C ATOM 1554 C ALA B 8 -10.564 -0.337 -3.060 1.00 0.00 C ATOM 1555 O ALA B 8 -10.438 0.751 -2.496 1.00 0.00 O ATOM 1556 CB ALA B 8 -10.965 -2.499 -1.788 1.00 0.00 C ATOM 0 H ALA B 8 -12.285 -2.865 -3.846 1.00 0.00 H new ATOM 0 HA ALA B 8 -12.269 -0.820 -1.884 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -10.382 -2.097 -0.960 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -11.745 -3.153 -1.398 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -10.311 -3.068 -2.449 1.00 0.00 H new ATOM 1562 N ILE B 9 -9.841 -0.676 -4.134 1.00 0.00 N ATOM 1563 CA ILE B 9 -8.931 0.256 -4.797 1.00 0.00 C ATOM 1564 C ILE B 9 -9.695 1.533 -5.159 1.00 0.00 C ATOM 1565 O ILE B 9 -9.243 2.633 -4.859 1.00 0.00 O ATOM 1566 CB ILE B 9 -8.279 -0.388 -6.040 1.00 0.00 C ATOM 1567 CG1 ILE B 9 -7.452 -1.645 -5.711 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -7.414 0.626 -6.804 1.00 0.00 C ATOM 1569 CD1 ILE B 9 -6.159 -1.373 -4.941 1.00 0.00 C ATOM 0 H ILE B 9 -9.872 -1.601 -4.564 1.00 0.00 H new ATOM 0 HA ILE B 9 -8.120 0.512 -4.115 1.00 0.00 H new ATOM 0 HB ILE B 9 -9.105 -0.706 -6.675 1.00 0.00 H new ATOM 0 HG12 ILE B 9 -8.070 -2.328 -5.128 1.00 0.00 H new ATOM 0 HG13 ILE B 9 -7.205 -2.155 -6.642 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -6.969 0.142 -7.673 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -8.035 1.460 -7.131 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -6.624 0.996 -6.150 1.00 0.00 H new ATOM 0 HD11 ILE B 9 -5.642 -2.314 -4.753 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -5.517 -0.717 -5.529 1.00 0.00 H new ATOM 0 HD13 ILE B 9 -6.395 -0.893 -3.991 1.00 0.00 H new ATOM 1581 N GLY B 10 -10.867 1.382 -5.778 1.00 0.00 N ATOM 1582 CA GLY B 10 -11.763 2.465 -6.141 1.00 0.00 C ATOM 1583 C GLY B 10 -12.008 3.395 -4.958 1.00 0.00 C ATOM 1584 O GLY B 10 -11.809 4.602 -5.075 1.00 0.00 O ATOM 0 H GLY B 10 -11.225 0.466 -6.047 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -11.338 3.031 -6.970 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -12.712 2.055 -6.488 1.00 0.00 H new ATOM 1588 N LEU B 11 -12.415 2.847 -3.810 1.00 0.00 N ATOM 1589 CA LEU B 11 -12.591 3.649 -2.606 1.00 0.00 C ATOM 1590 C LEU B 11 -11.283 4.337 -2.208 1.00 0.00 C ATOM 1591 O LEU B 11 -11.281 5.538 -1.951 1.00 0.00 O ATOM 1592 CB LEU B 11 -13.136 2.808 -1.445 1.00 0.00 C ATOM 1593 CG LEU B 11 -14.558 2.268 -1.665 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -14.959 1.473 -0.421 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -15.588 3.382 -1.892 1.00 0.00 C ATOM 0 H LEU B 11 -12.627 1.856 -3.693 1.00 0.00 H new ATOM 0 HA LEU B 11 -13.327 4.420 -2.833 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -12.464 1.967 -1.274 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -13.126 3.413 -0.538 1.00 0.00 H new ATOM 0 HG LEU B 11 -14.549 1.649 -2.562 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -15.966 1.078 -0.551 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -14.261 0.648 -0.276 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -14.935 2.126 0.451 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -16.574 2.941 -2.042 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -15.612 4.038 -1.022 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -15.311 3.959 -2.774 1.00 0.00 H new ATOM 1607 N LEU B 12 -10.170 3.602 -2.151 1.00 0.00 N ATOM 1608 CA LEU B 12 -8.884 4.169 -1.754 1.00 0.00 C ATOM 1609 C LEU B 12 -8.504 5.369 -2.633 1.00 0.00 C ATOM 1610 O LEU B 12 -8.163 6.434 -2.115 1.00 0.00 O ATOM 1611 CB LEU B 12 -7.816 3.068 -1.740 1.00 0.00 C ATOM 1612 CG LEU B 12 -6.444 3.591 -1.279 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -5.789 2.591 -0.323 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -5.514 3.821 -2.476 1.00 0.00 C ATOM 0 H LEU B 12 -10.136 2.608 -2.377 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.961 4.563 -0.740 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -8.136 2.263 -1.079 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -7.723 2.642 -2.739 1.00 0.00 H new ATOM 0 HG LEU B 12 -6.605 4.539 -0.766 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -4.819 2.974 -0.005 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -6.427 2.450 0.549 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -5.653 1.637 -0.832 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -4.551 4.190 -2.123 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -5.369 2.882 -3.010 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -5.960 4.555 -3.148 1.00 0.00 H new ATOM 1626 N ILE B 13 -8.590 5.213 -3.957 1.00 0.00 N ATOM 1627 CA ILE B 13 -8.428 6.300 -4.920 1.00 0.00 C ATOM 1628 C ILE B 13 -9.407 7.424 -4.565 1.00 0.00 C ATOM 1629 O ILE B 13 -9.019 8.587 -4.429 1.00 0.00 O ATOM 1630 CB ILE B 13 -8.669 5.765 -6.350 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -7.623 4.719 -6.787 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -8.755 6.902 -7.378 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -6.258 5.309 -7.139 1.00 0.00 C ATOM 0 H ILE B 13 -8.778 4.311 -4.395 1.00 0.00 H new ATOM 0 HA ILE B 13 -7.414 6.699 -4.881 1.00 0.00 H new ATOM 0 HB ILE B 13 -9.634 5.258 -6.316 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -7.496 3.991 -5.985 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -8.006 4.177 -7.652 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -8.925 6.484 -8.370 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -9.580 7.566 -7.118 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -7.822 7.465 -7.377 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -5.581 4.508 -7.436 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -6.368 6.015 -7.962 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -5.850 5.826 -6.270 1.00 0.00 H new ATOM 1645 N GLY B 14 -10.678 7.052 -4.398 1.00 0.00 N ATOM 1646 CA GLY B 14 -11.768 7.901 -3.952 1.00 0.00 C ATOM 1647 C GLY B 14 -11.330 8.827 -2.821 1.00 0.00 C ATOM 1648 O GLY B 14 -11.481 10.037 -2.939 1.00 0.00 O ATOM 0 H GLY B 14 -10.984 6.096 -4.582 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -12.133 8.496 -4.789 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -12.599 7.281 -3.615 1.00 0.00 H new ATOM 1652 N ILE B 15 -10.759 8.279 -1.749 1.00 0.00 N ATOM 1653 CA ILE B 15 -10.251 9.084 -0.649 1.00 0.00 C ATOM 1654 C ILE B 15 -9.028 9.891 -1.100 1.00 0.00 C ATOM 1655 O ILE B 15 -9.045 11.122 -1.079 1.00 0.00 O ATOM 1656 CB ILE B 15 -9.921 8.197 0.570 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -11.093 7.304 1.018 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -9.438 9.061 1.745 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -12.374 8.064 1.362 1.00 0.00 C ATOM 0 H ILE B 15 -10.638 7.274 -1.623 1.00 0.00 H new ATOM 0 HA ILE B 15 -11.026 9.788 -0.344 1.00 0.00 H new ATOM 0 HB ILE B 15 -9.125 7.525 0.250 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -11.312 6.589 0.225 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -10.782 6.728 1.890 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -9.209 8.421 2.597 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.542 9.607 1.451 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -10.220 9.768 2.022 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -13.146 7.357 1.667 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -12.176 8.760 2.178 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -12.715 8.618 0.487 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.954 9.192 -1.481 1.00 0.00 N ATOM 1672 CA PHE B 16 -6.643 9.790 -1.701 1.00 0.00 C ATOM 1673 C PHE B 16 -6.703 11.000 -2.634 1.00 0.00 C ATOM 1674 O PHE B 16 -6.142 12.052 -2.324 1.00 0.00 O ATOM 1675 CB PHE B 16 -5.649 8.733 -2.201 1.00 0.00 C ATOM 1676 CG PHE B 16 -4.207 9.211 -2.198 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -3.507 9.318 -0.981 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -3.597 9.647 -3.390 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -2.209 9.857 -0.956 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -2.283 10.148 -3.370 1.00 0.00 C ATOM 1681 CZ PHE B 16 -1.599 10.282 -2.150 1.00 0.00 C ATOM 0 H PHE B 16 -7.976 8.186 -1.646 1.00 0.00 H new ATOM 0 HA PHE B 16 -6.287 10.166 -0.742 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.730 7.844 -1.576 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.924 8.437 -3.213 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -3.969 8.985 -0.063 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -4.140 9.597 -4.322 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -1.679 9.945 -0.019 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -1.799 10.430 -4.293 1.00 0.00 H new ATOM 0 HZ PHE B 16 -0.608 10.710 -2.129 1.00 0.00 H new ATOM 1691 N HIS B 17 -7.389 10.870 -3.773 1.00 0.00 N ATOM 1692 CA HIS B 17 -7.361 11.912 -4.789 1.00 0.00 C ATOM 1693 C HIS B 17 -7.942 13.241 -4.296 1.00 0.00 C ATOM 1694 O HIS B 17 -7.552 14.293 -4.796 1.00 0.00 O ATOM 1695 CB HIS B 17 -8.012 11.434 -6.089 1.00 0.00 C ATOM 1696 CG HIS B 17 -9.509 11.581 -6.133 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -10.413 10.813 -5.444 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -10.212 12.528 -6.829 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -11.639 11.284 -5.725 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -11.570 12.332 -6.562 1.00 0.00 N ATOM 0 H HIS B 17 -7.963 10.061 -4.008 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.313 12.116 -5.006 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -7.581 11.991 -6.921 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -7.759 10.385 -6.242 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -10.194 10.028 -4.831 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -9.792 13.290 -7.469 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -12.557 10.875 -5.331 1.00 0.00 H new ATOM 1708 N LYS B 18 -8.844 13.224 -3.305 1.00 0.00 N ATOM 1709 CA LYS B 18 -9.362 14.467 -2.736 1.00 0.00 C ATOM 1710 C LYS B 18 -8.215 15.286 -2.150 1.00 0.00 C ATOM 1711 O LYS B 18 -8.174 16.507 -2.289 1.00 0.00 O ATOM 1712 CB LYS B 18 -10.409 14.191 -1.648 1.00 0.00 C ATOM 1713 CG LYS B 18 -11.571 13.309 -2.118 1.00 0.00 C ATOM 1714 CD LYS B 18 -12.284 13.803 -3.385 1.00 0.00 C ATOM 1715 CE LYS B 18 -12.895 15.198 -3.211 1.00 0.00 C ATOM 1716 NZ LYS B 18 -13.644 15.599 -4.414 1.00 0.00 N ATOM 0 H LYS B 18 -9.223 12.374 -2.888 1.00 0.00 H new ATOM 0 HA LYS B 18 -9.844 15.028 -3.536 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -9.920 13.711 -0.800 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -10.807 15.141 -1.291 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.194 12.302 -2.299 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -12.302 13.235 -1.312 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -11.575 13.821 -4.213 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -13.070 13.097 -3.654 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -13.559 15.203 -2.346 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -12.106 15.923 -3.011 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -14.048 16.547 -4.272 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -13.003 15.615 -5.233 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -14.411 14.918 -4.588 1.00 0.00 H new ATOM 1730 N TYR B 19 -7.279 14.602 -1.491 1.00 0.00 N ATOM 1731 CA TYR B 19 -6.074 15.229 -0.989 1.00 0.00 C ATOM 1732 C TYR B 19 -5.149 15.517 -2.165 1.00 0.00 C ATOM 1733 O TYR B 19 -4.798 16.670 -2.403 1.00 0.00 O ATOM 1734 CB TYR B 19 -5.431 14.341 0.082 1.00 0.00 C ATOM 1735 CG TYR B 19 -6.288 14.215 1.324 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -6.267 15.236 2.293 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -7.221 13.167 1.432 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -7.174 15.208 3.366 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -8.123 13.135 2.509 1.00 0.00 C ATOM 1740 CZ TYR B 19 -8.103 14.160 3.472 1.00 0.00 C ATOM 1741 OH TYR B 19 -8.988 14.150 4.509 1.00 0.00 O ATOM 0 H TYR B 19 -7.342 13.603 -1.295 1.00 0.00 H new ATOM 0 HA TYR B 19 -6.299 16.179 -0.505 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -5.251 13.349 -0.333 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -4.460 14.753 0.355 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -5.553 16.042 2.212 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -7.244 12.386 0.686 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -7.157 15.992 4.109 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -8.831 12.324 2.597 1.00 0.00 H new ATOM 0 HH TYR B 19 -9.564 13.360 4.440 1.00 0.00 H new ATOM 1751 N SER B 20 -4.766 14.473 -2.903 1.00 0.00 N ATOM 1752 CA SER B 20 -3.721 14.554 -3.919 1.00 0.00 C ATOM 1753 C SER B 20 -4.009 15.632 -4.973 1.00 0.00 C ATOM 1754 O SER B 20 -3.092 16.305 -5.438 1.00 0.00 O ATOM 1755 CB SER B 20 -3.464 13.164 -4.508 1.00 0.00 C ATOM 1756 OG SER B 20 -2.142 13.049 -5.008 1.00 0.00 O ATOM 0 H SER B 20 -5.176 13.544 -2.810 1.00 0.00 H new ATOM 0 HA SER B 20 -2.795 14.882 -3.447 1.00 0.00 H new ATOM 0 HB2 SER B 20 -3.632 12.406 -3.743 1.00 0.00 H new ATOM 0 HB3 SER B 20 -4.176 12.970 -5.310 1.00 0.00 H new ATOM 0 HG SER B 20 -1.503 13.220 -4.285 1.00 0.00 H new ATOM 1762 N GLY B 21 -5.283 15.863 -5.300 1.00 0.00 N ATOM 1763 CA GLY B 21 -5.691 16.934 -6.197 1.00 0.00 C ATOM 1764 C GLY B 21 -5.154 18.295 -5.748 1.00 0.00 C ATOM 1765 O GLY B 21 -4.780 19.123 -6.580 1.00 0.00 O ATOM 0 H GLY B 21 -6.061 15.306 -4.945 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -5.335 16.718 -7.204 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -6.779 16.972 -6.245 1.00 0.00 H new ATOM 1769 N LYS B 22 -5.085 18.539 -4.435 1.00 0.00 N ATOM 1770 CA LYS B 22 -4.567 19.779 -3.876 1.00 0.00 C ATOM 1771 C LYS B 22 -3.033 19.785 -3.921 1.00 0.00 C ATOM 1772 O LYS B 22 -2.364 19.795 -2.888 1.00 0.00 O ATOM 1773 CB LYS B 22 -5.120 19.991 -2.460 1.00 0.00 C ATOM 1774 CG LYS B 22 -6.657 19.990 -2.438 1.00 0.00 C ATOM 1775 CD LYS B 22 -7.209 20.485 -1.091 1.00 0.00 C ATOM 1776 CE LYS B 22 -7.037 19.468 0.045 1.00 0.00 C ATOM 1777 NZ LYS B 22 -7.944 18.316 -0.110 1.00 0.00 N ATOM 0 H LYS B 22 -5.392 17.870 -3.729 1.00 0.00 H new ATOM 0 HA LYS B 22 -4.903 20.622 -4.480 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -4.747 19.205 -1.803 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -4.752 20.938 -2.065 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -7.032 20.625 -3.240 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -7.023 18.982 -2.632 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -6.705 21.413 -0.818 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -8.268 20.718 -1.204 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -6.005 19.118 0.066 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -7.228 19.955 1.001 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -7.822 17.668 0.694 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -8.928 18.651 -0.139 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -7.722 17.816 -0.994 1.00 0.00 H new ATOM 1791 N GLU B 23 -2.490 19.816 -5.141 1.00 0.00 N ATOM 1792 CA GLU B 23 -1.074 19.971 -5.455 1.00 0.00 C ATOM 1793 C GLU B 23 -0.205 18.795 -4.989 1.00 0.00 C ATOM 1794 O GLU B 23 1.014 18.932 -4.894 1.00 0.00 O ATOM 1795 CB GLU B 23 -0.534 21.319 -4.947 1.00 0.00 C ATOM 1796 CG GLU B 23 -1.355 22.506 -5.467 1.00 0.00 C ATOM 1797 CD GLU B 23 -0.690 23.831 -5.107 1.00 0.00 C ATOM 1798 OE1 GLU B 23 -0.893 24.277 -3.957 1.00 0.00 O ATOM 1799 OE2 GLU B 23 0.018 24.369 -5.985 1.00 0.00 O ATOM 0 H GLU B 23 -3.062 19.728 -5.981 1.00 0.00 H new ATOM 0 HA GLU B 23 -1.005 19.966 -6.543 1.00 0.00 H new ATOM 0 HB2 GLU B 23 -0.542 21.324 -3.857 1.00 0.00 H new ATOM 0 HB3 GLU B 23 0.504 21.433 -5.259 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -1.463 22.432 -6.549 1.00 0.00 H new ATOM 0 HG3 GLU B 23 -2.359 22.472 -5.043 1.00 0.00 H new ATOM 1806 N GLY B 24 -0.785 17.610 -4.796 1.00 0.00 N ATOM 1807 CA GLY B 24 -0.040 16.388 -4.526 1.00 0.00 C ATOM 1808 C GLY B 24 0.529 15.814 -5.823 1.00 0.00 C ATOM 1809 O GLY B 24 0.332 14.640 -6.143 1.00 0.00 O ATOM 0 H GLY B 24 -1.796 17.474 -4.824 1.00 0.00 H new ATOM 0 HA2 GLY B 24 0.770 16.595 -3.826 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -0.692 15.655 -4.051 1.00 0.00 H new ATOM 1813 N ASP B 25 1.235 16.655 -6.584 1.00 0.00 N ATOM 1814 CA ASP B 25 1.726 16.317 -7.912 1.00 0.00 C ATOM 1815 C ASP B 25 2.666 15.111 -7.843 1.00 0.00 C ATOM 1816 O ASP B 25 3.287 14.875 -6.812 1.00 0.00 O ATOM 1817 CB ASP B 25 2.414 17.539 -8.534 1.00 0.00 C ATOM 1818 CG ASP B 25 2.922 17.264 -9.947 1.00 0.00 C ATOM 1819 OD1 ASP B 25 2.233 16.507 -10.667 1.00 0.00 O ATOM 1820 OD2 ASP B 25 4.003 17.798 -10.275 1.00 0.00 O ATOM 0 H ASP B 25 1.482 17.599 -6.287 1.00 0.00 H new ATOM 0 HA ASP B 25 0.887 16.039 -8.550 1.00 0.00 H new ATOM 0 HB2 ASP B 25 1.713 18.374 -8.559 1.00 0.00 H new ATOM 0 HB3 ASP B 25 3.249 17.843 -7.903 1.00 0.00 H new ATOM 1825 N LYS B 26 2.750 14.341 -8.931 1.00 0.00 N ATOM 1826 CA LYS B 26 3.529 13.107 -9.026 1.00 0.00 C ATOM 1827 C LYS B 26 2.964 12.001 -8.119 1.00 0.00 C ATOM 1828 O LYS B 26 3.670 11.040 -7.820 1.00 0.00 O ATOM 1829 CB LYS B 26 5.023 13.354 -8.739 1.00 0.00 C ATOM 1830 CG LYS B 26 5.640 14.491 -9.572 1.00 0.00 C ATOM 1831 CD LYS B 26 6.883 15.081 -8.889 1.00 0.00 C ATOM 1832 CE LYS B 26 6.498 15.999 -7.717 1.00 0.00 C ATOM 1833 NZ LYS B 26 7.686 16.584 -7.072 1.00 0.00 N ATOM 0 H LYS B 26 2.261 14.568 -9.797 1.00 0.00 H new ATOM 0 HA LYS B 26 3.444 12.758 -10.055 1.00 0.00 H new ATOM 0 HB2 LYS B 26 5.146 13.585 -7.681 1.00 0.00 H new ATOM 0 HB3 LYS B 26 5.576 12.435 -8.931 1.00 0.00 H new ATOM 0 HG2 LYS B 26 5.910 14.115 -10.559 1.00 0.00 H new ATOM 0 HG3 LYS B 26 4.899 15.276 -9.722 1.00 0.00 H new ATOM 0 HD2 LYS B 26 7.519 14.273 -8.526 1.00 0.00 H new ATOM 0 HD3 LYS B 26 7.467 15.644 -9.617 1.00 0.00 H new ATOM 0 HE2 LYS B 26 5.849 16.797 -8.078 1.00 0.00 H new ATOM 0 HE3 LYS B 26 5.927 15.431 -6.982 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 7.413 17.013 -6.165 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 8.392 15.839 -6.904 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 8.093 17.314 -7.691 1.00 0.00 H new ATOM 1847 N HIS B 27 1.690 12.105 -7.718 1.00 0.00 N ATOM 1848 CA HIS B 27 1.011 11.149 -6.846 1.00 0.00 C ATOM 1849 C HIS B 27 1.619 11.224 -5.442 1.00 0.00 C ATOM 1850 O HIS B 27 2.210 10.268 -4.932 1.00 0.00 O ATOM 1851 CB HIS B 27 1.016 9.726 -7.434 1.00 0.00 C ATOM 1852 CG HIS B 27 0.812 9.681 -8.928 1.00 0.00 C ATOM 1853 ND1 HIS B 27 1.821 9.612 -9.860 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -0.368 9.838 -9.603 1.00 0.00 C ATOM 1855 CE1 HIS B 27 1.258 9.718 -11.074 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -0.073 9.866 -10.970 1.00 0.00 N ATOM 0 H HIS B 27 1.090 12.880 -8.002 1.00 0.00 H new ATOM 0 HA HIS B 27 -0.043 11.418 -6.770 1.00 0.00 H new ATOM 0 HB2 HIS B 27 1.965 9.247 -7.192 1.00 0.00 H new ATOM 0 HB3 HIS B 27 0.232 9.142 -6.952 1.00 0.00 H new ATOM 0 HD1 HIS B 27 2.816 9.501 -9.664 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.349 9.925 -9.160 1.00 0.00 H new ATOM 0 HE1 HIS B 27 1.801 9.688 -12.007 1.00 0.00 H new ATOM 1864 N THR B 28 1.483 12.390 -4.814 1.00 0.00 N ATOM 1865 CA THR B 28 2.041 12.680 -3.515 1.00 0.00 C ATOM 1866 C THR B 28 0.961 13.291 -2.624 1.00 0.00 C ATOM 1867 O THR B 28 -0.177 13.510 -3.042 1.00 0.00 O ATOM 1868 CB THR B 28 3.297 13.555 -3.643 1.00 0.00 C ATOM 1869 OG1 THR B 28 2.967 14.849 -4.093 1.00 0.00 O ATOM 1870 CG2 THR B 28 4.358 12.947 -4.567 1.00 0.00 C ATOM 0 H THR B 28 0.966 13.173 -5.214 1.00 0.00 H new ATOM 0 HA THR B 28 2.372 11.759 -3.035 1.00 0.00 H new ATOM 0 HB THR B 28 3.726 13.612 -2.643 1.00 0.00 H new ATOM 0 HG1 THR B 28 3.178 14.927 -5.047 1.00 0.00 H new ATOM 0 HG21 THR B 28 5.221 13.611 -4.617 1.00 0.00 H new ATOM 0 HG22 THR B 28 4.668 11.978 -4.177 1.00 0.00 H new ATOM 0 HG23 THR B 28 3.941 12.819 -5.566 1.00 0.00 H new ATOM 1878 N LEU B 29 1.338 13.460 -1.364 1.00 0.00 N ATOM 1879 CA LEU B 29 0.579 13.951 -0.237 1.00 0.00 C ATOM 1880 C LEU B 29 1.439 15.062 0.378 1.00 0.00 C ATOM 1881 O LEU B 29 2.444 14.778 1.029 1.00 0.00 O ATOM 1882 CB LEU B 29 0.356 12.753 0.701 1.00 0.00 C ATOM 1883 CG LEU B 29 -0.450 13.044 1.973 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -1.910 13.382 1.660 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -0.422 11.797 2.862 1.00 0.00 C ATOM 0 H LEU B 29 2.291 13.228 -1.083 1.00 0.00 H new ATOM 0 HA LEU B 29 -0.401 14.362 -0.478 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -0.153 11.968 0.142 1.00 0.00 H new ATOM 0 HB3 LEU B 29 1.329 12.357 0.992 1.00 0.00 H new ATOM 0 HG LEU B 29 -0.000 13.903 2.471 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -2.445 13.581 2.589 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -1.950 14.265 1.022 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -2.376 12.541 1.146 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -0.991 11.986 3.772 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -0.864 10.958 2.325 1.00 0.00 H new ATOM 0 HD23 LEU B 29 0.609 11.558 3.122 1.00 0.00 H new ATOM 1897 N SER B 30 1.101 16.328 0.115 1.00 0.00 N ATOM 1898 CA SER B 30 1.958 17.460 0.450 1.00 0.00 C ATOM 1899 C SER B 30 1.626 18.038 1.826 1.00 0.00 C ATOM 1900 O SER B 30 0.580 17.736 2.399 1.00 0.00 O ATOM 1901 CB SER B 30 1.827 18.537 -0.635 1.00 0.00 C ATOM 1902 OG SER B 30 0.514 19.069 -0.655 1.00 0.00 O ATOM 0 H SER B 30 0.225 16.593 -0.336 1.00 0.00 H new ATOM 0 HA SER B 30 2.989 17.108 0.493 1.00 0.00 H new ATOM 0 HB2 SER B 30 2.546 19.335 -0.451 1.00 0.00 H new ATOM 0 HB3 SER B 30 2.067 18.111 -1.609 1.00 0.00 H new ATOM 0 HG SER B 30 -0.089 18.435 -1.096 1.00 0.00 H new ATOM 1908 N LYS B 31 2.511 18.896 2.343 1.00 0.00 N ATOM 1909 CA LYS B 31 2.364 19.569 3.632 1.00 0.00 C ATOM 1910 C LYS B 31 0.950 20.135 3.812 1.00 0.00 C ATOM 1911 O LYS B 31 0.325 19.958 4.857 1.00 0.00 O ATOM 1912 CB LYS B 31 3.416 20.688 3.755 1.00 0.00 C ATOM 1913 CG LYS B 31 4.135 20.674 5.111 1.00 0.00 C ATOM 1914 CD LYS B 31 3.217 20.877 6.329 1.00 0.00 C ATOM 1915 CE LYS B 31 2.456 22.209 6.329 1.00 0.00 C ATOM 1916 NZ LYS B 31 3.366 23.365 6.256 1.00 0.00 N ATOM 0 H LYS B 31 3.374 19.147 1.860 1.00 0.00 H new ATOM 0 HA LYS B 31 2.524 18.836 4.423 1.00 0.00 H new ATOM 0 HB2 LYS B 31 4.151 20.581 2.957 1.00 0.00 H new ATOM 0 HB3 LYS B 31 2.932 21.654 3.614 1.00 0.00 H new ATOM 0 HG2 LYS B 31 4.656 19.723 5.221 1.00 0.00 H new ATOM 0 HG3 LYS B 31 4.895 21.456 5.112 1.00 0.00 H new ATOM 0 HD2 LYS B 31 2.496 20.060 6.367 1.00 0.00 H new ATOM 0 HD3 LYS B 31 3.817 20.815 7.237 1.00 0.00 H new ATOM 0 HE2 LYS B 31 1.769 22.234 5.483 1.00 0.00 H new ATOM 0 HE3 LYS B 31 1.851 22.281 7.233 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 2.816 24.245 6.327 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 4.049 23.319 7.039 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 3.877 23.348 5.350 1.00 0.00 H new ATOM 1930 N LYS B 32 0.452 20.821 2.778 1.00 0.00 N ATOM 1931 CA LYS B 32 -0.898 21.363 2.730 1.00 0.00 C ATOM 1932 C LYS B 32 -1.908 20.268 3.086 1.00 0.00 C ATOM 1933 O LYS B 32 -2.699 20.396 4.022 1.00 0.00 O ATOM 1934 CB LYS B 32 -1.155 21.904 1.315 1.00 0.00 C ATOM 1935 CG LYS B 32 -2.503 22.631 1.192 1.00 0.00 C ATOM 1936 CD LYS B 32 -3.123 22.419 -0.196 1.00 0.00 C ATOM 1937 CE LYS B 32 -2.223 22.864 -1.357 1.00 0.00 C ATOM 1938 NZ LYS B 32 -1.865 24.289 -1.267 1.00 0.00 N ATOM 0 H LYS B 32 0.993 21.016 1.936 1.00 0.00 H new ATOM 0 HA LYS B 32 -1.009 22.172 3.452 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -0.352 22.588 1.041 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -1.126 21.078 0.604 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -3.187 22.266 1.958 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -2.362 23.697 1.371 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -3.361 21.362 -0.319 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -4.064 22.966 -0.249 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -1.314 22.262 -1.362 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -2.733 22.678 -2.302 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -1.465 24.604 -2.174 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -2.715 24.848 -1.051 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -1.162 24.423 -0.513 1.00 0.00 H new ATOM 1952 N GLU B 33 -1.874 19.186 2.313 1.00 0.00 N ATOM 1953 CA GLU B 33 -2.792 18.076 2.453 1.00 0.00 C ATOM 1954 C GLU B 33 -2.667 17.471 3.847 1.00 0.00 C ATOM 1955 O GLU B 33 -3.681 17.172 4.474 1.00 0.00 O ATOM 1956 CB GLU B 33 -2.489 17.034 1.382 1.00 0.00 C ATOM 1957 CG GLU B 33 -2.668 17.589 -0.036 1.00 0.00 C ATOM 1958 CD GLU B 33 -2.018 16.649 -1.037 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -2.471 15.489 -1.091 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -1.012 17.068 -1.649 1.00 0.00 O ATOM 0 H GLU B 33 -1.195 19.061 1.562 1.00 0.00 H new ATOM 0 HA GLU B 33 -3.816 18.427 2.324 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -1.466 16.678 1.504 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -3.145 16.174 1.519 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -3.728 17.701 -0.262 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -2.220 18.580 -0.109 1.00 0.00 H new ATOM 1967 N LEU B 34 -1.434 17.306 4.336 1.00 0.00 N ATOM 1968 CA LEU B 34 -1.206 16.830 5.689 1.00 0.00 C ATOM 1969 C LEU B 34 -1.907 17.732 6.696 1.00 0.00 C ATOM 1970 O LEU B 34 -2.713 17.230 7.469 1.00 0.00 O ATOM 1971 CB LEU B 34 0.282 16.708 6.029 1.00 0.00 C ATOM 1972 CG LEU B 34 1.041 15.653 5.213 1.00 0.00 C ATOM 1973 CD1 LEU B 34 2.468 15.600 5.756 1.00 0.00 C ATOM 1974 CD2 LEU B 34 0.425 14.255 5.326 1.00 0.00 C ATOM 0 H LEU B 34 -0.582 17.497 3.808 1.00 0.00 H new ATOM 0 HA LEU B 34 -1.629 15.827 5.747 1.00 0.00 H new ATOM 0 HB2 LEU B 34 0.757 17.677 5.876 1.00 0.00 H new ATOM 0 HB3 LEU B 34 0.381 16.469 7.088 1.00 0.00 H new ATOM 0 HG LEU B 34 1.000 15.937 4.162 1.00 0.00 H new ATOM 0 HD11 LEU B 34 3.042 14.859 5.200 1.00 0.00 H new ATOM 0 HD12 LEU B 34 2.936 16.578 5.646 1.00 0.00 H new ATOM 0 HD13 LEU B 34 2.446 15.325 6.811 1.00 0.00 H new ATOM 0 HD21 LEU B 34 1.005 13.552 4.728 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.433 13.937 6.369 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -0.602 14.280 4.962 1.00 0.00 H new ATOM 1986 N LYS B 35 -1.636 19.042 6.719 1.00 0.00 N ATOM 1987 CA LYS B 35 -2.263 19.883 7.734 1.00 0.00 C ATOM 1988 C LYS B 35 -3.793 19.820 7.642 1.00 0.00 C ATOM 1989 O LYS B 35 -4.476 19.803 8.668 1.00 0.00 O ATOM 1990 CB LYS B 35 -1.710 21.316 7.759 1.00 0.00 C ATOM 1991 CG LYS B 35 -1.974 22.145 6.498 1.00 0.00 C ATOM 1992 CD LYS B 35 -1.624 23.615 6.760 1.00 0.00 C ATOM 1993 CE LYS B 35 -1.922 24.473 5.527 1.00 0.00 C ATOM 1994 NZ LYS B 35 -1.664 25.899 5.792 1.00 0.00 N ATOM 0 H LYS B 35 -1.012 19.524 6.072 1.00 0.00 H new ATOM 0 HA LYS B 35 -1.990 19.469 8.705 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -2.140 21.838 8.613 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -0.634 21.269 7.923 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -1.379 21.762 5.669 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -3.021 22.057 6.206 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -2.196 23.983 7.612 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -0.570 23.701 7.022 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -1.307 24.139 4.692 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -2.962 24.338 5.230 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -1.875 26.454 4.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -2.269 26.222 6.574 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -0.665 26.029 6.051 1.00 0.00 H new ATOM 2008 N GLU B 36 -4.353 19.773 6.429 1.00 0.00 N ATOM 2009 CA GLU B 36 -5.789 19.580 6.265 1.00 0.00 C ATOM 2010 C GLU B 36 -6.237 18.256 6.895 1.00 0.00 C ATOM 2011 O GLU B 36 -7.140 18.247 7.731 1.00 0.00 O ATOM 2012 CB GLU B 36 -6.183 19.697 4.786 1.00 0.00 C ATOM 2013 CG GLU B 36 -5.960 21.120 4.244 1.00 0.00 C ATOM 2014 CD GLU B 36 -6.764 22.169 5.007 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -8.003 22.157 4.838 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -6.131 22.943 5.760 1.00 0.00 O ATOM 0 H GLU B 36 -3.835 19.866 5.555 1.00 0.00 H new ATOM 0 HA GLU B 36 -6.316 20.372 6.797 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -5.600 18.989 4.198 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -7.231 19.423 4.667 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -4.900 21.366 4.303 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -6.236 21.151 3.190 1.00 0.00 H new ATOM 2023 N LEU B 37 -5.605 17.144 6.516 1.00 0.00 N ATOM 2024 CA LEU B 37 -5.924 15.832 7.062 1.00 0.00 C ATOM 2025 C LEU B 37 -5.848 15.859 8.589 1.00 0.00 C ATOM 2026 O LEU B 37 -6.804 15.471 9.249 1.00 0.00 O ATOM 2027 CB LEU B 37 -4.998 14.767 6.458 1.00 0.00 C ATOM 2028 CG LEU B 37 -5.234 13.358 7.031 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -6.646 12.831 6.752 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -4.217 12.396 6.409 1.00 0.00 C ATOM 0 H LEU B 37 -4.858 17.132 5.822 1.00 0.00 H new ATOM 0 HA LEU B 37 -6.947 15.568 6.792 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -5.142 14.741 5.378 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -3.962 15.054 6.635 1.00 0.00 H new ATOM 0 HG LEU B 37 -5.117 13.422 8.113 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -6.753 11.834 7.180 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -7.380 13.500 7.202 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -6.811 12.784 5.676 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -4.374 11.393 6.807 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -4.345 12.381 5.327 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -3.207 12.728 6.650 1.00 0.00 H new ATOM 2042 N ILE B 38 -4.733 16.333 9.149 1.00 0.00 N ATOM 2043 CA ILE B 38 -4.529 16.480 10.585 1.00 0.00 C ATOM 2044 C ILE B 38 -5.708 17.232 11.213 1.00 0.00 C ATOM 2045 O ILE B 38 -6.308 16.742 12.169 1.00 0.00 O ATOM 2046 CB ILE B 38 -3.181 17.180 10.853 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -1.975 16.332 10.393 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -3.023 17.587 12.326 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -1.580 15.211 11.355 1.00 0.00 C ATOM 0 H ILE B 38 -3.928 16.632 8.599 1.00 0.00 H new ATOM 0 HA ILE B 38 -4.488 15.497 11.053 1.00 0.00 H new ATOM 0 HB ILE B 38 -3.193 18.090 10.253 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -2.205 15.895 9.421 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -1.118 16.990 10.252 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -2.059 18.076 12.467 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.823 18.275 12.601 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.075 16.699 12.956 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -0.725 14.669 10.951 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -1.315 15.638 12.322 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -2.418 14.526 11.479 1.00 0.00 H new ATOM 2061 N GLN B 39 -6.058 18.410 10.682 1.00 0.00 N ATOM 2062 CA GLN B 39 -7.205 19.165 11.179 1.00 0.00 C ATOM 2063 C GLN B 39 -8.472 18.303 11.168 1.00 0.00 C ATOM 2064 O GLN B 39 -9.162 18.218 12.180 1.00 0.00 O ATOM 2065 CB GLN B 39 -7.408 20.447 10.363 1.00 0.00 C ATOM 2066 CG GLN B 39 -6.373 21.525 10.709 1.00 0.00 C ATOM 2067 CD GLN B 39 -6.376 22.621 9.649 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -6.909 23.706 9.852 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -5.796 22.315 8.495 1.00 0.00 N ATOM 0 H GLN B 39 -5.562 18.856 9.910 1.00 0.00 H new ATOM 0 HA GLN B 39 -7.001 19.450 12.211 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -7.345 20.213 9.300 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -8.410 20.836 10.545 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -6.597 21.954 11.686 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -5.381 21.078 10.777 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -5.364 21.400 8.368 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -5.782 22.995 7.735 1.00 0.00 H new ATOM 2078 N LYS B 40 -8.784 17.660 10.039 1.00 0.00 N ATOM 2079 CA LYS B 40 -9.978 16.825 9.938 1.00 0.00 C ATOM 2080 C LYS B 40 -9.951 15.665 10.943 1.00 0.00 C ATOM 2081 O LYS B 40 -10.967 15.377 11.572 1.00 0.00 O ATOM 2082 CB LYS B 40 -10.197 16.353 8.488 1.00 0.00 C ATOM 2083 CG LYS B 40 -11.296 17.163 7.778 1.00 0.00 C ATOM 2084 CD LYS B 40 -10.984 18.661 7.639 1.00 0.00 C ATOM 2085 CE LYS B 40 -10.064 18.950 6.449 1.00 0.00 C ATOM 2086 NZ LYS B 40 -9.528 20.321 6.523 1.00 0.00 N ATOM 0 H LYS B 40 -8.226 17.703 9.186 1.00 0.00 H new ATOM 0 HA LYS B 40 -10.840 17.435 10.208 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -9.264 16.444 7.932 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -10.467 15.297 8.487 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -11.457 16.743 6.785 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -12.230 17.047 8.328 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -11.915 19.215 7.520 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -10.515 19.020 8.555 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -9.243 18.234 6.436 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -10.615 18.820 5.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -9.048 20.555 5.630 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -10.308 20.990 6.683 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -8.849 20.386 7.308 1.00 0.00 H new ATOM 2100 N GLU B 41 -8.804 15.003 11.108 1.00 0.00 N ATOM 2101 CA GLU B 41 -8.619 13.978 12.123 1.00 0.00 C ATOM 2102 C GLU B 41 -8.837 14.548 13.529 1.00 0.00 C ATOM 2103 O GLU B 41 -9.402 13.872 14.386 1.00 0.00 O ATOM 2104 CB GLU B 41 -7.217 13.370 11.997 1.00 0.00 C ATOM 2105 CG GLU B 41 -7.072 12.488 10.751 1.00 0.00 C ATOM 2106 CD GLU B 41 -5.662 11.912 10.653 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -4.717 12.729 10.675 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -5.552 10.669 10.564 1.00 0.00 O ATOM 0 H GLU B 41 -7.976 15.168 10.535 1.00 0.00 H new ATOM 0 HA GLU B 41 -9.361 13.195 11.965 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -6.479 14.171 11.960 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -7.000 12.777 12.886 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -7.799 11.677 10.788 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -7.293 13.073 9.858 1.00 0.00 H new ATOM 2115 N LEU B 42 -8.374 15.771 13.796 1.00 0.00 N ATOM 2116 CA LEU B 42 -8.467 16.381 15.116 1.00 0.00 C ATOM 2117 C LEU B 42 -9.917 16.793 15.411 1.00 0.00 C ATOM 2118 O LEU B 42 -10.260 17.973 15.404 1.00 0.00 O ATOM 2119 CB LEU B 42 -7.468 17.547 15.207 1.00 0.00 C ATOM 2120 CG LEU B 42 -7.325 18.156 16.614 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -6.805 17.140 17.640 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -6.352 19.338 16.540 1.00 0.00 C ATOM 0 H LEU B 42 -7.924 16.364 13.099 1.00 0.00 H new ATOM 0 HA LEU B 42 -8.194 15.663 15.890 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -6.490 17.198 14.875 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -7.779 18.330 14.516 1.00 0.00 H new ATOM 0 HG LEU B 42 -8.313 18.477 16.943 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -6.722 17.618 18.616 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -7.498 16.301 17.705 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -5.825 16.778 17.329 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -6.241 19.780 17.530 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -5.382 18.989 16.187 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -6.741 20.087 15.850 1.00 0.00 H new ATOM 2134 N THR B 43 -10.774 15.804 15.676 1.00 0.00 N ATOM 2135 CA THR B 43 -12.194 15.982 15.939 1.00 0.00 C ATOM 2136 C THR B 43 -12.670 14.932 16.952 1.00 0.00 C ATOM 2137 O THR B 43 -11.879 14.452 17.769 1.00 0.00 O ATOM 2138 CB THR B 43 -12.961 15.975 14.600 1.00 0.00 C ATOM 2139 OG1 THR B 43 -14.319 16.319 14.802 1.00 0.00 O ATOM 2140 CG2 THR B 43 -12.907 14.624 13.879 1.00 0.00 C ATOM 0 H THR B 43 -10.483 14.827 15.713 1.00 0.00 H new ATOM 0 HA THR B 43 -12.395 16.948 16.402 1.00 0.00 H new ATOM 0 HB THR B 43 -12.464 16.713 13.971 1.00 0.00 H new ATOM 0 HG1 THR B 43 -14.790 16.311 13.943 1.00 0.00 H new ATOM 0 HG21 THR B 43 -13.466 14.687 12.945 1.00 0.00 H new ATOM 0 HG22 THR B 43 -11.870 14.367 13.665 1.00 0.00 H new ATOM 0 HG23 THR B 43 -13.347 13.855 14.514 1.00 0.00 H new ATOM 2148 N ILE B 44 -13.963 14.595 16.908 1.00 0.00 N ATOM 2149 CA ILE B 44 -14.684 13.752 17.858 1.00 0.00 C ATOM 2150 C ILE B 44 -14.273 12.268 17.786 1.00 0.00 C ATOM 2151 O ILE B 44 -15.059 11.383 17.463 1.00 0.00 O ATOM 2152 CB ILE B 44 -16.203 14.020 17.724 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -17.071 13.315 18.783 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -16.761 13.706 16.325 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -16.632 13.608 20.221 1.00 0.00 C ATOM 0 H ILE B 44 -14.570 14.927 16.158 1.00 0.00 H new ATOM 0 HA ILE B 44 -14.398 14.027 18.873 1.00 0.00 H new ATOM 0 HB ILE B 44 -16.273 15.094 17.898 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -18.108 13.625 18.657 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -17.037 12.239 18.612 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -17.830 13.917 16.304 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -16.254 14.324 15.584 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -16.594 12.654 16.095 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -17.286 13.080 20.916 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -15.605 13.272 20.363 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -16.693 14.680 20.409 1.00 0.00 H new ATOM 2167 N GLY B 45 -13.021 11.995 18.146 1.00 0.00 N ATOM 2168 CA GLY B 45 -12.467 10.666 18.370 1.00 0.00 C ATOM 2169 C GLY B 45 -11.085 10.836 18.995 1.00 0.00 C ATOM 2170 O GLY B 45 -10.148 10.104 18.673 1.00 0.00 O ATOM 0 H GLY B 45 -12.333 12.733 18.296 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -13.115 10.088 19.028 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -12.397 10.118 17.430 1.00 0.00 H new ATOM 2174 N SER B 46 -10.986 11.817 19.900 1.00 0.00 N ATOM 2175 CA SER B 46 -9.795 12.425 20.471 1.00 0.00 C ATOM 2176 C SER B 46 -9.042 11.540 21.469 1.00 0.00 C ATOM 2177 O SER B 46 -8.663 11.978 22.552 1.00 0.00 O ATOM 2178 CB SER B 46 -10.231 13.757 21.100 1.00 0.00 C ATOM 2179 OG SER B 46 -11.384 14.262 20.436 1.00 0.00 O ATOM 0 H SER B 46 -11.829 12.243 20.285 1.00 0.00 H new ATOM 0 HA SER B 46 -9.067 12.579 19.675 1.00 0.00 H new ATOM 0 HB2 SER B 46 -10.446 13.614 22.159 1.00 0.00 H new ATOM 0 HB3 SER B 46 -9.419 14.481 21.035 1.00 0.00 H new ATOM 0 HG SER B 46 -11.239 14.241 19.467 1.00 0.00 H new ATOM 2185 N LYS B 47 -8.811 10.293 21.076 1.00 0.00 N ATOM 2186 CA LYS B 47 -7.945 9.343 21.744 1.00 0.00 C ATOM 2187 C LYS B 47 -7.381 8.445 20.648 1.00 0.00 C ATOM 2188 O LYS B 47 -6.222 8.583 20.265 1.00 0.00 O ATOM 2189 CB LYS B 47 -8.732 8.584 22.826 1.00 0.00 C ATOM 2190 CG LYS B 47 -7.954 7.440 23.494 1.00 0.00 C ATOM 2191 CD LYS B 47 -6.660 7.928 24.163 1.00 0.00 C ATOM 2192 CE LYS B 47 -5.932 6.792 24.895 1.00 0.00 C ATOM 2193 NZ LYS B 47 -6.717 6.264 26.025 1.00 0.00 N ATOM 0 H LYS B 47 -9.247 9.903 20.241 1.00 0.00 H new ATOM 0 HA LYS B 47 -7.120 9.819 22.275 1.00 0.00 H new ATOM 0 HB2 LYS B 47 -9.044 9.292 23.594 1.00 0.00 H new ATOM 0 HB3 LYS B 47 -9.639 8.177 22.380 1.00 0.00 H new ATOM 0 HG2 LYS B 47 -8.587 6.960 24.240 1.00 0.00 H new ATOM 0 HG3 LYS B 47 -7.712 6.684 22.747 1.00 0.00 H new ATOM 0 HD2 LYS B 47 -6.000 8.356 23.408 1.00 0.00 H new ATOM 0 HD3 LYS B 47 -6.894 8.724 24.870 1.00 0.00 H new ATOM 0 HE2 LYS B 47 -5.722 5.985 24.193 1.00 0.00 H new ATOM 0 HE3 LYS B 47 -4.971 7.155 25.260 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 -6.115 5.649 26.609 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 -7.069 7.054 26.603 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 -7.522 5.715 25.662 1.00 0.00 H new ATOM 2207 N LEU B 48 -8.228 7.575 20.092 1.00 0.00 N ATOM 2208 CA LEU B 48 -7.866 6.696 18.989 1.00 0.00 C ATOM 2209 C LEU B 48 -7.369 7.527 17.807 1.00 0.00 C ATOM 2210 O LEU B 48 -6.268 7.306 17.302 1.00 0.00 O ATOM 2211 CB LEU B 48 -9.082 5.823 18.631 1.00 0.00 C ATOM 2212 CG LEU B 48 -8.883 4.771 17.522 1.00 0.00 C ATOM 2213 CD1 LEU B 48 -8.914 5.356 16.103 1.00 0.00 C ATOM 2214 CD2 LEU B 48 -7.618 3.930 17.727 1.00 0.00 C ATOM 0 H LEU B 48 -9.193 7.464 20.402 1.00 0.00 H new ATOM 0 HA LEU B 48 -7.050 6.032 19.274 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -9.406 5.306 19.534 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -9.896 6.482 18.331 1.00 0.00 H new ATOM 0 HG LEU B 48 -9.747 4.113 17.613 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -8.767 4.557 15.377 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -9.878 5.834 15.927 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -8.119 6.094 15.996 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -7.528 3.206 16.918 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -6.744 4.582 17.730 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -7.681 3.404 18.679 1.00 0.00 H new ATOM 2226 N GLN B 49 -8.168 8.503 17.368 1.00 0.00 N ATOM 2227 CA GLN B 49 -7.818 9.287 16.196 1.00 0.00 C ATOM 2228 C GLN B 49 -6.544 10.095 16.454 1.00 0.00 C ATOM 2229 O GLN B 49 -5.766 10.319 15.531 1.00 0.00 O ATOM 2230 CB GLN B 49 -9.006 10.162 15.778 1.00 0.00 C ATOM 2231 CG GLN B 49 -8.781 10.965 14.494 1.00 0.00 C ATOM 2232 CD GLN B 49 -8.380 10.127 13.286 1.00 0.00 C ATOM 2233 OE1 GLN B 49 -9.224 9.698 12.508 1.00 0.00 O ATOM 2234 NE2 GLN B 49 -7.085 9.905 13.104 1.00 0.00 N ATOM 0 H GLN B 49 -9.052 8.762 17.806 1.00 0.00 H new ATOM 0 HA GLN B 49 -7.600 8.622 15.360 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -9.881 9.526 15.645 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -9.235 10.854 16.589 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -9.695 11.509 14.256 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -8.006 11.709 14.677 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -6.406 10.275 13.769 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -6.768 9.364 12.299 1.00 0.00 H new ATOM 2243 N ASP B 50 -6.302 10.516 17.698 1.00 0.00 N ATOM 2244 CA ASP B 50 -5.096 11.268 18.015 1.00 0.00 C ATOM 2245 C ASP B 50 -3.872 10.357 18.052 1.00 0.00 C ATOM 2246 O ASP B 50 -2.823 10.716 17.524 1.00 0.00 O ATOM 2247 CB ASP B 50 -5.223 12.024 19.332 1.00 0.00 C ATOM 2248 CG ASP B 50 -6.320 13.087 19.341 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -6.730 13.520 18.242 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -6.740 13.448 20.461 1.00 0.00 O ATOM 0 H ASP B 50 -6.921 10.349 18.491 1.00 0.00 H new ATOM 0 HA ASP B 50 -4.966 12.001 17.219 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -5.419 11.309 20.131 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -4.269 12.501 19.558 1.00 0.00 H new ATOM 2255 N ALA B 51 -3.995 9.167 18.643 1.00 0.00 N ATOM 2256 CA ALA B 51 -2.953 8.154 18.538 1.00 0.00 C ATOM 2257 C ALA B 51 -2.630 7.927 17.060 1.00 0.00 C ATOM 2258 O ALA B 51 -1.464 7.900 16.665 1.00 0.00 O ATOM 2259 CB ALA B 51 -3.399 6.862 19.228 1.00 0.00 C ATOM 0 H ALA B 51 -4.804 8.885 19.197 1.00 0.00 H new ATOM 0 HA ALA B 51 -2.048 8.492 19.043 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -2.612 6.113 19.142 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -3.597 7.062 20.281 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -4.307 6.490 18.752 1.00 0.00 H new ATOM 2265 N GLU B 52 -3.674 7.830 16.232 1.00 0.00 N ATOM 2266 CA GLU B 52 -3.507 7.760 14.793 1.00 0.00 C ATOM 2267 C GLU B 52 -2.838 9.026 14.240 1.00 0.00 C ATOM 2268 O GLU B 52 -2.004 8.893 13.352 1.00 0.00 O ATOM 2269 CB GLU B 52 -4.834 7.415 14.105 1.00 0.00 C ATOM 2270 CG GLU B 52 -4.644 7.214 12.596 1.00 0.00 C ATOM 2271 CD GLU B 52 -5.944 6.808 11.914 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -6.221 5.589 11.896 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -6.638 7.728 11.430 1.00 0.00 O ATOM 0 H GLU B 52 -4.645 7.799 16.544 1.00 0.00 H new ATOM 0 HA GLU B 52 -2.822 6.944 14.562 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -5.249 6.509 14.545 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -5.555 8.214 14.280 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -4.272 8.136 12.150 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -3.888 6.448 12.423 1.00 0.00 H new ATOM 2280 N ILE B 53 -3.141 10.236 14.737 1.00 0.00 N ATOM 2281 CA ILE B 53 -2.423 11.432 14.286 1.00 0.00 C ATOM 2282 C ILE B 53 -0.925 11.262 14.552 1.00 0.00 C ATOM 2283 O ILE B 53 -0.112 11.481 13.657 1.00 0.00 O ATOM 2284 CB ILE B 53 -2.989 12.727 14.914 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -4.304 13.113 14.214 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -1.979 13.882 14.821 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -5.066 14.233 14.932 1.00 0.00 C ATOM 0 H ILE B 53 -3.863 10.408 15.437 1.00 0.00 H new ATOM 0 HA ILE B 53 -2.572 11.540 13.212 1.00 0.00 H new ATOM 0 HB ILE B 53 -3.182 12.538 15.970 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -4.086 13.428 13.193 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -4.944 12.233 14.146 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -2.408 14.777 15.271 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -1.066 13.611 15.351 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -1.746 14.078 13.774 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -5.983 14.457 14.387 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -5.314 13.913 15.944 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -4.443 15.126 14.976 1.00 0.00 H new ATOM 2299 N VAL B 54 -0.554 10.874 15.774 1.00 0.00 N ATOM 2300 CA VAL B 54 0.848 10.682 16.132 1.00 0.00 C ATOM 2301 C VAL B 54 1.485 9.641 15.205 1.00 0.00 C ATOM 2302 O VAL B 54 2.531 9.895 14.604 1.00 0.00 O ATOM 2303 CB VAL B 54 0.975 10.308 17.621 1.00 0.00 C ATOM 2304 CG1 VAL B 54 2.430 9.993 17.996 1.00 0.00 C ATOM 2305 CG2 VAL B 54 0.487 11.460 18.510 1.00 0.00 C ATOM 0 H VAL B 54 -1.209 10.687 16.533 1.00 0.00 H new ATOM 0 HA VAL B 54 1.394 11.615 15.995 1.00 0.00 H new ATOM 0 HB VAL B 54 0.360 9.422 17.782 1.00 0.00 H new ATOM 0 HG11 VAL B 54 2.485 9.733 19.053 1.00 0.00 H new ATOM 0 HG12 VAL B 54 2.787 9.155 17.397 1.00 0.00 H new ATOM 0 HG13 VAL B 54 3.052 10.867 17.804 1.00 0.00 H new ATOM 0 HG21 VAL B 54 0.584 11.177 19.558 1.00 0.00 H new ATOM 0 HG22 VAL B 54 1.088 12.349 18.317 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -0.558 11.674 18.288 1.00 0.00 H new ATOM 2315 N LYS B 55 0.854 8.468 15.084 1.00 0.00 N ATOM 2316 CA LYS B 55 1.360 7.385 14.253 1.00 0.00 C ATOM 2317 C LYS B 55 1.526 7.844 12.803 1.00 0.00 C ATOM 2318 O LYS B 55 2.570 7.606 12.203 1.00 0.00 O ATOM 2319 CB LYS B 55 0.432 6.170 14.363 1.00 0.00 C ATOM 2320 CG LYS B 55 1.004 4.948 13.629 1.00 0.00 C ATOM 2321 CD LYS B 55 0.064 3.754 13.840 1.00 0.00 C ATOM 2322 CE LYS B 55 0.420 2.558 12.950 1.00 0.00 C ATOM 2323 NZ LYS B 55 1.760 2.020 13.238 1.00 0.00 N ATOM 0 H LYS B 55 -0.020 8.249 15.561 1.00 0.00 H new ATOM 0 HA LYS B 55 2.347 7.091 14.610 1.00 0.00 H new ATOM 0 HB2 LYS B 55 0.278 5.924 15.414 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -0.544 6.419 13.948 1.00 0.00 H new ATOM 0 HG2 LYS B 55 1.108 5.162 12.565 1.00 0.00 H new ATOM 0 HG3 LYS B 55 2.000 4.714 14.006 1.00 0.00 H new ATOM 0 HD2 LYS B 55 0.101 3.448 14.885 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -0.961 4.063 13.634 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -0.322 1.772 13.090 1.00 0.00 H new ATOM 0 HE3 LYS B 55 0.370 2.860 11.904 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 1.953 1.214 12.610 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 2.473 2.760 13.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 1.802 1.706 14.228 1.00 0.00 H new ATOM 2337 N LEU B 56 0.500 8.489 12.243 1.00 0.00 N ATOM 2338 CA LEU B 56 0.520 9.065 10.907 1.00 0.00 C ATOM 2339 C LEU B 56 1.731 9.984 10.777 1.00 0.00 C ATOM 2340 O LEU B 56 2.599 9.745 9.942 1.00 0.00 O ATOM 2341 CB LEU B 56 -0.799 9.819 10.653 1.00 0.00 C ATOM 2342 CG LEU B 56 -0.877 10.520 9.285 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -1.298 9.543 8.184 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -1.906 11.651 9.349 1.00 0.00 C ATOM 0 H LEU B 56 -0.389 8.626 12.724 1.00 0.00 H new ATOM 0 HA LEU B 56 0.606 8.281 10.154 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -1.627 9.115 10.735 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.935 10.564 11.437 1.00 0.00 H new ATOM 0 HG LEU B 56 0.113 10.912 9.051 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -1.344 10.068 7.230 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -0.571 8.734 8.118 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -2.279 9.131 8.419 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -1.961 12.148 8.380 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -2.883 11.240 9.603 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.607 12.372 10.110 1.00 0.00 H new ATOM 2356 N MET B 57 1.788 11.031 11.605 1.00 0.00 N ATOM 2357 CA MET B 57 2.843 12.029 11.550 1.00 0.00 C ATOM 2358 C MET B 57 4.204 11.335 11.551 1.00 0.00 C ATOM 2359 O MET B 57 4.990 11.528 10.627 1.00 0.00 O ATOM 2360 CB MET B 57 2.665 13.030 12.702 1.00 0.00 C ATOM 2361 CG MET B 57 3.566 14.266 12.565 1.00 0.00 C ATOM 2362 SD MET B 57 5.322 14.033 12.943 1.00 0.00 S ATOM 2363 CE MET B 57 5.933 15.700 12.615 1.00 0.00 C ATOM 0 H MET B 57 1.096 11.205 12.334 1.00 0.00 H new ATOM 0 HA MET B 57 2.785 12.603 10.625 1.00 0.00 H new ATOM 0 HB2 MET B 57 1.623 13.349 12.742 1.00 0.00 H new ATOM 0 HB3 MET B 57 2.882 12.531 13.647 1.00 0.00 H new ATOM 0 HG2 MET B 57 3.483 14.637 11.543 1.00 0.00 H new ATOM 0 HG3 MET B 57 3.177 15.046 13.219 1.00 0.00 H new ATOM 0 HE1 MET B 57 7.007 15.737 12.799 1.00 0.00 H new ATOM 0 HE2 MET B 57 5.734 15.963 11.576 1.00 0.00 H new ATOM 0 HE3 MET B 57 5.428 16.408 13.272 1.00 0.00 H new ATOM 2373 N ASP B 58 4.462 10.491 12.555 1.00 0.00 N ATOM 2374 CA ASP B 58 5.716 9.758 12.651 1.00 0.00 C ATOM 2375 C ASP B 58 5.986 8.954 11.376 1.00 0.00 C ATOM 2376 O ASP B 58 7.011 9.146 10.723 1.00 0.00 O ATOM 2377 CB ASP B 58 5.697 8.846 13.884 1.00 0.00 C ATOM 2378 CG ASP B 58 7.014 8.088 14.024 1.00 0.00 C ATOM 2379 OD1 ASP B 58 7.130 7.013 13.394 1.00 0.00 O ATOM 2380 OD2 ASP B 58 7.890 8.602 14.751 1.00 0.00 O ATOM 0 H ASP B 58 3.809 10.302 13.316 1.00 0.00 H new ATOM 0 HA ASP B 58 6.529 10.476 12.761 1.00 0.00 H new ATOM 0 HB2 ASP B 58 5.520 9.442 14.779 1.00 0.00 H new ATOM 0 HB3 ASP B 58 4.872 8.138 13.804 1.00 0.00 H new ATOM 2385 N ASP B 59 5.081 8.029 11.044 1.00 0.00 N ATOM 2386 CA ASP B 59 5.255 7.079 9.954 1.00 0.00 C ATOM 2387 C ASP B 59 5.522 7.792 8.629 1.00 0.00 C ATOM 2388 O ASP B 59 6.383 7.371 7.862 1.00 0.00 O ATOM 2389 CB ASP B 59 4.023 6.175 9.853 1.00 0.00 C ATOM 2390 CG ASP B 59 4.229 5.071 8.821 1.00 0.00 C ATOM 2391 OD1 ASP B 59 3.892 5.317 7.644 1.00 0.00 O ATOM 2392 OD2 ASP B 59 4.705 3.992 9.234 1.00 0.00 O ATOM 0 H ASP B 59 4.194 7.922 11.536 1.00 0.00 H new ATOM 0 HA ASP B 59 6.128 6.463 10.169 1.00 0.00 H new ATOM 0 HB2 ASP B 59 3.814 5.731 10.826 1.00 0.00 H new ATOM 0 HB3 ASP B 59 3.152 6.772 9.581 1.00 0.00 H new ATOM 2397 N LEU B 60 4.774 8.860 8.348 1.00 0.00 N ATOM 2398 CA LEU B 60 4.922 9.601 7.106 1.00 0.00 C ATOM 2399 C LEU B 60 6.167 10.489 7.141 1.00 0.00 C ATOM 2400 O LEU B 60 6.869 10.592 6.135 1.00 0.00 O ATOM 2401 CB LEU B 60 3.659 10.425 6.816 1.00 0.00 C ATOM 2402 CG LEU B 60 2.562 9.608 6.112 1.00 0.00 C ATOM 2403 CD1 LEU B 60 2.008 8.465 6.959 1.00 0.00 C ATOM 2404 CD2 LEU B 60 1.406 10.534 5.735 1.00 0.00 C ATOM 0 H LEU B 60 4.056 9.229 8.972 1.00 0.00 H new ATOM 0 HA LEU B 60 5.052 8.885 6.295 1.00 0.00 H new ATOM 0 HB2 LEU B 60 3.266 10.821 7.753 1.00 0.00 H new ATOM 0 HB3 LEU B 60 3.924 11.280 6.195 1.00 0.00 H new ATOM 0 HG LEU B 60 3.028 9.162 5.233 1.00 0.00 H new ATOM 0 HD11 LEU B 60 1.239 7.935 6.397 1.00 0.00 H new ATOM 0 HD12 LEU B 60 2.814 7.776 7.211 1.00 0.00 H new ATOM 0 HD13 LEU B 60 1.575 8.868 7.875 1.00 0.00 H new ATOM 0 HD21 LEU B 60 0.627 9.958 5.236 1.00 0.00 H new ATOM 0 HD22 LEU B 60 0.998 10.992 6.636 1.00 0.00 H new ATOM 0 HD23 LEU B 60 1.768 11.313 5.064 1.00 0.00 H new ATOM 2416 N ASP B 61 6.444 11.160 8.265 1.00 0.00 N ATOM 2417 CA ASP B 61 7.494 12.170 8.332 1.00 0.00 C ATOM 2418 C ASP B 61 8.895 11.562 8.438 1.00 0.00 C ATOM 2419 O ASP B 61 9.652 11.860 9.361 1.00 0.00 O ATOM 2420 CB ASP B 61 7.229 13.181 9.459 1.00 0.00 C ATOM 2421 CG ASP B 61 8.233 14.338 9.468 1.00 0.00 C ATOM 2422 OD1 ASP B 61 8.952 14.505 8.456 1.00 0.00 O ATOM 2423 OD2 ASP B 61 8.251 15.057 10.490 1.00 0.00 O ATOM 0 H ASP B 61 5.948 11.016 9.145 1.00 0.00 H new ATOM 0 HA ASP B 61 7.465 12.710 7.386 1.00 0.00 H new ATOM 0 HB2 ASP B 61 6.221 13.582 9.352 1.00 0.00 H new ATOM 0 HB3 ASP B 61 7.267 12.666 10.419 1.00 0.00 H new ATOM 2428 N ARG B 62 9.295 10.770 7.445 1.00 0.00 N ATOM 2429 CA ARG B 62 10.689 10.383 7.282 1.00 0.00 C ATOM 2430 C ARG B 62 11.354 11.577 6.587 1.00 0.00 C ATOM 2431 O ARG B 62 11.745 11.502 5.424 1.00 0.00 O ATOM 2432 CB ARG B 62 10.789 9.067 6.491 1.00 0.00 C ATOM 2433 CG ARG B 62 10.908 7.839 7.407 1.00 0.00 C ATOM 2434 CD ARG B 62 9.779 7.690 8.433 1.00 0.00 C ATOM 2435 NE ARG B 62 9.945 6.436 9.182 1.00 0.00 N ATOM 2436 CZ ARG B 62 9.415 6.154 10.382 1.00 0.00 C ATOM 2437 NH1 ARG B 62 8.613 7.019 11.010 1.00 0.00 N ATOM 2438 NH2 ARG B 62 9.695 4.983 10.961 1.00 0.00 N ATOM 0 H ARG B 62 8.668 10.384 6.740 1.00 0.00 H new ATOM 0 HA ARG B 62 11.195 10.174 8.225 1.00 0.00 H new ATOM 0 HB2 ARG B 62 9.909 8.960 5.857 1.00 0.00 H new ATOM 0 HB3 ARG B 62 11.655 9.109 5.830 1.00 0.00 H new ATOM 0 HG2 ARG B 62 10.937 6.943 6.787 1.00 0.00 H new ATOM 0 HG3 ARG B 62 11.858 7.890 7.938 1.00 0.00 H new ATOM 0 HD2 ARG B 62 9.785 8.537 9.119 1.00 0.00 H new ATOM 0 HD3 ARG B 62 8.813 7.697 7.927 1.00 0.00 H new ATOM 0 HE ARG B 62 10.517 5.712 8.748 1.00 0.00 H new ATOM 0 HH11 ARG B 62 8.392 7.916 10.578 1.00 0.00 H new ATOM 0 HH12 ARG B 62 8.222 6.782 11.922 1.00 0.00 H new ATOM 0 HH21 ARG B 62 10.306 4.315 10.491 1.00 0.00 H new ATOM 0 HH22 ARG B 62 9.298 4.757 11.873 1.00 0.00 H new ATOM 2452 N ASN B 63 11.386 12.724 7.279 1.00 0.00 N ATOM 2453 CA ASN B 63 11.837 14.030 6.793 1.00 0.00 C ATOM 2454 C ASN B 63 10.887 14.645 5.753 1.00 0.00 C ATOM 2455 O ASN B 63 10.645 15.853 5.779 1.00 0.00 O ATOM 2456 CB ASN B 63 13.279 13.959 6.261 1.00 0.00 C ATOM 2457 CG ASN B 63 14.030 15.295 6.274 1.00 0.00 C ATOM 2458 OD1 ASN B 63 15.247 15.306 6.418 1.00 0.00 O ATOM 2459 ND2 ASN B 63 13.359 16.435 6.131 1.00 0.00 N ATOM 0 H ASN B 63 11.079 12.765 8.251 1.00 0.00 H new ATOM 0 HA ASN B 63 11.823 14.700 7.653 1.00 0.00 H new ATOM 0 HB2 ASN B 63 13.837 13.237 6.857 1.00 0.00 H new ATOM 0 HB3 ASN B 63 13.257 13.579 5.240 1.00 0.00 H new ATOM 0 HD21 ASN B 63 13.857 17.325 6.141 1.00 0.00 H new ATOM 0 HD22 ASN B 63 12.346 16.419 6.012 1.00 0.00 H new ATOM 2466 N LYS B 64 10.362 13.848 4.820 1.00 0.00 N ATOM 2467 CA LYS B 64 9.628 14.296 3.641 1.00 0.00 C ATOM 2468 C LYS B 64 8.234 14.886 3.921 1.00 0.00 C ATOM 2469 O LYS B 64 7.416 14.931 3.006 1.00 0.00 O ATOM 2470 CB LYS B 64 9.509 13.111 2.668 1.00 0.00 C ATOM 2471 CG LYS B 64 10.862 12.625 2.130 1.00 0.00 C ATOM 2472 CD LYS B 64 10.702 11.362 1.267 1.00 0.00 C ATOM 2473 CE LYS B 64 9.695 11.507 0.116 1.00 0.00 C ATOM 2474 NZ LYS B 64 9.978 12.676 -0.735 1.00 0.00 N ATOM 0 H LYS B 64 10.441 12.832 4.870 1.00 0.00 H new ATOM 0 HA LYS B 64 10.199 15.122 3.216 1.00 0.00 H new ATOM 0 HB2 LYS B 64 9.009 12.284 3.173 1.00 0.00 H new ATOM 0 HB3 LYS B 64 8.876 13.401 1.829 1.00 0.00 H new ATOM 0 HG2 LYS B 64 11.325 13.415 1.539 1.00 0.00 H new ATOM 0 HG3 LYS B 64 11.533 12.416 2.963 1.00 0.00 H new ATOM 0 HD2 LYS B 64 11.674 11.094 0.853 1.00 0.00 H new ATOM 0 HD3 LYS B 64 10.389 10.536 1.906 1.00 0.00 H new ATOM 0 HE2 LYS B 64 9.713 10.604 -0.494 1.00 0.00 H new ATOM 0 HE3 LYS B 64 8.689 11.595 0.526 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 9.920 12.399 -1.736 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 9.281 13.423 -0.541 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 10.933 13.032 -0.529 1.00 0.00 H new ATOM 2488 N ASP B 65 7.951 15.399 5.126 1.00 0.00 N ATOM 2489 CA ASP B 65 6.644 15.963 5.489 1.00 0.00 C ATOM 2490 C ASP B 65 6.119 16.955 4.442 1.00 0.00 C ATOM 2491 O ASP B 65 4.918 17.084 4.226 1.00 0.00 O ATOM 2492 CB ASP B 65 6.754 16.658 6.850 1.00 0.00 C ATOM 2493 CG ASP B 65 5.391 17.064 7.396 1.00 0.00 C ATOM 2494 OD1 ASP B 65 4.727 16.174 7.971 1.00 0.00 O ATOM 2495 OD2 ASP B 65 5.044 18.255 7.248 1.00 0.00 O ATOM 0 H ASP B 65 8.631 15.434 5.885 1.00 0.00 H new ATOM 0 HA ASP B 65 5.932 15.139 5.536 1.00 0.00 H new ATOM 0 HB2 ASP B 65 7.244 15.991 7.559 1.00 0.00 H new ATOM 0 HB3 ASP B 65 7.385 17.542 6.756 1.00 0.00 H new ATOM 2500 N GLN B 66 7.047 17.661 3.797 1.00 0.00 N ATOM 2501 CA GLN B 66 6.783 18.647 2.765 1.00 0.00 C ATOM 2502 C GLN B 66 6.017 18.026 1.593 1.00 0.00 C ATOM 2503 O GLN B 66 5.045 18.600 1.099 1.00 0.00 O ATOM 2504 CB GLN B 66 8.103 19.281 2.290 1.00 0.00 C ATOM 2505 CG GLN B 66 8.861 20.067 3.379 1.00 0.00 C ATOM 2506 CD GLN B 66 9.382 19.196 4.521 1.00 0.00 C ATOM 2507 OE1 GLN B 66 9.096 19.447 5.685 1.00 0.00 O ATOM 2508 NE2 GLN B 66 10.093 18.119 4.192 1.00 0.00 N ATOM 0 H GLN B 66 8.042 17.553 3.992 1.00 0.00 H new ATOM 0 HA GLN B 66 6.155 19.431 3.188 1.00 0.00 H new ATOM 0 HB2 GLN B 66 8.753 18.494 1.908 1.00 0.00 H new ATOM 0 HB3 GLN B 66 7.891 19.951 1.457 1.00 0.00 H new ATOM 0 HG2 GLN B 66 9.701 20.587 2.919 1.00 0.00 H new ATOM 0 HG3 GLN B 66 8.200 20.830 3.790 1.00 0.00 H new ATOM 0 HE21 GLN B 66 10.317 17.935 3.214 1.00 0.00 H new ATOM 0 HE22 GLN B 66 10.414 17.478 4.918 1.00 0.00 H new ATOM 2517 N GLU B 67 6.500 16.870 1.141 1.00 0.00 N ATOM 2518 CA GLU B 67 5.978 16.105 0.019 1.00 0.00 C ATOM 2519 C GLU B 67 6.178 14.618 0.310 1.00 0.00 C ATOM 2520 O GLU B 67 7.226 14.060 -0.015 1.00 0.00 O ATOM 2521 CB GLU B 67 6.664 16.541 -1.287 1.00 0.00 C ATOM 2522 CG GLU B 67 6.003 15.882 -2.507 1.00 0.00 C ATOM 2523 CD GLU B 67 6.744 16.209 -3.800 1.00 0.00 C ATOM 2524 OE1 GLU B 67 6.532 17.326 -4.319 1.00 0.00 O ATOM 2525 OE2 GLU B 67 7.517 15.334 -4.249 1.00 0.00 O ATOM 0 H GLU B 67 7.308 16.422 1.573 1.00 0.00 H new ATOM 0 HA GLU B 67 4.912 16.292 -0.109 1.00 0.00 H new ATOM 0 HB2 GLU B 67 6.613 17.626 -1.384 1.00 0.00 H new ATOM 0 HB3 GLU B 67 7.720 16.274 -1.253 1.00 0.00 H new ATOM 0 HG2 GLU B 67 5.977 14.801 -2.367 1.00 0.00 H new ATOM 0 HG3 GLU B 67 4.969 16.218 -2.586 1.00 0.00 H new ATOM 2532 N VAL B 68 5.166 13.967 0.882 1.00 0.00 N ATOM 2533 CA VAL B 68 5.220 12.550 1.206 1.00 0.00 C ATOM 2534 C VAL B 68 4.646 11.818 -0.004 1.00 0.00 C ATOM 2535 O VAL B 68 3.707 12.306 -0.624 1.00 0.00 O ATOM 2536 CB VAL B 68 4.386 12.297 2.474 1.00 0.00 C ATOM 2537 CG1 VAL B 68 4.344 10.809 2.826 1.00 0.00 C ATOM 2538 CG2 VAL B 68 4.953 13.074 3.667 1.00 0.00 C ATOM 0 H VAL B 68 4.284 14.413 1.133 1.00 0.00 H new ATOM 0 HA VAL B 68 6.232 12.200 1.409 1.00 0.00 H new ATOM 0 HB VAL B 68 3.374 12.642 2.263 1.00 0.00 H new ATOM 0 HG11 VAL B 68 3.747 10.665 3.727 1.00 0.00 H new ATOM 0 HG12 VAL B 68 3.898 10.253 2.002 1.00 0.00 H new ATOM 0 HG13 VAL B 68 5.357 10.448 3.001 1.00 0.00 H new ATOM 0 HG21 VAL B 68 4.346 12.878 4.551 1.00 0.00 H new ATOM 0 HG22 VAL B 68 5.979 12.756 3.854 1.00 0.00 H new ATOM 0 HG23 VAL B 68 4.938 14.141 3.446 1.00 0.00 H new ATOM 2548 N ASN B 69 5.192 10.664 -0.384 1.00 0.00 N ATOM 2549 CA ASN B 69 4.796 10.027 -1.633 1.00 0.00 C ATOM 2550 C ASN B 69 3.645 9.060 -1.375 1.00 0.00 C ATOM 2551 O ASN B 69 3.581 8.445 -0.312 1.00 0.00 O ATOM 2552 CB ASN B 69 5.987 9.292 -2.258 1.00 0.00 C ATOM 2553 CG ASN B 69 5.586 8.674 -3.596 1.00 0.00 C ATOM 2554 OD1 ASN B 69 5.142 7.532 -3.647 1.00 0.00 O ATOM 2555 ND2 ASN B 69 5.698 9.431 -4.683 1.00 0.00 N ATOM 0 H ASN B 69 5.900 10.159 0.149 1.00 0.00 H new ATOM 0 HA ASN B 69 4.463 10.793 -2.334 1.00 0.00 H new ATOM 0 HB2 ASN B 69 6.815 9.986 -2.404 1.00 0.00 H new ATOM 0 HB3 ASN B 69 6.339 8.513 -1.581 1.00 0.00 H new ATOM 0 HD21 ASN B 69 5.411 9.065 -5.591 1.00 0.00 H new ATOM 0 HD22 ASN B 69 6.071 10.377 -4.609 1.00 0.00 H new ATOM 2562 N PHE B 70 2.741 8.912 -2.349 1.00 0.00 N ATOM 2563 CA PHE B 70 1.658 7.934 -2.283 1.00 0.00 C ATOM 2564 C PHE B 70 2.112 6.570 -1.733 1.00 0.00 C ATOM 2565 O PHE B 70 1.455 6.000 -0.866 1.00 0.00 O ATOM 2566 CB PHE B 70 1.023 7.788 -3.667 1.00 0.00 C ATOM 2567 CG PHE B 70 -0.002 6.682 -3.758 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -1.184 6.759 -3.001 1.00 0.00 C ATOM 2569 CD2 PHE B 70 0.233 5.565 -4.577 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -2.163 5.763 -3.122 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -0.754 4.576 -4.714 1.00 0.00 C ATOM 2572 CZ PHE B 70 -1.955 4.678 -3.991 1.00 0.00 C ATOM 0 H PHE B 70 2.742 9.468 -3.204 1.00 0.00 H new ATOM 0 HA PHE B 70 0.917 8.306 -1.576 1.00 0.00 H new ATOM 0 HB2 PHE B 70 0.550 8.731 -3.940 1.00 0.00 H new ATOM 0 HB3 PHE B 70 1.809 7.602 -4.399 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -1.338 7.587 -2.325 1.00 0.00 H new ATOM 0 HD2 PHE B 70 1.172 5.467 -5.101 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.076 5.829 -2.548 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -0.591 3.737 -5.375 1.00 0.00 H new ATOM 0 HZ PHE B 70 -2.718 3.922 -4.103 1.00 0.00 H new ATOM 2582 N GLN B 71 3.251 6.046 -2.193 1.00 0.00 N ATOM 2583 CA GLN B 71 3.768 4.769 -1.714 1.00 0.00 C ATOM 2584 C GLN B 71 3.979 4.769 -0.191 1.00 0.00 C ATOM 2585 O GLN B 71 3.800 3.736 0.457 1.00 0.00 O ATOM 2586 CB GLN B 71 5.054 4.412 -2.476 1.00 0.00 C ATOM 2587 CG GLN B 71 5.663 3.052 -2.094 1.00 0.00 C ATOM 2588 CD GLN B 71 4.711 1.877 -2.311 1.00 0.00 C ATOM 2589 OE1 GLN B 71 4.714 1.248 -3.363 1.00 0.00 O ATOM 2590 NE2 GLN B 71 3.892 1.560 -1.314 1.00 0.00 N ATOM 0 H GLN B 71 3.833 6.493 -2.901 1.00 0.00 H new ATOM 0 HA GLN B 71 3.025 3.997 -1.914 1.00 0.00 H new ATOM 0 HB2 GLN B 71 4.841 4.413 -3.545 1.00 0.00 H new ATOM 0 HB3 GLN B 71 5.795 5.191 -2.298 1.00 0.00 H new ATOM 0 HG2 GLN B 71 6.567 2.890 -2.680 1.00 0.00 H new ATOM 0 HG3 GLN B 71 5.963 3.078 -1.046 1.00 0.00 H new ATOM 0 HE21 GLN B 71 3.909 2.100 -0.449 1.00 0.00 H new ATOM 0 HE22 GLN B 71 3.246 0.777 -1.414 1.00 0.00 H new ATOM 2599 N GLU B 72 4.353 5.907 0.399 1.00 0.00 N ATOM 2600 CA GLU B 72 4.498 6.033 1.842 1.00 0.00 C ATOM 2601 C GLU B 72 3.119 6.016 2.510 1.00 0.00 C ATOM 2602 O GLU B 72 2.948 5.367 3.537 1.00 0.00 O ATOM 2603 CB GLU B 72 5.296 7.292 2.200 1.00 0.00 C ATOM 2604 CG GLU B 72 6.715 7.245 1.614 1.00 0.00 C ATOM 2605 CD GLU B 72 7.473 8.539 1.888 1.00 0.00 C ATOM 2606 OE1 GLU B 72 7.217 9.507 1.139 1.00 0.00 O ATOM 2607 OE2 GLU B 72 8.289 8.541 2.834 1.00 0.00 O ATOM 0 H GLU B 72 4.562 6.763 -0.114 1.00 0.00 H new ATOM 0 HA GLU B 72 5.062 5.181 2.221 1.00 0.00 H new ATOM 0 HB2 GLU B 72 4.775 8.173 1.825 1.00 0.00 H new ATOM 0 HB3 GLU B 72 5.352 7.393 3.284 1.00 0.00 H new ATOM 0 HG2 GLU B 72 7.260 6.404 2.043 1.00 0.00 H new ATOM 0 HG3 GLU B 72 6.661 7.074 0.539 1.00 0.00 H new ATOM 2614 N TYR B 73 2.120 6.681 1.921 1.00 0.00 N ATOM 2615 CA TYR B 73 0.736 6.572 2.385 1.00 0.00 C ATOM 2616 C TYR B 73 0.278 5.104 2.366 1.00 0.00 C ATOM 2617 O TYR B 73 -0.290 4.603 3.337 1.00 0.00 O ATOM 2618 CB TYR B 73 -0.176 7.497 1.563 1.00 0.00 C ATOM 2619 CG TYR B 73 -1.657 7.191 1.670 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -2.401 7.649 2.773 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -2.284 6.414 0.678 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -3.770 7.345 2.874 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -3.653 6.116 0.777 1.00 0.00 C ATOM 2624 CZ TYR B 73 -4.396 6.577 1.876 1.00 0.00 C ATOM 2625 OH TYR B 73 -5.727 6.295 1.955 1.00 0.00 O ATOM 0 H TYR B 73 2.246 7.301 1.121 1.00 0.00 H new ATOM 0 HA TYR B 73 0.671 6.906 3.421 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -0.008 8.526 1.882 1.00 0.00 H new ATOM 0 HB3 TYR B 73 0.118 7.436 0.515 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -1.920 8.235 3.543 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -1.712 6.046 -0.161 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -4.341 7.701 3.718 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.135 5.532 0.007 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.994 5.755 1.182 1.00 0.00 H new ATOM 2635 N ILE B 74 0.557 4.384 1.280 1.00 0.00 N ATOM 2636 CA ILE B 74 0.305 2.950 1.218 1.00 0.00 C ATOM 2637 C ILE B 74 1.044 2.220 2.348 1.00 0.00 C ATOM 2638 O ILE B 74 0.449 1.412 3.063 1.00 0.00 O ATOM 2639 CB ILE B 74 0.687 2.424 -0.174 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -0.223 2.943 -1.294 1.00 0.00 C ATOM 2641 CG2 ILE B 74 0.715 0.897 -0.213 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.718 2.722 -1.042 1.00 0.00 C ATOM 0 H ILE B 74 0.960 4.775 0.429 1.00 0.00 H new ATOM 0 HA ILE B 74 -0.757 2.755 1.368 1.00 0.00 H new ATOM 0 HB ILE B 74 1.689 2.812 -0.357 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -0.043 4.009 -1.429 1.00 0.00 H new ATOM 0 HG13 ILE B 74 0.053 2.453 -2.228 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.989 0.564 -1.214 1.00 0.00 H new ATOM 0 HG22 ILE B 74 1.447 0.528 0.506 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.271 0.508 0.041 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.291 3.117 -1.881 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -1.916 1.655 -0.938 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.013 3.236 -0.127 1.00 0.00 H new ATOM 2654 N THR B 75 2.334 2.507 2.534 1.00 0.00 N ATOM 2655 CA THR B 75 3.100 1.913 3.625 1.00 0.00 C ATOM 2656 C THR B 75 2.424 2.198 4.971 1.00 0.00 C ATOM 2657 O THR B 75 2.358 1.311 5.814 1.00 0.00 O ATOM 2658 CB THR B 75 4.560 2.394 3.600 1.00 0.00 C ATOM 2659 OG1 THR B 75 5.113 2.180 2.317 1.00 0.00 O ATOM 2660 CG2 THR B 75 5.422 1.627 4.607 1.00 0.00 C ATOM 0 H THR B 75 2.867 3.146 1.943 1.00 0.00 H new ATOM 0 HA THR B 75 3.119 0.832 3.489 1.00 0.00 H new ATOM 0 HB THR B 75 4.555 3.453 3.857 1.00 0.00 H new ATOM 0 HG1 THR B 75 4.731 2.824 1.685 1.00 0.00 H new ATOM 0 HG21 THR B 75 6.448 1.993 4.562 1.00 0.00 H new ATOM 0 HG22 THR B 75 5.027 1.776 5.612 1.00 0.00 H new ATOM 0 HG23 THR B 75 5.405 0.564 4.365 1.00 0.00 H new ATOM 2668 N PHE B 76 1.889 3.406 5.169 1.00 0.00 N ATOM 2669 CA PHE B 76 1.125 3.758 6.359 1.00 0.00 C ATOM 2670 C PHE B 76 -0.121 2.882 6.503 1.00 0.00 C ATOM 2671 O PHE B 76 -0.403 2.406 7.600 1.00 0.00 O ATOM 2672 CB PHE B 76 0.780 5.247 6.359 1.00 0.00 C ATOM 2673 CG PHE B 76 -0.207 5.662 7.433 1.00 0.00 C ATOM 2674 CD1 PHE B 76 0.160 5.614 8.791 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -1.522 6.016 7.076 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -0.772 5.966 9.784 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -2.447 6.382 8.068 1.00 0.00 C ATOM 2678 CZ PHE B 76 -2.065 6.377 9.420 1.00 0.00 C ATOM 0 H PHE B 76 1.977 4.170 4.499 1.00 0.00 H new ATOM 0 HA PHE B 76 1.748 3.565 7.232 1.00 0.00 H new ATOM 0 HB2 PHE B 76 1.698 5.820 6.486 1.00 0.00 H new ATOM 0 HB3 PHE B 76 0.371 5.513 5.384 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.157 5.307 9.071 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -1.820 6.006 6.038 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -0.493 5.920 10.826 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -3.451 6.667 7.791 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.766 6.689 10.180 1.00 0.00 H new ATOM 2688 N LEU B 77 -0.851 2.628 5.411 1.00 0.00 N ATOM 2689 CA LEU B 77 -1.956 1.667 5.435 1.00 0.00 C ATOM 2690 C LEU B 77 -1.437 0.335 5.996 1.00 0.00 C ATOM 2691 O LEU B 77 -2.010 -0.238 6.926 1.00 0.00 O ATOM 2692 CB LEU B 77 -2.546 1.511 4.023 1.00 0.00 C ATOM 2693 CG LEU B 77 -4.018 1.067 3.993 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -4.454 0.942 2.530 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -4.278 -0.269 4.696 1.00 0.00 C ATOM 0 H LEU B 77 -0.697 3.072 4.506 1.00 0.00 H new ATOM 0 HA LEU B 77 -2.760 2.022 6.080 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -2.456 2.462 3.498 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -1.949 0.784 3.472 1.00 0.00 H new ATOM 0 HG LEU B 77 -4.589 1.822 4.534 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -5.497 0.628 2.487 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.345 1.907 2.034 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.831 0.203 2.027 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -5.338 -0.514 4.632 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -3.695 -1.053 4.214 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -3.986 -0.192 5.743 1.00 0.00 H new ATOM 2707 N GLY B 78 -0.301 -0.119 5.460 1.00 0.00 N ATOM 2708 CA GLY B 78 0.435 -1.247 6.008 1.00 0.00 C ATOM 2709 C GLY B 78 0.631 -1.107 7.520 1.00 0.00 C ATOM 2710 O GLY B 78 0.204 -1.972 8.279 1.00 0.00 O ATOM 0 H GLY B 78 0.130 0.291 4.631 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -0.101 -2.172 5.793 1.00 0.00 H new ATOM 0 HA3 GLY B 78 1.406 -1.321 5.519 1.00 0.00 H new ATOM 2714 N ALA B 79 1.258 -0.013 7.956 1.00 0.00 N ATOM 2715 CA ALA B 79 1.602 0.264 9.344 1.00 0.00 C ATOM 2716 C ALA B 79 0.381 0.194 10.263 1.00 0.00 C ATOM 2717 O ALA B 79 0.478 -0.340 11.366 1.00 0.00 O ATOM 2718 CB ALA B 79 2.293 1.626 9.453 1.00 0.00 C ATOM 0 H ALA B 79 1.550 0.732 7.323 1.00 0.00 H new ATOM 0 HA ALA B 79 2.293 -0.511 9.677 1.00 0.00 H new ATOM 0 HB1 ALA B 79 2.546 1.823 10.495 1.00 0.00 H new ATOM 0 HB2 ALA B 79 3.203 1.621 8.853 1.00 0.00 H new ATOM 0 HB3 ALA B 79 1.622 2.404 9.089 1.00 0.00 H new ATOM 2724 N LEU B 80 -0.762 0.733 9.826 1.00 0.00 N ATOM 2725 CA LEU B 80 -2.011 0.607 10.565 1.00 0.00 C ATOM 2726 C LEU B 80 -2.327 -0.870 10.787 1.00 0.00 C ATOM 2727 O LEU B 80 -2.434 -1.316 11.926 1.00 0.00 O ATOM 2728 CB LEU B 80 -3.172 1.304 9.839 1.00 0.00 C ATOM 2729 CG LEU B 80 -3.103 2.839 9.841 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -4.264 3.377 8.998 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -3.223 3.413 11.258 1.00 0.00 C ATOM 0 H LEU B 80 -0.842 1.263 8.958 1.00 0.00 H new ATOM 0 HA LEU B 80 -1.889 1.101 11.529 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -3.197 0.957 8.806 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -4.109 0.996 10.302 1.00 0.00 H new ATOM 0 HG LEU B 80 -2.138 3.139 9.433 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -4.232 4.466 8.988 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -4.178 3.002 7.978 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -5.210 3.046 9.428 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -3.170 4.501 11.216 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -4.177 3.113 11.692 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -2.408 3.033 11.875 1.00 0.00 H new ATOM 2743 N ALA B 81 -2.465 -1.643 9.710 1.00 0.00 N ATOM 2744 CA ALA B 81 -2.785 -3.061 9.834 1.00 0.00 C ATOM 2745 C ALA B 81 -1.749 -3.795 10.697 1.00 0.00 C ATOM 2746 O ALA B 81 -2.104 -4.635 11.521 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.898 -3.673 8.442 1.00 0.00 C ATOM 0 H ALA B 81 -2.361 -1.313 8.750 1.00 0.00 H new ATOM 0 HA ALA B 81 -3.743 -3.169 10.343 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -3.137 -4.733 8.529 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.687 -3.167 7.885 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -1.951 -3.557 7.915 1.00 0.00 H new ATOM 2753 N MET B 82 -0.467 -3.459 10.539 1.00 0.00 N ATOM 2754 CA MET B 82 0.637 -4.087 11.254 1.00 0.00 C ATOM 2755 C MET B 82 0.510 -4.015 12.782 1.00 0.00 C ATOM 2756 O MET B 82 1.194 -4.772 13.468 1.00 0.00 O ATOM 2757 CB MET B 82 1.979 -3.536 10.757 1.00 0.00 C ATOM 2758 CG MET B 82 2.318 -4.084 9.365 1.00 0.00 C ATOM 2759 SD MET B 82 3.625 -3.197 8.483 1.00 0.00 S ATOM 2760 CE MET B 82 3.623 -4.117 6.927 1.00 0.00 C ATOM 0 H MET B 82 -0.165 -2.727 9.896 1.00 0.00 H new ATOM 0 HA MET B 82 0.593 -5.152 11.024 1.00 0.00 H new ATOM 0 HB2 MET B 82 1.939 -2.447 10.723 1.00 0.00 H new ATOM 0 HB3 MET B 82 2.768 -3.804 11.459 1.00 0.00 H new ATOM 0 HG2 MET B 82 2.614 -5.128 9.466 1.00 0.00 H new ATOM 0 HG3 MET B 82 1.414 -4.066 8.756 1.00 0.00 H new ATOM 0 HE1 MET B 82 4.376 -3.701 6.257 1.00 0.00 H new ATOM 0 HE2 MET B 82 3.851 -5.165 7.123 1.00 0.00 H new ATOM 0 HE3 MET B 82 2.641 -4.041 6.460 1.00 0.00 H new ATOM 2770 N ILE B 83 -0.383 -3.183 13.339 1.00 0.00 N ATOM 2771 CA ILE B 83 -0.685 -3.251 14.769 1.00 0.00 C ATOM 2772 C ILE B 83 -1.179 -4.644 15.189 1.00 0.00 C ATOM 2773 O ILE B 83 -1.132 -4.968 16.376 1.00 0.00 O ATOM 2774 CB ILE B 83 -1.658 -2.144 15.212 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -3.078 -2.318 14.639 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -1.077 -0.759 14.890 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -4.037 -2.957 15.648 1.00 0.00 C ATOM 0 H ILE B 83 -0.899 -2.467 12.827 1.00 0.00 H new ATOM 0 HA ILE B 83 0.255 -3.074 15.292 1.00 0.00 H new ATOM 0 HB ILE B 83 -1.769 -2.230 16.293 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -3.467 -1.346 14.337 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -3.033 -2.936 13.742 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -1.777 0.013 15.210 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -0.131 -0.630 15.415 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -0.910 -0.675 13.816 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -5.024 -3.059 15.198 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -3.664 -3.941 15.931 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -4.106 -2.326 16.534 1.00 0.00 H new ATOM 2789 N TYR B 84 -1.644 -5.477 14.246 1.00 0.00 N ATOM 2790 CA TYR B 84 -1.935 -6.886 14.491 1.00 0.00 C ATOM 2791 C TYR B 84 -0.642 -7.630 14.861 1.00 0.00 C ATOM 2792 O TYR B 84 -0.043 -8.325 14.038 1.00 0.00 O ATOM 2793 CB TYR B 84 -2.619 -7.508 13.261 1.00 0.00 C ATOM 2794 CG TYR B 84 -3.862 -6.805 12.735 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -4.716 -6.080 13.590 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -4.158 -6.873 11.360 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -5.827 -5.397 13.065 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -5.272 -6.197 10.836 1.00 0.00 C ATOM 2799 CZ TYR B 84 -6.101 -5.450 11.690 1.00 0.00 C ATOM 2800 OH TYR B 84 -7.193 -4.803 11.194 1.00 0.00 O ATOM 0 H TYR B 84 -1.828 -5.183 13.287 1.00 0.00 H new ATOM 0 HA TYR B 84 -2.624 -6.975 15.331 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -1.888 -7.554 12.454 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -2.888 -8.535 13.506 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -4.517 -6.049 14.651 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -3.523 -7.449 10.703 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -6.471 -4.830 13.721 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -5.491 -6.251 9.780 1.00 0.00 H new ATOM 0 HH TYR B 84 -7.387 -4.017 11.747 1.00 0.00 H new ATOM 2810 N ASN B 85 -0.212 -7.469 16.115 1.00 0.00 N ATOM 2811 CA ASN B 85 1.025 -8.030 16.637 1.00 0.00 C ATOM 2812 C ASN B 85 1.119 -9.536 16.418 1.00 0.00 C ATOM 2813 O ASN B 85 0.093 -10.216 16.351 1.00 0.00 O ATOM 2814 CB ASN B 85 1.241 -7.639 18.108 1.00 0.00 C ATOM 2815 CG ASN B 85 0.232 -8.186 19.127 1.00 0.00 C ATOM 2816 OD1 ASN B 85 0.285 -7.802 20.289 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -0.695 -9.065 18.752 1.00 0.00 N ATOM 0 H ASN B 85 -0.731 -6.931 16.808 1.00 0.00 H new ATOM 0 HA ASN B 85 1.842 -7.591 16.064 1.00 0.00 H new ATOM 0 HB2 ASN B 85 2.236 -7.970 18.405 1.00 0.00 H new ATOM 0 HB3 ASN B 85 1.234 -6.551 18.174 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -1.365 -9.422 19.433 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -0.735 -9.382 17.783 1.00 0.00 H new ATOM 2824 N GLU B 86 2.347 -10.045 16.307 1.00 0.00 N ATOM 2825 CA GLU B 86 2.667 -11.414 15.933 1.00 0.00 C ATOM 2826 C GLU B 86 2.257 -11.672 14.480 1.00 0.00 C ATOM 2827 O GLU B 86 3.125 -11.805 13.620 1.00 0.00 O ATOM 2828 CB GLU B 86 2.084 -12.440 16.921 1.00 0.00 C ATOM 2829 CG GLU B 86 2.491 -12.128 18.368 1.00 0.00 C ATOM 2830 CD GLU B 86 1.995 -13.205 19.328 1.00 0.00 C ATOM 2831 OE1 GLU B 86 0.757 -13.321 19.459 1.00 0.00 O ATOM 2832 OE2 GLU B 86 2.860 -13.894 19.909 1.00 0.00 O ATOM 0 H GLU B 86 3.180 -9.484 16.485 1.00 0.00 H new ATOM 0 HA GLU B 86 3.747 -11.546 15.995 1.00 0.00 H new ATOM 0 HB2 GLU B 86 0.997 -12.445 16.842 1.00 0.00 H new ATOM 0 HB3 GLU B 86 2.428 -13.439 16.653 1.00 0.00 H new ATOM 0 HG2 GLU B 86 3.576 -12.051 18.434 1.00 0.00 H new ATOM 0 HG3 GLU B 86 2.084 -11.160 18.662 1.00 0.00 H new ATOM 2839 N ALA B 87 0.949 -11.691 14.202 1.00 0.00 N ATOM 2840 CA ALA B 87 0.379 -11.946 12.882 1.00 0.00 C ATOM 2841 C ALA B 87 1.088 -11.135 11.796 1.00 0.00 C ATOM 2842 O ALA B 87 1.513 -11.690 10.786 1.00 0.00 O ATOM 2843 CB ALA B 87 -1.123 -11.642 12.903 1.00 0.00 C ATOM 0 H ALA B 87 0.239 -11.524 14.915 1.00 0.00 H new ATOM 0 HA ALA B 87 0.526 -12.999 12.640 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -1.547 -11.833 11.917 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -1.613 -12.280 13.638 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -1.279 -10.596 13.169 1.00 0.00 H new ATOM 2849 N LEU B 88 1.235 -9.828 12.025 1.00 0.00 N ATOM 2850 CA LEU B 88 2.006 -8.929 11.178 1.00 0.00 C ATOM 2851 C LEU B 88 3.149 -8.311 11.987 1.00 0.00 C ATOM 2852 O LEU B 88 3.481 -7.141 11.800 1.00 0.00 O ATOM 2853 CB LEU B 88 1.083 -7.843 10.616 1.00 0.00 C ATOM 2854 CG LEU B 88 -0.043 -8.370 9.718 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -0.904 -7.183 9.274 1.00 0.00 C ATOM 2856 CD2 LEU B 88 0.501 -9.088 8.478 1.00 0.00 C ATOM 0 H LEU B 88 0.809 -9.359 12.825 1.00 0.00 H new ATOM 0 HA LEU B 88 2.438 -9.484 10.345 1.00 0.00 H new ATOM 0 HB2 LEU B 88 0.641 -7.293 11.447 1.00 0.00 H new ATOM 0 HB3 LEU B 88 1.683 -7.133 10.047 1.00 0.00 H new ATOM 0 HG LEU B 88 -0.628 -9.092 10.288 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.711 -7.538 8.634 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -1.326 -6.691 10.151 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -0.288 -6.473 8.721 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.330 -9.445 7.870 1.00 0.00 H new ATOM 0 HD22 LEU B 88 1.107 -8.396 7.893 1.00 0.00 H new ATOM 0 HD23 LEU B 88 1.114 -9.935 8.787 1.00 0.00 H new ATOM 2868 N LYS B 89 3.773 -9.105 12.864 1.00 0.00 N ATOM 2869 CA LYS B 89 4.872 -8.702 13.737 1.00 0.00 C ATOM 2870 C LYS B 89 4.383 -7.735 14.822 1.00 0.00 C ATOM 2871 O LYS B 89 4.355 -8.093 15.999 1.00 0.00 O ATOM 2872 CB LYS B 89 6.060 -8.117 12.949 1.00 0.00 C ATOM 2873 CG LYS B 89 6.465 -8.975 11.740 1.00 0.00 C ATOM 2874 CD LYS B 89 7.540 -8.293 10.879 1.00 0.00 C ATOM 2875 CE LYS B 89 7.145 -6.896 10.369 1.00 0.00 C ATOM 2876 NZ LYS B 89 5.775 -6.852 9.822 1.00 0.00 N ATOM 0 H LYS B 89 3.513 -10.084 12.987 1.00 0.00 H new ATOM 0 HA LYS B 89 5.240 -9.602 14.229 1.00 0.00 H new ATOM 0 HB2 LYS B 89 5.802 -7.115 12.605 1.00 0.00 H new ATOM 0 HB3 LYS B 89 6.915 -8.014 13.617 1.00 0.00 H new ATOM 0 HG2 LYS B 89 6.838 -9.938 12.089 1.00 0.00 H new ATOM 0 HG3 LYS B 89 5.586 -9.176 11.128 1.00 0.00 H new ATOM 0 HD2 LYS B 89 8.457 -8.209 11.462 1.00 0.00 H new ATOM 0 HD3 LYS B 89 7.763 -8.930 10.023 1.00 0.00 H new ATOM 0 HE2 LYS B 89 7.228 -6.179 11.186 1.00 0.00 H new ATOM 0 HE3 LYS B 89 7.849 -6.583 9.598 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 5.616 -5.935 9.357 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 5.653 -7.617 9.129 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 5.089 -6.972 10.594 1.00 0.00 H new ATOM 2890 N GLY B 90 3.992 -6.521 14.430 1.00 0.00 N ATOM 2891 CA GLY B 90 3.638 -5.422 15.316 1.00 0.00 C ATOM 2892 C GLY B 90 3.836 -4.081 14.609 1.00 0.00 C ATOM 2893 O GLY B 90 4.502 -4.083 13.549 1.00 0.00 O ATOM 2894 OXT GLY B 90 3.335 -3.073 15.153 1.00 0.00 O ATOM 0 H GLY B 90 3.912 -6.271 13.444 1.00 0.00 H new ATOM 0 HA2 GLY B 90 2.600 -5.523 15.634 1.00 0.00 H new ATOM 0 HA3 GLY B 90 4.252 -5.460 16.216 1.00 0.00 H new TER 2898 GLY B 90