USER MOD reduce.3.24.130724 H: found=0, std=0, add=2148, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 2145 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: D 55 THR OG1 : rot 121:sc= 0.326 USER MOD Set 1.2: D 57 SER OG : rot 180:sc= 0.375 USER MOD Set 2.1: D 6 LYS NZ :NH3+ 141:sc= 1.83 (180deg=0.887) USER MOD Set 2.2: D 12 THR OG1 : rot 58:sc= 0.116 USER MOD Set 3.1: D 7 THR OG1 : rot -63:sc= -0.512 USER MOD Set 3.2: D 9 THR OG1 : rot -35:sc= 0.129 USER MOD Set 4.1: C 55 THR OG1 : rot 117:sc= 0.36 USER MOD Set 4.2: C 57 SER OG : rot 180:sc= 0.335 USER MOD Set 5.1: A 121 CYS SG : rot 49:sc= 0.812 USER MOD Set 5.2: A 125 ASN : amide:sc= -0.0988 K(o=0.71,f=-4.3!) USER MOD Set 6.1: A 52 THR OG1 : rot -142:sc= 1.23 USER MOD Set 6.2: A 58 HIS : no HE2:sc= -4.04! C(o=-2.8!,f=-11!) USER MOD Set 7.1: A 22 TYR OH : rot -110:sc= 0.0839 USER MOD Set 7.2: A 48 TYR OH : rot 70:sc= -1.23 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -171:sc= 1.07 (180deg=0.779) USER MOD Single : A 31 MET CE :methyl -150:sc= -3.53! (180deg=-5.56!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 82:sc= 0.00802 USER MOD Single : A 37 THR OG1 : rot -97:sc= 1.26 USER MOD Single : A 39 THR OG1 : rot 44:sc= 0.0632 USER MOD Single : A 42 LYS NZ :NH3+ -138:sc= -1.39 (180deg=-3.41!) USER MOD Single : A 44 LYS NZ :NH3+ -115:sc= 1.24 (180deg=-0.696) USER MOD Single : A 50 GLN : amide:sc= -0.721 K(o=-0.72,f=-5.1!) USER MOD Single : A 51 GLN : amide:sc= -0.962 K(o=-0.96,f=-3.1!) USER MOD Single : A 55 SER OG : rot -53:sc= 0.0348 USER MOD Single : A 60 CYS SG : rot 180:sc= -1.92 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 84:sc= 0.00457 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.107 X(o=-0.11,f=-0.11) USER MOD Single : A 80 CYS SG : rot 180:sc= -8.54! USER MOD Single : A 83 LYS NZ :NH3+ -179:sc=-0.00272 (180deg=-0.00652) USER MOD Single : A 87 GLN : amide:sc= -0.563 K(o=-0.56,f=-4.5!) USER MOD Single : A 88 CYS SG : rot 180:sc= -0.0048 USER MOD Single : A 90 SER OG : rot 74:sc= 1.15 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 139:sc= -2.29 (180deg=-3.48) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -137:sc= -2.92 (180deg=-5.65!) USER MOD Single : A 110 GLN : amide:sc= -5.17 K(o=-5.2,f=-9.3!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= -0.266 X(o=-0.27,f=-0.26) USER MOD Single : A 120 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-2.4!) USER MOD Single : A 123 LYS NZ :NH3+ -132:sc= 0.475 (180deg=-0.0383) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 ASN :FLIP amide:sc= 0.227 F(o=-0.38,f=0.23) USER MOD Single : A 130 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.7!) USER MOD Single : B 940 GLN : amide:sc= -0.55 X(o=-0.55,f=-0.82) USER MOD Single : B 950 TYR OH : rot 100:sc= -1.23 USER MOD Single : C 1 MET CE :methyl 164:sc= -0.846 (180deg=-1.88) USER MOD Single : C 1 MET N :NH3+ 165:sc= 1.15 (180deg=1.07) USER MOD Single : C 2 GLN : amide:sc= -1.18 K(o=-1.2,f=-4.3!) USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 7 THR OG1 : rot 180:sc= 0 USER MOD Single : C 12 THR OG1 : rot 40:sc= -0.732 USER MOD Single : C 14 THR OG1 : rot -124:sc= 1.62 USER MOD Single : C 20 SER OG : rot 180:sc= 0 USER MOD Single : C 22 THR OG1 : rot 180:sc= 0.014 USER MOD Single : C 25 ASN : amide:sc= -2.89 K(o=-2.9,f=-4.3!) USER MOD Single : C 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 29 LYS NZ :NH3+ -159:sc= -0.0408 (180deg=-0.463) USER MOD Single : C 31 GLN : amide:sc= -0.39 K(o=-0.39,f=-2.6) USER MOD Single : C 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 40 GLN : amide:sc= -1.09 K(o=-1.1,f=-7.9!) USER MOD Single : C 41 GLN : amide:sc= -3.26! C(o=-3.3!,f=-11!) USER MOD Single : C 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 49 GLN : amide:sc= 0 X(o=0,f=-0.0041) USER MOD Single : C 59 TYR OH : rot 159:sc= 0.94 USER MOD Single : C 60 ASN : amide:sc= -0.214 K(o=-0.21,f=-1.7!) USER MOD Single : C 62 GLN : amide:sc= -0.0349 K(o=-0.035,f=-1.6!) USER MOD Single : C 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 65 SER OG : rot 64:sc= -1.57! USER MOD Single : C 66 THR OG1 : rot 180:sc= 0 USER MOD Single : C 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : D 1 MET CE :methyl 168:sc= -1.05 (180deg=-1.68) USER MOD Single : D 1 MET N :NH3+ 176:sc= 1.24 (180deg=1.12) USER MOD Single : D 2 GLN : amide:sc= -1.82 K(o=-1.8,f=-4.5!) USER MOD Single : D 11 LYS NZ :NH3+ -146:sc= -1.12 (180deg=-3!) USER MOD Single : D 14 THR OG1 : rot -92:sc= 1.24 USER MOD Single : D 20 SER OG : rot 180:sc= 0 USER MOD Single : D 22 THR OG1 : rot 180:sc= 0 USER MOD Single : D 25 ASN : amide:sc= -3.34 K(o=-3.3,f=-5.6!) USER MOD Single : D 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 29 LYS NZ :NH3+ -162:sc= -0.0144 (180deg=-0.287) USER MOD Single : D 31 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : D 33 LYS NZ :NH3+ -131:sc= -0.618 (180deg=-2.79!) USER MOD Single : D 40 GLN : amide:sc= -1.93 X(o=-1.9,f=-2.3!) USER MOD Single : D 41 GLN :FLIP amide:sc= -0.592 F(o=-3.4,f=-0.59) USER MOD Single : D 49 GLN : amide:sc= -1.22 X(o=-1.2,f=-1.6) USER MOD Single : D 59 TYR OH : rot -100:sc= 0.0367 USER MOD Single : D 60 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : D 62 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : D 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 65 SER OG : rot 61:sc= -1.37! USER MOD Single : D 66 THR OG1 : rot 180:sc= 0 USER MOD Single : D 68 HIS :FLIP no HD1:sc= -2.67 F(o=-3.6,f=-2.7) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 -3.536 10.280 -23.282 1.00 0.00 N ATOM 2 CA MET C 1 -4.393 9.076 -23.481 1.00 0.00 C ATOM 3 C MET C 1 -5.846 9.503 -23.501 1.00 0.00 C ATOM 4 O MET C 1 -6.604 9.224 -22.576 1.00 0.00 O ATOM 5 CB MET C 1 -4.161 8.078 -22.340 1.00 0.00 C ATOM 6 CG MET C 1 -4.963 6.801 -22.605 1.00 0.00 C ATOM 7 SD MET C 1 -4.943 5.744 -21.141 1.00 0.00 S ATOM 8 CE MET C 1 -6.129 6.702 -20.167 1.00 0.00 C ATOM 0 H1 MET C 1 -2.576 9.982 -23.015 1.00 0.00 H new ATOM 0 H2 MET C 1 -3.495 10.827 -24.166 1.00 0.00 H new ATOM 0 H3 MET C 1 -3.938 10.871 -22.527 1.00 0.00 H new ATOM 0 HA MET C 1 -4.138 8.596 -24.426 1.00 0.00 H new ATOM 0 HB2 MET C 1 -3.100 7.843 -22.259 1.00 0.00 H new ATOM 0 HB3 MET C 1 -4.463 8.519 -21.390 1.00 0.00 H new ATOM 0 HG2 MET C 1 -5.990 7.055 -22.866 1.00 0.00 H new ATOM 0 HG3 MET C 1 -4.540 6.266 -23.456 1.00 0.00 H new ATOM 0 HE1 MET C 1 -6.491 6.096 -19.336 1.00 0.00 H new ATOM 0 HE2 MET C 1 -5.642 7.597 -19.779 1.00 0.00 H new ATOM 0 HE3 MET C 1 -6.969 6.991 -20.798 1.00 0.00 H new ATOM 20 N GLN C 2 -6.228 10.175 -24.570 1.00 0.00 N ATOM 21 CA GLN C 2 -7.594 10.634 -24.724 1.00 0.00 C ATOM 22 C GLN C 2 -8.546 9.454 -24.685 1.00 0.00 C ATOM 23 O GLN C 2 -8.132 8.312 -24.830 1.00 0.00 O ATOM 24 CB GLN C 2 -7.728 11.356 -26.054 1.00 0.00 C ATOM 25 CG GLN C 2 -7.690 10.322 -27.167 1.00 0.00 C ATOM 26 CD GLN C 2 -7.383 10.994 -28.501 1.00 0.00 C ATOM 27 OE1 GLN C 2 -8.034 11.971 -28.868 1.00 0.00 O ATOM 28 NE2 GLN C 2 -6.425 10.523 -29.250 1.00 0.00 N ATOM 0 H GLN C 2 -5.610 10.415 -25.345 1.00 0.00 H new ATOM 0 HA GLN C 2 -7.843 11.313 -23.909 1.00 0.00 H new ATOM 0 HB2 GLN C 2 -8.662 11.917 -26.089 1.00 0.00 H new ATOM 0 HB3 GLN C 2 -6.919 12.076 -26.178 1.00 0.00 H new ATOM 0 HG2 GLN C 2 -6.933 9.569 -26.948 1.00 0.00 H new ATOM 0 HG3 GLN C 2 -8.647 9.804 -27.224 1.00 0.00 H new ATOM 0 HE21 GLN C 2 -5.888 9.713 -28.941 1.00 0.00 H new ATOM 0 HE22 GLN C 2 -6.213 10.965 -30.144 1.00 0.00 H new ATOM 37 N ILE C 3 -9.813 9.745 -24.469 1.00 0.00 N ATOM 38 CA ILE C 3 -10.828 8.709 -24.399 1.00 0.00 C ATOM 39 C ILE C 3 -12.118 9.201 -25.035 1.00 0.00 C ATOM 40 O ILE C 3 -12.500 10.354 -24.860 1.00 0.00 O ATOM 41 CB ILE C 3 -11.049 8.342 -22.938 1.00 0.00 C ATOM 42 CG1 ILE C 3 -11.287 9.633 -22.144 1.00 0.00 C ATOM 43 CG2 ILE C 3 -9.806 7.615 -22.414 1.00 0.00 C ATOM 44 CD1 ILE C 3 -11.601 9.317 -20.681 1.00 0.00 C ATOM 0 H ILE C 3 -10.167 10.693 -24.338 1.00 0.00 H new ATOM 0 HA ILE C 3 -10.501 7.825 -24.946 1.00 0.00 H new ATOM 0 HB ILE C 3 -11.913 7.686 -22.830 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -10.404 10.270 -22.202 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -12.112 10.191 -22.586 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -9.955 7.348 -21.368 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -9.640 6.711 -22.999 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -8.938 8.269 -22.502 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -11.766 10.246 -20.135 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -12.498 8.700 -20.626 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -10.763 8.780 -20.237 1.00 0.00 H new ATOM 56 N PHE C 4 -12.779 8.327 -25.778 1.00 0.00 N ATOM 57 CA PHE C 4 -14.015 8.693 -26.451 1.00 0.00 C ATOM 58 C PHE C 4 -15.207 8.567 -25.520 1.00 0.00 C ATOM 59 O PHE C 4 -15.478 7.496 -25.001 1.00 0.00 O ATOM 60 CB PHE C 4 -14.222 7.777 -27.656 1.00 0.00 C ATOM 61 CG PHE C 4 -13.385 8.262 -28.817 1.00 0.00 C ATOM 62 CD1 PHE C 4 -12.014 8.497 -28.653 1.00 0.00 C ATOM 63 CD2 PHE C 4 -13.981 8.456 -30.066 1.00 0.00 C ATOM 64 CE1 PHE C 4 -11.242 8.929 -29.738 1.00 0.00 C ATOM 65 CE2 PHE C 4 -13.211 8.891 -31.152 1.00 0.00 C ATOM 66 CZ PHE C 4 -11.840 9.127 -30.987 1.00 0.00 C ATOM 0 H PHE C 4 -12.482 7.363 -25.930 1.00 0.00 H new ATOM 0 HA PHE C 4 -13.936 9.732 -26.771 1.00 0.00 H new ATOM 0 HB2 PHE C 4 -13.946 6.754 -27.399 1.00 0.00 H new ATOM 0 HB3 PHE C 4 -15.275 7.762 -27.936 1.00 0.00 H new ATOM 0 HD1 PHE C 4 -11.552 8.345 -27.689 1.00 0.00 H new ATOM 0 HD2 PHE C 4 -15.037 8.270 -30.194 1.00 0.00 H new ATOM 0 HE1 PHE C 4 -10.185 9.109 -29.611 1.00 0.00 H new ATOM 0 HE2 PHE C 4 -13.674 9.044 -32.116 1.00 0.00 H new ATOM 0 HZ PHE C 4 -11.245 9.462 -31.824 1.00 0.00 H new ATOM 76 N VAL C 5 -15.931 9.660 -25.324 1.00 0.00 N ATOM 77 CA VAL C 5 -17.103 9.628 -24.465 1.00 0.00 C ATOM 78 C VAL C 5 -18.363 9.700 -25.315 1.00 0.00 C ATOM 79 O VAL C 5 -18.696 10.747 -25.860 1.00 0.00 O ATOM 80 CB VAL C 5 -17.054 10.799 -23.492 1.00 0.00 C ATOM 81 CG1 VAL C 5 -18.323 10.805 -22.639 1.00 0.00 C ATOM 82 CG2 VAL C 5 -15.826 10.636 -22.596 1.00 0.00 C ATOM 0 H VAL C 5 -15.730 10.568 -25.743 1.00 0.00 H new ATOM 0 HA VAL C 5 -17.115 8.697 -23.898 1.00 0.00 H new ATOM 0 HB VAL C 5 -16.990 11.740 -24.038 1.00 0.00 H new ATOM 0 HG11 VAL C 5 -18.289 11.643 -21.942 1.00 0.00 H new ATOM 0 HG12 VAL C 5 -19.195 10.905 -23.285 1.00 0.00 H new ATOM 0 HG13 VAL C 5 -18.391 9.871 -22.081 1.00 0.00 H new ATOM 0 HG21 VAL C 5 -15.776 11.467 -21.893 1.00 0.00 H new ATOM 0 HG22 VAL C 5 -15.899 9.698 -22.045 1.00 0.00 H new ATOM 0 HG23 VAL C 5 -14.926 10.626 -23.211 1.00 0.00 H new ATOM 92 N LYS C 6 -19.055 8.576 -25.440 1.00 0.00 N ATOM 93 CA LYS C 6 -20.260 8.536 -26.252 1.00 0.00 C ATOM 94 C LYS C 6 -21.491 8.924 -25.437 1.00 0.00 C ATOM 95 O LYS C 6 -21.678 8.457 -24.312 1.00 0.00 O ATOM 96 CB LYS C 6 -20.439 7.141 -26.840 1.00 0.00 C ATOM 97 CG LYS C 6 -21.227 7.239 -28.144 1.00 0.00 C ATOM 98 CD LYS C 6 -20.508 6.424 -29.210 1.00 0.00 C ATOM 99 CE LYS C 6 -21.322 6.435 -30.502 1.00 0.00 C ATOM 100 NZ LYS C 6 -20.584 5.682 -31.552 1.00 0.00 N1+ ATOM 0 H LYS C 6 -18.806 7.692 -24.996 1.00 0.00 H new ATOM 0 HA LYS C 6 -20.152 9.260 -27.060 1.00 0.00 H new ATOM 0 HB2 LYS C 6 -19.467 6.684 -27.023 1.00 0.00 H new ATOM 0 HB3 LYS C 6 -20.964 6.500 -26.132 1.00 0.00 H new ATOM 0 HG2 LYS C 6 -22.241 6.865 -28.002 1.00 0.00 H new ATOM 0 HG3 LYS C 6 -21.312 8.280 -28.457 1.00 0.00 H new ATOM 0 HD2 LYS C 6 -19.516 6.838 -29.390 1.00 0.00 H new ATOM 0 HD3 LYS C 6 -20.368 5.399 -28.866 1.00 0.00 H new ATOM 0 HE2 LYS C 6 -22.300 5.984 -30.334 1.00 0.00 H new ATOM 0 HE3 LYS C 6 -21.496 7.461 -30.828 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 -21.135 5.687 -32.434 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 -19.661 6.132 -31.718 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 -20.440 4.701 -31.239 1.00 0.00 H new ATOM 114 N THR C 7 -22.317 9.792 -26.013 1.00 0.00 N ATOM 115 CA THR C 7 -23.525 10.259 -25.344 1.00 0.00 C ATOM 116 C THR C 7 -24.751 9.480 -25.788 1.00 0.00 C ATOM 117 O THR C 7 -24.710 8.699 -26.740 1.00 0.00 O ATOM 118 CB THR C 7 -23.755 11.739 -25.639 1.00 0.00 C ATOM 119 OG1 THR C 7 -23.902 11.923 -27.039 1.00 0.00 O ATOM 120 CG2 THR C 7 -22.571 12.559 -25.129 1.00 0.00 C ATOM 0 H THR C 7 -22.171 10.186 -26.942 1.00 0.00 H new ATOM 0 HA THR C 7 -23.379 10.105 -24.275 1.00 0.00 H new ATOM 0 HB THR C 7 -24.661 12.073 -25.133 1.00 0.00 H new ATOM 0 HG1 THR C 7 -24.051 12.872 -27.230 1.00 0.00 H new ATOM 0 HG21 THR C 7 -22.741 13.614 -25.342 1.00 0.00 H new ATOM 0 HG22 THR C 7 -22.467 12.418 -24.053 1.00 0.00 H new ATOM 0 HG23 THR C 7 -21.659 12.230 -25.627 1.00 0.00 H new ATOM 190 N THR C 12 -20.082 11.501 -29.984 1.00 0.00 N ATOM 191 CA THR C 12 -18.895 11.085 -29.244 1.00 0.00 C ATOM 192 C THR C 12 -17.971 12.273 -28.995 1.00 0.00 C ATOM 193 O THR C 12 -17.689 13.055 -29.902 1.00 0.00 O ATOM 194 CB THR C 12 -18.137 10.022 -30.023 1.00 0.00 C ATOM 195 OG1 THR C 12 -18.961 8.884 -30.193 1.00 0.00 O ATOM 196 CG2 THR C 12 -16.870 9.648 -29.254 1.00 0.00 C ATOM 0 HA THR C 12 -19.220 10.677 -28.287 1.00 0.00 H new ATOM 0 HB THR C 12 -17.861 10.405 -31.005 1.00 0.00 H new ATOM 0 HG1 THR C 12 -19.880 9.170 -30.378 1.00 0.00 H new ATOM 0 HG21 THR C 12 -16.321 8.886 -29.807 1.00 0.00 H new ATOM 0 HG22 THR C 12 -16.243 10.532 -29.134 1.00 0.00 H new ATOM 0 HG23 THR C 12 -17.141 9.260 -28.272 1.00 0.00 H new ATOM 204 N ILE C 13 -17.517 12.406 -27.757 1.00 0.00 N ATOM 205 CA ILE C 13 -16.641 13.505 -27.384 1.00 0.00 C ATOM 206 C ILE C 13 -15.318 12.967 -26.846 1.00 0.00 C ATOM 207 O ILE C 13 -15.233 12.561 -25.686 1.00 0.00 O ATOM 208 CB ILE C 13 -17.314 14.350 -26.295 1.00 0.00 C ATOM 209 CG1 ILE C 13 -18.820 14.064 -26.286 1.00 0.00 C ATOM 210 CG2 ILE C 13 -17.079 15.841 -26.570 1.00 0.00 C ATOM 211 CD1 ILE C 13 -19.500 14.972 -25.273 1.00 0.00 C ATOM 0 H ILE C 13 -17.741 11.766 -26.995 1.00 0.00 H new ATOM 0 HA ILE C 13 -16.450 14.115 -28.267 1.00 0.00 H new ATOM 0 HB ILE C 13 -16.886 14.093 -25.326 1.00 0.00 H new ATOM 0 HG12 ILE C 13 -19.239 14.230 -27.279 1.00 0.00 H new ATOM 0 HG13 ILE C 13 -19.002 13.019 -26.034 1.00 0.00 H new ATOM 0 HG21 ILE C 13 -17.560 16.435 -25.793 1.00 0.00 H new ATOM 0 HG22 ILE C 13 -16.008 16.046 -26.573 1.00 0.00 H new ATOM 0 HG23 ILE C 13 -17.501 16.103 -27.540 1.00 0.00 H new ATOM 0 HD11 ILE C 13 -20.571 14.770 -25.265 1.00 0.00 H new ATOM 0 HD12 ILE C 13 -19.088 14.784 -24.282 1.00 0.00 H new ATOM 0 HD13 ILE C 13 -19.329 16.013 -25.545 1.00 0.00 H new ATOM 223 N THR C 14 -14.278 12.970 -27.675 1.00 0.00 N ATOM 224 CA THR C 14 -12.987 12.484 -27.227 1.00 0.00 C ATOM 225 C THR C 14 -12.344 13.524 -26.324 1.00 0.00 C ATOM 226 O THR C 14 -12.229 14.691 -26.697 1.00 0.00 O ATOM 227 CB THR C 14 -12.075 12.200 -28.416 1.00 0.00 C ATOM 228 OG1 THR C 14 -12.733 11.332 -29.326 1.00 0.00 O ATOM 229 CG2 THR C 14 -10.802 11.537 -27.918 1.00 0.00 C ATOM 0 H THR C 14 -14.306 13.297 -28.641 1.00 0.00 H new ATOM 0 HA THR C 14 -13.133 11.555 -26.676 1.00 0.00 H new ATOM 0 HB THR C 14 -11.832 13.135 -28.922 1.00 0.00 H new ATOM 0 HG1 THR C 14 -12.179 10.538 -29.479 1.00 0.00 H new ATOM 0 HG21 THR C 14 -10.145 11.331 -28.763 1.00 0.00 H new ATOM 0 HG22 THR C 14 -10.296 12.201 -27.218 1.00 0.00 H new ATOM 0 HG23 THR C 14 -11.051 10.602 -27.416 1.00 0.00 H new ATOM 237 N LEU C 15 -11.936 13.100 -25.137 1.00 0.00 N ATOM 238 CA LEU C 15 -11.317 14.013 -24.191 1.00 0.00 C ATOM 239 C LEU C 15 -9.910 13.549 -23.841 1.00 0.00 C ATOM 240 O LEU C 15 -9.721 12.424 -23.393 1.00 0.00 O ATOM 241 CB LEU C 15 -12.156 14.078 -22.910 1.00 0.00 C ATOM 242 CG LEU C 15 -13.586 14.517 -23.232 1.00 0.00 C ATOM 243 CD1 LEU C 15 -14.408 14.547 -21.941 1.00 0.00 C ATOM 244 CD2 LEU C 15 -13.573 15.915 -23.853 1.00 0.00 C ATOM 0 H LEU C 15 -12.022 12.138 -24.809 1.00 0.00 H new ATOM 0 HA LEU C 15 -11.263 15.000 -24.651 1.00 0.00 H new ATOM 0 HB2 LEU C 15 -12.169 13.102 -22.426 1.00 0.00 H new ATOM 0 HB3 LEU C 15 -11.704 14.777 -22.206 1.00 0.00 H new ATOM 0 HG LEU C 15 -14.028 13.813 -23.937 1.00 0.00 H new ATOM 0 HD11 LEU C 15 -15.428 14.859 -22.166 1.00 0.00 H new ATOM 0 HD12 LEU C 15 -14.423 13.552 -21.496 1.00 0.00 H new ATOM 0 HD13 LEU C 15 -13.959 15.251 -21.240 1.00 0.00 H new ATOM 0 HD21 LEU C 15 -14.594 16.222 -24.080 1.00 0.00 H new ATOM 0 HD22 LEU C 15 -13.130 16.621 -23.151 1.00 0.00 H new ATOM 0 HD23 LEU C 15 -12.986 15.900 -24.771 1.00 0.00 H new ATOM 256 N GLU C 16 -8.931 14.427 -24.036 1.00 0.00 N ATOM 257 CA GLU C 16 -7.542 14.095 -23.730 1.00 0.00 C ATOM 258 C GLU C 16 -7.353 13.891 -22.222 1.00 0.00 C ATOM 259 O GLU C 16 -7.478 14.824 -21.428 1.00 0.00 O ATOM 260 CB GLU C 16 -6.621 15.209 -24.239 1.00 0.00 C ATOM 261 CG GLU C 16 -6.986 16.532 -23.566 1.00 0.00 C ATOM 262 CD GLU C 16 -6.461 17.704 -24.387 1.00 0.00 C ATOM 263 OE1 GLU C 16 -5.261 17.760 -24.603 1.00 0.00 O ATOM 264 OE2 GLU C 16 -7.267 18.528 -24.786 1.00 0.00 O1- ATOM 0 H GLU C 16 -9.071 15.369 -24.402 1.00 0.00 H new ATOM 0 HA GLU C 16 -7.284 13.162 -24.232 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -5.581 14.958 -24.028 1.00 0.00 H new ATOM 0 HB3 GLU C 16 -6.713 15.303 -25.321 1.00 0.00 H new ATOM 0 HG2 GLU C 16 -8.068 16.608 -23.461 1.00 0.00 H new ATOM 0 HG3 GLU C 16 -6.565 16.565 -22.561 1.00 0.00 H new ATOM 271 N VAL C 17 -7.064 12.654 -21.823 1.00 0.00 N ATOM 272 CA VAL C 17 -6.870 12.345 -20.414 1.00 0.00 C ATOM 273 C VAL C 17 -5.639 11.461 -20.240 1.00 0.00 C ATOM 274 O VAL C 17 -5.147 10.873 -21.205 1.00 0.00 O ATOM 275 CB VAL C 17 -8.097 11.620 -19.862 1.00 0.00 C ATOM 276 CG1 VAL C 17 -9.347 12.485 -20.064 1.00 0.00 C ATOM 277 CG2 VAL C 17 -8.265 10.290 -20.594 1.00 0.00 C ATOM 0 H VAL C 17 -6.960 11.858 -22.452 1.00 0.00 H new ATOM 0 HA VAL C 17 -6.727 13.277 -19.868 1.00 0.00 H new ATOM 0 HB VAL C 17 -7.963 11.436 -18.796 1.00 0.00 H new ATOM 0 HG11 VAL C 17 -10.218 11.963 -19.669 1.00 0.00 H new ATOM 0 HG12 VAL C 17 -9.223 13.432 -19.539 1.00 0.00 H new ATOM 0 HG13 VAL C 17 -9.490 12.675 -21.128 1.00 0.00 H new ATOM 0 HG21 VAL C 17 -9.139 9.768 -20.204 1.00 0.00 H new ATOM 0 HG22 VAL C 17 -8.398 10.476 -21.660 1.00 0.00 H new ATOM 0 HG23 VAL C 17 -7.378 9.676 -20.441 1.00 0.00 H new ATOM 287 N GLU C 18 -5.150 11.362 -19.012 1.00 0.00 N ATOM 288 CA GLU C 18 -3.984 10.535 -18.731 1.00 0.00 C ATOM 289 C GLU C 18 -4.406 9.263 -17.999 1.00 0.00 C ATOM 290 O GLU C 18 -5.434 9.248 -17.325 1.00 0.00 O ATOM 291 CB GLU C 18 -2.984 11.315 -17.881 1.00 0.00 C ATOM 292 CG GLU C 18 -2.504 12.538 -18.665 1.00 0.00 C ATOM 293 CD GLU C 18 -1.534 13.352 -17.820 1.00 0.00 C ATOM 294 OE1 GLU C 18 -1.306 12.970 -16.682 1.00 0.00 O ATOM 295 OE2 GLU C 18 -1.033 14.346 -18.318 1.00 0.00 O1- ATOM 0 H GLU C 18 -5.539 11.840 -18.199 1.00 0.00 H new ATOM 0 HA GLU C 18 -3.512 10.260 -19.674 1.00 0.00 H new ATOM 0 HB2 GLU C 18 -3.449 11.627 -16.946 1.00 0.00 H new ATOM 0 HB3 GLU C 18 -2.137 10.680 -17.620 1.00 0.00 H new ATOM 0 HG2 GLU C 18 -2.017 12.221 -19.587 1.00 0.00 H new ATOM 0 HG3 GLU C 18 -3.356 13.155 -18.950 1.00 0.00 H new ATOM 302 N PRO C 19 -3.649 8.200 -18.117 1.00 0.00 N ATOM 303 CA PRO C 19 -3.986 6.910 -17.444 1.00 0.00 C ATOM 304 C PRO C 19 -4.165 7.080 -15.936 1.00 0.00 C ATOM 305 O PRO C 19 -5.022 6.441 -15.325 1.00 0.00 O ATOM 306 CB PRO C 19 -2.785 6.019 -17.754 1.00 0.00 C ATOM 307 CG PRO C 19 -2.175 6.591 -18.984 1.00 0.00 C ATOM 308 CD PRO C 19 -2.394 8.094 -18.891 1.00 0.00 C ATOM 0 HA PRO C 19 -4.931 6.496 -17.796 1.00 0.00 H new ATOM 0 HB2 PRO C 19 -2.074 6.017 -16.928 1.00 0.00 H new ATOM 0 HB3 PRO C 19 -3.093 4.986 -17.912 1.00 0.00 H new ATOM 0 HG2 PRO C 19 -1.113 6.353 -19.042 1.00 0.00 H new ATOM 0 HG3 PRO C 19 -2.642 6.182 -19.880 1.00 0.00 H new ATOM 0 HD2 PRO C 19 -1.566 8.592 -18.387 1.00 0.00 H new ATOM 0 HD3 PRO C 19 -2.488 8.550 -19.877 1.00 0.00 H new ATOM 316 N SER C 20 -3.355 7.952 -15.345 1.00 0.00 N ATOM 317 CA SER C 20 -3.435 8.209 -13.911 1.00 0.00 C ATOM 318 C SER C 20 -4.549 9.207 -13.593 1.00 0.00 C ATOM 319 O SER C 20 -4.846 9.462 -12.426 1.00 0.00 O ATOM 320 CB SER C 20 -2.102 8.760 -13.403 1.00 0.00 C ATOM 321 OG SER C 20 -1.093 7.772 -13.563 1.00 0.00 O ATOM 0 H SER C 20 -2.639 8.490 -15.833 1.00 0.00 H new ATOM 0 HA SER C 20 -3.658 7.266 -13.412 1.00 0.00 H new ATOM 0 HB2 SER C 20 -1.835 9.662 -13.954 1.00 0.00 H new ATOM 0 HB3 SER C 20 -2.188 9.041 -12.354 1.00 0.00 H new ATOM 0 HG SER C 20 -0.237 8.123 -13.240 1.00 0.00 H new ATOM 327 N ASP C 21 -5.160 9.775 -14.631 1.00 0.00 N ATOM 328 CA ASP C 21 -6.230 10.741 -14.438 1.00 0.00 C ATOM 329 C ASP C 21 -7.394 10.112 -13.683 1.00 0.00 C ATOM 330 O ASP C 21 -7.807 8.986 -13.979 1.00 0.00 O ATOM 331 CB ASP C 21 -6.717 11.253 -15.792 1.00 0.00 C ATOM 332 CG ASP C 21 -7.594 12.481 -15.595 1.00 0.00 C ATOM 333 OD1 ASP C 21 -7.359 13.197 -14.637 1.00 0.00 O ATOM 334 OD2 ASP C 21 -8.488 12.684 -16.399 1.00 0.00 O1- ATOM 0 H ASP C 21 -4.932 9.582 -15.606 1.00 0.00 H new ATOM 0 HA ASP C 21 -5.841 11.573 -13.851 1.00 0.00 H new ATOM 0 HB2 ASP C 21 -5.865 11.501 -16.425 1.00 0.00 H new ATOM 0 HB3 ASP C 21 -7.279 10.473 -16.305 1.00 0.00 H new ATOM 339 N THR C 22 -7.917 10.842 -12.703 1.00 0.00 N ATOM 340 CA THR C 22 -9.030 10.342 -11.907 1.00 0.00 C ATOM 341 C THR C 22 -10.341 10.440 -12.682 1.00 0.00 C ATOM 342 O THR C 22 -10.452 11.180 -13.662 1.00 0.00 O ATOM 343 CB THR C 22 -9.142 11.130 -10.602 1.00 0.00 C ATOM 344 OG1 THR C 22 -9.451 12.485 -10.890 1.00 0.00 O ATOM 345 CG2 THR C 22 -7.816 11.056 -9.843 1.00 0.00 C ATOM 0 H THR C 22 -7.591 11.773 -12.443 1.00 0.00 H new ATOM 0 HA THR C 22 -8.839 9.293 -11.679 1.00 0.00 H new ATOM 0 HB THR C 22 -9.934 10.702 -9.988 1.00 0.00 H new ATOM 0 HG1 THR C 22 -9.524 12.989 -10.053 1.00 0.00 H new ATOM 0 HG21 THR C 22 -7.897 11.618 -8.913 1.00 0.00 H new ATOM 0 HG22 THR C 22 -7.583 10.015 -9.619 1.00 0.00 H new ATOM 0 HG23 THR C 22 -7.022 11.482 -10.456 1.00 0.00 H new ATOM 353 N ILE C 23 -11.333 9.682 -12.231 1.00 0.00 N ATOM 354 CA ILE C 23 -12.636 9.675 -12.880 1.00 0.00 C ATOM 355 C ILE C 23 -13.292 11.044 -12.758 1.00 0.00 C ATOM 356 O ILE C 23 -13.921 11.530 -13.700 1.00 0.00 O ATOM 357 CB ILE C 23 -13.533 8.604 -12.253 1.00 0.00 C ATOM 358 CG1 ILE C 23 -12.875 7.219 -12.394 1.00 0.00 C ATOM 359 CG2 ILE C 23 -14.896 8.601 -12.949 1.00 0.00 C ATOM 360 CD1 ILE C 23 -12.556 6.908 -13.864 1.00 0.00 C ATOM 0 H ILE C 23 -11.260 9.066 -11.421 1.00 0.00 H new ATOM 0 HA ILE C 23 -12.499 9.444 -13.936 1.00 0.00 H new ATOM 0 HB ILE C 23 -13.669 8.828 -11.195 1.00 0.00 H new ATOM 0 HG12 ILE C 23 -11.959 7.186 -11.805 1.00 0.00 H new ATOM 0 HG13 ILE C 23 -13.540 6.454 -11.993 1.00 0.00 H new ATOM 0 HG21 ILE C 23 -15.532 7.838 -12.500 1.00 0.00 H new ATOM 0 HG22 ILE C 23 -15.365 9.578 -12.834 1.00 0.00 H new ATOM 0 HG23 ILE C 23 -14.763 8.385 -14.009 1.00 0.00 H new ATOM 0 HD11 ILE C 23 -12.092 5.924 -13.935 1.00 0.00 H new ATOM 0 HD12 ILE C 23 -13.477 6.918 -14.446 1.00 0.00 H new ATOM 0 HD13 ILE C 23 -11.872 7.661 -14.255 1.00 0.00 H new ATOM 372 N GLU C 24 -13.138 11.664 -11.595 1.00 0.00 N ATOM 373 CA GLU C 24 -13.719 12.980 -11.369 1.00 0.00 C ATOM 374 C GLU C 24 -13.149 13.978 -12.369 1.00 0.00 C ATOM 375 O GLU C 24 -13.866 14.829 -12.891 1.00 0.00 O ATOM 376 CB GLU C 24 -13.409 13.453 -9.946 1.00 0.00 C ATOM 377 CG GLU C 24 -14.212 12.627 -8.936 1.00 0.00 C ATOM 378 CD GLU C 24 -13.751 12.946 -7.517 1.00 0.00 C ATOM 379 OE1 GLU C 24 -12.639 13.428 -7.372 1.00 0.00 O ATOM 380 OE2 GLU C 24 -14.518 12.715 -6.599 1.00 0.00 O1- ATOM 0 H GLU C 24 -12.622 11.282 -10.802 1.00 0.00 H new ATOM 0 HA GLU C 24 -14.799 12.913 -11.499 1.00 0.00 H new ATOM 0 HB2 GLU C 24 -12.342 13.353 -9.744 1.00 0.00 H new ATOM 0 HB3 GLU C 24 -13.656 14.510 -9.843 1.00 0.00 H new ATOM 0 HG2 GLU C 24 -15.275 12.844 -9.039 1.00 0.00 H new ATOM 0 HG3 GLU C 24 -14.083 11.564 -9.139 1.00 0.00 H new ATOM 387 N ASN C 25 -11.855 13.859 -12.638 1.00 0.00 N ATOM 388 CA ASN C 25 -11.197 14.749 -13.584 1.00 0.00 C ATOM 389 C ASN C 25 -11.814 14.601 -14.969 1.00 0.00 C ATOM 390 O ASN C 25 -12.060 15.585 -15.668 1.00 0.00 O ATOM 391 CB ASN C 25 -9.712 14.409 -13.654 1.00 0.00 C ATOM 392 CG ASN C 25 -9.001 15.377 -14.590 1.00 0.00 C ATOM 393 OD1 ASN C 25 -8.897 15.118 -15.787 1.00 0.00 O ATOM 394 ND2 ASN C 25 -8.497 16.482 -14.112 1.00 0.00 N ATOM 0 H ASN C 25 -11.244 13.159 -12.217 1.00 0.00 H new ATOM 0 HA ASN C 25 -11.326 15.777 -13.247 1.00 0.00 H new ATOM 0 HB2 ASN C 25 -9.271 14.462 -12.659 1.00 0.00 H new ATOM 0 HB3 ASN C 25 -9.581 13.386 -14.007 1.00 0.00 H new ATOM 0 HD21 ASN C 25 -8.015 17.133 -14.732 1.00 0.00 H new ATOM 0 HD22 ASN C 25 -8.585 16.695 -13.118 1.00 0.00 H new ATOM 401 N VAL C 26 -12.061 13.359 -15.355 1.00 0.00 N ATOM 402 CA VAL C 26 -12.647 13.077 -16.658 1.00 0.00 C ATOM 403 C VAL C 26 -14.039 13.702 -16.772 1.00 0.00 C ATOM 404 O VAL C 26 -14.389 14.291 -17.797 1.00 0.00 O ATOM 405 CB VAL C 26 -12.721 11.567 -16.867 1.00 0.00 C ATOM 406 CG1 VAL C 26 -13.543 11.263 -18.121 1.00 0.00 C ATOM 407 CG2 VAL C 26 -11.303 11.022 -17.035 1.00 0.00 C ATOM 0 H VAL C 26 -11.866 12.533 -14.789 1.00 0.00 H new ATOM 0 HA VAL C 26 -12.017 13.516 -17.432 1.00 0.00 H new ATOM 0 HB VAL C 26 -13.197 11.096 -16.007 1.00 0.00 H new ATOM 0 HG11 VAL C 26 -13.595 10.184 -18.269 1.00 0.00 H new ATOM 0 HG12 VAL C 26 -14.550 11.662 -18.001 1.00 0.00 H new ATOM 0 HG13 VAL C 26 -13.070 11.726 -18.987 1.00 0.00 H new ATOM 0 HG21 VAL C 26 -11.343 9.943 -17.185 1.00 0.00 H new ATOM 0 HG22 VAL C 26 -10.833 11.491 -17.899 1.00 0.00 H new ATOM 0 HG23 VAL C 26 -10.720 11.242 -16.141 1.00 0.00 H new ATOM 417 N LYS C 27 -14.827 13.584 -15.710 1.00 0.00 N ATOM 418 CA LYS C 27 -16.169 14.156 -15.713 1.00 0.00 C ATOM 419 C LYS C 27 -16.085 15.667 -15.905 1.00 0.00 C ATOM 420 O LYS C 27 -16.904 16.263 -16.599 1.00 0.00 O ATOM 421 CB LYS C 27 -16.884 13.839 -14.398 1.00 0.00 C ATOM 422 CG LYS C 27 -17.220 12.346 -14.351 1.00 0.00 C ATOM 423 CD LYS C 27 -18.096 12.053 -13.131 1.00 0.00 C ATOM 424 CE LYS C 27 -17.266 12.198 -11.856 1.00 0.00 C ATOM 425 NZ LYS C 27 -18.110 11.859 -10.674 1.00 0.00 N1+ ATOM 0 H LYS C 27 -14.566 13.105 -14.848 1.00 0.00 H new ATOM 0 HA LYS C 27 -16.736 13.719 -16.535 1.00 0.00 H new ATOM 0 HB2 LYS C 27 -16.251 14.108 -13.553 1.00 0.00 H new ATOM 0 HB3 LYS C 27 -17.795 14.431 -14.314 1.00 0.00 H new ATOM 0 HG2 LYS C 27 -17.739 12.051 -15.263 1.00 0.00 H new ATOM 0 HG3 LYS C 27 -16.303 11.758 -14.302 1.00 0.00 H new ATOM 0 HD2 LYS C 27 -18.943 12.739 -13.106 1.00 0.00 H new ATOM 0 HD3 LYS C 27 -18.505 11.045 -13.198 1.00 0.00 H new ATOM 0 HE2 LYS C 27 -16.398 11.540 -11.897 1.00 0.00 H new ATOM 0 HE3 LYS C 27 -16.890 13.217 -11.768 1.00 0.00 H new ATOM 0 HZ1 LYS C 27 -17.546 11.957 -9.805 1.00 0.00 H new ATOM 0 HZ2 LYS C 27 -18.925 12.504 -10.633 1.00 0.00 H new ATOM 0 HZ3 LYS C 27 -18.448 10.879 -10.758 1.00 0.00 H new ATOM 439 N ALA C 28 -15.084 16.282 -15.295 1.00 0.00 N ATOM 440 CA ALA C 28 -14.901 17.721 -15.428 1.00 0.00 C ATOM 441 C ALA C 28 -14.672 18.073 -16.888 1.00 0.00 C ATOM 442 O ALA C 28 -15.187 19.074 -17.378 1.00 0.00 O ATOM 443 CB ALA C 28 -13.700 18.173 -14.614 1.00 0.00 C ATOM 0 H ALA C 28 -14.392 15.815 -14.709 1.00 0.00 H new ATOM 0 HA ALA C 28 -15.796 18.224 -15.061 1.00 0.00 H new ATOM 0 HB1 ALA C 28 -13.573 19.250 -14.721 1.00 0.00 H new ATOM 0 HB2 ALA C 28 -13.860 17.929 -13.564 1.00 0.00 H new ATOM 0 HB3 ALA C 28 -12.805 17.665 -14.973 1.00 0.00 H new ATOM 449 N LYS C 29 -13.912 17.234 -17.587 1.00 0.00 N ATOM 450 CA LYS C 29 -13.655 17.478 -19.000 1.00 0.00 C ATOM 451 C LYS C 29 -14.974 17.481 -19.745 1.00 0.00 C ATOM 452 O LYS C 29 -15.192 18.291 -20.643 1.00 0.00 O ATOM 453 CB LYS C 29 -12.730 16.412 -19.582 1.00 0.00 C ATOM 454 CG LYS C 29 -11.334 16.622 -19.019 1.00 0.00 C ATOM 455 CD LYS C 29 -10.395 15.563 -19.577 1.00 0.00 C ATOM 456 CE LYS C 29 -9.009 15.804 -19.000 1.00 0.00 C ATOM 457 NZ LYS C 29 -8.442 17.058 -19.574 1.00 0.00 N1+ ATOM 0 H LYS C 29 -13.472 16.396 -17.206 1.00 0.00 H new ATOM 0 HA LYS C 29 -13.162 18.444 -19.108 1.00 0.00 H new ATOM 0 HB2 LYS C 29 -13.094 15.416 -19.329 1.00 0.00 H new ATOM 0 HB3 LYS C 29 -12.713 16.479 -20.670 1.00 0.00 H new ATOM 0 HG2 LYS C 29 -10.972 17.617 -19.278 1.00 0.00 H new ATOM 0 HG3 LYS C 29 -11.357 16.565 -17.931 1.00 0.00 H new ATOM 0 HD2 LYS C 29 -10.748 14.566 -19.314 1.00 0.00 H new ATOM 0 HD3 LYS C 29 -10.368 15.615 -20.665 1.00 0.00 H new ATOM 0 HE2 LYS C 29 -9.064 15.881 -17.914 1.00 0.00 H new ATOM 0 HE3 LYS C 29 -8.357 14.960 -19.227 1.00 0.00 H new ATOM 0 HZ1 LYS C 29 -7.407 17.047 -19.478 1.00 0.00 H new ATOM 0 HZ2 LYS C 29 -8.695 17.125 -20.580 1.00 0.00 H new ATOM 0 HZ3 LYS C 29 -8.828 17.878 -19.065 1.00 0.00 H new ATOM 471 N ILE C 30 -15.870 16.592 -19.340 1.00 0.00 N ATOM 472 CA ILE C 30 -17.190 16.537 -19.963 1.00 0.00 C ATOM 473 C ILE C 30 -17.939 17.837 -19.707 1.00 0.00 C ATOM 474 O ILE C 30 -18.620 18.368 -20.589 1.00 0.00 O ATOM 475 CB ILE C 30 -18.001 15.339 -19.447 1.00 0.00 C ATOM 476 CG1 ILE C 30 -17.461 14.055 -20.079 1.00 0.00 C ATOM 477 CG2 ILE C 30 -19.479 15.514 -19.828 1.00 0.00 C ATOM 478 CD1 ILE C 30 -17.988 13.935 -21.510 1.00 0.00 C ATOM 0 H ILE C 30 -15.715 15.910 -18.598 1.00 0.00 H new ATOM 0 HA ILE C 30 -17.056 16.408 -21.037 1.00 0.00 H new ATOM 0 HB ILE C 30 -17.913 15.280 -18.362 1.00 0.00 H new ATOM 0 HG12 ILE C 30 -16.371 14.067 -20.081 1.00 0.00 H new ATOM 0 HG13 ILE C 30 -17.769 13.190 -19.492 1.00 0.00 H new ATOM 0 HG21 ILE C 30 -20.053 14.663 -19.461 1.00 0.00 H new ATOM 0 HG22 ILE C 30 -19.864 16.431 -19.381 1.00 0.00 H new ATOM 0 HG23 ILE C 30 -19.571 15.573 -20.913 1.00 0.00 H new ATOM 0 HD11 ILE C 30 -17.605 13.021 -21.963 1.00 0.00 H new ATOM 0 HD12 ILE C 30 -19.077 13.904 -21.495 1.00 0.00 H new ATOM 0 HD13 ILE C 30 -17.658 14.795 -22.093 1.00 0.00 H new ATOM 490 N GLN C 31 -17.820 18.348 -18.491 1.00 0.00 N ATOM 491 CA GLN C 31 -18.499 19.584 -18.142 1.00 0.00 C ATOM 492 C GLN C 31 -18.003 20.744 -19.016 1.00 0.00 C ATOM 493 O GLN C 31 -18.789 21.520 -19.539 1.00 0.00 O ATOM 494 CB GLN C 31 -18.252 19.913 -16.669 1.00 0.00 C ATOM 495 CG GLN C 31 -19.067 21.148 -16.292 1.00 0.00 C ATOM 496 CD GLN C 31 -18.896 21.454 -14.808 1.00 0.00 C ATOM 497 OE1 GLN C 31 -18.682 20.546 -14.007 1.00 0.00 O ATOM 498 NE2 GLN C 31 -18.980 22.689 -14.394 1.00 0.00 N ATOM 0 H GLN C 31 -17.268 17.933 -17.740 1.00 0.00 H new ATOM 0 HA GLN C 31 -19.567 19.449 -18.314 1.00 0.00 H new ATOM 0 HB2 GLN C 31 -18.537 19.068 -16.042 1.00 0.00 H new ATOM 0 HB3 GLN C 31 -17.191 20.095 -16.497 1.00 0.00 H new ATOM 0 HG2 GLN C 31 -18.744 22.002 -16.887 1.00 0.00 H new ATOM 0 HG3 GLN C 31 -20.120 20.982 -16.518 1.00 0.00 H new ATOM 0 HE21 GLN C 31 -19.158 23.440 -15.061 1.00 0.00 H new ATOM 0 HE22 GLN C 31 -18.868 22.903 -13.403 1.00 0.00 H new ATOM 507 N ASP C 32 -16.694 20.858 -19.174 1.00 0.00 N ATOM 508 CA ASP C 32 -16.127 21.939 -19.978 1.00 0.00 C ATOM 509 C ASP C 32 -16.331 21.711 -21.480 1.00 0.00 C ATOM 510 O ASP C 32 -16.130 22.624 -22.282 1.00 0.00 O ATOM 511 CB ASP C 32 -14.633 22.078 -19.675 1.00 0.00 C ATOM 512 CG ASP C 32 -14.440 22.647 -18.271 1.00 0.00 C ATOM 513 OD1 ASP C 32 -15.406 23.142 -17.715 1.00 0.00 O ATOM 514 OD2 ASP C 32 -13.328 22.574 -17.771 1.00 0.00 O1- ATOM 0 H ASP C 32 -16.007 20.225 -18.763 1.00 0.00 H new ATOM 0 HA ASP C 32 -16.651 22.857 -19.711 1.00 0.00 H new ATOM 0 HB2 ASP C 32 -14.145 21.107 -19.754 1.00 0.00 H new ATOM 0 HB3 ASP C 32 -14.163 22.732 -20.410 1.00 0.00 H new ATOM 519 N LYS C 33 -16.711 20.493 -21.859 1.00 0.00 N ATOM 520 CA LYS C 33 -16.917 20.166 -23.271 1.00 0.00 C ATOM 521 C LYS C 33 -18.400 20.073 -23.627 1.00 0.00 C ATOM 522 O LYS C 33 -18.755 20.013 -24.804 1.00 0.00 O ATOM 523 CB LYS C 33 -16.265 18.821 -23.585 1.00 0.00 C ATOM 524 CG LYS C 33 -14.815 19.030 -24.016 1.00 0.00 C ATOM 525 CD LYS C 33 -14.665 18.633 -25.485 1.00 0.00 C ATOM 526 CE LYS C 33 -13.196 18.723 -25.887 1.00 0.00 C ATOM 527 NZ LYS C 33 -13.090 19.318 -27.248 1.00 0.00 N1+ ATOM 0 H LYS C 33 -16.882 19.720 -21.215 1.00 0.00 H new ATOM 0 HA LYS C 33 -16.467 20.967 -23.858 1.00 0.00 H new ATOM 0 HB2 LYS C 33 -16.302 18.176 -22.707 1.00 0.00 H new ATOM 0 HB3 LYS C 33 -16.819 18.315 -24.376 1.00 0.00 H new ATOM 0 HG2 LYS C 33 -14.529 20.073 -23.878 1.00 0.00 H new ATOM 0 HG3 LYS C 33 -14.149 18.431 -23.395 1.00 0.00 H new ATOM 0 HD2 LYS C 33 -15.034 17.619 -25.639 1.00 0.00 H new ATOM 0 HD3 LYS C 33 -15.266 19.290 -26.114 1.00 0.00 H new ATOM 0 HE2 LYS C 33 -12.648 19.332 -25.168 1.00 0.00 H new ATOM 0 HE3 LYS C 33 -12.743 17.732 -25.875 1.00 0.00 H new ATOM 0 HZ1 LYS C 33 -12.089 19.380 -27.523 1.00 0.00 H new ATOM 0 HZ2 LYS C 33 -13.600 18.720 -27.929 1.00 0.00 H new ATOM 0 HZ3 LYS C 33 -13.507 20.271 -27.244 1.00 0.00 H new ATOM 541 N GLU C 34 -19.259 20.037 -22.619 1.00 0.00 N ATOM 542 CA GLU C 34 -20.690 19.924 -22.868 1.00 0.00 C ATOM 543 C GLU C 34 -21.468 20.784 -21.890 1.00 0.00 C ATOM 544 O GLU C 34 -22.483 21.388 -22.242 1.00 0.00 O ATOM 545 CB GLU C 34 -21.125 18.461 -22.728 1.00 0.00 C ATOM 546 CG GLU C 34 -20.538 17.624 -23.866 1.00 0.00 C ATOM 547 CD GLU C 34 -21.028 18.146 -25.213 1.00 0.00 C ATOM 548 OE1 GLU C 34 -22.221 18.370 -25.341 1.00 0.00 O ATOM 549 OE2 GLU C 34 -20.204 18.313 -26.097 1.00 0.00 O1- ATOM 0 H GLU C 34 -18.997 20.084 -21.634 1.00 0.00 H new ATOM 0 HA GLU C 34 -20.897 20.270 -23.881 1.00 0.00 H new ATOM 0 HB2 GLU C 34 -20.794 18.066 -21.768 1.00 0.00 H new ATOM 0 HB3 GLU C 34 -22.213 18.395 -22.742 1.00 0.00 H new ATOM 0 HG2 GLU C 34 -19.449 17.659 -23.829 1.00 0.00 H new ATOM 0 HG3 GLU C 34 -20.827 16.580 -23.746 1.00 0.00 H new ATOM 556 N GLY C 35 -20.984 20.836 -20.662 1.00 0.00 N ATOM 557 CA GLY C 35 -21.639 21.624 -19.629 1.00 0.00 C ATOM 558 C GLY C 35 -22.434 20.732 -18.686 1.00 0.00 C ATOM 559 O GLY C 35 -23.271 21.219 -17.923 1.00 0.00 O ATOM 0 H GLY C 35 -20.144 20.345 -20.355 1.00 0.00 H new ATOM 0 HA2 GLY C 35 -20.893 22.183 -19.064 1.00 0.00 H new ATOM 0 HA3 GLY C 35 -22.303 22.355 -20.090 1.00 0.00 H new ATOM 563 N ILE C 36 -22.185 19.422 -18.742 1.00 0.00 N ATOM 564 CA ILE C 36 -22.906 18.502 -17.882 1.00 0.00 C ATOM 565 C ILE C 36 -22.182 18.316 -16.540 1.00 0.00 C ATOM 566 O ILE C 36 -21.058 17.811 -16.514 1.00 0.00 O ATOM 567 CB ILE C 36 -23.038 17.147 -18.556 1.00 0.00 C ATOM 568 CG1 ILE C 36 -23.635 17.358 -19.940 1.00 0.00 C ATOM 569 CG2 ILE C 36 -23.968 16.266 -17.712 1.00 0.00 C ATOM 570 CD1 ILE C 36 -23.813 16.012 -20.611 1.00 0.00 C ATOM 0 H ILE C 36 -21.502 18.988 -19.363 1.00 0.00 H new ATOM 0 HA ILE C 36 -23.893 18.927 -17.700 1.00 0.00 H new ATOM 0 HB ILE C 36 -22.067 16.661 -18.646 1.00 0.00 H new ATOM 0 HG12 ILE C 36 -24.594 17.870 -19.862 1.00 0.00 H new ATOM 0 HG13 ILE C 36 -22.982 17.994 -20.539 1.00 0.00 H new ATOM 0 HG21 ILE C 36 -24.072 15.289 -18.185 1.00 0.00 H new ATOM 0 HG22 ILE C 36 -23.547 16.143 -16.714 1.00 0.00 H new ATOM 0 HG23 ILE C 36 -24.947 16.739 -17.637 1.00 0.00 H new ATOM 0 HD11 ILE C 36 -24.240 16.154 -21.604 1.00 0.00 H new ATOM 0 HD12 ILE C 36 -22.845 15.519 -20.700 1.00 0.00 H new ATOM 0 HD13 ILE C 36 -24.482 15.393 -20.013 1.00 0.00 H new ATOM 582 N PRO C 37 -22.793 18.681 -15.431 1.00 0.00 N ATOM 583 CA PRO C 37 -22.168 18.515 -14.083 1.00 0.00 C ATOM 584 C PRO C 37 -21.836 17.044 -13.797 1.00 0.00 C ATOM 585 O PRO C 37 -22.562 16.152 -14.243 1.00 0.00 O ATOM 586 CB PRO C 37 -23.248 19.005 -13.112 1.00 0.00 C ATOM 587 CG PRO C 37 -24.137 19.882 -13.922 1.00 0.00 C ATOM 588 CD PRO C 37 -24.120 19.305 -15.330 1.00 0.00 C ATOM 0 HA PRO C 37 -21.229 19.062 -13.998 1.00 0.00 H new ATOM 0 HB2 PRO C 37 -23.803 18.169 -12.686 1.00 0.00 H new ATOM 0 HB3 PRO C 37 -22.808 19.553 -12.279 1.00 0.00 H new ATOM 0 HG2 PRO C 37 -25.149 19.894 -13.517 1.00 0.00 H new ATOM 0 HG3 PRO C 37 -23.780 20.912 -13.917 1.00 0.00 H new ATOM 0 HD2 PRO C 37 -24.918 18.576 -15.475 1.00 0.00 H new ATOM 0 HD3 PRO C 37 -24.257 20.081 -16.083 1.00 0.00 H new ATOM 596 N PRO C 38 -20.775 16.764 -13.076 1.00 0.00 N ATOM 597 CA PRO C 38 -20.381 15.357 -12.757 1.00 0.00 C ATOM 598 C PRO C 38 -21.530 14.557 -12.158 1.00 0.00 C ATOM 599 O PRO C 38 -21.705 13.382 -12.464 1.00 0.00 O ATOM 600 CB PRO C 38 -19.260 15.528 -11.731 1.00 0.00 C ATOM 601 CG PRO C 38 -18.666 16.856 -12.041 1.00 0.00 C ATOM 602 CD PRO C 38 -19.833 17.732 -12.482 1.00 0.00 C ATOM 0 HA PRO C 38 -20.083 14.805 -13.648 1.00 0.00 H new ATOM 0 HB2 PRO C 38 -19.647 15.495 -10.712 1.00 0.00 H new ATOM 0 HB3 PRO C 38 -18.519 14.733 -11.817 1.00 0.00 H new ATOM 0 HG2 PRO C 38 -18.168 17.277 -11.167 1.00 0.00 H new ATOM 0 HG3 PRO C 38 -17.916 16.776 -12.828 1.00 0.00 H new ATOM 0 HD2 PRO C 38 -20.278 18.263 -11.641 1.00 0.00 H new ATOM 0 HD3 PRO C 38 -19.520 18.485 -13.205 1.00 0.00 H new ATOM 610 N ASP C 39 -22.306 15.198 -11.299 1.00 0.00 N ATOM 611 CA ASP C 39 -23.432 14.528 -10.666 1.00 0.00 C ATOM 612 C ASP C 39 -24.519 14.211 -11.692 1.00 0.00 C ATOM 613 O ASP C 39 -25.240 13.223 -11.552 1.00 0.00 O ATOM 614 CB ASP C 39 -23.996 15.393 -9.539 1.00 0.00 C ATOM 615 CG ASP C 39 -23.018 15.414 -8.370 1.00 0.00 C ATOM 616 OD1 ASP C 39 -22.112 14.594 -8.367 1.00 0.00 O ATOM 617 OD2 ASP C 39 -23.183 16.248 -7.496 1.00 0.00 O1- ATOM 0 H ASP C 39 -22.180 16.172 -11.025 1.00 0.00 H new ATOM 0 HA ASP C 39 -23.080 13.588 -10.242 1.00 0.00 H new ATOM 0 HB2 ASP C 39 -24.170 16.407 -9.898 1.00 0.00 H new ATOM 0 HB3 ASP C 39 -24.959 15.000 -9.213 1.00 0.00 H new ATOM 622 N GLN C 40 -24.640 15.053 -12.717 1.00 0.00 N ATOM 623 CA GLN C 40 -25.653 14.837 -13.749 1.00 0.00 C ATOM 624 C GLN C 40 -25.168 13.858 -14.815 1.00 0.00 C ATOM 625 O GLN C 40 -25.960 13.396 -15.638 1.00 0.00 O ATOM 626 CB GLN C 40 -26.054 16.167 -14.392 1.00 0.00 C ATOM 627 CG GLN C 40 -26.666 17.072 -13.316 1.00 0.00 C ATOM 628 CD GLN C 40 -27.512 18.174 -13.953 1.00 0.00 C ATOM 629 OE1 GLN C 40 -27.025 18.938 -14.784 1.00 0.00 O ATOM 630 NE2 GLN C 40 -28.762 18.301 -13.603 1.00 0.00 N ATOM 0 H GLN C 40 -24.059 15.880 -12.855 1.00 0.00 H new ATOM 0 HA GLN C 40 -26.527 14.399 -13.267 1.00 0.00 H new ATOM 0 HB2 GLN C 40 -25.184 16.648 -14.839 1.00 0.00 H new ATOM 0 HB3 GLN C 40 -26.771 15.997 -15.195 1.00 0.00 H new ATOM 0 HG2 GLN C 40 -27.282 16.478 -12.642 1.00 0.00 H new ATOM 0 HG3 GLN C 40 -25.873 17.517 -12.714 1.00 0.00 H new ATOM 0 HE21 GLN C 40 -29.166 17.667 -12.914 1.00 0.00 H new ATOM 0 HE22 GLN C 40 -29.336 19.034 -14.019 1.00 0.00 H new ATOM 639 N GLN C 41 -23.878 13.521 -14.792 1.00 0.00 N ATOM 640 CA GLN C 41 -23.340 12.571 -15.765 1.00 0.00 C ATOM 641 C GLN C 41 -22.712 11.371 -15.070 1.00 0.00 C ATOM 642 O GLN C 41 -22.099 11.498 -14.013 1.00 0.00 O ATOM 643 CB GLN C 41 -22.275 13.230 -16.641 1.00 0.00 C ATOM 644 CG GLN C 41 -21.106 13.664 -15.772 1.00 0.00 C ATOM 645 CD GLN C 41 -20.038 14.342 -16.618 1.00 0.00 C ATOM 646 OE1 GLN C 41 -19.584 13.777 -17.613 1.00 0.00 O ATOM 647 NE2 GLN C 41 -19.598 15.520 -16.274 1.00 0.00 N ATOM 0 H GLN C 41 -23.198 13.884 -14.124 1.00 0.00 H new ATOM 0 HA GLN C 41 -24.175 12.242 -16.383 1.00 0.00 H new ATOM 0 HB2 GLN C 41 -21.935 12.532 -17.406 1.00 0.00 H new ATOM 0 HB3 GLN C 41 -22.696 14.091 -17.160 1.00 0.00 H new ATOM 0 HG2 GLN C 41 -21.454 14.348 -14.998 1.00 0.00 H new ATOM 0 HG3 GLN C 41 -20.681 12.798 -15.264 1.00 0.00 H new ATOM 0 HE21 GLN C 41 -19.977 15.985 -15.449 1.00 0.00 H new ATOM 0 HE22 GLN C 41 -18.875 15.977 -16.830 1.00 0.00 H new ATOM 656 N ARG C 42 -22.840 10.209 -15.688 1.00 0.00 N ATOM 657 CA ARG C 42 -22.253 8.999 -15.141 1.00 0.00 C ATOM 658 C ARG C 42 -21.406 8.324 -16.211 1.00 0.00 C ATOM 659 O ARG C 42 -21.851 8.147 -17.347 1.00 0.00 O ATOM 660 CB ARG C 42 -23.342 8.046 -14.643 1.00 0.00 C ATOM 661 CG ARG C 42 -24.029 8.661 -13.419 1.00 0.00 C ATOM 662 CD ARG C 42 -25.076 7.689 -12.873 1.00 0.00 C ATOM 663 NE ARG C 42 -26.177 7.540 -13.821 1.00 0.00 N ATOM 664 CZ ARG C 42 -27.178 6.687 -13.604 1.00 0.00 C ATOM 665 NH1 ARG C 42 -27.212 5.954 -12.519 1.00 0.00 N1+ ATOM 666 NH2 ARG C 42 -28.133 6.577 -14.485 1.00 0.00 N ATOM 0 H ARG C 42 -23.343 10.079 -16.566 1.00 0.00 H new ATOM 0 HA ARG C 42 -21.623 9.261 -14.291 1.00 0.00 H new ATOM 0 HB2 ARG C 42 -24.072 7.865 -15.432 1.00 0.00 H new ATOM 0 HB3 ARG C 42 -22.907 7.081 -14.384 1.00 0.00 H new ATOM 0 HG2 ARG C 42 -23.290 8.885 -12.649 1.00 0.00 H new ATOM 0 HG3 ARG C 42 -24.502 9.605 -13.691 1.00 0.00 H new ATOM 0 HD2 ARG C 42 -24.617 6.719 -12.684 1.00 0.00 H new ATOM 0 HD3 ARG C 42 -25.456 8.053 -11.919 1.00 0.00 H new ATOM 0 HE ARG C 42 -26.180 8.103 -14.671 1.00 0.00 H new ATOM 0 HH11 ARG C 42 -26.466 6.032 -11.827 1.00 0.00 H new ATOM 0 HH12 ARG C 42 -27.984 5.305 -12.366 1.00 0.00 H new ATOM 0 HH21 ARG C 42 -28.111 7.142 -15.334 1.00 0.00 H new ATOM 0 HH22 ARG C 42 -28.902 5.926 -14.325 1.00 0.00 H new ATOM 680 N LEU C 43 -20.183 7.967 -15.845 1.00 0.00 N ATOM 681 CA LEU C 43 -19.275 7.332 -16.788 1.00 0.00 C ATOM 682 C LEU C 43 -19.208 5.831 -16.522 1.00 0.00 C ATOM 683 O LEU C 43 -18.866 5.408 -15.420 1.00 0.00 O ATOM 684 CB LEU C 43 -17.875 7.944 -16.638 1.00 0.00 C ATOM 685 CG LEU C 43 -17.953 9.466 -16.802 1.00 0.00 C ATOM 686 CD1 LEU C 43 -16.567 10.083 -16.594 1.00 0.00 C ATOM 687 CD2 LEU C 43 -18.449 9.813 -18.208 1.00 0.00 C ATOM 0 H LEU C 43 -19.799 8.105 -14.910 1.00 0.00 H new ATOM 0 HA LEU C 43 -19.640 7.496 -17.802 1.00 0.00 H new ATOM 0 HB2 LEU C 43 -17.462 7.695 -15.660 1.00 0.00 H new ATOM 0 HB3 LEU C 43 -17.202 7.523 -17.385 1.00 0.00 H new ATOM 0 HG LEU C 43 -18.646 9.864 -16.061 1.00 0.00 H new ATOM 0 HD11 LEU C 43 -16.629 11.165 -16.712 1.00 0.00 H new ATOM 0 HD12 LEU C 43 -16.210 9.847 -15.591 1.00 0.00 H new ATOM 0 HD13 LEU C 43 -15.874 9.677 -17.331 1.00 0.00 H new ATOM 0 HD21 LEU C 43 -18.502 10.896 -18.318 1.00 0.00 H new ATOM 0 HD22 LEU C 43 -17.759 9.407 -18.948 1.00 0.00 H new ATOM 0 HD23 LEU C 43 -19.439 9.384 -18.361 1.00 0.00 H new ATOM 699 N ILE C 44 -19.535 5.033 -17.534 1.00 0.00 N ATOM 700 CA ILE C 44 -19.497 3.578 -17.386 1.00 0.00 C ATOM 701 C ILE C 44 -18.654 2.953 -18.494 1.00 0.00 C ATOM 702 O ILE C 44 -18.883 3.205 -19.673 1.00 0.00 O ATOM 703 CB ILE C 44 -20.914 3.001 -17.421 1.00 0.00 C ATOM 704 CG1 ILE C 44 -21.725 3.574 -16.256 1.00 0.00 C ATOM 705 CG2 ILE C 44 -20.850 1.477 -17.297 1.00 0.00 C ATOM 706 CD1 ILE C 44 -23.198 3.192 -16.416 1.00 0.00 C ATOM 0 H ILE C 44 -19.826 5.361 -18.455 1.00 0.00 H new ATOM 0 HA ILE C 44 -19.044 3.342 -16.423 1.00 0.00 H new ATOM 0 HB ILE C 44 -21.391 3.268 -18.364 1.00 0.00 H new ATOM 0 HG12 ILE C 44 -21.341 3.192 -15.310 1.00 0.00 H new ATOM 0 HG13 ILE C 44 -21.622 4.659 -16.227 1.00 0.00 H new ATOM 0 HG21 ILE C 44 -21.860 1.067 -17.322 1.00 0.00 H new ATOM 0 HG22 ILE C 44 -20.272 1.068 -18.126 1.00 0.00 H new ATOM 0 HG23 ILE C 44 -20.373 1.208 -16.355 1.00 0.00 H new ATOM 0 HD11 ILE C 44 -23.772 3.601 -15.585 1.00 0.00 H new ATOM 0 HD12 ILE C 44 -23.579 3.596 -17.354 1.00 0.00 H new ATOM 0 HD13 ILE C 44 -23.294 2.106 -16.423 1.00 0.00 H new ATOM 718 N PHE C 45 -17.676 2.142 -18.106 1.00 0.00 N ATOM 719 CA PHE C 45 -16.805 1.498 -19.084 1.00 0.00 C ATOM 720 C PHE C 45 -16.969 -0.019 -19.044 1.00 0.00 C ATOM 721 O PHE C 45 -16.731 -0.654 -18.018 1.00 0.00 O ATOM 722 CB PHE C 45 -15.350 1.874 -18.798 1.00 0.00 C ATOM 723 CG PHE C 45 -14.449 1.238 -19.827 1.00 0.00 C ATOM 724 CD1 PHE C 45 -14.610 1.549 -21.182 1.00 0.00 C ATOM 725 CD2 PHE C 45 -13.445 0.350 -19.429 1.00 0.00 C ATOM 726 CE1 PHE C 45 -13.770 0.972 -22.138 1.00 0.00 C ATOM 727 CE2 PHE C 45 -12.603 -0.228 -20.387 1.00 0.00 C ATOM 728 CZ PHE C 45 -12.766 0.083 -21.742 1.00 0.00 C ATOM 0 H PHE C 45 -17.467 1.916 -17.133 1.00 0.00 H new ATOM 0 HA PHE C 45 -17.083 1.844 -20.080 1.00 0.00 H new ATOM 0 HB2 PHE C 45 -15.234 2.958 -18.819 1.00 0.00 H new ATOM 0 HB3 PHE C 45 -15.068 1.542 -17.799 1.00 0.00 H new ATOM 0 HD1 PHE C 45 -15.385 2.236 -21.489 1.00 0.00 H new ATOM 0 HD2 PHE C 45 -13.319 0.110 -18.384 1.00 0.00 H new ATOM 0 HE1 PHE C 45 -13.896 1.213 -23.183 1.00 0.00 H new ATOM 0 HE2 PHE C 45 -11.827 -0.914 -20.080 1.00 0.00 H new ATOM 0 HZ PHE C 45 -12.117 -0.363 -22.481 1.00 0.00 H new ATOM 738 N ALA C 46 -17.378 -0.592 -20.175 1.00 0.00 N ATOM 739 CA ALA C 46 -17.573 -2.036 -20.269 1.00 0.00 C ATOM 740 C ALA C 46 -18.500 -2.537 -19.166 1.00 0.00 C ATOM 741 O ALA C 46 -18.278 -3.604 -18.594 1.00 0.00 O ATOM 742 CB ALA C 46 -16.225 -2.752 -20.168 1.00 0.00 C ATOM 0 H ALA C 46 -17.580 -0.081 -21.034 1.00 0.00 H new ATOM 0 HA ALA C 46 -18.033 -2.253 -21.233 1.00 0.00 H new ATOM 0 HB1 ALA C 46 -16.379 -3.829 -20.239 1.00 0.00 H new ATOM 0 HB2 ALA C 46 -15.577 -2.424 -20.981 1.00 0.00 H new ATOM 0 HB3 ALA C 46 -15.758 -2.514 -19.212 1.00 0.00 H new ATOM 748 N GLY C 47 -19.540 -1.764 -18.870 1.00 0.00 N ATOM 749 CA GLY C 47 -20.490 -2.145 -17.831 1.00 0.00 C ATOM 750 C GLY C 47 -19.888 -1.958 -16.441 1.00 0.00 C ATOM 751 O GLY C 47 -20.416 -2.469 -15.451 1.00 0.00 O ATOM 0 H GLY C 47 -19.745 -0.877 -19.330 1.00 0.00 H new ATOM 0 HA2 GLY C 47 -21.395 -1.544 -17.923 1.00 0.00 H new ATOM 0 HA3 GLY C 47 -20.784 -3.186 -17.966 1.00 0.00 H new ATOM 755 N LYS C 48 -18.782 -1.224 -16.370 1.00 0.00 N ATOM 756 CA LYS C 48 -18.117 -0.977 -15.101 1.00 0.00 C ATOM 757 C LYS C 48 -18.228 0.504 -14.747 1.00 0.00 C ATOM 758 O LYS C 48 -17.554 1.344 -15.343 1.00 0.00 O ATOM 759 CB LYS C 48 -16.643 -1.377 -15.218 1.00 0.00 C ATOM 760 CG LYS C 48 -16.136 -1.909 -13.878 1.00 0.00 C ATOM 761 CD LYS C 48 -15.085 -2.989 -14.136 1.00 0.00 C ATOM 762 CE LYS C 48 -14.002 -2.924 -13.059 1.00 0.00 C ATOM 763 NZ LYS C 48 -13.721 -4.262 -12.547 1.00 0.00 N1+ ATOM 0 H LYS C 48 -18.330 -0.792 -17.176 1.00 0.00 H new ATOM 0 HA LYS C 48 -18.590 -1.567 -14.316 1.00 0.00 H new ATOM 0 HB2 LYS C 48 -16.525 -2.139 -15.989 1.00 0.00 H new ATOM 0 HB3 LYS C 48 -16.048 -0.517 -15.526 1.00 0.00 H new ATOM 0 HG2 LYS C 48 -15.706 -1.098 -13.290 1.00 0.00 H new ATOM 0 HG3 LYS C 48 -16.963 -2.319 -13.299 1.00 0.00 H new ATOM 0 HD2 LYS C 48 -15.554 -3.973 -14.135 1.00 0.00 H new ATOM 0 HD3 LYS C 48 -14.640 -2.849 -15.121 1.00 0.00 H new ATOM 0 HE2 LYS C 48 -13.093 -2.486 -13.472 1.00 0.00 H new ATOM 0 HE3 LYS C 48 -14.326 -2.276 -12.245 1.00 0.00 H new ATOM 0 HZ1 LYS C 48 -12.984 -4.206 -11.816 1.00 0.00 H new ATOM 0 HZ2 LYS C 48 -14.587 -4.665 -12.136 1.00 0.00 H new ATOM 0 HZ3 LYS C 48 -13.392 -4.869 -13.325 1.00 0.00 H new ATOM 775 N GLN C 49 -19.087 0.816 -13.785 1.00 0.00 N ATOM 776 CA GLN C 49 -19.284 2.198 -13.373 1.00 0.00 C ATOM 777 C GLN C 49 -17.983 2.780 -12.831 1.00 0.00 C ATOM 778 O GLN C 49 -17.300 2.152 -12.023 1.00 0.00 O ATOM 779 CB GLN C 49 -20.376 2.267 -12.303 1.00 0.00 C ATOM 780 CG GLN C 49 -20.626 3.722 -11.908 1.00 0.00 C ATOM 781 CD GLN C 49 -21.696 3.788 -10.821 1.00 0.00 C ATOM 782 OE1 GLN C 49 -21.537 3.189 -9.758 1.00 0.00 O ATOM 783 NE2 GLN C 49 -22.783 4.482 -11.027 1.00 0.00 N ATOM 0 H GLN C 49 -19.654 0.136 -13.279 1.00 0.00 H new ATOM 0 HA GLN C 49 -19.593 2.784 -14.238 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -21.296 1.820 -12.680 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -20.077 1.690 -11.428 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -19.702 4.175 -11.549 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -20.944 4.295 -12.779 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -22.912 4.978 -11.909 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -23.503 4.528 -10.306 1.00 0.00 H new ATOM 792 N LEU C 50 -17.644 3.982 -13.287 1.00 0.00 N ATOM 793 CA LEU C 50 -16.417 4.634 -12.846 1.00 0.00 C ATOM 794 C LEU C 50 -16.659 5.376 -11.535 1.00 0.00 C ATOM 795 O LEU C 50 -17.207 6.479 -11.525 1.00 0.00 O ATOM 796 CB LEU C 50 -15.940 5.619 -13.919 1.00 0.00 C ATOM 797 CG LEU C 50 -15.809 4.902 -15.271 1.00 0.00 C ATOM 798 CD1 LEU C 50 -15.331 5.893 -16.337 1.00 0.00 C ATOM 799 CD2 LEU C 50 -14.804 3.757 -15.154 1.00 0.00 C ATOM 0 H LEU C 50 -18.196 4.520 -13.955 1.00 0.00 H new ATOM 0 HA LEU C 50 -15.650 3.876 -12.687 1.00 0.00 H new ATOM 0 HB2 LEU C 50 -16.645 6.446 -14.004 1.00 0.00 H new ATOM 0 HB3 LEU C 50 -14.980 6.047 -13.630 1.00 0.00 H new ATOM 0 HG LEU C 50 -16.781 4.501 -15.558 1.00 0.00 H new ATOM 0 HD11 LEU C 50 -15.239 5.381 -17.295 1.00 0.00 H new ATOM 0 HD12 LEU C 50 -16.052 6.706 -16.428 1.00 0.00 H new ATOM 0 HD13 LEU C 50 -14.361 6.299 -16.048 1.00 0.00 H new ATOM 0 HD21 LEU C 50 -14.715 3.252 -16.116 1.00 0.00 H new ATOM 0 HD22 LEU C 50 -13.832 4.154 -14.861 1.00 0.00 H new ATOM 0 HD23 LEU C 50 -15.147 3.047 -14.402 1.00 0.00 H new ATOM 811 N GLU C 51 -16.254 4.757 -10.429 1.00 0.00 N ATOM 812 CA GLU C 51 -16.437 5.357 -9.111 1.00 0.00 C ATOM 813 C GLU C 51 -15.431 6.478 -8.864 1.00 0.00 C ATOM 814 O GLU C 51 -14.288 6.430 -9.329 1.00 0.00 O ATOM 815 CB GLU C 51 -16.291 4.286 -8.028 1.00 0.00 C ATOM 816 CG GLU C 51 -17.428 3.271 -8.164 1.00 0.00 C ATOM 817 CD GLU C 51 -17.285 2.177 -7.112 1.00 0.00 C ATOM 818 OE1 GLU C 51 -16.310 2.209 -6.380 1.00 0.00 O ATOM 819 OE2 GLU C 51 -18.151 1.319 -7.055 1.00 0.00 O1- ATOM 0 H GLU C 51 -15.799 3.844 -10.419 1.00 0.00 H new ATOM 0 HA GLU C 51 -17.438 5.786 -9.073 1.00 0.00 H new ATOM 0 HB2 GLU C 51 -15.328 3.785 -8.123 1.00 0.00 H new ATOM 0 HB3 GLU C 51 -16.315 4.746 -7.040 1.00 0.00 H new ATOM 0 HG2 GLU C 51 -18.389 3.773 -8.049 1.00 0.00 H new ATOM 0 HG3 GLU C 51 -17.415 2.831 -9.161 1.00 0.00 H new ATOM 826 N ASP C 52 -15.857 7.488 -8.118 1.00 0.00 N ATOM 827 CA ASP C 52 -14.979 8.607 -7.817 1.00 0.00 C ATOM 828 C ASP C 52 -13.786 8.135 -6.995 1.00 0.00 C ATOM 829 O ASP C 52 -13.876 7.164 -6.242 1.00 0.00 O ATOM 830 CB ASP C 52 -15.748 9.686 -7.048 1.00 0.00 C ATOM 831 CG ASP C 52 -16.307 9.119 -5.745 1.00 0.00 C ATOM 832 OD1 ASP C 52 -16.131 7.936 -5.510 1.00 0.00 O ATOM 833 OD2 ASP C 52 -16.905 9.878 -5.003 1.00 0.00 O1- ATOM 0 H ASP C 52 -16.792 7.555 -7.716 1.00 0.00 H new ATOM 0 HA ASP C 52 -14.616 9.028 -8.754 1.00 0.00 H new ATOM 0 HB2 ASP C 52 -15.089 10.527 -6.832 1.00 0.00 H new ATOM 0 HB3 ASP C 52 -16.562 10.069 -7.663 1.00 0.00 H new ATOM 838 N GLY C 53 -12.666 8.821 -7.155 1.00 0.00 N ATOM 839 CA GLY C 53 -11.453 8.463 -6.434 1.00 0.00 C ATOM 840 C GLY C 53 -10.638 7.429 -7.210 1.00 0.00 C ATOM 841 O GLY C 53 -9.476 7.181 -6.891 1.00 0.00 O ATOM 0 H GLY C 53 -12.570 9.626 -7.775 1.00 0.00 H new ATOM 0 HA2 GLY C 53 -10.849 9.355 -6.266 1.00 0.00 H new ATOM 0 HA3 GLY C 53 -11.713 8.064 -5.453 1.00 0.00 H new ATOM 845 N ARG C 54 -11.246 6.834 -8.239 1.00 0.00 N ATOM 846 CA ARG C 54 -10.548 5.844 -9.050 1.00 0.00 C ATOM 847 C ARG C 54 -9.858 6.513 -10.229 1.00 0.00 C ATOM 848 O ARG C 54 -10.109 7.679 -10.533 1.00 0.00 O ATOM 849 CB ARG C 54 -11.524 4.793 -9.575 1.00 0.00 C ATOM 850 CG ARG C 54 -12.235 4.090 -8.417 1.00 0.00 C ATOM 851 CD ARG C 54 -11.325 3.003 -7.836 1.00 0.00 C ATOM 852 NE ARG C 54 -10.374 3.578 -6.892 1.00 0.00 N ATOM 853 CZ ARG C 54 -9.318 2.889 -6.454 1.00 0.00 C ATOM 854 NH1 ARG C 54 -9.105 1.662 -6.861 1.00 0.00 N1+ ATOM 855 NH2 ARG C 54 -8.487 3.443 -5.616 1.00 0.00 N ATOM 0 H ARG C 54 -12.207 7.020 -8.525 1.00 0.00 H new ATOM 0 HA ARG C 54 -9.803 5.360 -8.419 1.00 0.00 H new ATOM 0 HB2 ARG C 54 -12.259 5.265 -10.227 1.00 0.00 H new ATOM 0 HB3 ARG C 54 -10.988 4.060 -10.178 1.00 0.00 H new ATOM 0 HG2 ARG C 54 -12.493 4.813 -7.643 1.00 0.00 H new ATOM 0 HG3 ARG C 54 -13.169 3.648 -8.765 1.00 0.00 H new ATOM 0 HD2 ARG C 54 -11.928 2.245 -7.336 1.00 0.00 H new ATOM 0 HD3 ARG C 54 -10.788 2.502 -8.642 1.00 0.00 H new ATOM 0 HE ARG C 54 -10.519 4.531 -6.558 1.00 0.00 H new ATOM 0 HH11 ARG C 54 -9.749 1.224 -7.519 1.00 0.00 H new ATOM 0 HH12 ARG C 54 -8.295 1.145 -6.520 1.00 0.00 H new ATOM 0 HH21 ARG C 54 -8.645 4.399 -5.298 1.00 0.00 H new ATOM 0 HH22 ARG C 54 -7.679 2.920 -5.279 1.00 0.00 H new ATOM 869 N THR C 55 -8.990 5.760 -10.892 1.00 0.00 N ATOM 870 CA THR C 55 -8.269 6.279 -12.045 1.00 0.00 C ATOM 871 C THR C 55 -8.656 5.498 -13.293 1.00 0.00 C ATOM 872 O THR C 55 -9.234 4.416 -13.204 1.00 0.00 O ATOM 873 CB THR C 55 -6.762 6.172 -11.810 1.00 0.00 C ATOM 874 OG1 THR C 55 -6.392 4.802 -11.729 1.00 0.00 O ATOM 875 CG2 THR C 55 -6.395 6.879 -10.504 1.00 0.00 C ATOM 0 H THR C 55 -8.769 4.793 -10.652 1.00 0.00 H new ATOM 0 HA THR C 55 -8.532 7.327 -12.186 1.00 0.00 H new ATOM 0 HB THR C 55 -6.232 6.644 -12.637 1.00 0.00 H new ATOM 0 HG1 THR C 55 -5.777 4.585 -12.461 1.00 0.00 H new ATOM 0 HG21 THR C 55 -5.320 6.802 -10.338 1.00 0.00 H new ATOM 0 HG22 THR C 55 -6.678 7.930 -10.567 1.00 0.00 H new ATOM 0 HG23 THR C 55 -6.925 6.410 -9.675 1.00 0.00 H new ATOM 883 N LEU C 56 -8.347 6.054 -14.456 1.00 0.00 N ATOM 884 CA LEU C 56 -8.687 5.389 -15.708 1.00 0.00 C ATOM 885 C LEU C 56 -7.988 4.038 -15.809 1.00 0.00 C ATOM 886 O LEU C 56 -8.578 3.061 -16.270 1.00 0.00 O ATOM 887 CB LEU C 56 -8.289 6.269 -16.893 1.00 0.00 C ATOM 888 CG LEU C 56 -9.214 7.486 -16.959 1.00 0.00 C ATOM 889 CD1 LEU C 56 -8.671 8.483 -17.979 1.00 0.00 C ATOM 890 CD2 LEU C 56 -10.619 7.042 -17.379 1.00 0.00 C ATOM 0 H LEU C 56 -7.869 6.949 -14.560 1.00 0.00 H new ATOM 0 HA LEU C 56 -9.764 5.224 -15.728 1.00 0.00 H new ATOM 0 HB2 LEU C 56 -7.253 6.592 -16.788 1.00 0.00 H new ATOM 0 HB3 LEU C 56 -8.353 5.700 -17.820 1.00 0.00 H new ATOM 0 HG LEU C 56 -9.261 7.957 -15.977 1.00 0.00 H new ATOM 0 HD11 LEU C 56 -9.330 9.350 -18.026 1.00 0.00 H new ATOM 0 HD12 LEU C 56 -7.672 8.802 -17.680 1.00 0.00 H new ATOM 0 HD13 LEU C 56 -8.623 8.010 -18.960 1.00 0.00 H new ATOM 0 HD21 LEU C 56 -11.276 7.910 -17.425 1.00 0.00 H new ATOM 0 HD22 LEU C 56 -10.573 6.569 -18.360 1.00 0.00 H new ATOM 0 HD23 LEU C 56 -11.009 6.331 -16.651 1.00 0.00 H new ATOM 902 N SER C 57 -6.734 3.983 -15.372 1.00 0.00 N ATOM 903 CA SER C 57 -5.980 2.735 -15.419 1.00 0.00 C ATOM 904 C SER C 57 -6.630 1.681 -14.526 1.00 0.00 C ATOM 905 O SER C 57 -6.459 0.479 -14.742 1.00 0.00 O ATOM 906 CB SER C 57 -4.542 2.975 -14.966 1.00 0.00 C ATOM 907 OG SER C 57 -4.540 3.379 -13.603 1.00 0.00 O ATOM 0 H SER C 57 -6.223 4.777 -14.986 1.00 0.00 H new ATOM 0 HA SER C 57 -5.979 2.372 -16.447 1.00 0.00 H new ATOM 0 HB2 SER C 57 -3.953 2.066 -15.089 1.00 0.00 H new ATOM 0 HB3 SER C 57 -4.077 3.742 -15.585 1.00 0.00 H new ATOM 0 HG SER C 57 -3.618 3.532 -13.309 1.00 0.00 H new ATOM 913 N ASP C 58 -7.381 2.137 -13.525 1.00 0.00 N ATOM 914 CA ASP C 58 -8.060 1.225 -12.609 1.00 0.00 C ATOM 915 C ASP C 58 -9.067 0.370 -13.365 1.00 0.00 C ATOM 916 O ASP C 58 -9.249 -0.811 -13.068 1.00 0.00 O ATOM 917 CB ASP C 58 -8.776 2.008 -11.510 1.00 0.00 C ATOM 918 CG ASP C 58 -9.272 1.049 -10.435 1.00 0.00 C ATOM 919 OD1 ASP C 58 -8.438 0.454 -9.770 1.00 0.00 O ATOM 920 OD2 ASP C 58 -10.476 0.916 -10.294 1.00 0.00 O1- ATOM 0 H ASP C 58 -7.534 3.126 -13.329 1.00 0.00 H new ATOM 0 HA ASP C 58 -7.311 0.577 -12.153 1.00 0.00 H new ATOM 0 HB2 ASP C 58 -8.098 2.741 -11.072 1.00 0.00 H new ATOM 0 HB3 ASP C 58 -9.615 2.561 -11.932 1.00 0.00 H new ATOM 925 N TYR C 59 -9.728 0.989 -14.334 1.00 0.00 N ATOM 926 CA TYR C 59 -10.733 0.302 -15.133 1.00 0.00 C ATOM 927 C TYR C 59 -10.146 -0.206 -16.446 1.00 0.00 C ATOM 928 O TYR C 59 -10.883 -0.591 -17.354 1.00 0.00 O ATOM 929 CB TYR C 59 -11.879 1.261 -15.417 1.00 0.00 C ATOM 930 CG TYR C 59 -12.619 1.525 -14.132 1.00 0.00 C ATOM 931 CD1 TYR C 59 -12.094 2.417 -13.192 1.00 0.00 C ATOM 932 CD2 TYR C 59 -13.841 0.891 -13.885 1.00 0.00 C ATOM 933 CE1 TYR C 59 -12.785 2.674 -12.015 1.00 0.00 C ATOM 934 CE2 TYR C 59 -14.534 1.149 -12.698 1.00 0.00 C ATOM 935 CZ TYR C 59 -14.006 2.042 -11.762 1.00 0.00 C ATOM 936 OH TYR C 59 -14.690 2.306 -10.591 1.00 0.00 O ATOM 0 H TYR C 59 -9.586 1.967 -14.586 1.00 0.00 H new ATOM 0 HA TYR C 59 -11.094 -0.561 -14.573 1.00 0.00 H new ATOM 0 HB2 TYR C 59 -11.497 2.194 -15.831 1.00 0.00 H new ATOM 0 HB3 TYR C 59 -12.553 0.835 -16.160 1.00 0.00 H new ATOM 0 HD1 TYR C 59 -11.150 2.907 -13.381 1.00 0.00 H new ATOM 0 HD2 TYR C 59 -14.249 0.203 -14.610 1.00 0.00 H new ATOM 0 HE1 TYR C 59 -12.377 3.365 -11.292 1.00 0.00 H new ATOM 0 HE2 TYR C 59 -15.477 0.658 -12.505 1.00 0.00 H new ATOM 0 HH TYR C 59 -15.635 2.073 -10.705 1.00 0.00 H new ATOM 946 N ASN C 60 -8.819 -0.205 -16.542 1.00 0.00 N ATOM 947 CA ASN C 60 -8.158 -0.667 -17.750 1.00 0.00 C ATOM 948 C ASN C 60 -8.630 0.140 -18.951 1.00 0.00 C ATOM 949 O ASN C 60 -8.883 -0.408 -20.024 1.00 0.00 O ATOM 950 CB ASN C 60 -8.462 -2.151 -17.971 1.00 0.00 C ATOM 951 CG ASN C 60 -7.443 -2.759 -18.928 1.00 0.00 C ATOM 952 OD1 ASN C 60 -6.279 -2.356 -18.936 1.00 0.00 O ATOM 953 ND2 ASN C 60 -7.811 -3.714 -19.737 1.00 0.00 N ATOM 0 H ASN C 60 -8.189 0.108 -15.803 1.00 0.00 H new ATOM 0 HA ASN C 60 -7.082 -0.532 -17.636 1.00 0.00 H new ATOM 0 HB2 ASN C 60 -8.439 -2.680 -17.019 1.00 0.00 H new ATOM 0 HB3 ASN C 60 -9.467 -2.268 -18.376 1.00 0.00 H new ATOM 0 HD21 ASN C 60 -7.134 -4.129 -20.378 1.00 0.00 H new ATOM 0 HD22 ASN C 60 -8.775 -4.046 -19.729 1.00 0.00 H new ATOM 960 N ILE C 61 -8.737 1.453 -18.764 1.00 0.00 N ATOM 961 CA ILE C 61 -9.168 2.333 -19.839 1.00 0.00 C ATOM 962 C ILE C 61 -7.943 2.842 -20.588 1.00 0.00 C ATOM 963 O ILE C 61 -7.091 3.524 -20.021 1.00 0.00 O ATOM 964 CB ILE C 61 -9.991 3.498 -19.267 1.00 0.00 C ATOM 965 CG1 ILE C 61 -11.215 2.913 -18.540 1.00 0.00 C ATOM 966 CG2 ILE C 61 -10.464 4.423 -20.401 1.00 0.00 C ATOM 967 CD1 ILE C 61 -11.901 3.988 -17.692 1.00 0.00 C ATOM 0 H ILE C 61 -8.532 1.926 -17.884 1.00 0.00 H new ATOM 0 HA ILE C 61 -9.803 1.785 -20.535 1.00 0.00 H new ATOM 0 HB ILE C 61 -9.378 4.078 -18.578 1.00 0.00 H new ATOM 0 HG12 ILE C 61 -11.920 2.511 -19.268 1.00 0.00 H new ATOM 0 HG13 ILE C 61 -10.905 2.083 -17.905 1.00 0.00 H new ATOM 0 HG21 ILE C 61 -11.046 5.244 -19.982 1.00 0.00 H new ATOM 0 HG22 ILE C 61 -9.598 4.824 -20.929 1.00 0.00 H new ATOM 0 HG23 ILE C 61 -11.083 3.858 -21.097 1.00 0.00 H new ATOM 0 HD11 ILE C 61 -12.764 3.556 -17.186 1.00 0.00 H new ATOM 0 HD12 ILE C 61 -11.199 4.370 -16.951 1.00 0.00 H new ATOM 0 HD13 ILE C 61 -12.229 4.804 -18.335 1.00 0.00 H new ATOM 979 N GLN C 62 -7.858 2.484 -21.864 1.00 0.00 N ATOM 980 CA GLN C 62 -6.731 2.887 -22.694 1.00 0.00 C ATOM 981 C GLN C 62 -7.113 4.061 -23.581 1.00 0.00 C ATOM 982 O GLN C 62 -8.234 4.562 -23.522 1.00 0.00 O ATOM 983 CB GLN C 62 -6.276 1.720 -23.570 1.00 0.00 C ATOM 984 CG GLN C 62 -5.644 0.636 -22.697 1.00 0.00 C ATOM 985 CD GLN C 62 -5.374 -0.610 -23.536 1.00 0.00 C ATOM 986 OE1 GLN C 62 -6.058 -0.848 -24.531 1.00 0.00 O ATOM 987 NE2 GLN C 62 -4.416 -1.423 -23.189 1.00 0.00 N ATOM 0 H GLN C 62 -8.555 1.916 -22.345 1.00 0.00 H new ATOM 0 HA GLN C 62 -5.915 3.187 -22.036 1.00 0.00 H new ATOM 0 HB2 GLN C 62 -7.125 1.311 -24.117 1.00 0.00 H new ATOM 0 HB3 GLN C 62 -5.557 2.068 -24.312 1.00 0.00 H new ATOM 0 HG2 GLN C 62 -4.714 1.002 -22.263 1.00 0.00 H new ATOM 0 HG3 GLN C 62 -6.308 0.391 -21.868 1.00 0.00 H new ATOM 0 HE21 GLN C 62 -3.851 -1.223 -22.364 1.00 0.00 H new ATOM 0 HE22 GLN C 62 -4.231 -2.259 -23.743 1.00 0.00 H new ATOM 996 N LYS C 63 -6.173 4.502 -24.403 1.00 0.00 N ATOM 997 CA LYS C 63 -6.437 5.618 -25.292 1.00 0.00 C ATOM 998 C LYS C 63 -7.568 5.268 -26.255 1.00 0.00 C ATOM 999 O LYS C 63 -7.699 4.125 -26.693 1.00 0.00 O ATOM 1000 CB LYS C 63 -5.196 5.978 -26.107 1.00 0.00 C ATOM 1001 CG LYS C 63 -5.408 7.349 -26.761 1.00 0.00 C ATOM 1002 CD LYS C 63 -4.238 7.673 -27.691 1.00 0.00 C ATOM 1003 CE LYS C 63 -4.311 6.817 -28.962 1.00 0.00 C ATOM 1004 NZ LYS C 63 -3.144 7.130 -29.834 1.00 0.00 N1+ ATOM 0 H LYS C 63 -5.234 4.110 -24.472 1.00 0.00 H new ATOM 0 HA LYS C 63 -6.720 6.471 -24.675 1.00 0.00 H new ATOM 0 HB2 LYS C 63 -4.316 6.000 -25.464 1.00 0.00 H new ATOM 0 HB3 LYS C 63 -5.014 5.221 -26.870 1.00 0.00 H new ATOM 0 HG2 LYS C 63 -6.342 7.352 -27.323 1.00 0.00 H new ATOM 0 HG3 LYS C 63 -5.496 8.117 -25.993 1.00 0.00 H new ATOM 0 HD2 LYS C 63 -4.258 8.730 -27.956 1.00 0.00 H new ATOM 0 HD3 LYS C 63 -3.295 7.491 -27.176 1.00 0.00 H new ATOM 0 HE2 LYS C 63 -4.312 5.758 -28.702 1.00 0.00 H new ATOM 0 HE3 LYS C 63 -5.241 7.015 -29.495 1.00 0.00 H new ATOM 0 HZ1 LYS C 63 -3.190 6.551 -30.697 1.00 0.00 H new ATOM 0 HZ2 LYS C 63 -3.163 8.137 -30.091 1.00 0.00 H new ATOM 0 HZ3 LYS C 63 -2.263 6.920 -29.323 1.00 0.00 H new ATOM 1018 N GLU C 64 -8.374 6.265 -26.575 1.00 0.00 N ATOM 1019 CA GLU C 64 -9.495 6.090 -27.483 1.00 0.00 C ATOM 1020 C GLU C 64 -10.523 5.122 -26.901 1.00 0.00 C ATOM 1021 O GLU C 64 -11.385 4.620 -27.621 1.00 0.00 O ATOM 1022 CB GLU C 64 -9.001 5.573 -28.833 1.00 0.00 C ATOM 1023 CG GLU C 64 -7.814 6.419 -29.301 1.00 0.00 C ATOM 1024 CD GLU C 64 -7.624 6.266 -30.806 1.00 0.00 C ATOM 1025 OE1 GLU C 64 -8.334 5.470 -31.395 1.00 0.00 O ATOM 1026 OE2 GLU C 64 -6.765 6.945 -31.346 1.00 0.00 O1- ATOM 0 H GLU C 64 -8.271 7.214 -26.215 1.00 0.00 H new ATOM 0 HA GLU C 64 -9.975 7.059 -27.622 1.00 0.00 H new ATOM 0 HB2 GLU C 64 -8.705 4.528 -28.748 1.00 0.00 H new ATOM 0 HB3 GLU C 64 -9.805 5.618 -29.568 1.00 0.00 H new ATOM 0 HG2 GLU C 64 -7.983 7.467 -29.052 1.00 0.00 H new ATOM 0 HG3 GLU C 64 -6.909 6.110 -28.779 1.00 0.00 H new ATOM 1033 N SER C 65 -10.446 4.880 -25.592 1.00 0.00 N ATOM 1034 CA SER C 65 -11.398 3.993 -24.940 1.00 0.00 C ATOM 1035 C SER C 65 -12.783 4.614 -24.988 1.00 0.00 C ATOM 1036 O SER C 65 -12.952 5.781 -24.648 1.00 0.00 O ATOM 1037 CB SER C 65 -10.982 3.764 -23.487 1.00 0.00 C ATOM 1038 OG SER C 65 -12.008 3.050 -22.814 1.00 0.00 O ATOM 0 H SER C 65 -9.742 5.282 -24.973 1.00 0.00 H new ATOM 0 HA SER C 65 -11.414 3.035 -25.459 1.00 0.00 H new ATOM 0 HB2 SER C 65 -10.047 3.204 -23.448 1.00 0.00 H new ATOM 0 HB3 SER C 65 -10.803 4.719 -22.993 1.00 0.00 H new ATOM 0 HG SER C 65 -12.105 2.161 -23.215 1.00 0.00 H new ATOM 1044 N THR C 66 -13.771 3.838 -25.408 1.00 0.00 N ATOM 1045 CA THR C 66 -15.131 4.348 -25.490 1.00 0.00 C ATOM 1046 C THR C 66 -15.820 4.214 -24.138 1.00 0.00 C ATOM 1047 O THR C 66 -15.823 3.143 -23.531 1.00 0.00 O ATOM 1048 CB THR C 66 -15.918 3.584 -26.558 1.00 0.00 C ATOM 1049 OG1 THR C 66 -15.263 3.719 -27.811 1.00 0.00 O ATOM 1050 CG2 THR C 66 -17.333 4.156 -26.662 1.00 0.00 C ATOM 0 H THR C 66 -13.659 2.865 -25.694 1.00 0.00 H new ATOM 0 HA THR C 66 -15.096 5.402 -25.767 1.00 0.00 H new ATOM 0 HB THR C 66 -15.973 2.531 -26.283 1.00 0.00 H new ATOM 0 HG1 THR C 66 -15.764 3.229 -28.496 1.00 0.00 H new ATOM 0 HG21 THR C 66 -17.891 3.610 -27.423 1.00 0.00 H new ATOM 0 HG22 THR C 66 -17.837 4.056 -25.701 1.00 0.00 H new ATOM 0 HG23 THR C 66 -17.280 5.210 -26.936 1.00 0.00 H new ATOM 1058 N LEU C 67 -16.391 5.314 -23.667 1.00 0.00 N ATOM 1059 CA LEU C 67 -17.068 5.331 -22.384 1.00 0.00 C ATOM 1060 C LEU C 67 -18.543 5.649 -22.575 1.00 0.00 C ATOM 1061 O LEU C 67 -18.912 6.415 -23.466 1.00 0.00 O ATOM 1062 CB LEU C 67 -16.435 6.386 -21.470 1.00 0.00 C ATOM 1063 CG LEU C 67 -14.929 6.139 -21.350 1.00 0.00 C ATOM 1064 CD1 LEU C 67 -14.305 7.205 -20.451 1.00 0.00 C ATOM 1065 CD2 LEU C 67 -14.671 4.756 -20.753 1.00 0.00 C ATOM 0 H LEU C 67 -16.397 6.208 -24.159 1.00 0.00 H new ATOM 0 HA LEU C 67 -16.968 4.348 -21.925 1.00 0.00 H new ATOM 0 HB2 LEU C 67 -16.618 7.383 -21.871 1.00 0.00 H new ATOM 0 HB3 LEU C 67 -16.898 6.349 -20.484 1.00 0.00 H new ATOM 0 HG LEU C 67 -14.481 6.189 -22.342 1.00 0.00 H new ATOM 0 HD11 LEU C 67 -13.233 7.028 -20.367 1.00 0.00 H new ATOM 0 HD12 LEU C 67 -14.477 8.191 -20.883 1.00 0.00 H new ATOM 0 HD13 LEU C 67 -14.760 7.158 -19.461 1.00 0.00 H new ATOM 0 HD21 LEU C 67 -13.597 4.589 -20.672 1.00 0.00 H new ATOM 0 HD22 LEU C 67 -15.123 4.697 -19.763 1.00 0.00 H new ATOM 0 HD23 LEU C 67 -15.108 3.994 -21.398 1.00 0.00 H new ATOM 1077 N HIS C 68 -19.381 5.062 -21.734 1.00 0.00 N ATOM 1078 CA HIS C 68 -20.812 5.300 -21.820 1.00 0.00 C ATOM 1079 C HIS C 68 -21.196 6.469 -20.925 1.00 0.00 C ATOM 1080 O HIS C 68 -21.039 6.406 -19.703 1.00 0.00 O ATOM 1081 CB HIS C 68 -21.586 4.053 -21.389 1.00 0.00 C ATOM 1082 CG HIS C 68 -21.231 2.897 -22.282 1.00 0.00 C ATOM 1083 ND1 HIS C 68 -21.649 2.826 -23.602 1.00 0.00 N ATOM 1084 CD2 HIS C 68 -20.506 1.754 -22.057 1.00 0.00 C ATOM 1085 CE1 HIS C 68 -21.176 1.676 -24.116 1.00 0.00 C ATOM 1086 NE2 HIS C 68 -20.472 0.985 -23.216 1.00 0.00 N ATOM 0 H HIS C 68 -19.098 4.423 -20.991 1.00 0.00 H new ATOM 0 HA HIS C 68 -21.064 5.535 -22.854 1.00 0.00 H new ATOM 0 HB2 HIS C 68 -21.352 3.809 -20.353 1.00 0.00 H new ATOM 0 HB3 HIS C 68 -22.658 4.245 -21.437 1.00 0.00 H new ATOM 0 HD2 HIS C 68 -20.033 1.491 -21.122 1.00 0.00 H new ATOM 0 HE1 HIS C 68 -21.345 1.352 -25.132 1.00 0.00 H new ATOM 0 HE2 HIS C 68 -20.009 0.086 -23.350 1.00 0.00 H new ATOM 1094 N LEU C 69 -21.699 7.531 -21.542 1.00 0.00 N ATOM 1095 CA LEU C 69 -22.107 8.716 -20.805 1.00 0.00 C ATOM 1096 C LEU C 69 -23.609 8.665 -20.558 1.00 0.00 C ATOM 1097 O LEU C 69 -24.397 8.619 -21.502 1.00 0.00 O ATOM 1098 CB LEU C 69 -21.758 9.968 -21.619 1.00 0.00 C ATOM 1099 CG LEU C 69 -22.139 11.228 -20.842 1.00 0.00 C ATOM 1100 CD1 LEU C 69 -21.301 11.314 -19.568 1.00 0.00 C ATOM 1101 CD2 LEU C 69 -21.875 12.464 -21.706 1.00 0.00 C ATOM 0 H LEU C 69 -21.833 7.594 -22.551 1.00 0.00 H new ATOM 0 HA LEU C 69 -21.585 8.751 -19.849 1.00 0.00 H new ATOM 0 HB2 LEU C 69 -20.691 9.979 -21.843 1.00 0.00 H new ATOM 0 HB3 LEU C 69 -22.284 9.948 -22.574 1.00 0.00 H new ATOM 0 HG LEU C 69 -23.197 11.185 -20.582 1.00 0.00 H new ATOM 0 HD11 LEU C 69 -21.573 12.212 -19.014 1.00 0.00 H new ATOM 0 HD12 LEU C 69 -21.488 10.436 -18.950 1.00 0.00 H new ATOM 0 HD13 LEU C 69 -20.244 11.355 -19.830 1.00 0.00 H new ATOM 0 HD21 LEU C 69 -22.147 13.361 -21.150 1.00 0.00 H new ATOM 0 HD22 LEU C 69 -20.818 12.506 -21.968 1.00 0.00 H new ATOM 0 HD23 LEU C 69 -22.472 12.406 -22.616 1.00 0.00 H new ATOM 1113 N VAL C 70 -24.005 8.661 -19.288 1.00 0.00 N ATOM 1114 CA VAL C 70 -25.424 8.601 -18.948 1.00 0.00 C ATOM 1115 C VAL C 70 -25.853 9.862 -18.217 1.00 0.00 C ATOM 1116 O VAL C 70 -25.207 10.289 -17.263 1.00 0.00 O ATOM 1117 CB VAL C 70 -25.714 7.378 -18.073 1.00 0.00 C ATOM 1118 CG1 VAL C 70 -27.202 7.345 -17.720 1.00 0.00 C ATOM 1119 CG2 VAL C 70 -25.343 6.102 -18.833 1.00 0.00 C ATOM 0 H VAL C 70 -23.374 8.698 -18.487 1.00 0.00 H new ATOM 0 HA VAL C 70 -25.990 8.519 -19.876 1.00 0.00 H new ATOM 0 HB VAL C 70 -25.123 7.440 -17.159 1.00 0.00 H new ATOM 0 HG11 VAL C 70 -27.409 6.475 -17.097 1.00 0.00 H new ATOM 0 HG12 VAL C 70 -27.467 8.252 -17.176 1.00 0.00 H new ATOM 0 HG13 VAL C 70 -27.792 7.285 -18.635 1.00 0.00 H new ATOM 0 HG21 VAL C 70 -25.550 5.233 -18.208 1.00 0.00 H new ATOM 0 HG22 VAL C 70 -25.932 6.040 -19.748 1.00 0.00 H new ATOM 0 HG23 VAL C 70 -24.283 6.124 -19.084 1.00 0.00 H new ATOM 1129 N LEU C 71 -26.938 10.467 -18.687 1.00 0.00 N ATOM 1130 CA LEU C 71 -27.430 11.694 -18.079 1.00 0.00 C ATOM 1131 C LEU C 71 -28.731 11.443 -17.329 1.00 0.00 C ATOM 1132 O LEU C 71 -29.626 10.758 -17.827 1.00 0.00 O ATOM 1133 CB LEU C 71 -27.662 12.738 -19.170 1.00 0.00 C ATOM 1134 CG LEU C 71 -26.426 12.805 -20.066 1.00 0.00 C ATOM 1135 CD1 LEU C 71 -26.611 13.901 -21.115 1.00 0.00 C ATOM 1136 CD2 LEU C 71 -25.189 13.090 -19.211 1.00 0.00 C ATOM 0 H LEU C 71 -27.487 10.131 -19.478 1.00 0.00 H new ATOM 0 HA LEU C 71 -26.687 12.055 -17.368 1.00 0.00 H new ATOM 0 HB2 LEU C 71 -28.541 12.477 -19.760 1.00 0.00 H new ATOM 0 HB3 LEU C 71 -27.856 13.713 -18.723 1.00 0.00 H new ATOM 0 HG LEU C 71 -26.291 11.851 -20.575 1.00 0.00 H new ATOM 0 HD11 LEU C 71 -25.728 13.947 -21.753 1.00 0.00 H new ATOM 0 HD12 LEU C 71 -27.487 13.678 -21.724 1.00 0.00 H new ATOM 0 HD13 LEU C 71 -26.750 14.861 -20.618 1.00 0.00 H new ATOM 0 HD21 LEU C 71 -24.308 13.138 -19.851 1.00 0.00 H new ATOM 0 HD22 LEU C 71 -25.315 14.042 -18.695 1.00 0.00 H new ATOM 0 HD23 LEU C 71 -25.062 12.294 -18.478 1.00 0.00 H new ATOM 1243 N MET D 1 3.403 -26.325 1.575 1.00 0.00 N ATOM 1244 CA MET D 1 3.795 -25.031 2.202 1.00 0.00 C ATOM 1245 C MET D 1 2.679 -24.023 2.002 1.00 0.00 C ATOM 1246 O MET D 1 2.797 -23.096 1.204 1.00 0.00 O ATOM 1247 CB MET D 1 5.084 -24.516 1.553 1.00 0.00 C ATOM 1248 CG MET D 1 5.545 -23.250 2.274 1.00 0.00 C ATOM 1249 SD MET D 1 6.921 -22.495 1.380 1.00 0.00 S ATOM 1250 CE MET D 1 5.935 -21.789 0.042 1.00 0.00 C ATOM 0 H1 MET D 1 4.191 -27.000 1.649 1.00 0.00 H new ATOM 0 H2 MET D 1 2.570 -26.710 2.065 1.00 0.00 H new ATOM 0 H3 MET D 1 3.174 -26.170 0.573 1.00 0.00 H new ATOM 0 HA MET D 1 3.967 -25.176 3.269 1.00 0.00 H new ATOM 0 HB2 MET D 1 5.860 -25.280 1.604 1.00 0.00 H new ATOM 0 HB3 MET D 1 4.913 -24.305 0.497 1.00 0.00 H new ATOM 0 HG2 MET D 1 4.718 -22.543 2.350 1.00 0.00 H new ATOM 0 HG3 MET D 1 5.851 -23.492 3.292 1.00 0.00 H new ATOM 0 HE1 MET D 1 6.545 -21.090 -0.530 1.00 0.00 H new ATOM 0 HE2 MET D 1 5.587 -22.587 -0.614 1.00 0.00 H new ATOM 0 HE3 MET D 1 5.077 -21.264 0.461 1.00 0.00 H new ATOM 1262 N GLN D 2 1.600 -24.211 2.741 1.00 0.00 N ATOM 1263 CA GLN D 2 0.460 -23.315 2.657 1.00 0.00 C ATOM 1264 C GLN D 2 0.859 -21.917 3.075 1.00 0.00 C ATOM 1265 O GLN D 2 1.883 -21.720 3.715 1.00 0.00 O ATOM 1266 CB GLN D 2 -0.646 -23.817 3.578 1.00 0.00 C ATOM 1267 CG GLN D 2 -0.247 -23.529 5.011 1.00 0.00 C ATOM 1268 CD GLN D 2 -0.981 -24.471 5.957 1.00 0.00 C ATOM 1269 OE1 GLN D 2 -0.710 -25.671 5.974 1.00 0.00 O ATOM 1270 NE2 GLN D 2 -1.897 -23.996 6.755 1.00 0.00 N ATOM 0 H GLN D 2 1.489 -24.976 3.406 1.00 0.00 H new ATOM 0 HA GLN D 2 0.105 -23.291 1.627 1.00 0.00 H new ATOM 0 HB2 GLN D 2 -1.589 -23.324 3.341 1.00 0.00 H new ATOM 0 HB3 GLN D 2 -0.801 -24.887 3.436 1.00 0.00 H new ATOM 0 HG2 GLN D 2 0.830 -23.649 5.128 1.00 0.00 H new ATOM 0 HG3 GLN D 2 -0.481 -22.494 5.261 1.00 0.00 H new ATOM 0 HE21 GLN D 2 -2.121 -23.001 6.740 1.00 0.00 H new ATOM 0 HE22 GLN D 2 -2.390 -24.620 7.394 1.00 0.00 H new ATOM 1279 N ILE D 3 0.047 -20.954 2.694 1.00 0.00 N ATOM 1280 CA ILE D 3 0.308 -19.568 3.025 1.00 0.00 C ATOM 1281 C ILE D 3 -1.003 -18.851 3.313 1.00 0.00 C ATOM 1282 O ILE D 3 -2.011 -19.117 2.666 1.00 0.00 O ATOM 1283 CB ILE D 3 1.047 -18.912 1.862 1.00 0.00 C ATOM 1284 CG1 ILE D 3 0.321 -19.263 0.556 1.00 0.00 C ATOM 1285 CG2 ILE D 3 2.486 -19.431 1.820 1.00 0.00 C ATOM 1286 CD1 ILE D 3 1.003 -18.585 -0.631 1.00 0.00 C ATOM 0 H ILE D 3 -0.804 -21.106 2.152 1.00 0.00 H new ATOM 0 HA ILE D 3 0.929 -19.506 3.918 1.00 0.00 H new ATOM 0 HB ILE D 3 1.065 -17.829 1.988 1.00 0.00 H new ATOM 0 HG12 ILE D 3 0.318 -20.344 0.413 1.00 0.00 H new ATOM 0 HG13 ILE D 3 -0.720 -18.946 0.615 1.00 0.00 H new ATOM 0 HG21 ILE D 3 3.017 -18.964 0.990 1.00 0.00 H new ATOM 0 HG22 ILE D 3 2.988 -19.186 2.756 1.00 0.00 H new ATOM 0 HG23 ILE D 3 2.479 -20.512 1.684 1.00 0.00 H new ATOM 0 HD11 ILE D 3 0.476 -18.844 -1.550 1.00 0.00 H new ATOM 0 HD12 ILE D 3 0.983 -17.504 -0.493 1.00 0.00 H new ATOM 0 HD13 ILE D 3 2.037 -18.923 -0.698 1.00 0.00 H new ATOM 1298 N PHE D 4 -0.985 -17.952 4.286 1.00 0.00 N ATOM 1299 CA PHE D 4 -2.190 -17.220 4.657 1.00 0.00 C ATOM 1300 C PHE D 4 -2.306 -15.933 3.861 1.00 0.00 C ATOM 1301 O PHE D 4 -1.472 -15.051 3.979 1.00 0.00 O ATOM 1302 CB PHE D 4 -2.144 -16.910 6.152 1.00 0.00 C ATOM 1303 CG PHE D 4 -2.346 -18.192 6.926 1.00 0.00 C ATOM 1304 CD1 PHE D 4 -1.287 -19.095 7.061 1.00 0.00 C ATOM 1305 CD2 PHE D 4 -3.585 -18.473 7.510 1.00 0.00 C ATOM 1306 CE1 PHE D 4 -1.467 -20.284 7.781 1.00 0.00 C ATOM 1307 CE2 PHE D 4 -3.764 -19.658 8.233 1.00 0.00 C ATOM 1308 CZ PHE D 4 -2.707 -20.564 8.369 1.00 0.00 C ATOM 0 H PHE D 4 -0.156 -17.712 4.830 1.00 0.00 H new ATOM 0 HA PHE D 4 -3.063 -17.834 4.434 1.00 0.00 H new ATOM 0 HB2 PHE D 4 -1.187 -16.459 6.414 1.00 0.00 H new ATOM 0 HB3 PHE D 4 -2.918 -16.188 6.411 1.00 0.00 H new ATOM 0 HD1 PHE D 4 -0.330 -18.876 6.610 1.00 0.00 H new ATOM 0 HD2 PHE D 4 -4.403 -17.776 7.403 1.00 0.00 H new ATOM 0 HE1 PHE D 4 -0.650 -20.984 7.882 1.00 0.00 H new ATOM 0 HE2 PHE D 4 -4.720 -19.873 8.687 1.00 0.00 H new ATOM 0 HZ PHE D 4 -2.847 -21.478 8.927 1.00 0.00 H new ATOM 1318 N VAL D 5 -3.343 -15.823 3.047 1.00 0.00 N ATOM 1319 CA VAL D 5 -3.523 -14.627 2.248 1.00 0.00 C ATOM 1320 C VAL D 5 -4.477 -13.666 2.938 1.00 0.00 C ATOM 1321 O VAL D 5 -5.687 -13.859 2.927 1.00 0.00 O ATOM 1322 CB VAL D 5 -4.060 -15.020 0.878 1.00 0.00 C ATOM 1323 CG1 VAL D 5 -4.350 -13.765 0.062 1.00 0.00 C ATOM 1324 CG2 VAL D 5 -3.001 -15.867 0.166 1.00 0.00 C ATOM 0 H VAL D 5 -4.062 -16.536 2.924 1.00 0.00 H new ATOM 0 HA VAL D 5 -2.564 -14.122 2.130 1.00 0.00 H new ATOM 0 HB VAL D 5 -4.982 -15.591 0.987 1.00 0.00 H new ATOM 0 HG11 VAL D 5 -4.734 -14.049 -0.918 1.00 0.00 H new ATOM 0 HG12 VAL D 5 -5.092 -13.157 0.580 1.00 0.00 H new ATOM 0 HG13 VAL D 5 -3.432 -13.191 -0.061 1.00 0.00 H new ATOM 0 HG21 VAL D 5 -3.369 -16.158 -0.818 1.00 0.00 H new ATOM 0 HG22 VAL D 5 -2.086 -15.286 0.054 1.00 0.00 H new ATOM 0 HG23 VAL D 5 -2.794 -16.761 0.755 1.00 0.00 H new ATOM 1334 N LYS D 6 -3.919 -12.629 3.544 1.00 0.00 N ATOM 1335 CA LYS D 6 -4.735 -11.655 4.248 1.00 0.00 C ATOM 1336 C LYS D 6 -5.250 -10.601 3.277 1.00 0.00 C ATOM 1337 O LYS D 6 -4.469 -9.949 2.581 1.00 0.00 O ATOM 1338 CB LYS D 6 -3.904 -10.980 5.341 1.00 0.00 C ATOM 1339 CG LYS D 6 -4.753 -10.767 6.597 1.00 0.00 C ATOM 1340 CD LYS D 6 -4.149 -11.579 7.741 1.00 0.00 C ATOM 1341 CE LYS D 6 -4.650 -11.036 9.078 1.00 0.00 C ATOM 1342 NZ LYS D 6 -5.885 -11.763 9.486 1.00 0.00 N1+ ATOM 0 H LYS D 6 -2.916 -12.442 3.562 1.00 0.00 H new ATOM 0 HA LYS D 6 -5.584 -12.168 4.700 1.00 0.00 H new ATOM 0 HB2 LYS D 6 -3.036 -11.595 5.580 1.00 0.00 H new ATOM 0 HB3 LYS D 6 -3.527 -10.023 4.982 1.00 0.00 H new ATOM 0 HG2 LYS D 6 -4.782 -9.709 6.859 1.00 0.00 H new ATOM 0 HG3 LYS D 6 -5.782 -11.078 6.415 1.00 0.00 H new ATOM 0 HD2 LYS D 6 -4.423 -12.629 7.638 1.00 0.00 H new ATOM 0 HD3 LYS D 6 -3.061 -11.528 7.701 1.00 0.00 H new ATOM 0 HE2 LYS D 6 -3.880 -11.153 9.840 1.00 0.00 H new ATOM 0 HE3 LYS D 6 -4.856 -9.969 8.994 1.00 0.00 H new ATOM 0 HZ1 LYS D 6 -5.868 -11.928 10.513 1.00 0.00 H new ATOM 0 HZ2 LYS D 6 -6.720 -11.194 9.241 1.00 0.00 H new ATOM 0 HZ3 LYS D 6 -5.930 -12.676 8.990 1.00 0.00 H new ATOM 1356 N THR D 7 -6.565 -10.438 3.235 1.00 0.00 N ATOM 1357 CA THR D 7 -7.174 -9.459 2.348 1.00 0.00 C ATOM 1358 C THR D 7 -7.030 -8.059 2.921 1.00 0.00 C ATOM 1359 O THR D 7 -6.330 -7.851 3.911 1.00 0.00 O ATOM 1360 CB THR D 7 -8.652 -9.780 2.136 1.00 0.00 C ATOM 1361 OG1 THR D 7 -9.336 -9.693 3.377 1.00 0.00 O ATOM 1362 CG2 THR D 7 -8.791 -11.193 1.563 1.00 0.00 C ATOM 0 H THR D 7 -7.227 -10.968 3.802 1.00 0.00 H new ATOM 0 HA THR D 7 -6.660 -9.502 1.388 1.00 0.00 H new ATOM 0 HB THR D 7 -9.085 -9.066 1.436 1.00 0.00 H new ATOM 0 HG1 THR D 7 -8.978 -10.363 3.996 1.00 0.00 H new ATOM 0 HG21 THR D 7 -9.846 -11.422 1.412 1.00 0.00 H new ATOM 0 HG22 THR D 7 -8.266 -11.252 0.609 1.00 0.00 H new ATOM 0 HG23 THR D 7 -8.360 -11.912 2.259 1.00 0.00 H new ATOM 1370 N LEU D 8 -7.695 -7.102 2.290 1.00 0.00 N ATOM 1371 CA LEU D 8 -7.630 -5.726 2.748 1.00 0.00 C ATOM 1372 C LEU D 8 -8.156 -5.630 4.181 1.00 0.00 C ATOM 1373 O LEU D 8 -7.888 -4.658 4.887 1.00 0.00 O ATOM 1374 CB LEU D 8 -8.468 -4.833 1.831 1.00 0.00 C ATOM 1375 CG LEU D 8 -7.942 -4.912 0.399 1.00 0.00 C ATOM 1376 CD1 LEU D 8 -8.844 -4.085 -0.519 1.00 0.00 C ATOM 1377 CD2 LEU D 8 -6.517 -4.357 0.341 1.00 0.00 C ATOM 0 H LEU D 8 -8.280 -7.252 1.468 1.00 0.00 H new ATOM 0 HA LEU D 8 -6.593 -5.392 2.724 1.00 0.00 H new ATOM 0 HB2 LEU D 8 -9.512 -5.145 1.861 1.00 0.00 H new ATOM 0 HB3 LEU D 8 -8.433 -3.802 2.183 1.00 0.00 H new ATOM 0 HG LEU D 8 -7.939 -5.952 0.073 1.00 0.00 H new ATOM 0 HD11 LEU D 8 -8.471 -4.140 -1.542 1.00 0.00 H new ATOM 0 HD12 LEU D 8 -9.860 -4.479 -0.482 1.00 0.00 H new ATOM 0 HD13 LEU D 8 -8.845 -3.046 -0.188 1.00 0.00 H new ATOM 0 HD21 LEU D 8 -6.145 -4.415 -0.682 1.00 0.00 H new ATOM 0 HD22 LEU D 8 -6.518 -3.317 0.668 1.00 0.00 H new ATOM 0 HD23 LEU D 8 -5.871 -4.943 0.995 1.00 0.00 H new ATOM 1389 N THR D 9 -8.908 -6.647 4.600 1.00 0.00 N ATOM 1390 CA THR D 9 -9.470 -6.677 5.943 1.00 0.00 C ATOM 1391 C THR D 9 -8.883 -7.846 6.733 1.00 0.00 C ATOM 1392 O THR D 9 -7.961 -8.518 6.270 1.00 0.00 O ATOM 1393 CB THR D 9 -10.990 -6.823 5.858 1.00 0.00 C ATOM 1394 OG1 THR D 9 -11.317 -8.152 5.475 1.00 0.00 O ATOM 1395 CG2 THR D 9 -11.539 -5.844 4.816 1.00 0.00 C ATOM 0 H THR D 9 -9.140 -7.458 4.027 1.00 0.00 H new ATOM 0 HA THR D 9 -9.222 -5.746 6.454 1.00 0.00 H new ATOM 0 HB THR D 9 -11.431 -6.605 6.831 1.00 0.00 H new ATOM 0 HG1 THR D 9 -10.643 -8.487 4.847 1.00 0.00 H new ATOM 0 HG21 THR D 9 -12.622 -5.947 4.755 1.00 0.00 H new ATOM 0 HG22 THR D 9 -11.288 -4.824 5.107 1.00 0.00 H new ATOM 0 HG23 THR D 9 -11.098 -6.063 3.843 1.00 0.00 H new ATOM 1403 N GLY D 10 -9.415 -8.081 7.926 1.00 0.00 N ATOM 1404 CA GLY D 10 -8.931 -9.169 8.771 1.00 0.00 C ATOM 1405 C GLY D 10 -9.123 -10.526 8.093 1.00 0.00 C ATOM 1406 O GLY D 10 -8.473 -11.505 8.457 1.00 0.00 O ATOM 0 H GLY D 10 -10.178 -7.537 8.330 1.00 0.00 H new ATOM 0 HA2 GLY D 10 -7.875 -9.017 8.993 1.00 0.00 H new ATOM 0 HA3 GLY D 10 -9.462 -9.157 9.723 1.00 0.00 H new ATOM 1410 N LYS D 11 -10.023 -10.580 7.114 1.00 0.00 N ATOM 1411 CA LYS D 11 -10.289 -11.828 6.406 1.00 0.00 C ATOM 1412 C LYS D 11 -8.984 -12.428 5.879 1.00 0.00 C ATOM 1413 O LYS D 11 -8.171 -11.733 5.270 1.00 0.00 O ATOM 1414 CB LYS D 11 -11.254 -11.561 5.245 1.00 0.00 C ATOM 1415 CG LYS D 11 -12.043 -12.829 4.911 1.00 0.00 C ATOM 1416 CD LYS D 11 -11.411 -13.531 3.707 1.00 0.00 C ATOM 1417 CE LYS D 11 -12.341 -14.650 3.230 1.00 0.00 C ATOM 1418 NZ LYS D 11 -11.800 -15.250 1.979 1.00 0.00 N1+ ATOM 0 H LYS D 11 -10.575 -9.783 6.796 1.00 0.00 H new ATOM 0 HA LYS D 11 -10.743 -12.540 7.095 1.00 0.00 H new ATOM 0 HB2 LYS D 11 -11.940 -10.757 5.510 1.00 0.00 H new ATOM 0 HB3 LYS D 11 -10.697 -11.229 4.369 1.00 0.00 H new ATOM 0 HG2 LYS D 11 -12.053 -13.499 5.771 1.00 0.00 H new ATOM 0 HG3 LYS D 11 -13.080 -12.576 4.693 1.00 0.00 H new ATOM 0 HD2 LYS D 11 -11.241 -12.816 2.902 1.00 0.00 H new ATOM 0 HD3 LYS D 11 -10.439 -13.942 3.980 1.00 0.00 H new ATOM 0 HE2 LYS D 11 -12.433 -15.414 4.002 1.00 0.00 H new ATOM 0 HE3 LYS D 11 -13.341 -14.255 3.053 1.00 0.00 H new ATOM 0 HZ1 LYS D 11 -12.587 -15.541 1.365 1.00 0.00 H new ATOM 0 HZ2 LYS D 11 -11.214 -14.548 1.482 1.00 0.00 H new ATOM 0 HZ3 LYS D 11 -11.220 -16.080 2.215 1.00 0.00 H new ATOM 1432 N THR D 12 -8.788 -13.719 6.138 1.00 0.00 N ATOM 1433 CA THR D 12 -7.573 -14.411 5.707 1.00 0.00 C ATOM 1434 C THR D 12 -7.924 -15.682 4.937 1.00 0.00 C ATOM 1435 O THR D 12 -8.872 -16.388 5.283 1.00 0.00 O ATOM 1436 CB THR D 12 -6.725 -14.768 6.923 1.00 0.00 C ATOM 1437 OG1 THR D 12 -6.444 -13.591 7.658 1.00 0.00 O ATOM 1438 CG2 THR D 12 -5.414 -15.413 6.462 1.00 0.00 C ATOM 0 H THR D 12 -9.452 -14.306 6.642 1.00 0.00 H new ATOM 0 HA THR D 12 -7.010 -13.748 5.050 1.00 0.00 H new ATOM 0 HB THR D 12 -7.268 -15.471 7.555 1.00 0.00 H new ATOM 0 HG1 THR D 12 -7.284 -13.163 7.924 1.00 0.00 H new ATOM 0 HG21 THR D 12 -4.808 -15.668 7.332 1.00 0.00 H new ATOM 0 HG22 THR D 12 -5.633 -16.318 5.895 1.00 0.00 H new ATOM 0 HG23 THR D 12 -4.866 -14.713 5.831 1.00 0.00 H new ATOM 1446 N ILE D 13 -7.170 -15.955 3.877 1.00 0.00 N ATOM 1447 CA ILE D 13 -7.419 -17.125 3.044 1.00 0.00 C ATOM 1448 C ILE D 13 -6.163 -17.988 2.932 1.00 0.00 C ATOM 1449 O ILE D 13 -5.250 -17.662 2.175 1.00 0.00 O ATOM 1450 CB ILE D 13 -7.830 -16.660 1.643 1.00 0.00 C ATOM 1451 CG1 ILE D 13 -8.537 -15.302 1.739 1.00 0.00 C ATOM 1452 CG2 ILE D 13 -8.778 -17.687 1.020 1.00 0.00 C ATOM 1453 CD1 ILE D 13 -9.041 -14.893 0.360 1.00 0.00 C ATOM 0 H ILE D 13 -6.382 -15.382 3.575 1.00 0.00 H new ATOM 0 HA ILE D 13 -8.212 -17.718 3.500 1.00 0.00 H new ATOM 0 HB ILE D 13 -6.941 -16.562 1.020 1.00 0.00 H new ATOM 0 HG12 ILE D 13 -9.370 -15.362 2.439 1.00 0.00 H new ATOM 0 HG13 ILE D 13 -7.850 -14.549 2.125 1.00 0.00 H new ATOM 0 HG21 ILE D 13 -9.070 -17.355 0.024 1.00 0.00 H new ATOM 0 HG22 ILE D 13 -8.274 -18.651 0.949 1.00 0.00 H new ATOM 0 HG23 ILE D 13 -9.666 -17.787 1.644 1.00 0.00 H new ATOM 0 HD11 ILE D 13 -9.543 -13.928 0.428 1.00 0.00 H new ATOM 0 HD12 ILE D 13 -8.198 -14.816 -0.327 1.00 0.00 H new ATOM 0 HD13 ILE D 13 -9.742 -15.642 -0.008 1.00 0.00 H new ATOM 1465 N THR D 14 -6.116 -19.089 3.677 1.00 0.00 N ATOM 1466 CA THR D 14 -4.956 -19.967 3.629 1.00 0.00 C ATOM 1467 C THR D 14 -5.028 -20.884 2.414 1.00 0.00 C ATOM 1468 O THR D 14 -6.042 -21.541 2.179 1.00 0.00 O ATOM 1469 CB THR D 14 -4.866 -20.796 4.904 1.00 0.00 C ATOM 1470 OG1 THR D 14 -5.398 -20.048 5.988 1.00 0.00 O ATOM 1471 CG2 THR D 14 -3.405 -21.121 5.183 1.00 0.00 C ATOM 0 H THR D 14 -6.856 -19.389 4.311 1.00 0.00 H new ATOM 0 HA THR D 14 -4.062 -19.349 3.546 1.00 0.00 H new ATOM 0 HB THR D 14 -5.433 -21.720 4.786 1.00 0.00 H new ATOM 0 HG1 THR D 14 -4.677 -19.552 6.429 1.00 0.00 H new ATOM 0 HG21 THR D 14 -3.332 -21.714 6.094 1.00 0.00 H new ATOM 0 HG22 THR D 14 -2.992 -21.687 4.348 1.00 0.00 H new ATOM 0 HG23 THR D 14 -2.844 -20.195 5.307 1.00 0.00 H new ATOM 1479 N LEU D 15 -3.945 -20.919 1.641 1.00 0.00 N ATOM 1480 CA LEU D 15 -3.897 -21.752 0.445 1.00 0.00 C ATOM 1481 C LEU D 15 -2.660 -22.646 0.448 1.00 0.00 C ATOM 1482 O LEU D 15 -1.537 -22.159 0.543 1.00 0.00 O ATOM 1483 CB LEU D 15 -3.877 -20.861 -0.800 1.00 0.00 C ATOM 1484 CG LEU D 15 -5.243 -20.197 -0.981 1.00 0.00 C ATOM 1485 CD1 LEU D 15 -5.150 -19.118 -2.061 1.00 0.00 C ATOM 1486 CD2 LEU D 15 -6.266 -21.252 -1.408 1.00 0.00 C ATOM 0 H LEU D 15 -3.095 -20.384 1.821 1.00 0.00 H new ATOM 0 HA LEU D 15 -4.783 -22.387 0.435 1.00 0.00 H new ATOM 0 HB2 LEU D 15 -3.102 -20.100 -0.702 1.00 0.00 H new ATOM 0 HB3 LEU D 15 -3.631 -21.455 -1.680 1.00 0.00 H new ATOM 0 HG LEU D 15 -5.553 -19.743 -0.040 1.00 0.00 H new ATOM 0 HD11 LEU D 15 -6.124 -18.646 -2.189 1.00 0.00 H new ATOM 0 HD12 LEU D 15 -4.419 -18.367 -1.763 1.00 0.00 H new ATOM 0 HD13 LEU D 15 -4.840 -19.571 -3.003 1.00 0.00 H new ATOM 0 HD21 LEU D 15 -7.241 -20.782 -1.538 1.00 0.00 H new ATOM 0 HD22 LEU D 15 -5.952 -21.703 -2.349 1.00 0.00 H new ATOM 0 HD23 LEU D 15 -6.335 -22.024 -0.641 1.00 0.00 H new ATOM 1498 N GLU D 16 -2.879 -23.952 0.329 1.00 0.00 N ATOM 1499 CA GLU D 16 -1.776 -24.911 0.307 1.00 0.00 C ATOM 1500 C GLU D 16 -0.953 -24.755 -0.978 1.00 0.00 C ATOM 1501 O GLU D 16 -1.433 -25.019 -2.079 1.00 0.00 O ATOM 1502 CB GLU D 16 -2.333 -26.335 0.429 1.00 0.00 C ATOM 1503 CG GLU D 16 -3.271 -26.627 -0.741 1.00 0.00 C ATOM 1504 CD GLU D 16 -4.149 -27.833 -0.426 1.00 0.00 C ATOM 1505 OE1 GLU D 16 -3.992 -28.392 0.647 1.00 0.00 O ATOM 1506 OE2 GLU D 16 -4.970 -28.178 -1.261 1.00 0.00 O1- ATOM 0 H GLU D 16 -3.805 -24.371 0.247 1.00 0.00 H new ATOM 0 HA GLU D 16 -1.115 -24.717 1.152 1.00 0.00 H new ATOM 0 HB2 GLU D 16 -1.515 -27.055 0.440 1.00 0.00 H new ATOM 0 HB3 GLU D 16 -2.868 -26.446 1.372 1.00 0.00 H new ATOM 0 HG2 GLU D 16 -3.895 -25.756 -0.942 1.00 0.00 H new ATOM 0 HG3 GLU D 16 -2.690 -26.817 -1.643 1.00 0.00 H new ATOM 1513 N VAL D 17 0.289 -24.298 -0.839 1.00 0.00 N ATOM 1514 CA VAL D 17 1.145 -24.096 -2.001 1.00 0.00 C ATOM 1515 C VAL D 17 2.548 -24.634 -1.733 1.00 0.00 C ATOM 1516 O VAL D 17 2.911 -24.889 -0.587 1.00 0.00 O ATOM 1517 CB VAL D 17 1.237 -22.611 -2.331 1.00 0.00 C ATOM 1518 CG1 VAL D 17 -0.167 -22.044 -2.569 1.00 0.00 C ATOM 1519 CG2 VAL D 17 1.897 -21.881 -1.165 1.00 0.00 C ATOM 0 H VAL D 17 0.720 -24.064 0.055 1.00 0.00 H new ATOM 0 HA VAL D 17 0.709 -24.634 -2.843 1.00 0.00 H new ATOM 0 HB VAL D 17 1.832 -22.473 -3.234 1.00 0.00 H new ATOM 0 HG11 VAL D 17 -0.095 -20.982 -2.804 1.00 0.00 H new ATOM 0 HG12 VAL D 17 -0.635 -22.570 -3.401 1.00 0.00 H new ATOM 0 HG13 VAL D 17 -0.770 -22.177 -1.671 1.00 0.00 H new ATOM 0 HG21 VAL D 17 1.966 -20.818 -1.394 1.00 0.00 H new ATOM 0 HG22 VAL D 17 1.300 -22.020 -0.264 1.00 0.00 H new ATOM 0 HG23 VAL D 17 2.897 -22.283 -1.003 1.00 0.00 H new ATOM 1529 N GLU D 18 3.338 -24.784 -2.790 1.00 0.00 N ATOM 1530 CA GLU D 18 4.706 -25.269 -2.640 1.00 0.00 C ATOM 1531 C GLU D 18 5.690 -24.151 -2.958 1.00 0.00 C ATOM 1532 O GLU D 18 5.362 -23.221 -3.690 1.00 0.00 O ATOM 1533 CB GLU D 18 4.957 -26.463 -3.556 1.00 0.00 C ATOM 1534 CG GLU D 18 4.091 -27.634 -3.099 1.00 0.00 C ATOM 1535 CD GLU D 18 4.596 -28.162 -1.760 1.00 0.00 C ATOM 1536 OE1 GLU D 18 5.698 -27.800 -1.381 1.00 0.00 O ATOM 1537 OE2 GLU D 18 3.874 -28.920 -1.133 1.00 0.00 O1- ATOM 0 H GLU D 18 3.060 -24.580 -3.750 1.00 0.00 H new ATOM 0 HA GLU D 18 4.850 -25.590 -1.608 1.00 0.00 H new ATOM 0 HB2 GLU D 18 4.722 -26.201 -4.588 1.00 0.00 H new ATOM 0 HB3 GLU D 18 6.010 -26.742 -3.530 1.00 0.00 H new ATOM 0 HG2 GLU D 18 3.053 -27.315 -3.006 1.00 0.00 H new ATOM 0 HG3 GLU D 18 4.115 -28.428 -3.845 1.00 0.00 H new ATOM 1544 N PRO D 19 6.878 -24.206 -2.418 1.00 0.00 N ATOM 1545 CA PRO D 19 7.904 -23.147 -2.651 1.00 0.00 C ATOM 1546 C PRO D 19 8.185 -22.930 -4.139 1.00 0.00 C ATOM 1547 O PRO D 19 8.317 -21.791 -4.602 1.00 0.00 O ATOM 1548 CB PRO D 19 9.146 -23.689 -1.948 1.00 0.00 C ATOM 1549 CG PRO D 19 8.646 -24.665 -0.939 1.00 0.00 C ATOM 1550 CD PRO D 19 7.386 -25.276 -1.536 1.00 0.00 C ATOM 0 HA PRO D 19 7.578 -22.177 -2.276 1.00 0.00 H new ATOM 0 HB2 PRO D 19 9.819 -24.170 -2.658 1.00 0.00 H new ATOM 0 HB3 PRO D 19 9.707 -22.886 -1.471 1.00 0.00 H new ATOM 0 HG2 PRO D 19 9.393 -25.432 -0.735 1.00 0.00 H new ATOM 0 HG3 PRO D 19 8.429 -24.171 0.008 1.00 0.00 H new ATOM 0 HD2 PRO D 19 7.605 -26.187 -2.093 1.00 0.00 H new ATOM 0 HD3 PRO D 19 6.662 -25.540 -0.765 1.00 0.00 H new ATOM 1558 N SER D 20 8.261 -24.033 -4.879 1.00 0.00 N ATOM 1559 CA SER D 20 8.520 -23.973 -6.314 1.00 0.00 C ATOM 1560 C SER D 20 7.317 -23.404 -7.059 1.00 0.00 C ATOM 1561 O SER D 20 7.427 -23.009 -8.221 1.00 0.00 O ATOM 1562 CB SER D 20 8.828 -25.372 -6.846 1.00 0.00 C ATOM 1563 OG SER D 20 7.652 -26.169 -6.776 1.00 0.00 O ATOM 0 H SER D 20 8.147 -24.977 -4.509 1.00 0.00 H new ATOM 0 HA SER D 20 9.377 -23.319 -6.478 1.00 0.00 H new ATOM 0 HB2 SER D 20 9.181 -25.313 -7.876 1.00 0.00 H new ATOM 0 HB3 SER D 20 9.626 -25.829 -6.261 1.00 0.00 H new ATOM 0 HG SER D 20 7.845 -27.067 -7.118 1.00 0.00 H new ATOM 1569 N ASP D 21 6.167 -23.369 -6.393 1.00 0.00 N ATOM 1570 CA ASP D 21 4.959 -22.852 -7.012 1.00 0.00 C ATOM 1571 C ASP D 21 5.173 -21.416 -7.471 1.00 0.00 C ATOM 1572 O ASP D 21 5.768 -20.607 -6.755 1.00 0.00 O ATOM 1573 CB ASP D 21 3.801 -22.904 -6.018 1.00 0.00 C ATOM 1574 CG ASP D 21 2.481 -22.760 -6.759 1.00 0.00 C ATOM 1575 OD1 ASP D 21 2.416 -23.213 -7.889 1.00 0.00 O ATOM 1576 OD2 ASP D 21 1.561 -22.198 -6.191 1.00 0.00 O1- ATOM 0 H ASP D 21 6.050 -23.691 -5.432 1.00 0.00 H new ATOM 0 HA ASP D 21 4.720 -23.469 -7.878 1.00 0.00 H new ATOM 0 HB2 ASP D 21 3.821 -23.847 -5.471 1.00 0.00 H new ATOM 0 HB3 ASP D 21 3.905 -22.106 -5.282 1.00 0.00 H new ATOM 1581 N THR D 22 4.697 -21.107 -8.672 1.00 0.00 N ATOM 1582 CA THR D 22 4.851 -19.766 -9.216 1.00 0.00 C ATOM 1583 C THR D 22 3.786 -18.826 -8.662 1.00 0.00 C ATOM 1584 O THR D 22 2.774 -19.264 -8.105 1.00 0.00 O ATOM 1585 CB THR D 22 4.766 -19.805 -10.741 1.00 0.00 C ATOM 1586 OG1 THR D 22 3.455 -20.184 -11.133 1.00 0.00 O ATOM 1587 CG2 THR D 22 5.776 -20.817 -11.283 1.00 0.00 C ATOM 0 H THR D 22 4.206 -21.761 -9.281 1.00 0.00 H new ATOM 0 HA THR D 22 5.830 -19.390 -8.919 1.00 0.00 H new ATOM 0 HB THR D 22 4.992 -18.817 -11.143 1.00 0.00 H new ATOM 0 HG1 THR D 22 3.400 -20.207 -12.111 1.00 0.00 H new ATOM 0 HG21 THR D 22 5.715 -20.845 -12.371 1.00 0.00 H new ATOM 0 HG22 THR D 22 6.782 -20.523 -10.983 1.00 0.00 H new ATOM 0 HG23 THR D 22 5.552 -21.805 -10.882 1.00 0.00 H new ATOM 1595 N ILE D 23 4.018 -17.529 -8.817 1.00 0.00 N ATOM 1596 CA ILE D 23 3.075 -16.528 -8.330 1.00 0.00 C ATOM 1597 C ILE D 23 1.745 -16.668 -9.061 1.00 0.00 C ATOM 1598 O ILE D 23 0.680 -16.510 -8.463 1.00 0.00 O ATOM 1599 CB ILE D 23 3.639 -15.116 -8.530 1.00 0.00 C ATOM 1600 CG1 ILE D 23 4.986 -14.977 -7.799 1.00 0.00 C ATOM 1601 CG2 ILE D 23 2.655 -14.082 -7.982 1.00 0.00 C ATOM 1602 CD1 ILE D 23 4.844 -15.327 -6.309 1.00 0.00 C ATOM 0 H ILE D 23 4.846 -17.146 -9.273 1.00 0.00 H new ATOM 0 HA ILE D 23 2.915 -16.689 -7.264 1.00 0.00 H new ATOM 0 HB ILE D 23 3.789 -14.946 -9.596 1.00 0.00 H new ATOM 0 HG12 ILE D 23 5.724 -15.633 -8.261 1.00 0.00 H new ATOM 0 HG13 ILE D 23 5.356 -13.957 -7.903 1.00 0.00 H new ATOM 0 HG21 ILE D 23 3.061 -13.081 -8.127 1.00 0.00 H new ATOM 0 HG22 ILE D 23 1.705 -14.168 -8.510 1.00 0.00 H new ATOM 0 HG23 ILE D 23 2.496 -14.259 -6.918 1.00 0.00 H new ATOM 0 HD11 ILE D 23 5.811 -15.220 -5.817 1.00 0.00 H new ATOM 0 HD12 ILE D 23 4.124 -14.654 -5.844 1.00 0.00 H new ATOM 0 HD13 ILE D 23 4.497 -16.355 -6.208 1.00 0.00 H new ATOM 1614 N GLU D 24 1.815 -16.968 -10.355 1.00 0.00 N ATOM 1615 CA GLU D 24 0.612 -17.134 -11.166 1.00 0.00 C ATOM 1616 C GLU D 24 -0.260 -18.242 -10.586 1.00 0.00 C ATOM 1617 O GLU D 24 -1.483 -18.128 -10.540 1.00 0.00 O ATOM 1618 CB GLU D 24 1.001 -17.480 -12.605 1.00 0.00 C ATOM 1619 CG GLU D 24 -0.259 -17.612 -13.465 1.00 0.00 C ATOM 1620 CD GLU D 24 0.127 -17.925 -14.908 1.00 0.00 C ATOM 1621 OE1 GLU D 24 1.314 -18.032 -15.172 1.00 0.00 O ATOM 1622 OE2 GLU D 24 -0.769 -18.052 -15.727 1.00 0.00 O1- ATOM 0 H GLU D 24 2.689 -17.101 -10.864 1.00 0.00 H new ATOM 0 HA GLU D 24 0.049 -16.201 -11.161 1.00 0.00 H new ATOM 0 HB2 GLU D 24 1.651 -16.705 -13.012 1.00 0.00 H new ATOM 0 HB3 GLU D 24 1.565 -18.412 -12.625 1.00 0.00 H new ATOM 0 HG2 GLU D 24 -0.898 -18.402 -13.071 1.00 0.00 H new ATOM 0 HG3 GLU D 24 -0.835 -16.687 -13.426 1.00 0.00 H new ATOM 1629 N ASN D 25 0.373 -19.315 -10.138 1.00 0.00 N ATOM 1630 CA ASN D 25 -0.367 -20.422 -9.554 1.00 0.00 C ATOM 1631 C ASN D 25 -1.062 -19.979 -8.269 1.00 0.00 C ATOM 1632 O ASN D 25 -2.216 -20.326 -8.015 1.00 0.00 O ATOM 1633 CB ASN D 25 0.583 -21.573 -9.241 1.00 0.00 C ATOM 1634 CG ASN D 25 -0.213 -22.814 -8.854 1.00 0.00 C ATOM 1635 OD1 ASN D 25 -1.284 -22.705 -8.258 1.00 0.00 O ATOM 1636 ND2 ASN D 25 0.242 -23.998 -9.166 1.00 0.00 N ATOM 0 H ASN D 25 1.385 -19.442 -10.167 1.00 0.00 H new ATOM 0 HA ASN D 25 -1.119 -20.752 -10.271 1.00 0.00 H new ATOM 0 HB2 ASN D 25 1.207 -21.787 -10.109 1.00 0.00 H new ATOM 0 HB3 ASN D 25 1.253 -21.292 -8.428 1.00 0.00 H new ATOM 0 HD21 ASN D 25 -0.290 -24.831 -8.916 1.00 0.00 H new ATOM 0 HD22 ASN D 25 1.130 -24.089 -9.660 1.00 0.00 H new ATOM 1643 N VAL D 26 -0.337 -19.226 -7.449 1.00 0.00 N ATOM 1644 CA VAL D 26 -0.875 -18.756 -6.178 1.00 0.00 C ATOM 1645 C VAL D 26 -2.086 -17.842 -6.374 1.00 0.00 C ATOM 1646 O VAL D 26 -3.122 -18.011 -5.718 1.00 0.00 O ATOM 1647 CB VAL D 26 0.217 -18.011 -5.414 1.00 0.00 C ATOM 1648 CG1 VAL D 26 -0.385 -17.334 -4.183 1.00 0.00 C ATOM 1649 CG2 VAL D 26 1.291 -19.010 -4.982 1.00 0.00 C ATOM 0 H VAL D 26 0.620 -18.929 -7.640 1.00 0.00 H new ATOM 0 HA VAL D 26 -1.208 -19.624 -5.610 1.00 0.00 H new ATOM 0 HB VAL D 26 0.661 -17.249 -6.055 1.00 0.00 H new ATOM 0 HG11 VAL D 26 0.397 -16.803 -3.640 1.00 0.00 H new ATOM 0 HG12 VAL D 26 -1.153 -16.627 -4.496 1.00 0.00 H new ATOM 0 HG13 VAL D 26 -0.829 -18.088 -3.534 1.00 0.00 H new ATOM 0 HG21 VAL D 26 2.076 -18.487 -4.435 1.00 0.00 H new ATOM 0 HG22 VAL D 26 0.845 -19.769 -4.339 1.00 0.00 H new ATOM 0 HG23 VAL D 26 1.719 -19.488 -5.863 1.00 0.00 H new ATOM 1659 N LYS D 27 -1.969 -16.877 -7.279 1.00 0.00 N ATOM 1660 CA LYS D 27 -3.079 -15.970 -7.523 1.00 0.00 C ATOM 1661 C LYS D 27 -4.280 -16.749 -8.043 1.00 0.00 C ATOM 1662 O LYS D 27 -5.425 -16.402 -7.770 1.00 0.00 O ATOM 1663 CB LYS D 27 -2.672 -14.873 -8.517 1.00 0.00 C ATOM 1664 CG LYS D 27 -2.180 -15.510 -9.811 1.00 0.00 C ATOM 1665 CD LYS D 27 -1.877 -14.426 -10.848 1.00 0.00 C ATOM 1666 CE LYS D 27 -0.613 -13.661 -10.447 1.00 0.00 C ATOM 1667 NZ LYS D 27 -0.289 -12.662 -11.504 1.00 0.00 N1+ ATOM 0 H LYS D 27 -1.137 -16.706 -7.843 1.00 0.00 H new ATOM 0 HA LYS D 27 -3.353 -15.489 -6.584 1.00 0.00 H new ATOM 0 HB2 LYS D 27 -3.521 -14.221 -8.721 1.00 0.00 H new ATOM 0 HB3 LYS D 27 -1.888 -14.250 -8.086 1.00 0.00 H new ATOM 0 HG2 LYS D 27 -1.284 -16.100 -9.617 1.00 0.00 H new ATOM 0 HG3 LYS D 27 -2.935 -16.194 -10.199 1.00 0.00 H new ATOM 0 HD2 LYS D 27 -1.743 -14.878 -11.831 1.00 0.00 H new ATOM 0 HD3 LYS D 27 -2.719 -13.739 -10.925 1.00 0.00 H new ATOM 0 HE2 LYS D 27 -0.765 -13.160 -9.491 1.00 0.00 H new ATOM 0 HE3 LYS D 27 0.219 -14.353 -10.316 1.00 0.00 H new ATOM 0 HZ1 LYS D 27 0.569 -12.139 -11.236 1.00 0.00 H new ATOM 0 HZ2 LYS D 27 -0.128 -13.152 -12.407 1.00 0.00 H new ATOM 0 HZ3 LYS D 27 -1.081 -11.996 -11.607 1.00 0.00 H new ATOM 1681 N ALA D 28 -4.007 -17.825 -8.770 1.00 0.00 N ATOM 1682 CA ALA D 28 -5.069 -18.670 -9.296 1.00 0.00 C ATOM 1683 C ALA D 28 -5.848 -19.297 -8.151 1.00 0.00 C ATOM 1684 O ALA D 28 -7.073 -19.395 -8.195 1.00 0.00 O ATOM 1685 CB ALA D 28 -4.471 -19.776 -10.152 1.00 0.00 C ATOM 0 H ALA D 28 -3.064 -18.131 -9.008 1.00 0.00 H new ATOM 0 HA ALA D 28 -5.738 -18.057 -9.901 1.00 0.00 H new ATOM 0 HB1 ALA D 28 -5.270 -20.406 -10.543 1.00 0.00 H new ATOM 0 HB2 ALA D 28 -3.917 -19.335 -10.981 1.00 0.00 H new ATOM 0 HB3 ALA D 28 -3.796 -20.381 -9.546 1.00 0.00 H new ATOM 1691 N LYS D 29 -5.121 -19.715 -7.119 1.00 0.00 N ATOM 1692 CA LYS D 29 -5.753 -20.322 -5.959 1.00 0.00 C ATOM 1693 C LYS D 29 -6.712 -19.325 -5.342 1.00 0.00 C ATOM 1694 O LYS D 29 -7.808 -19.679 -4.915 1.00 0.00 O ATOM 1695 CB LYS D 29 -4.699 -20.731 -4.932 1.00 0.00 C ATOM 1696 CG LYS D 29 -3.917 -21.920 -5.474 1.00 0.00 C ATOM 1697 CD LYS D 29 -2.805 -22.285 -4.500 1.00 0.00 C ATOM 1698 CE LYS D 29 -2.040 -23.474 -5.064 1.00 0.00 C ATOM 1699 NZ LYS D 29 -2.881 -24.700 -4.964 1.00 0.00 N1+ ATOM 0 H LYS D 29 -4.105 -19.645 -7.065 1.00 0.00 H new ATOM 0 HA LYS D 29 -6.296 -21.214 -6.270 1.00 0.00 H new ATOM 0 HB2 LYS D 29 -4.026 -19.898 -4.730 1.00 0.00 H new ATOM 0 HB3 LYS D 29 -5.175 -20.992 -3.987 1.00 0.00 H new ATOM 0 HG2 LYS D 29 -4.583 -22.771 -5.618 1.00 0.00 H new ATOM 0 HG3 LYS D 29 -3.495 -21.677 -6.449 1.00 0.00 H new ATOM 0 HD2 LYS D 29 -2.135 -21.438 -4.355 1.00 0.00 H new ATOM 0 HD3 LYS D 29 -3.222 -22.532 -3.524 1.00 0.00 H new ATOM 0 HE2 LYS D 29 -1.773 -23.288 -6.104 1.00 0.00 H new ATOM 0 HE3 LYS D 29 -1.108 -23.614 -4.516 1.00 0.00 H new ATOM 0 HZ1 LYS D 29 -2.278 -25.543 -5.055 1.00 0.00 H new ATOM 0 HZ2 LYS D 29 -3.363 -24.716 -4.042 1.00 0.00 H new ATOM 0 HZ3 LYS D 29 -3.590 -24.698 -5.725 1.00 0.00 H new ATOM 1713 N ILE D 30 -6.295 -18.064 -5.325 1.00 0.00 N ATOM 1714 CA ILE D 30 -7.148 -17.007 -4.784 1.00 0.00 C ATOM 1715 C ILE D 30 -8.399 -16.861 -5.640 1.00 0.00 C ATOM 1716 O ILE D 30 -9.497 -16.669 -5.122 1.00 0.00 O ATOM 1717 CB ILE D 30 -6.414 -15.668 -4.711 1.00 0.00 C ATOM 1718 CG1 ILE D 30 -5.331 -15.744 -3.637 1.00 0.00 C ATOM 1719 CG2 ILE D 30 -7.415 -14.563 -4.348 1.00 0.00 C ATOM 1720 CD1 ILE D 30 -4.454 -14.504 -3.735 1.00 0.00 C ATOM 0 H ILE D 30 -5.389 -17.750 -5.672 1.00 0.00 H new ATOM 0 HA ILE D 30 -7.426 -17.292 -3.769 1.00 0.00 H new ATOM 0 HB ILE D 30 -5.957 -15.446 -5.675 1.00 0.00 H new ATOM 0 HG12 ILE D 30 -5.784 -15.808 -2.648 1.00 0.00 H new ATOM 0 HG13 ILE D 30 -4.729 -16.643 -3.771 1.00 0.00 H new ATOM 0 HG21 ILE D 30 -6.897 -13.606 -4.295 1.00 0.00 H new ATOM 0 HG22 ILE D 30 -8.193 -14.512 -5.110 1.00 0.00 H new ATOM 0 HG23 ILE D 30 -7.867 -14.785 -3.381 1.00 0.00 H new ATOM 0 HD11 ILE D 30 -3.676 -14.547 -2.972 1.00 0.00 H new ATOM 0 HD12 ILE D 30 -3.993 -14.462 -4.722 1.00 0.00 H new ATOM 0 HD13 ILE D 30 -5.064 -13.614 -3.581 1.00 0.00 H new ATOM 1732 N GLN D 31 -8.221 -16.955 -6.953 1.00 0.00 N ATOM 1733 CA GLN D 31 -9.341 -16.832 -7.877 1.00 0.00 C ATOM 1734 C GLN D 31 -10.389 -17.911 -7.585 1.00 0.00 C ATOM 1735 O GLN D 31 -11.589 -17.661 -7.669 1.00 0.00 O ATOM 1736 CB GLN D 31 -8.850 -16.975 -9.320 1.00 0.00 C ATOM 1737 CG GLN D 31 -10.027 -16.759 -10.274 1.00 0.00 C ATOM 1738 CD GLN D 31 -9.543 -16.748 -11.719 1.00 0.00 C ATOM 1739 OE1 GLN D 31 -8.539 -17.381 -12.045 1.00 0.00 O ATOM 1740 NE2 GLN D 31 -10.205 -16.065 -12.614 1.00 0.00 N ATOM 0 H GLN D 31 -7.318 -17.115 -7.399 1.00 0.00 H new ATOM 0 HA GLN D 31 -9.793 -15.849 -7.746 1.00 0.00 H new ATOM 0 HB2 GLN D 31 -8.063 -16.248 -9.523 1.00 0.00 H new ATOM 0 HB3 GLN D 31 -8.418 -17.964 -9.474 1.00 0.00 H new ATOM 0 HG2 GLN D 31 -10.765 -17.550 -10.137 1.00 0.00 H new ATOM 0 HG3 GLN D 31 -10.523 -15.816 -10.043 1.00 0.00 H new ATOM 0 HE21 GLN D 31 -11.037 -15.541 -12.343 1.00 0.00 H new ATOM 0 HE22 GLN D 31 -9.890 -16.056 -13.584 1.00 0.00 H new ATOM 1749 N ASP D 32 -9.929 -19.117 -7.264 1.00 0.00 N ATOM 1750 CA ASP D 32 -10.849 -20.216 -6.981 1.00 0.00 C ATOM 1751 C ASP D 32 -11.601 -20.014 -5.656 1.00 0.00 C ATOM 1752 O ASP D 32 -12.812 -20.222 -5.591 1.00 0.00 O ATOM 1753 CB ASP D 32 -10.071 -21.531 -6.907 1.00 0.00 C ATOM 1754 CG ASP D 32 -9.571 -21.924 -8.292 1.00 0.00 C ATOM 1755 OD1 ASP D 32 -10.051 -21.354 -9.257 1.00 0.00 O ATOM 1756 OD2 ASP D 32 -8.712 -22.786 -8.365 1.00 0.00 O1- ATOM 0 H ASP D 32 -8.940 -19.357 -7.194 1.00 0.00 H new ATOM 0 HA ASP D 32 -11.580 -20.243 -7.789 1.00 0.00 H new ATOM 0 HB2 ASP D 32 -9.228 -21.426 -6.224 1.00 0.00 H new ATOM 0 HB3 ASP D 32 -10.710 -22.318 -6.506 1.00 0.00 H new ATOM 1761 N LYS D 33 -10.881 -19.619 -4.601 1.00 0.00 N ATOM 1762 CA LYS D 33 -11.510 -19.413 -3.293 1.00 0.00 C ATOM 1763 C LYS D 33 -12.447 -18.215 -3.298 1.00 0.00 C ATOM 1764 O LYS D 33 -13.531 -18.256 -2.717 1.00 0.00 O ATOM 1765 CB LYS D 33 -10.453 -19.231 -2.203 1.00 0.00 C ATOM 1766 CG LYS D 33 -9.919 -20.602 -1.786 1.00 0.00 C ATOM 1767 CD LYS D 33 -9.447 -20.546 -0.331 1.00 0.00 C ATOM 1768 CE LYS D 33 -9.606 -21.925 0.314 1.00 0.00 C ATOM 1769 NZ LYS D 33 -8.840 -22.937 -0.465 1.00 0.00 N1+ ATOM 0 H LYS D 33 -9.878 -19.438 -4.625 1.00 0.00 H new ATOM 0 HA LYS D 33 -12.098 -20.306 -3.080 1.00 0.00 H new ATOM 0 HB2 LYS D 33 -9.639 -18.607 -2.570 1.00 0.00 H new ATOM 0 HB3 LYS D 33 -10.885 -18.719 -1.343 1.00 0.00 H new ATOM 0 HG2 LYS D 33 -10.698 -21.357 -1.898 1.00 0.00 H new ATOM 0 HG3 LYS D 33 -9.095 -20.896 -2.436 1.00 0.00 H new ATOM 0 HD2 LYS D 33 -8.404 -20.231 -0.288 1.00 0.00 H new ATOM 0 HD3 LYS D 33 -10.026 -19.806 0.221 1.00 0.00 H new ATOM 0 HE2 LYS D 33 -9.249 -21.899 1.344 1.00 0.00 H new ATOM 0 HE3 LYS D 33 -10.660 -22.201 0.349 1.00 0.00 H new ATOM 0 HZ1 LYS D 33 -9.447 -23.759 -0.658 1.00 0.00 H new ATOM 0 HZ2 LYS D 33 -8.528 -22.519 -1.365 1.00 0.00 H new ATOM 0 HZ3 LYS D 33 -8.009 -23.241 0.082 1.00 0.00 H new ATOM 1783 N GLU D 34 -12.019 -17.153 -3.959 1.00 0.00 N ATOM 1784 CA GLU D 34 -12.820 -15.942 -4.046 1.00 0.00 C ATOM 1785 C GLU D 34 -12.908 -15.500 -5.489 1.00 0.00 C ATOM 1786 O GLU D 34 -11.973 -15.701 -6.253 1.00 0.00 O ATOM 1787 CB GLU D 34 -12.187 -14.814 -3.233 1.00 0.00 C ATOM 1788 CG GLU D 34 -12.108 -15.204 -1.762 1.00 0.00 C ATOM 1789 CD GLU D 34 -13.505 -15.510 -1.228 1.00 0.00 C ATOM 1790 OE1 GLU D 34 -14.424 -14.796 -1.590 1.00 0.00 O ATOM 1791 OE2 GLU D 34 -13.632 -16.456 -0.469 1.00 0.00 O1- ATOM 0 H GLU D 34 -11.123 -17.104 -4.443 1.00 0.00 H new ATOM 0 HA GLU D 34 -13.812 -16.159 -3.649 1.00 0.00 H new ATOM 0 HB2 GLU D 34 -11.189 -14.598 -3.613 1.00 0.00 H new ATOM 0 HB3 GLU D 34 -12.774 -13.902 -3.344 1.00 0.00 H new ATOM 0 HG2 GLU D 34 -11.465 -16.076 -1.642 1.00 0.00 H new ATOM 0 HG3 GLU D 34 -11.659 -14.395 -1.186 1.00 0.00 H new ATOM 1798 N GLY D 35 -14.018 -14.884 -5.859 1.00 0.00 N ATOM 1799 CA GLY D 35 -14.176 -14.411 -7.223 1.00 0.00 C ATOM 1800 C GLY D 35 -13.358 -13.141 -7.439 1.00 0.00 C ATOM 1801 O GLY D 35 -13.902 -12.093 -7.787 1.00 0.00 O ATOM 0 H GLY D 35 -14.812 -14.702 -5.245 1.00 0.00 H new ATOM 0 HA2 GLY D 35 -13.855 -15.183 -7.923 1.00 0.00 H new ATOM 0 HA3 GLY D 35 -15.228 -14.214 -7.428 1.00 0.00 H new ATOM 1805 N ILE D 36 -12.043 -13.246 -7.235 1.00 0.00 N ATOM 1806 CA ILE D 36 -11.160 -12.105 -7.417 1.00 0.00 C ATOM 1807 C ILE D 36 -10.264 -12.341 -8.637 1.00 0.00 C ATOM 1808 O ILE D 36 -9.338 -13.149 -8.568 1.00 0.00 O ATOM 1809 CB ILE D 36 -10.249 -11.906 -6.200 1.00 0.00 C ATOM 1810 CG1 ILE D 36 -11.059 -11.904 -4.897 1.00 0.00 C ATOM 1811 CG2 ILE D 36 -9.558 -10.553 -6.358 1.00 0.00 C ATOM 1812 CD1 ILE D 36 -11.938 -10.659 -4.821 1.00 0.00 C ATOM 0 H ILE D 36 -11.574 -14.105 -6.946 1.00 0.00 H new ATOM 0 HA ILE D 36 -11.784 -11.222 -7.551 1.00 0.00 H new ATOM 0 HB ILE D 36 -9.528 -12.722 -6.148 1.00 0.00 H new ATOM 0 HG12 ILE D 36 -11.679 -12.799 -4.845 1.00 0.00 H new ATOM 0 HG13 ILE D 36 -10.384 -11.934 -4.041 1.00 0.00 H new ATOM 0 HG21 ILE D 36 -8.900 -10.379 -5.507 1.00 0.00 H new ATOM 0 HG22 ILE D 36 -8.971 -10.549 -7.277 1.00 0.00 H new ATOM 0 HG23 ILE D 36 -10.309 -9.764 -6.404 1.00 0.00 H new ATOM 0 HD11 ILE D 36 -12.507 -10.671 -3.891 1.00 0.00 H new ATOM 0 HD12 ILE D 36 -11.311 -9.768 -4.851 1.00 0.00 H new ATOM 0 HD13 ILE D 36 -12.626 -10.647 -5.667 1.00 0.00 H new ATOM 1824 N PRO D 37 -10.495 -11.666 -9.735 1.00 0.00 N ATOM 1825 CA PRO D 37 -9.658 -11.841 -10.959 1.00 0.00 C ATOM 1826 C PRO D 37 -8.184 -11.544 -10.672 1.00 0.00 C ATOM 1827 O PRO D 37 -7.877 -10.769 -9.767 1.00 0.00 O ATOM 1828 CB PRO D 37 -10.223 -10.814 -11.942 1.00 0.00 C ATOM 1829 CG PRO D 37 -11.606 -10.534 -11.464 1.00 0.00 C ATOM 1830 CD PRO D 37 -11.567 -10.687 -9.953 1.00 0.00 C ATOM 0 HA PRO D 37 -9.692 -12.862 -11.338 1.00 0.00 H new ATOM 0 HB2 PRO D 37 -9.619 -9.907 -11.953 1.00 0.00 H new ATOM 0 HB3 PRO D 37 -10.230 -11.205 -12.959 1.00 0.00 H new ATOM 0 HG2 PRO D 37 -11.920 -9.529 -11.746 1.00 0.00 H new ATOM 0 HG3 PRO D 37 -12.320 -11.228 -11.908 1.00 0.00 H new ATOM 0 HD2 PRO D 37 -11.352 -9.739 -9.459 1.00 0.00 H new ATOM 0 HD3 PRO D 37 -12.520 -11.042 -9.561 1.00 0.00 H new ATOM 1838 N PRO D 38 -7.273 -12.140 -11.401 1.00 0.00 N ATOM 1839 CA PRO D 38 -5.812 -11.917 -11.179 1.00 0.00 C ATOM 1840 C PRO D 38 -5.447 -10.436 -11.136 1.00 0.00 C ATOM 1841 O PRO D 38 -4.645 -10.018 -10.309 1.00 0.00 O ATOM 1842 CB PRO D 38 -5.170 -12.587 -12.396 1.00 0.00 C ATOM 1843 CG PRO D 38 -6.129 -13.654 -12.789 1.00 0.00 C ATOM 1844 CD PRO D 38 -7.515 -13.084 -12.510 1.00 0.00 C ATOM 0 HA PRO D 38 -5.479 -12.318 -10.222 1.00 0.00 H new ATOM 0 HB2 PRO D 38 -5.017 -11.874 -13.206 1.00 0.00 H new ATOM 0 HB3 PRO D 38 -4.193 -13.003 -12.150 1.00 0.00 H new ATOM 0 HG2 PRO D 38 -6.017 -13.913 -13.842 1.00 0.00 H new ATOM 0 HG3 PRO D 38 -5.958 -14.565 -12.216 1.00 0.00 H new ATOM 0 HD2 PRO D 38 -7.927 -12.581 -13.385 1.00 0.00 H new ATOM 0 HD3 PRO D 38 -8.222 -13.864 -12.228 1.00 0.00 H new ATOM 1852 N ASP D 39 -6.036 -9.649 -12.027 1.00 0.00 N ATOM 1853 CA ASP D 39 -5.750 -8.218 -12.061 1.00 0.00 C ATOM 1854 C ASP D 39 -6.299 -7.524 -10.816 1.00 0.00 C ATOM 1855 O ASP D 39 -5.654 -6.640 -10.250 1.00 0.00 O ATOM 1856 CB ASP D 39 -6.359 -7.594 -13.315 1.00 0.00 C ATOM 1857 CG ASP D 39 -5.633 -8.108 -14.552 1.00 0.00 C ATOM 1858 OD1 ASP D 39 -6.072 -9.106 -15.100 1.00 0.00 O ATOM 1859 OD2 ASP D 39 -4.644 -7.501 -14.932 1.00 0.00 O1- ATOM 0 H ASP D 39 -6.705 -9.969 -12.727 1.00 0.00 H new ATOM 0 HA ASP D 39 -4.668 -8.085 -12.081 1.00 0.00 H new ATOM 0 HB2 ASP D 39 -7.419 -7.839 -13.376 1.00 0.00 H new ATOM 0 HB3 ASP D 39 -6.286 -6.508 -13.264 1.00 0.00 H new ATOM 1864 N GLN D 40 -7.493 -7.932 -10.394 1.00 0.00 N ATOM 1865 CA GLN D 40 -8.125 -7.345 -9.215 1.00 0.00 C ATOM 1866 C GLN D 40 -7.296 -7.617 -7.969 1.00 0.00 C ATOM 1867 O GLN D 40 -7.149 -6.749 -7.109 1.00 0.00 O ATOM 1868 CB GLN D 40 -9.527 -7.926 -9.032 1.00 0.00 C ATOM 1869 CG GLN D 40 -10.236 -7.217 -7.876 1.00 0.00 C ATOM 1870 CD GLN D 40 -11.666 -7.731 -7.749 1.00 0.00 C ATOM 1871 OE1 GLN D 40 -12.379 -7.841 -8.746 1.00 0.00 O ATOM 1872 NE2 GLN D 40 -12.132 -8.060 -6.575 1.00 0.00 N ATOM 0 H GLN D 40 -8.040 -8.663 -10.848 1.00 0.00 H new ATOM 0 HA GLN D 40 -8.193 -6.267 -9.363 1.00 0.00 H new ATOM 0 HB2 GLN D 40 -10.102 -7.808 -9.950 1.00 0.00 H new ATOM 0 HB3 GLN D 40 -9.464 -8.995 -8.831 1.00 0.00 H new ATOM 0 HG2 GLN D 40 -9.695 -7.389 -6.946 1.00 0.00 H new ATOM 0 HG3 GLN D 40 -10.241 -6.141 -8.047 1.00 0.00 H new ATOM 0 HE21 GLN D 40 -11.542 -7.969 -5.748 1.00 0.00 H new ATOM 0 HE22 GLN D 40 -13.087 -8.408 -6.484 1.00 0.00 H new ATOM 1881 N GLN D 41 -6.761 -8.827 -7.877 1.00 0.00 N ATOM 1882 CA GLN D 41 -5.953 -9.196 -6.718 1.00 0.00 C ATOM 1883 C GLN D 41 -4.472 -8.971 -6.978 1.00 0.00 C ATOM 1884 O GLN D 41 -3.976 -9.201 -8.077 1.00 0.00 O ATOM 1885 CB GLN D 41 -6.154 -10.664 -6.331 1.00 0.00 C ATOM 1886 CG GLN D 41 -6.230 -11.540 -7.577 1.00 0.00 C ATOM 1887 CD GLN D 41 -5.498 -12.853 -7.335 1.00 0.00 C ATOM 1888 OE1 GLN D 41 -4.279 -12.829 -6.871 1.00 0.00 O flip ATOM 1889 NE2 GLN D 41 -6.053 -13.927 -7.570 1.00 0.00 N flip ATOM 0 H GLN D 41 -6.868 -9.561 -8.578 1.00 0.00 H new ATOM 0 HA GLN D 41 -6.285 -8.556 -5.901 1.00 0.00 H new ATOM 0 HB2 GLN D 41 -5.332 -10.995 -5.697 1.00 0.00 H new ATOM 0 HB3 GLN D 41 -7.069 -10.770 -5.748 1.00 0.00 H new ATOM 0 HG2 GLN D 41 -7.272 -11.736 -7.831 1.00 0.00 H new ATOM 0 HG3 GLN D 41 -5.788 -11.019 -8.426 1.00 0.00 H new ATOM 0 HE21 GLN D 41 -7.006 -13.940 -7.933 1.00 0.00 H new ATOM 0 HE22 GLN D 41 -5.559 -14.804 -7.402 1.00 0.00 H new ATOM 1898 N ARG D 42 -3.762 -8.542 -5.945 1.00 0.00 N ATOM 1899 CA ARG D 42 -2.332 -8.320 -6.065 1.00 0.00 C ATOM 1900 C ARG D 42 -1.627 -8.984 -4.888 1.00 0.00 C ATOM 1901 O ARG D 42 -1.901 -8.662 -3.728 1.00 0.00 O ATOM 1902 CB ARG D 42 -2.030 -6.822 -6.084 1.00 0.00 C ATOM 1903 CG ARG D 42 -0.657 -6.581 -6.711 1.00 0.00 C ATOM 1904 CD ARG D 42 -0.425 -5.078 -6.855 1.00 0.00 C ATOM 1905 NE ARG D 42 0.829 -4.826 -7.555 1.00 0.00 N ATOM 1906 CZ ARG D 42 0.914 -4.892 -8.886 1.00 0.00 C ATOM 1907 NH1 ARG D 42 -0.132 -5.200 -9.612 1.00 0.00 N1+ ATOM 1908 NH2 ARG D 42 2.049 -4.641 -9.473 1.00 0.00 N ATOM 0 H ARG D 42 -4.150 -8.343 -5.023 1.00 0.00 H new ATOM 0 HA ARG D 42 -1.972 -8.754 -6.998 1.00 0.00 H new ATOM 0 HB2 ARG D 42 -2.797 -6.294 -6.651 1.00 0.00 H new ATOM 0 HB3 ARG D 42 -2.052 -6.424 -5.070 1.00 0.00 H new ATOM 0 HG2 ARG D 42 0.122 -7.023 -6.090 1.00 0.00 H new ATOM 0 HG3 ARG D 42 -0.600 -7.065 -7.686 1.00 0.00 H new ATOM 0 HD2 ARG D 42 -1.252 -4.626 -7.402 1.00 0.00 H new ATOM 0 HD3 ARG D 42 -0.401 -4.611 -5.871 1.00 0.00 H new ATOM 0 HE ARG D 42 1.662 -4.593 -7.014 1.00 0.00 H new ATOM 0 HH11 ARG D 42 -1.026 -5.393 -9.161 1.00 0.00 H new ATOM 0 HH12 ARG D 42 -0.052 -5.247 -10.628 1.00 0.00 H new ATOM 0 HH21 ARG D 42 2.868 -4.395 -8.916 1.00 0.00 H new ATOM 0 HH22 ARG D 42 2.119 -4.690 -10.489 1.00 0.00 H new ATOM 1922 N LEU D 43 -0.731 -9.920 -5.195 1.00 0.00 N ATOM 1923 CA LEU D 43 0.003 -10.642 -4.158 1.00 0.00 C ATOM 1924 C LEU D 43 1.291 -9.906 -3.813 1.00 0.00 C ATOM 1925 O LEU D 43 2.121 -9.656 -4.686 1.00 0.00 O ATOM 1926 CB LEU D 43 0.344 -12.055 -4.654 1.00 0.00 C ATOM 1927 CG LEU D 43 -0.944 -12.820 -4.966 1.00 0.00 C ATOM 1928 CD1 LEU D 43 -0.605 -14.168 -5.607 1.00 0.00 C ATOM 1929 CD2 LEU D 43 -1.707 -13.071 -3.668 1.00 0.00 C ATOM 0 H LEU D 43 -0.497 -10.195 -6.149 1.00 0.00 H new ATOM 0 HA LEU D 43 -0.622 -10.705 -3.267 1.00 0.00 H new ATOM 0 HB2 LEU D 43 0.968 -11.997 -5.546 1.00 0.00 H new ATOM 0 HB3 LEU D 43 0.919 -12.587 -3.897 1.00 0.00 H new ATOM 0 HG LEU D 43 -1.552 -12.231 -5.652 1.00 0.00 H new ATOM 0 HD11 LEU D 43 -1.526 -14.708 -5.827 1.00 0.00 H new ATOM 0 HD12 LEU D 43 -0.052 -14.002 -6.532 1.00 0.00 H new ATOM 0 HD13 LEU D 43 0.004 -14.755 -4.920 1.00 0.00 H new ATOM 0 HD21 LEU D 43 -2.626 -13.616 -3.885 1.00 0.00 H new ATOM 0 HD22 LEU D 43 -1.088 -13.659 -2.990 1.00 0.00 H new ATOM 0 HD23 LEU D 43 -1.953 -12.118 -3.200 1.00 0.00 H new ATOM 1941 N ILE D 44 1.455 -9.555 -2.542 1.00 0.00 N ATOM 1942 CA ILE D 44 2.654 -8.843 -2.115 1.00 0.00 C ATOM 1943 C ILE D 44 3.261 -9.498 -0.871 1.00 0.00 C ATOM 1944 O ILE D 44 2.555 -9.780 0.098 1.00 0.00 O ATOM 1945 CB ILE D 44 2.316 -7.376 -1.835 1.00 0.00 C ATOM 1946 CG1 ILE D 44 1.631 -6.767 -3.066 1.00 0.00 C ATOM 1947 CG2 ILE D 44 3.605 -6.604 -1.542 1.00 0.00 C ATOM 1948 CD1 ILE D 44 1.226 -5.324 -2.770 1.00 0.00 C ATOM 0 H ILE D 44 0.784 -9.748 -1.799 1.00 0.00 H new ATOM 0 HA ILE D 44 3.391 -8.891 -2.916 1.00 0.00 H new ATOM 0 HB ILE D 44 1.648 -7.314 -0.976 1.00 0.00 H new ATOM 0 HG12 ILE D 44 2.306 -6.797 -3.921 1.00 0.00 H new ATOM 0 HG13 ILE D 44 0.752 -7.354 -3.332 1.00 0.00 H new ATOM 0 HG21 ILE D 44 3.366 -5.559 -1.342 1.00 0.00 H new ATOM 0 HG22 ILE D 44 4.098 -7.036 -0.671 1.00 0.00 H new ATOM 0 HG23 ILE D 44 4.270 -6.666 -2.403 1.00 0.00 H new ATOM 0 HD11 ILE D 44 0.740 -4.895 -3.647 1.00 0.00 H new ATOM 0 HD12 ILE D 44 0.535 -5.306 -1.927 1.00 0.00 H new ATOM 0 HD13 ILE D 44 2.113 -4.740 -2.525 1.00 0.00 H new ATOM 1960 N PHE D 45 4.571 -9.746 -0.907 1.00 0.00 N ATOM 1961 CA PHE D 45 5.251 -10.378 0.226 1.00 0.00 C ATOM 1962 C PHE D 45 6.667 -9.828 0.394 1.00 0.00 C ATOM 1963 O PHE D 45 7.285 -9.365 -0.565 1.00 0.00 O ATOM 1964 CB PHE D 45 5.319 -11.892 0.027 1.00 0.00 C ATOM 1965 CG PHE D 45 5.915 -12.532 1.259 1.00 0.00 C ATOM 1966 CD1 PHE D 45 5.098 -12.828 2.357 1.00 0.00 C ATOM 1967 CD2 PHE D 45 7.283 -12.827 1.304 1.00 0.00 C ATOM 1968 CE1 PHE D 45 5.649 -13.419 3.500 1.00 0.00 C ATOM 1969 CE2 PHE D 45 7.834 -13.418 2.448 1.00 0.00 C ATOM 1970 CZ PHE D 45 7.017 -13.715 3.545 1.00 0.00 C ATOM 0 H PHE D 45 5.176 -9.523 -1.697 1.00 0.00 H new ATOM 0 HA PHE D 45 4.677 -10.152 1.125 1.00 0.00 H new ATOM 0 HB2 PHE D 45 4.322 -12.291 -0.158 1.00 0.00 H new ATOM 0 HB3 PHE D 45 5.924 -12.128 -0.848 1.00 0.00 H new ATOM 0 HD1 PHE D 45 4.043 -12.600 2.322 1.00 0.00 H new ATOM 0 HD2 PHE D 45 7.913 -12.599 0.457 1.00 0.00 H new ATOM 0 HE1 PHE D 45 5.019 -13.647 4.347 1.00 0.00 H new ATOM 0 HE2 PHE D 45 8.889 -13.645 2.484 1.00 0.00 H new ATOM 0 HZ PHE D 45 7.442 -14.173 4.426 1.00 0.00 H new ATOM 1980 N ALA D 46 7.168 -9.871 1.627 1.00 0.00 N ATOM 1981 CA ALA D 46 8.506 -9.367 1.926 1.00 0.00 C ATOM 1982 C ALA D 46 8.557 -7.852 1.757 1.00 0.00 C ATOM 1983 O ALA D 46 9.633 -7.270 1.615 1.00 0.00 O ATOM 1984 CB ALA D 46 9.538 -10.022 1.001 1.00 0.00 C ATOM 0 H ALA D 46 6.669 -10.248 2.433 1.00 0.00 H new ATOM 0 HA ALA D 46 8.742 -9.616 2.961 1.00 0.00 H new ATOM 0 HB1 ALA D 46 10.531 -9.638 1.234 1.00 0.00 H new ATOM 0 HB2 ALA D 46 9.523 -11.102 1.147 1.00 0.00 H new ATOM 0 HB3 ALA D 46 9.294 -9.792 -0.036 1.00 0.00 H new ATOM 1990 N GLY D 47 7.387 -7.220 1.772 1.00 0.00 N ATOM 1991 CA GLY D 47 7.309 -5.776 1.619 1.00 0.00 C ATOM 1992 C GLY D 47 7.309 -5.382 0.146 1.00 0.00 C ATOM 1993 O GLY D 47 7.100 -4.222 -0.187 1.00 0.00 O ATOM 0 H GLY D 47 6.486 -7.684 1.888 1.00 0.00 H new ATOM 0 HA2 GLY D 47 6.404 -5.404 2.099 1.00 0.00 H new ATOM 0 HA3 GLY D 47 8.153 -5.307 2.125 1.00 0.00 H new ATOM 1997 N ARG D 48 7.534 -6.347 -0.737 1.00 0.00 N ATOM 1998 CA ARG D 48 7.553 -6.062 -2.163 1.00 0.00 C ATOM 1999 C ARG D 48 6.549 -6.927 -2.897 1.00 0.00 C ATOM 2000 O ARG D 48 6.327 -8.086 -2.544 1.00 0.00 O ATOM 2001 CB ARG D 48 8.946 -6.315 -2.722 1.00 0.00 C ATOM 2002 CG ARG D 48 9.325 -7.771 -2.480 1.00 0.00 C ATOM 2003 CD ARG D 48 10.712 -8.017 -3.051 1.00 0.00 C ATOM 2004 NE ARG D 48 11.127 -9.392 -2.799 1.00 0.00 N ATOM 2005 CZ ARG D 48 11.648 -9.765 -1.627 1.00 0.00 C ATOM 2006 NH1 ARG D 48 11.796 -8.904 -0.653 1.00 0.00 N1+ ATOM 2007 NH2 ARG D 48 12.020 -11.002 -1.451 1.00 0.00 N ATOM 0 H ARG D 48 7.704 -7.323 -0.493 1.00 0.00 H new ATOM 0 HA ARG D 48 7.285 -5.015 -2.307 1.00 0.00 H new ATOM 0 HB2 ARG D 48 8.969 -6.093 -3.789 1.00 0.00 H new ATOM 0 HB3 ARG D 48 9.669 -5.654 -2.244 1.00 0.00 H new ATOM 0 HG2 ARG D 48 9.311 -7.992 -1.413 1.00 0.00 H new ATOM 0 HG3 ARG D 48 8.599 -8.433 -2.952 1.00 0.00 H new ATOM 0 HD2 ARG D 48 10.711 -7.821 -4.123 1.00 0.00 H new ATOM 0 HD3 ARG D 48 11.425 -7.326 -2.601 1.00 0.00 H new ATOM 0 HE ARG D 48 11.017 -10.087 -3.537 1.00 0.00 H new ATOM 0 HH11 ARG D 48 11.512 -7.933 -0.783 1.00 0.00 H new ATOM 0 HH12 ARG D 48 12.195 -9.204 0.236 1.00 0.00 H new ATOM 0 HH21 ARG D 48 11.913 -11.679 -2.206 1.00 0.00 H new ATOM 0 HH22 ARG D 48 12.419 -11.293 -0.558 1.00 0.00 H new ATOM 2021 N GLN D 49 5.946 -6.353 -3.923 1.00 0.00 N ATOM 2022 CA GLN D 49 4.962 -7.069 -4.706 1.00 0.00 C ATOM 2023 C GLN D 49 5.602 -8.281 -5.375 1.00 0.00 C ATOM 2024 O GLN D 49 6.796 -8.278 -5.669 1.00 0.00 O ATOM 2025 CB GLN D 49 4.357 -6.125 -5.742 1.00 0.00 C ATOM 2026 CG GLN D 49 5.429 -5.758 -6.769 1.00 0.00 C ATOM 2027 CD GLN D 49 4.887 -4.726 -7.750 1.00 0.00 C ATOM 2028 OE1 GLN D 49 4.284 -3.734 -7.339 1.00 0.00 O ATOM 2029 NE2 GLN D 49 5.072 -4.897 -9.031 1.00 0.00 N ATOM 0 H GLN D 49 6.121 -5.396 -4.230 1.00 0.00 H new ATOM 0 HA GLN D 49 4.166 -7.429 -4.054 1.00 0.00 H new ATOM 0 HB2 GLN D 49 3.510 -6.601 -6.236 1.00 0.00 H new ATOM 0 HB3 GLN D 49 3.978 -5.226 -5.256 1.00 0.00 H new ATOM 0 HG2 GLN D 49 6.308 -5.361 -6.262 1.00 0.00 H new ATOM 0 HG3 GLN D 49 5.747 -6.650 -7.308 1.00 0.00 H new ATOM 0 HE21 GLN D 49 5.572 -5.719 -9.369 1.00 0.00 H new ATOM 0 HE22 GLN D 49 4.717 -4.208 -9.694 1.00 0.00 H new ATOM 2038 N LEU D 50 4.806 -9.324 -5.587 1.00 0.00 N ATOM 2039 CA LEU D 50 5.321 -10.543 -6.193 1.00 0.00 C ATOM 2040 C LEU D 50 5.259 -10.469 -7.712 1.00 0.00 C ATOM 2041 O LEU D 50 4.186 -10.323 -8.298 1.00 0.00 O ATOM 2042 CB LEU D 50 4.503 -11.746 -5.715 1.00 0.00 C ATOM 2043 CG LEU D 50 4.511 -11.803 -4.186 1.00 0.00 C ATOM 2044 CD1 LEU D 50 3.662 -12.987 -3.717 1.00 0.00 C ATOM 2045 CD2 LEU D 50 5.946 -11.978 -3.684 1.00 0.00 C ATOM 0 H LEU D 50 3.814 -9.349 -5.351 1.00 0.00 H new ATOM 0 HA LEU D 50 6.362 -10.656 -5.891 1.00 0.00 H new ATOM 0 HB2 LEU D 50 3.479 -11.669 -6.080 1.00 0.00 H new ATOM 0 HB3 LEU D 50 4.919 -12.666 -6.125 1.00 0.00 H new ATOM 0 HG LEU D 50 4.099 -10.876 -3.788 1.00 0.00 H new ATOM 0 HD11 LEU D 50 3.667 -13.029 -2.628 1.00 0.00 H new ATOM 0 HD12 LEU D 50 2.639 -12.864 -4.071 1.00 0.00 H new ATOM 0 HD13 LEU D 50 4.075 -13.913 -4.118 1.00 0.00 H new ATOM 0 HD21 LEU D 50 5.948 -12.018 -2.595 1.00 0.00 H new ATOM 0 HD22 LEU D 50 6.360 -12.904 -4.082 1.00 0.00 H new ATOM 0 HD23 LEU D 50 6.553 -11.136 -4.017 1.00 0.00 H new ATOM 2057 N GLU D 51 6.422 -10.588 -8.339 1.00 0.00 N ATOM 2058 CA GLU D 51 6.510 -10.549 -9.790 1.00 0.00 C ATOM 2059 C GLU D 51 6.026 -11.861 -10.404 1.00 0.00 C ATOM 2060 O GLU D 51 6.445 -12.946 -9.998 1.00 0.00 O ATOM 2061 CB GLU D 51 7.952 -10.277 -10.212 1.00 0.00 C ATOM 2062 CG GLU D 51 8.074 -10.401 -11.731 1.00 0.00 C ATOM 2063 CD GLU D 51 9.450 -9.930 -12.184 1.00 0.00 C ATOM 2064 OE1 GLU D 51 10.219 -9.512 -11.336 1.00 0.00 O ATOM 2065 OE2 GLU D 51 9.714 -9.994 -13.373 1.00 0.00 O1- ATOM 0 H GLU D 51 7.316 -10.712 -7.864 1.00 0.00 H new ATOM 0 HA GLU D 51 5.867 -9.747 -10.152 1.00 0.00 H new ATOM 0 HB2 GLU D 51 8.253 -9.279 -9.893 1.00 0.00 H new ATOM 0 HB3 GLU D 51 8.624 -10.983 -9.724 1.00 0.00 H new ATOM 0 HG2 GLU D 51 7.917 -11.437 -12.033 1.00 0.00 H new ATOM 0 HG3 GLU D 51 7.299 -9.807 -12.216 1.00 0.00 H new ATOM 2072 N ASP D 52 5.146 -11.753 -11.392 1.00 0.00 N ATOM 2073 CA ASP D 52 4.618 -12.935 -12.060 1.00 0.00 C ATOM 2074 C ASP D 52 5.744 -13.695 -12.757 1.00 0.00 C ATOM 2075 O ASP D 52 6.613 -13.095 -13.390 1.00 0.00 O ATOM 2076 CB ASP D 52 3.556 -12.527 -13.083 1.00 0.00 C ATOM 2077 CG ASP D 52 2.891 -13.769 -13.669 1.00 0.00 C ATOM 2078 OD1 ASP D 52 2.213 -14.460 -12.926 1.00 0.00 O ATOM 2079 OD2 ASP D 52 3.068 -14.011 -14.851 1.00 0.00 O1- ATOM 0 H ASP D 52 4.786 -10.867 -11.746 1.00 0.00 H new ATOM 0 HA ASP D 52 4.163 -13.585 -11.313 1.00 0.00 H new ATOM 0 HB2 ASP D 52 2.807 -11.893 -12.609 1.00 0.00 H new ATOM 0 HB3 ASP D 52 4.013 -11.939 -13.879 1.00 0.00 H new ATOM 2084 N GLY D 53 5.722 -15.017 -12.632 1.00 0.00 N ATOM 2085 CA GLY D 53 6.749 -15.852 -13.248 1.00 0.00 C ATOM 2086 C GLY D 53 7.772 -16.327 -12.218 1.00 0.00 C ATOM 2087 O GLY D 53 8.509 -17.281 -12.465 1.00 0.00 O ATOM 0 H GLY D 53 5.010 -15.532 -12.114 1.00 0.00 H new ATOM 0 HA2 GLY D 53 6.282 -16.714 -13.724 1.00 0.00 H new ATOM 0 HA3 GLY D 53 7.255 -15.290 -14.033 1.00 0.00 H new ATOM 2091 N ARG D 54 7.807 -15.672 -11.059 1.00 0.00 N ATOM 2092 CA ARG D 54 8.740 -16.062 -10.008 1.00 0.00 C ATOM 2093 C ARG D 54 8.114 -17.120 -9.106 1.00 0.00 C ATOM 2094 O ARG D 54 6.906 -17.356 -9.157 1.00 0.00 O ATOM 2095 CB ARG D 54 9.148 -14.848 -9.187 1.00 0.00 C ATOM 2096 CG ARG D 54 10.492 -14.333 -9.702 1.00 0.00 C ATOM 2097 CD ARG D 54 10.500 -12.812 -9.676 1.00 0.00 C ATOM 2098 NE ARG D 54 11.856 -12.307 -9.869 1.00 0.00 N ATOM 2099 CZ ARG D 54 12.423 -12.264 -11.075 1.00 0.00 C ATOM 2100 NH1 ARG D 54 11.779 -12.687 -12.132 1.00 0.00 N1+ ATOM 2101 NH2 ARG D 54 13.635 -11.796 -11.205 1.00 0.00 N ATOM 0 H ARG D 54 7.208 -14.880 -10.827 1.00 0.00 H new ATOM 0 HA ARG D 54 9.630 -16.485 -10.475 1.00 0.00 H new ATOM 0 HB2 ARG D 54 8.390 -14.068 -9.265 1.00 0.00 H new ATOM 0 HB3 ARG D 54 9.225 -15.114 -8.133 1.00 0.00 H new ATOM 0 HG2 ARG D 54 11.302 -14.721 -9.085 1.00 0.00 H new ATOM 0 HG3 ARG D 54 10.665 -14.690 -10.717 1.00 0.00 H new ATOM 0 HD2 ARG D 54 9.846 -12.425 -10.458 1.00 0.00 H new ATOM 0 HD3 ARG D 54 10.104 -12.456 -8.725 1.00 0.00 H new ATOM 0 HE ARG D 54 12.383 -11.978 -9.060 1.00 0.00 H new ATOM 0 HH11 ARG D 54 10.832 -13.055 -12.039 1.00 0.00 H new ATOM 0 HH12 ARG D 54 12.224 -12.649 -13.049 1.00 0.00 H new ATOM 0 HH21 ARG D 54 14.144 -11.465 -10.386 1.00 0.00 H new ATOM 0 HH22 ARG D 54 14.072 -11.761 -12.126 1.00 0.00 H new ATOM 2115 N THR D 55 8.942 -17.764 -8.292 1.00 0.00 N ATOM 2116 CA THR D 55 8.456 -18.801 -7.392 1.00 0.00 C ATOM 2117 C THR D 55 8.311 -18.253 -5.978 1.00 0.00 C ATOM 2118 O THR D 55 8.783 -17.159 -5.680 1.00 0.00 O ATOM 2119 CB THR D 55 9.416 -19.988 -7.390 1.00 0.00 C ATOM 2120 OG1 THR D 55 10.628 -19.615 -6.750 1.00 0.00 O ATOM 2121 CG2 THR D 55 9.711 -20.408 -8.831 1.00 0.00 C ATOM 0 H THR D 55 9.945 -17.588 -8.237 1.00 0.00 H new ATOM 0 HA THR D 55 7.479 -19.132 -7.743 1.00 0.00 H new ATOM 0 HB THR D 55 8.962 -20.821 -6.854 1.00 0.00 H new ATOM 0 HG1 THR D 55 10.784 -20.199 -5.978 1.00 0.00 H new ATOM 0 HG21 THR D 55 10.396 -21.256 -8.830 1.00 0.00 H new ATOM 0 HG22 THR D 55 8.782 -20.693 -9.324 1.00 0.00 H new ATOM 0 HG23 THR D 55 10.165 -19.575 -9.367 1.00 0.00 H new ATOM 2129 N LEU D 56 7.655 -19.008 -5.108 1.00 0.00 N ATOM 2130 CA LEU D 56 7.470 -18.563 -3.736 1.00 0.00 C ATOM 2131 C LEU D 56 8.808 -18.482 -3.011 1.00 0.00 C ATOM 2132 O LEU D 56 9.041 -17.570 -2.219 1.00 0.00 O ATOM 2133 CB LEU D 56 6.521 -19.506 -2.995 1.00 0.00 C ATOM 2134 CG LEU D 56 5.098 -19.332 -3.534 1.00 0.00 C ATOM 2135 CD1 LEU D 56 4.201 -20.421 -2.955 1.00 0.00 C ATOM 2136 CD2 LEU D 56 4.549 -17.962 -3.122 1.00 0.00 C ATOM 0 H LEU D 56 7.248 -19.918 -5.324 1.00 0.00 H new ATOM 0 HA LEU D 56 7.029 -17.566 -3.755 1.00 0.00 H new ATOM 0 HB2 LEU D 56 6.845 -20.539 -3.123 1.00 0.00 H new ATOM 0 HB3 LEU D 56 6.544 -19.295 -1.926 1.00 0.00 H new ATOM 0 HG LEU D 56 5.117 -19.404 -4.621 1.00 0.00 H new ATOM 0 HD11 LEU D 56 3.188 -20.299 -3.337 1.00 0.00 H new ATOM 0 HD12 LEU D 56 4.583 -21.400 -3.245 1.00 0.00 H new ATOM 0 HD13 LEU D 56 4.190 -20.344 -1.868 1.00 0.00 H new ATOM 0 HD21 LEU D 56 3.537 -17.845 -3.508 1.00 0.00 H new ATOM 0 HD22 LEU D 56 4.533 -17.888 -2.035 1.00 0.00 H new ATOM 0 HD23 LEU D 56 5.186 -17.177 -3.529 1.00 0.00 H new ATOM 2148 N SER D 57 9.683 -19.445 -3.278 1.00 0.00 N ATOM 2149 CA SER D 57 10.991 -19.469 -2.635 1.00 0.00 C ATOM 2150 C SER D 57 11.816 -18.245 -3.027 1.00 0.00 C ATOM 2151 O SER D 57 12.702 -17.823 -2.287 1.00 0.00 O ATOM 2152 CB SER D 57 11.743 -20.740 -3.024 1.00 0.00 C ATOM 2153 OG SER D 57 12.010 -20.721 -4.420 1.00 0.00 O ATOM 0 H SER D 57 9.513 -20.212 -3.929 1.00 0.00 H new ATOM 0 HA SER D 57 10.838 -19.453 -1.556 1.00 0.00 H new ATOM 0 HB2 SER D 57 12.676 -20.809 -2.465 1.00 0.00 H new ATOM 0 HB3 SER D 57 11.152 -21.619 -2.767 1.00 0.00 H new ATOM 0 HG SER D 57 12.494 -21.535 -4.672 1.00 0.00 H new ATOM 2159 N ASP D 58 11.514 -17.670 -4.186 1.00 0.00 N ATOM 2160 CA ASP D 58 12.236 -16.488 -4.648 1.00 0.00 C ATOM 2161 C ASP D 58 11.998 -15.323 -3.697 1.00 0.00 C ATOM 2162 O ASP D 58 12.841 -14.438 -3.555 1.00 0.00 O ATOM 2163 CB ASP D 58 11.797 -16.112 -6.064 1.00 0.00 C ATOM 2164 CG ASP D 58 12.329 -17.139 -7.057 1.00 0.00 C ATOM 2165 OD1 ASP D 58 13.191 -17.913 -6.674 1.00 0.00 O ATOM 2166 OD2 ASP D 58 11.867 -17.137 -8.185 1.00 0.00 O1- ATOM 0 H ASP D 58 10.783 -17.998 -4.817 1.00 0.00 H new ATOM 0 HA ASP D 58 13.302 -16.717 -4.665 1.00 0.00 H new ATOM 0 HB2 ASP D 58 10.709 -16.069 -6.118 1.00 0.00 H new ATOM 0 HB3 ASP D 58 12.168 -15.119 -6.319 1.00 0.00 H new ATOM 2171 N TYR D 59 10.838 -15.332 -3.054 1.00 0.00 N ATOM 2172 CA TYR D 59 10.476 -14.277 -2.118 1.00 0.00 C ATOM 2173 C TYR D 59 10.593 -14.747 -0.671 1.00 0.00 C ATOM 2174 O TYR D 59 10.076 -14.102 0.240 1.00 0.00 O ATOM 2175 CB TYR D 59 9.049 -13.826 -2.405 1.00 0.00 C ATOM 2176 CG TYR D 59 9.040 -13.081 -3.712 1.00 0.00 C ATOM 2177 CD1 TYR D 59 9.014 -13.780 -4.925 1.00 0.00 C ATOM 2178 CD2 TYR D 59 9.066 -11.681 -3.710 1.00 0.00 C ATOM 2179 CE1 TYR D 59 9.016 -13.080 -6.129 1.00 0.00 C ATOM 2180 CE2 TYR D 59 9.063 -10.982 -4.919 1.00 0.00 C ATOM 2181 CZ TYR D 59 9.040 -11.681 -6.130 1.00 0.00 C ATOM 2182 OH TYR D 59 9.044 -10.990 -7.323 1.00 0.00 O ATOM 0 H TYR D 59 10.131 -16.059 -3.164 1.00 0.00 H new ATOM 0 HA TYR D 59 11.167 -13.444 -2.250 1.00 0.00 H new ATOM 0 HB2 TYR D 59 8.382 -14.687 -2.455 1.00 0.00 H new ATOM 0 HB3 TYR D 59 8.685 -13.186 -1.601 1.00 0.00 H new ATOM 0 HD1 TYR D 59 8.992 -14.860 -4.927 1.00 0.00 H new ATOM 0 HD2 TYR D 59 9.088 -11.142 -2.774 1.00 0.00 H new ATOM 0 HE1 TYR D 59 8.999 -13.619 -7.065 1.00 0.00 H new ATOM 0 HE2 TYR D 59 9.078 -9.902 -4.919 1.00 0.00 H new ATOM 0 HH TYR D 59 9.957 -10.702 -7.531 1.00 0.00 H new ATOM 2192 N ASN D 60 11.273 -15.871 -0.463 1.00 0.00 N ATOM 2193 CA ASN D 60 11.441 -16.407 0.880 1.00 0.00 C ATOM 2194 C ASN D 60 10.082 -16.604 1.543 1.00 0.00 C ATOM 2195 O ASN D 60 9.919 -16.346 2.736 1.00 0.00 O ATOM 2196 CB ASN D 60 12.288 -15.454 1.726 1.00 0.00 C ATOM 2197 CG ASN D 60 13.667 -15.278 1.099 1.00 0.00 C ATOM 2198 OD1 ASN D 60 14.272 -16.248 0.643 1.00 0.00 O ATOM 2199 ND2 ASN D 60 14.203 -14.088 1.050 1.00 0.00 N ATOM 0 H ASN D 60 11.712 -16.422 -1.201 1.00 0.00 H new ATOM 0 HA ASN D 60 11.947 -17.370 0.807 1.00 0.00 H new ATOM 0 HB2 ASN D 60 11.791 -14.487 1.806 1.00 0.00 H new ATOM 0 HB3 ASN D 60 12.388 -15.846 2.738 1.00 0.00 H new ATOM 0 HD21 ASN D 60 15.125 -13.961 0.633 1.00 0.00 H new ATOM 0 HD22 ASN D 60 13.699 -13.286 1.429 1.00 0.00 H new ATOM 2206 N ILE D 61 9.112 -17.072 0.765 1.00 0.00 N ATOM 2207 CA ILE D 61 7.774 -17.311 1.289 1.00 0.00 C ATOM 2208 C ILE D 61 7.689 -18.724 1.853 1.00 0.00 C ATOM 2209 O ILE D 61 7.582 -19.697 1.107 1.00 0.00 O ATOM 2210 CB ILE D 61 6.740 -17.118 0.177 1.00 0.00 C ATOM 2211 CG1 ILE D 61 6.745 -15.644 -0.248 1.00 0.00 C ATOM 2212 CG2 ILE D 61 5.352 -17.508 0.693 1.00 0.00 C ATOM 2213 CD1 ILE D 61 6.059 -15.483 -1.606 1.00 0.00 C ATOM 0 H ILE D 61 9.227 -17.292 -0.224 1.00 0.00 H new ATOM 0 HA ILE D 61 7.565 -16.600 2.088 1.00 0.00 H new ATOM 0 HB ILE D 61 6.987 -17.748 -0.677 1.00 0.00 H new ATOM 0 HG12 ILE D 61 6.232 -15.040 0.501 1.00 0.00 H new ATOM 0 HG13 ILE D 61 7.770 -15.278 -0.305 1.00 0.00 H new ATOM 0 HG21 ILE D 61 4.617 -17.370 -0.100 1.00 0.00 H new ATOM 0 HG22 ILE D 61 5.359 -18.553 1.003 1.00 0.00 H new ATOM 0 HG23 ILE D 61 5.090 -16.879 1.544 1.00 0.00 H new ATOM 0 HD11 ILE D 61 6.069 -14.432 -1.896 1.00 0.00 H new ATOM 0 HD12 ILE D 61 6.590 -16.071 -2.354 1.00 0.00 H new ATOM 0 HD13 ILE D 61 5.028 -15.830 -1.536 1.00 0.00 H new ATOM 2225 N GLN D 62 7.748 -18.824 3.178 1.00 0.00 N ATOM 2226 CA GLN D 62 7.692 -20.120 3.839 1.00 0.00 C ATOM 2227 C GLN D 62 6.258 -20.501 4.165 1.00 0.00 C ATOM 2228 O GLN D 62 5.314 -19.784 3.831 1.00 0.00 O ATOM 2229 CB GLN D 62 8.526 -20.096 5.120 1.00 0.00 C ATOM 2230 CG GLN D 62 7.877 -19.156 6.127 1.00 0.00 C ATOM 2231 CD GLN D 62 8.726 -19.075 7.390 1.00 0.00 C ATOM 2232 OE1 GLN D 62 9.899 -19.453 7.377 1.00 0.00 O ATOM 2233 NE2 GLN D 62 8.203 -18.605 8.488 1.00 0.00 N ATOM 0 H GLN D 62 7.834 -18.028 3.810 1.00 0.00 H new ATOM 0 HA GLN D 62 8.102 -20.866 3.158 1.00 0.00 H new ATOM 0 HB2 GLN D 62 8.600 -21.100 5.538 1.00 0.00 H new ATOM 0 HB3 GLN D 62 9.541 -19.767 4.900 1.00 0.00 H new ATOM 0 HG2 GLN D 62 7.765 -18.164 5.690 1.00 0.00 H new ATOM 0 HG3 GLN D 62 6.876 -19.510 6.374 1.00 0.00 H new ATOM 0 HE21 GLN D 62 7.232 -18.292 8.497 1.00 0.00 H new ATOM 0 HE22 GLN D 62 8.765 -18.550 9.338 1.00 0.00 H new ATOM 2242 N LYS D 63 6.096 -21.642 4.812 1.00 0.00 N ATOM 2243 CA LYS D 63 4.768 -22.105 5.165 1.00 0.00 C ATOM 2244 C LYS D 63 4.152 -21.159 6.191 1.00 0.00 C ATOM 2245 O LYS D 63 4.851 -20.592 7.033 1.00 0.00 O ATOM 2246 CB LYS D 63 4.819 -23.518 5.747 1.00 0.00 C ATOM 2247 CG LYS D 63 3.406 -24.100 5.782 1.00 0.00 C ATOM 2248 CD LYS D 63 3.464 -25.519 6.343 1.00 0.00 C ATOM 2249 CE LYS D 63 2.062 -26.128 6.346 1.00 0.00 C ATOM 2250 NZ LYS D 63 2.130 -27.517 6.883 1.00 0.00 N1+ ATOM 0 H LYS D 63 6.857 -22.257 5.100 1.00 0.00 H new ATOM 0 HA LYS D 63 4.159 -22.122 4.261 1.00 0.00 H new ATOM 0 HB2 LYS D 63 5.470 -24.150 5.143 1.00 0.00 H new ATOM 0 HB3 LYS D 63 5.240 -23.495 6.752 1.00 0.00 H new ATOM 0 HG2 LYS D 63 2.758 -23.478 6.399 1.00 0.00 H new ATOM 0 HG3 LYS D 63 2.978 -24.109 4.780 1.00 0.00 H new ATOM 0 HD2 LYS D 63 4.136 -26.131 5.742 1.00 0.00 H new ATOM 0 HD3 LYS D 63 3.867 -25.504 7.356 1.00 0.00 H new ATOM 0 HE2 LYS D 63 1.391 -25.523 6.956 1.00 0.00 H new ATOM 0 HE3 LYS D 63 1.654 -26.136 5.335 1.00 0.00 H new ATOM 0 HZ1 LYS D 63 1.178 -27.935 6.887 1.00 0.00 H new ATOM 0 HZ2 LYS D 63 2.757 -28.091 6.284 1.00 0.00 H new ATOM 0 HZ3 LYS D 63 2.502 -27.496 7.854 1.00 0.00 H new ATOM 2264 N GLU D 64 2.848 -20.990 6.100 1.00 0.00 N ATOM 2265 CA GLU D 64 2.115 -20.114 6.997 1.00 0.00 C ATOM 2266 C GLU D 64 2.510 -18.652 6.793 1.00 0.00 C ATOM 2267 O GLU D 64 2.111 -17.788 7.574 1.00 0.00 O ATOM 2268 CB GLU D 64 2.353 -20.522 8.450 1.00 0.00 C ATOM 2269 CG GLU D 64 2.164 -22.032 8.575 1.00 0.00 C ATOM 2270 CD GLU D 64 1.966 -22.418 10.036 1.00 0.00 C ATOM 2271 OE1 GLU D 64 0.903 -22.137 10.565 1.00 0.00 O ATOM 2272 OE2 GLU D 64 2.880 -22.991 10.606 1.00 0.00 O1- ATOM 0 H GLU D 64 2.266 -21.455 5.403 1.00 0.00 H new ATOM 0 HA GLU D 64 1.054 -20.214 6.766 1.00 0.00 H new ATOM 0 HB2 GLU D 64 3.359 -20.241 8.761 1.00 0.00 H new ATOM 0 HB3 GLU D 64 1.658 -19.999 9.107 1.00 0.00 H new ATOM 0 HG2 GLU D 64 1.302 -22.348 7.988 1.00 0.00 H new ATOM 0 HG3 GLU D 64 3.033 -22.550 8.169 1.00 0.00 H new ATOM 2279 N SER D 65 3.264 -18.363 5.731 1.00 0.00 N ATOM 2280 CA SER D 65 3.651 -16.985 5.454 1.00 0.00 C ATOM 2281 C SER D 65 2.404 -16.174 5.151 1.00 0.00 C ATOM 2282 O SER D 65 1.529 -16.623 4.417 1.00 0.00 O ATOM 2283 CB SER D 65 4.603 -16.924 4.259 1.00 0.00 C ATOM 2284 OG SER D 65 5.857 -17.480 4.630 1.00 0.00 O ATOM 0 H SER D 65 3.611 -19.051 5.063 1.00 0.00 H new ATOM 0 HA SER D 65 4.162 -16.576 6.325 1.00 0.00 H new ATOM 0 HB2 SER D 65 4.183 -17.474 3.416 1.00 0.00 H new ATOM 0 HB3 SER D 65 4.732 -15.892 3.934 1.00 0.00 H new ATOM 0 HG SER D 65 5.735 -18.417 4.890 1.00 0.00 H new ATOM 2290 N THR D 66 2.321 -14.982 5.722 1.00 0.00 N ATOM 2291 CA THR D 66 1.161 -14.141 5.494 1.00 0.00 C ATOM 2292 C THR D 66 1.407 -13.256 4.278 1.00 0.00 C ATOM 2293 O THR D 66 2.261 -12.370 4.302 1.00 0.00 O ATOM 2294 CB THR D 66 0.903 -13.273 6.731 1.00 0.00 C ATOM 2295 OG1 THR D 66 0.914 -14.092 7.891 1.00 0.00 O ATOM 2296 CG2 THR D 66 -0.464 -12.598 6.614 1.00 0.00 C ATOM 0 H THR D 66 3.031 -14.582 6.336 1.00 0.00 H new ATOM 0 HA THR D 66 0.287 -14.766 5.311 1.00 0.00 H new ATOM 0 HB THR D 66 1.681 -12.513 6.803 1.00 0.00 H new ATOM 0 HG1 THR D 66 0.751 -13.539 8.683 1.00 0.00 H new ATOM 0 HG21 THR D 66 -0.642 -11.982 7.496 1.00 0.00 H new ATOM 0 HG22 THR D 66 -0.485 -11.971 5.723 1.00 0.00 H new ATOM 0 HG23 THR D 66 -1.241 -13.359 6.540 1.00 0.00 H new ATOM 2304 N LEU D 67 0.654 -13.509 3.215 1.00 0.00 N ATOM 2305 CA LEU D 67 0.787 -12.743 1.990 1.00 0.00 C ATOM 2306 C LEU D 67 -0.231 -11.617 1.973 1.00 0.00 C ATOM 2307 O LEU D 67 -1.390 -11.814 2.342 1.00 0.00 O ATOM 2308 CB LEU D 67 0.570 -13.655 0.780 1.00 0.00 C ATOM 2309 CG LEU D 67 1.913 -14.232 0.330 1.00 0.00 C ATOM 2310 CD1 LEU D 67 2.455 -15.173 1.407 1.00 0.00 C ATOM 2311 CD2 LEU D 67 1.724 -15.007 -0.975 1.00 0.00 C ATOM 0 H LEU D 67 -0.056 -14.241 3.180 1.00 0.00 H new ATOM 0 HA LEU D 67 1.790 -12.319 1.943 1.00 0.00 H new ATOM 0 HB2 LEU D 67 -0.117 -14.461 1.037 1.00 0.00 H new ATOM 0 HB3 LEU D 67 0.112 -13.094 -0.034 1.00 0.00 H new ATOM 0 HG LEU D 67 2.620 -13.418 0.171 1.00 0.00 H new ATOM 0 HD11 LEU D 67 3.412 -15.583 1.084 1.00 0.00 H new ATOM 0 HD12 LEU D 67 2.592 -14.621 2.337 1.00 0.00 H new ATOM 0 HD13 LEU D 67 1.748 -15.987 1.569 1.00 0.00 H new ATOM 0 HD21 LEU D 67 2.681 -15.418 -1.296 1.00 0.00 H new ATOM 0 HD22 LEU D 67 1.015 -15.819 -0.816 1.00 0.00 H new ATOM 0 HD23 LEU D 67 1.341 -14.336 -1.744 1.00 0.00 H new ATOM 2323 N HIS D 68 0.203 -10.439 1.548 1.00 0.00 N ATOM 2324 CA HIS D 68 -0.691 -9.295 1.497 1.00 0.00 C ATOM 2325 C HIS D 68 -1.458 -9.291 0.183 1.00 0.00 C ATOM 2326 O HIS D 68 -0.865 -9.340 -0.894 1.00 0.00 O ATOM 2327 CB HIS D 68 0.110 -7.998 1.634 1.00 0.00 C ATOM 2328 CG HIS D 68 0.851 -7.999 2.943 1.00 0.00 C ATOM 2329 ND1 HIS D 68 0.463 -7.676 4.219 1.00 0.00 N flip ATOM 2330 CD2 HIS D 68 2.183 -8.377 3.037 1.00 0.00 C flip ATOM 2331 CE1 HIS D 68 1.533 -7.849 5.092 1.00 0.00 C flip ATOM 2332 NE2 HIS D 68 2.544 -8.272 4.329 1.00 0.00 N flip ATOM 0 H HIS D 68 1.157 -10.253 1.237 1.00 0.00 H new ATOM 0 HA HIS D 68 -1.400 -9.365 2.322 1.00 0.00 H new ATOM 0 HB2 HIS D 68 0.813 -7.904 0.806 1.00 0.00 H new ATOM 0 HB3 HIS D 68 -0.559 -7.139 1.584 1.00 0.00 H new ATOM 0 HD2 HIS D 68 2.815 -8.697 2.222 1.00 0.00 H new ATOM 0 HE1 HIS D 68 1.543 -7.678 6.158 1.00 0.00 H new ATOM 0 HE2 HIS D 68 3.476 -8.489 4.682 1.00 0.00 H new ATOM 2340 N LEU D 69 -2.778 -9.235 0.281 1.00 0.00 N ATOM 2341 CA LEU D 69 -3.626 -9.231 -0.902 1.00 0.00 C ATOM 2342 C LEU D 69 -4.302 -7.873 -1.052 1.00 0.00 C ATOM 2343 O LEU D 69 -4.974 -7.403 -0.135 1.00 0.00 O ATOM 2344 CB LEU D 69 -4.681 -10.331 -0.779 1.00 0.00 C ATOM 2345 CG LEU D 69 -5.579 -10.339 -2.012 1.00 0.00 C ATOM 2346 CD1 LEU D 69 -4.747 -10.701 -3.240 1.00 0.00 C ATOM 2347 CD2 LEU D 69 -6.691 -11.373 -1.831 1.00 0.00 C ATOM 0 H LEU D 69 -3.284 -9.192 1.165 1.00 0.00 H new ATOM 0 HA LEU D 69 -3.014 -9.418 -1.785 1.00 0.00 H new ATOM 0 HB2 LEU D 69 -4.195 -11.300 -0.668 1.00 0.00 H new ATOM 0 HB3 LEU D 69 -5.282 -10.171 0.116 1.00 0.00 H new ATOM 0 HG LEU D 69 -6.021 -9.352 -2.145 1.00 0.00 H new ATOM 0 HD11 LEU D 69 -5.386 -10.708 -4.123 1.00 0.00 H new ATOM 0 HD12 LEU D 69 -3.953 -9.965 -3.372 1.00 0.00 H new ATOM 0 HD13 LEU D 69 -4.307 -11.689 -3.103 1.00 0.00 H new ATOM 0 HD21 LEU D 69 -7.331 -11.377 -2.713 1.00 0.00 H new ATOM 0 HD22 LEU D 69 -6.251 -12.361 -1.698 1.00 0.00 H new ATOM 0 HD23 LEU D 69 -7.285 -11.119 -0.953 1.00 0.00 H new ATOM 2359 N VAL D 70 -4.116 -7.248 -2.207 1.00 0.00 N ATOM 2360 CA VAL D 70 -4.716 -5.941 -2.457 1.00 0.00 C ATOM 2361 C VAL D 70 -5.799 -6.061 -3.523 1.00 0.00 C ATOM 2362 O VAL D 70 -5.575 -6.654 -4.578 1.00 0.00 O ATOM 2363 CB VAL D 70 -3.651 -4.949 -2.927 1.00 0.00 C ATOM 2364 CG1 VAL D 70 -4.298 -3.585 -3.172 1.00 0.00 C ATOM 2365 CG2 VAL D 70 -2.558 -4.817 -1.860 1.00 0.00 C ATOM 0 H VAL D 70 -3.561 -7.618 -2.979 1.00 0.00 H new ATOM 0 HA VAL D 70 -5.157 -5.579 -1.528 1.00 0.00 H new ATOM 0 HB VAL D 70 -3.204 -5.311 -3.853 1.00 0.00 H new ATOM 0 HG11 VAL D 70 -3.540 -2.877 -3.507 1.00 0.00 H new ATOM 0 HG12 VAL D 70 -5.069 -3.680 -3.937 1.00 0.00 H new ATOM 0 HG13 VAL D 70 -4.748 -3.224 -2.247 1.00 0.00 H new ATOM 0 HG21 VAL D 70 -1.802 -4.109 -2.199 1.00 0.00 H new ATOM 0 HG22 VAL D 70 -2.999 -4.458 -0.930 1.00 0.00 H new ATOM 0 HG23 VAL D 70 -2.095 -5.789 -1.691 1.00 0.00 H new ATOM 2375 N LEU D 71 -6.974 -5.510 -3.235 1.00 0.00 N ATOM 2376 CA LEU D 71 -8.087 -5.573 -4.175 1.00 0.00 C ATOM 2377 C LEU D 71 -8.319 -4.204 -4.807 1.00 0.00 C ATOM 2378 O LEU D 71 -8.341 -3.187 -4.115 1.00 0.00 O ATOM 2379 CB LEU D 71 -9.353 -6.018 -3.444 1.00 0.00 C ATOM 2380 CG LEU D 71 -9.075 -7.315 -2.683 1.00 0.00 C ATOM 2381 CD1 LEU D 71 -10.346 -7.763 -1.960 1.00 0.00 C ATOM 2382 CD2 LEU D 71 -8.632 -8.403 -3.662 1.00 0.00 C ATOM 0 H LEU D 71 -7.179 -5.019 -2.365 1.00 0.00 H new ATOM 0 HA LEU D 71 -7.847 -6.291 -4.959 1.00 0.00 H new ATOM 0 HB2 LEU D 71 -9.678 -5.241 -2.752 1.00 0.00 H new ATOM 0 HB3 LEU D 71 -10.163 -6.169 -4.157 1.00 0.00 H new ATOM 0 HG LEU D 71 -8.283 -7.144 -1.954 1.00 0.00 H new ATOM 0 HD11 LEU D 71 -10.149 -8.687 -1.417 1.00 0.00 H new ATOM 0 HD12 LEU D 71 -10.657 -6.989 -1.258 1.00 0.00 H new ATOM 0 HD13 LEU D 71 -11.139 -7.932 -2.689 1.00 0.00 H new ATOM 0 HD21 LEU D 71 -8.435 -9.326 -3.116 1.00 0.00 H new ATOM 0 HD22 LEU D 71 -9.420 -8.576 -4.394 1.00 0.00 H new ATOM 0 HD23 LEU D 71 -7.724 -8.084 -4.174 1.00 0.00 H new ATOM 2490 N LYS A 21 1.289 11.652 -2.104 1.00 0.00 N ATOM 2491 CA LYS A 21 1.682 12.387 -0.911 1.00 0.00 C ATOM 2492 C LYS A 21 2.696 11.582 -0.109 1.00 0.00 C ATOM 2493 O LYS A 21 2.597 10.351 -0.007 1.00 0.00 O ATOM 2494 CB LYS A 21 0.454 12.673 -0.045 1.00 0.00 C ATOM 2495 CG LYS A 21 -0.572 13.493 -0.837 1.00 0.00 C ATOM 2496 CD LYS A 21 -0.008 14.880 -1.158 1.00 0.00 C ATOM 2497 CE LYS A 21 -1.079 15.709 -1.871 1.00 0.00 C ATOM 2498 NZ LYS A 21 -0.537 17.061 -2.187 1.00 0.00 N1+ ATOM 0 HA LYS A 21 2.136 13.330 -1.215 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.006 11.736 0.284 1.00 0.00 H new ATOM 0 HB3 LYS A 21 0.751 13.217 0.852 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -0.828 12.974 -1.761 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -1.492 13.591 -0.261 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.304 15.379 -0.241 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.877 14.789 -1.788 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.391 15.208 -2.787 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -1.963 15.799 -1.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.266 17.623 -2.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.260 17.539 -1.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.294 16.966 -2.805 1.00 0.00 H new ATOM 2512 N TYR A 22 3.669 12.284 0.463 1.00 0.00 N ATOM 2513 CA TYR A 22 4.698 11.642 1.255 1.00 0.00 C ATOM 2514 C TYR A 22 4.316 11.686 2.720 1.00 0.00 C ATOM 2515 O TYR A 22 4.246 12.755 3.327 1.00 0.00 O ATOM 2516 CB TYR A 22 6.039 12.347 1.054 1.00 0.00 C ATOM 2517 CG TYR A 22 6.688 11.888 -0.235 1.00 0.00 C ATOM 2518 CD1 TYR A 22 5.911 11.360 -1.280 1.00 0.00 C ATOM 2519 CD2 TYR A 22 8.073 11.999 -0.385 1.00 0.00 C ATOM 2520 CE1 TYR A 22 6.527 10.950 -2.468 1.00 0.00 C ATOM 2521 CE2 TYR A 22 8.687 11.587 -1.573 1.00 0.00 C ATOM 2522 CZ TYR A 22 7.914 11.063 -2.614 1.00 0.00 C ATOM 2523 OH TYR A 22 8.520 10.657 -3.786 1.00 0.00 O ATOM 0 H TYR A 22 3.762 13.297 0.390 1.00 0.00 H new ATOM 0 HA TYR A 22 4.793 10.605 0.934 1.00 0.00 H new ATOM 0 HB2 TYR A 22 5.890 13.426 1.029 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.698 12.136 1.896 1.00 0.00 H new ATOM 0 HD1 TYR A 22 4.841 11.271 -1.167 1.00 0.00 H new ATOM 0 HD2 TYR A 22 8.671 12.404 0.418 1.00 0.00 H new ATOM 0 HE1 TYR A 22 5.931 10.546 -3.273 1.00 0.00 H new ATOM 0 HE2 TYR A 22 9.758 11.674 -1.686 1.00 0.00 H new ATOM 0 HH TYR A 22 9.043 9.845 -3.620 1.00 0.00 H new ATOM 2533 N LEU A 23 4.070 10.517 3.277 1.00 0.00 N ATOM 2534 CA LEU A 23 3.696 10.413 4.663 1.00 0.00 C ATOM 2535 C LEU A 23 4.843 10.833 5.564 1.00 0.00 C ATOM 2536 O LEU A 23 4.633 11.470 6.595 1.00 0.00 O ATOM 2537 CB LEU A 23 3.289 8.983 4.976 1.00 0.00 C ATOM 2538 CG LEU A 23 2.025 8.616 4.196 1.00 0.00 C ATOM 2539 CD1 LEU A 23 1.723 7.131 4.394 1.00 0.00 C ATOM 2540 CD2 LEU A 23 0.842 9.445 4.702 1.00 0.00 C ATOM 0 H LEU A 23 4.124 9.626 2.784 1.00 0.00 H new ATOM 0 HA LEU A 23 2.854 11.080 4.847 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.098 8.301 4.715 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.111 8.873 6.046 1.00 0.00 H new ATOM 0 HG LEU A 23 2.182 8.824 3.138 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.823 6.866 3.840 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.562 6.537 4.030 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.569 6.929 5.454 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.055 9.179 4.142 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.682 9.242 5.761 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.055 10.505 4.563 1.00 0.00 H new ATOM 2552 N VAL A 24 6.058 10.481 5.172 1.00 0.00 N ATOM 2553 CA VAL A 24 7.230 10.847 5.971 1.00 0.00 C ATOM 2554 C VAL A 24 8.432 11.025 5.067 1.00 0.00 C ATOM 2555 O VAL A 24 8.435 10.571 3.927 1.00 0.00 O ATOM 2556 CB VAL A 24 7.547 9.782 7.027 1.00 0.00 C ATOM 2557 CG1 VAL A 24 8.417 8.689 6.403 1.00 0.00 C ATOM 2558 CG2 VAL A 24 8.306 10.437 8.194 1.00 0.00 C ATOM 0 H VAL A 24 6.262 9.953 4.324 1.00 0.00 H new ATOM 0 HA VAL A 24 7.003 11.782 6.484 1.00 0.00 H new ATOM 0 HB VAL A 24 6.620 9.342 7.394 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.643 7.931 7.153 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.883 8.229 5.572 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.346 9.127 6.039 1.00 0.00 H new ATOM 0 HG21 VAL A 24 8.534 9.684 8.948 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.234 10.874 7.825 1.00 0.00 H new ATOM 0 HG23 VAL A 24 7.688 11.218 8.637 1.00 0.00 H new ATOM 2568 N GLU A 25 9.452 11.681 5.583 1.00 0.00 N ATOM 2569 CA GLU A 25 10.662 11.907 4.809 1.00 0.00 C ATOM 2570 C GLU A 25 11.741 12.539 5.669 1.00 0.00 C ATOM 2571 O GLU A 25 11.551 13.611 6.243 1.00 0.00 O ATOM 2572 CB GLU A 25 10.364 12.821 3.618 1.00 0.00 C ATOM 2573 CG GLU A 25 9.251 13.803 3.988 1.00 0.00 C ATOM 2574 CD GLU A 25 9.303 15.017 3.066 1.00 0.00 C ATOM 2575 OE1 GLU A 25 10.251 15.779 3.175 1.00 0.00 O ATOM 2576 OE2 GLU A 25 8.396 15.168 2.266 1.00 0.00 O1- ATOM 0 H GLU A 25 9.471 12.065 6.528 1.00 0.00 H new ATOM 0 HA GLU A 25 11.017 10.942 4.448 1.00 0.00 H new ATOM 0 HB2 GLU A 25 11.263 13.366 3.332 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.065 12.225 2.756 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.280 13.314 3.906 1.00 0.00 H new ATOM 0 HG3 GLU A 25 9.362 14.118 5.025 1.00 0.00 H new ATOM 2583 N PHE A 26 12.878 11.873 5.731 1.00 0.00 N ATOM 2584 CA PHE A 26 14.002 12.382 6.504 1.00 0.00 C ATOM 2585 C PHE A 26 15.324 11.855 5.957 1.00 0.00 C ATOM 2586 O PHE A 26 15.359 10.851 5.246 1.00 0.00 O ATOM 2587 CB PHE A 26 13.839 12.019 7.978 1.00 0.00 C ATOM 2588 CG PHE A 26 13.708 10.528 8.134 1.00 0.00 C ATOM 2589 CD1 PHE A 26 14.847 9.740 8.303 1.00 0.00 C ATOM 2590 CD2 PHE A 26 12.439 9.935 8.125 1.00 0.00 C ATOM 2591 CE1 PHE A 26 14.723 8.359 8.465 1.00 0.00 C ATOM 2592 CE2 PHE A 26 12.309 8.556 8.285 1.00 0.00 C ATOM 2593 CZ PHE A 26 13.452 7.762 8.455 1.00 0.00 C ATOM 0 H PHE A 26 13.051 10.985 5.260 1.00 0.00 H new ATOM 0 HA PHE A 26 14.016 13.468 6.416 1.00 0.00 H new ATOM 0 HB2 PHE A 26 14.698 12.377 8.546 1.00 0.00 H new ATOM 0 HB3 PHE A 26 12.958 12.514 8.387 1.00 0.00 H new ATOM 0 HD1 PHE A 26 15.825 10.199 8.308 1.00 0.00 H new ATOM 0 HD2 PHE A 26 11.559 10.547 7.994 1.00 0.00 H new ATOM 0 HE1 PHE A 26 15.605 7.750 8.598 1.00 0.00 H new ATOM 0 HE2 PHE A 26 11.330 8.100 8.278 1.00 0.00 H new ATOM 0 HZ PHE A 26 13.355 6.693 8.578 1.00 0.00 H new ATOM 2603 N ARG A 27 16.412 12.548 6.277 1.00 0.00 N ATOM 2604 CA ARG A 27 17.720 12.140 5.786 1.00 0.00 C ATOM 2605 C ARG A 27 18.219 10.920 6.542 1.00 0.00 C ATOM 2606 O ARG A 27 18.379 10.955 7.762 1.00 0.00 O ATOM 2607 CB ARG A 27 18.728 13.283 5.954 1.00 0.00 C ATOM 2608 CG ARG A 27 18.264 14.504 5.156 1.00 0.00 C ATOM 2609 CD ARG A 27 19.235 15.669 5.380 1.00 0.00 C ATOM 2610 NE ARG A 27 20.517 15.403 4.732 1.00 0.00 N ATOM 2611 CZ ARG A 27 21.531 16.271 4.798 1.00 0.00 C ATOM 2612 NH1 ARG A 27 21.411 17.393 5.462 1.00 0.00 N1+ ATOM 2613 NH2 ARG A 27 22.652 16.003 4.187 1.00 0.00 N ATOM 0 H ARG A 27 16.414 13.382 6.865 1.00 0.00 H new ATOM 0 HA ARG A 27 17.622 11.891 4.729 1.00 0.00 H new ATOM 0 HB2 ARG A 27 18.826 13.542 7.008 1.00 0.00 H new ATOM 0 HB3 ARG A 27 19.713 12.965 5.611 1.00 0.00 H new ATOM 0 HG2 ARG A 27 18.214 14.259 4.095 1.00 0.00 H new ATOM 0 HG3 ARG A 27 17.259 14.791 5.465 1.00 0.00 H new ATOM 0 HD2 ARG A 27 18.805 16.589 4.984 1.00 0.00 H new ATOM 0 HD3 ARG A 27 19.387 15.823 6.448 1.00 0.00 H new ATOM 0 HE ARG A 27 20.641 14.532 4.216 1.00 0.00 H new ATOM 0 HH11 ARG A 27 20.536 17.613 5.937 1.00 0.00 H new ATOM 0 HH12 ARG A 27 22.193 18.047 5.504 1.00 0.00 H new ATOM 0 HH21 ARG A 27 22.752 15.134 3.662 1.00 0.00 H new ATOM 0 HH22 ARG A 27 23.429 16.662 4.234 1.00 0.00 H new ATOM 2627 N ALA A 28 18.488 9.849 5.807 1.00 0.00 N ATOM 2628 CA ALA A 28 18.995 8.633 6.418 1.00 0.00 C ATOM 2629 C ALA A 28 19.754 7.796 5.400 1.00 0.00 C ATOM 2630 O ALA A 28 19.361 7.697 4.237 1.00 0.00 O ATOM 2631 CB ALA A 28 17.855 7.798 7.014 1.00 0.00 C ATOM 0 H ALA A 28 18.364 9.799 4.796 1.00 0.00 H new ATOM 0 HA ALA A 28 19.673 8.927 7.219 1.00 0.00 H new ATOM 0 HB1 ALA A 28 18.264 6.894 7.465 1.00 0.00 H new ATOM 0 HB2 ALA A 28 17.337 8.381 7.776 1.00 0.00 H new ATOM 0 HB3 ALA A 28 17.153 7.525 6.226 1.00 0.00 H new ATOM 2637 N GLY A 29 20.840 7.188 5.851 1.00 0.00 N ATOM 2638 CA GLY A 29 21.650 6.345 4.983 1.00 0.00 C ATOM 2639 C GLY A 29 21.443 4.871 5.323 1.00 0.00 C ATOM 2640 O GLY A 29 21.018 4.533 6.426 1.00 0.00 O ATOM 0 H GLY A 29 21.181 7.261 6.810 1.00 0.00 H new ATOM 0 HA2 GLY A 29 21.384 6.525 3.941 1.00 0.00 H new ATOM 0 HA3 GLY A 29 22.703 6.605 5.093 1.00 0.00 H new ATOM 2644 N LYS A 30 21.735 4.006 4.359 1.00 0.00 N ATOM 2645 CA LYS A 30 21.569 2.565 4.543 1.00 0.00 C ATOM 2646 C LYS A 30 22.870 1.922 5.026 1.00 0.00 C ATOM 2647 O LYS A 30 23.954 2.435 4.767 1.00 0.00 O ATOM 2648 CB LYS A 30 21.157 1.926 3.213 1.00 0.00 C ATOM 2649 CG LYS A 30 20.463 0.594 3.481 1.00 0.00 C ATOM 2650 CD LYS A 30 20.291 -0.179 2.169 1.00 0.00 C ATOM 2651 CE LYS A 30 19.282 0.540 1.271 1.00 0.00 C ATOM 2652 NZ LYS A 30 17.952 0.573 1.943 1.00 0.00 N1+ ATOM 0 H LYS A 30 22.088 4.275 3.441 1.00 0.00 H new ATOM 0 HA LYS A 30 20.798 2.401 5.295 1.00 0.00 H new ATOM 0 HB2 LYS A 30 20.489 2.593 2.669 1.00 0.00 H new ATOM 0 HB3 LYS A 30 22.034 1.771 2.585 1.00 0.00 H new ATOM 0 HG2 LYS A 30 21.049 0.004 4.186 1.00 0.00 H new ATOM 0 HG3 LYS A 30 19.490 0.767 3.941 1.00 0.00 H new ATOM 0 HD2 LYS A 30 21.250 -0.264 1.658 1.00 0.00 H new ATOM 0 HD3 LYS A 30 19.949 -1.193 2.376 1.00 0.00 H new ATOM 0 HE2 LYS A 30 19.622 1.555 1.064 1.00 0.00 H new ATOM 0 HE3 LYS A 30 19.204 0.028 0.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 17.235 0.922 1.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 17.697 -0.386 2.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 17.995 1.206 2.767 1.00 0.00 H new ATOM 2666 N MET A 31 22.760 0.798 5.734 1.00 0.00 N ATOM 2667 CA MET A 31 23.944 0.101 6.241 1.00 0.00 C ATOM 2668 C MET A 31 23.903 -1.367 5.805 1.00 0.00 C ATOM 2669 O MET A 31 22.926 -1.800 5.192 1.00 0.00 O ATOM 2670 CB MET A 31 24.019 0.197 7.772 1.00 0.00 C ATOM 2671 CG MET A 31 23.472 1.556 8.236 1.00 0.00 C ATOM 2672 SD MET A 31 24.401 2.174 9.667 1.00 0.00 S ATOM 2673 CE MET A 31 24.574 0.617 10.568 1.00 0.00 C ATOM 0 H MET A 31 21.872 0.353 5.968 1.00 0.00 H new ATOM 0 HA MET A 31 24.833 0.576 5.827 1.00 0.00 H new ATOM 0 HB2 MET A 31 23.444 -0.611 8.225 1.00 0.00 H new ATOM 0 HB3 MET A 31 25.051 0.078 8.103 1.00 0.00 H new ATOM 0 HG2 MET A 31 23.534 2.275 7.419 1.00 0.00 H new ATOM 0 HG3 MET A 31 22.418 1.459 8.496 1.00 0.00 H new ATOM 0 HE1 MET A 31 24.615 0.819 11.638 1.00 0.00 H new ATOM 0 HE2 MET A 31 23.720 -0.025 10.352 1.00 0.00 H new ATOM 0 HE3 MET A 31 25.491 0.117 10.257 1.00 0.00 H new ATOM 2683 N SER A 32 24.956 -2.135 6.110 1.00 0.00 N ATOM 2684 CA SER A 32 24.985 -3.540 5.721 1.00 0.00 C ATOM 2685 C SER A 32 25.269 -4.421 6.916 1.00 0.00 C ATOM 2686 O SER A 32 26.122 -4.104 7.737 1.00 0.00 O ATOM 2687 CB SER A 32 26.072 -3.783 4.672 1.00 0.00 C ATOM 2688 OG SER A 32 25.767 -3.051 3.494 1.00 0.00 O ATOM 0 H SER A 32 25.781 -1.811 6.615 1.00 0.00 H new ATOM 0 HA SER A 32 24.007 -3.787 5.307 1.00 0.00 H new ATOM 0 HB2 SER A 32 27.043 -3.477 5.062 1.00 0.00 H new ATOM 0 HB3 SER A 32 26.141 -4.847 4.444 1.00 0.00 H new ATOM 0 HG SER A 32 26.464 -3.206 2.823 1.00 0.00 H new ATOM 2694 N LEU A 33 24.573 -5.543 6.997 1.00 0.00 N ATOM 2695 CA LEU A 33 24.793 -6.472 8.085 1.00 0.00 C ATOM 2696 C LEU A 33 25.286 -7.807 7.551 1.00 0.00 C ATOM 2697 O LEU A 33 24.595 -8.482 6.787 1.00 0.00 O ATOM 2698 CB LEU A 33 23.510 -6.664 8.900 1.00 0.00 C ATOM 2699 CG LEU A 33 23.662 -7.856 9.857 1.00 0.00 C ATOM 2700 CD1 LEU A 33 24.887 -7.659 10.752 1.00 0.00 C ATOM 2701 CD2 LEU A 33 22.412 -7.949 10.735 1.00 0.00 C ATOM 0 H LEU A 33 23.858 -5.828 6.328 1.00 0.00 H new ATOM 0 HA LEU A 33 25.557 -6.056 8.741 1.00 0.00 H new ATOM 0 HB2 LEU A 33 23.292 -5.759 9.467 1.00 0.00 H new ATOM 0 HB3 LEU A 33 22.667 -6.832 8.230 1.00 0.00 H new ATOM 0 HG LEU A 33 23.787 -8.770 9.277 1.00 0.00 H new ATOM 0 HD11 LEU A 33 24.985 -8.510 11.426 1.00 0.00 H new ATOM 0 HD12 LEU A 33 25.781 -7.581 10.133 1.00 0.00 H new ATOM 0 HD13 LEU A 33 24.769 -6.746 11.335 1.00 0.00 H new ATOM 0 HD21 LEU A 33 22.509 -8.792 11.419 1.00 0.00 H new ATOM 0 HD22 LEU A 33 22.301 -7.028 11.308 1.00 0.00 H new ATOM 0 HD23 LEU A 33 21.534 -8.092 10.105 1.00 0.00 H new ATOM 2713 N LYS A 34 26.481 -8.183 7.974 1.00 0.00 N ATOM 2714 CA LYS A 34 27.069 -9.444 7.556 1.00 0.00 C ATOM 2715 C LYS A 34 27.332 -10.306 8.782 1.00 0.00 C ATOM 2716 O LYS A 34 28.193 -9.986 9.605 1.00 0.00 O ATOM 2717 CB LYS A 34 28.371 -9.183 6.794 1.00 0.00 C ATOM 2718 CG LYS A 34 28.053 -8.576 5.426 1.00 0.00 C ATOM 2719 CD LYS A 34 29.359 -8.338 4.666 1.00 0.00 C ATOM 2720 CE LYS A 34 29.051 -7.744 3.291 1.00 0.00 C ATOM 2721 NZ LYS A 34 30.324 -7.513 2.553 1.00 0.00 N1+ ATOM 0 H LYS A 34 27.063 -7.633 8.606 1.00 0.00 H new ATOM 0 HA LYS A 34 26.381 -9.969 6.893 1.00 0.00 H new ATOM 0 HB2 LYS A 34 29.008 -8.507 7.364 1.00 0.00 H new ATOM 0 HB3 LYS A 34 28.924 -10.114 6.670 1.00 0.00 H new ATOM 0 HG2 LYS A 34 27.405 -9.245 4.860 1.00 0.00 H new ATOM 0 HG3 LYS A 34 27.513 -7.637 5.548 1.00 0.00 H new ATOM 0 HD2 LYS A 34 30.002 -7.662 5.230 1.00 0.00 H new ATOM 0 HD3 LYS A 34 29.903 -9.276 4.555 1.00 0.00 H new ATOM 0 HE2 LYS A 34 28.409 -8.420 2.727 1.00 0.00 H new ATOM 0 HE3 LYS A 34 28.507 -6.806 3.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 30.115 -7.109 1.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 30.921 -6.852 3.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 30.826 -8.416 2.435 1.00 0.00 H new ATOM 2735 N GLY A 35 26.576 -11.390 8.913 1.00 0.00 N ATOM 2736 CA GLY A 35 26.731 -12.268 10.062 1.00 0.00 C ATOM 2737 C GLY A 35 26.223 -11.572 11.320 1.00 0.00 C ATOM 2738 O GLY A 35 25.017 -11.494 11.555 1.00 0.00 O ATOM 0 H GLY A 35 25.859 -11.678 8.247 1.00 0.00 H new ATOM 0 HA2 GLY A 35 26.179 -13.194 9.900 1.00 0.00 H new ATOM 0 HA3 GLY A 35 27.780 -12.539 10.184 1.00 0.00 H new ATOM 2742 N THR A 36 27.151 -11.062 12.119 1.00 0.00 N ATOM 2743 CA THR A 36 26.789 -10.362 13.345 1.00 0.00 C ATOM 2744 C THR A 36 27.449 -8.987 13.408 1.00 0.00 C ATOM 2745 O THR A 36 27.601 -8.420 14.485 1.00 0.00 O ATOM 2746 CB THR A 36 27.188 -11.190 14.569 1.00 0.00 C ATOM 2747 OG1 THR A 36 28.534 -11.624 14.432 1.00 0.00 O ATOM 2748 CG2 THR A 36 26.256 -12.396 14.689 1.00 0.00 C ATOM 0 H THR A 36 28.154 -11.119 11.942 1.00 0.00 H new ATOM 0 HA THR A 36 25.708 -10.224 13.345 1.00 0.00 H new ATOM 0 HB THR A 36 27.103 -10.581 15.469 1.00 0.00 H new ATOM 0 HG1 THR A 36 29.139 -10.906 14.711 1.00 0.00 H new ATOM 0 HG21 THR A 36 26.537 -12.988 15.560 1.00 0.00 H new ATOM 0 HG22 THR A 36 25.228 -12.052 14.801 1.00 0.00 H new ATOM 0 HG23 THR A 36 26.337 -13.009 13.792 1.00 0.00 H new ATOM 2756 N THR A 37 27.839 -8.457 12.252 1.00 0.00 N ATOM 2757 CA THR A 37 28.474 -7.144 12.208 1.00 0.00 C ATOM 2758 C THR A 37 27.714 -6.211 11.265 1.00 0.00 C ATOM 2759 O THR A 37 27.447 -6.558 10.114 1.00 0.00 O ATOM 2760 CB THR A 37 29.925 -7.280 11.738 1.00 0.00 C ATOM 2761 OG1 THR A 37 30.632 -8.128 12.633 1.00 0.00 O ATOM 2762 CG2 THR A 37 30.586 -5.900 11.716 1.00 0.00 C ATOM 0 H THR A 37 27.729 -8.910 11.345 1.00 0.00 H new ATOM 0 HA THR A 37 28.457 -6.719 13.212 1.00 0.00 H new ATOM 0 HB THR A 37 29.945 -7.708 10.736 1.00 0.00 H new ATOM 0 HG1 THR A 37 31.118 -7.582 13.286 1.00 0.00 H new ATOM 0 HG21 THR A 37 31.619 -5.997 11.381 1.00 0.00 H new ATOM 0 HG22 THR A 37 30.043 -5.247 11.033 1.00 0.00 H new ATOM 0 HG23 THR A 37 30.568 -5.472 12.718 1.00 0.00 H new ATOM 2770 N VAL A 38 27.375 -5.024 11.762 1.00 0.00 N ATOM 2771 CA VAL A 38 26.652 -4.042 10.960 1.00 0.00 C ATOM 2772 C VAL A 38 27.593 -2.889 10.616 1.00 0.00 C ATOM 2773 O VAL A 38 28.134 -2.244 11.511 1.00 0.00 O ATOM 2774 CB VAL A 38 25.456 -3.494 11.756 1.00 0.00 C ATOM 2775 CG1 VAL A 38 24.648 -2.513 10.897 1.00 0.00 C ATOM 2776 CG2 VAL A 38 24.548 -4.641 12.201 1.00 0.00 C ATOM 0 H VAL A 38 27.588 -4.720 12.712 1.00 0.00 H new ATOM 0 HA VAL A 38 26.291 -4.517 10.048 1.00 0.00 H new ATOM 0 HB VAL A 38 25.838 -2.973 12.634 1.00 0.00 H new ATOM 0 HG11 VAL A 38 23.805 -2.133 11.474 1.00 0.00 H new ATOM 0 HG12 VAL A 38 25.286 -1.682 10.597 1.00 0.00 H new ATOM 0 HG13 VAL A 38 24.279 -3.026 10.009 1.00 0.00 H new ATOM 0 HG21 VAL A 38 23.705 -4.240 12.764 1.00 0.00 H new ATOM 0 HG22 VAL A 38 24.179 -5.174 11.325 1.00 0.00 H new ATOM 0 HG23 VAL A 38 25.112 -5.328 12.832 1.00 0.00 H new ATOM 2786 N THR A 39 27.790 -2.637 9.325 1.00 0.00 N ATOM 2787 CA THR A 39 28.669 -1.562 8.898 1.00 0.00 C ATOM 2788 C THR A 39 27.871 -0.456 8.197 1.00 0.00 C ATOM 2789 O THR A 39 27.038 -0.751 7.346 1.00 0.00 O ATOM 2790 CB THR A 39 29.713 -2.115 7.932 1.00 0.00 C ATOM 2791 OG1 THR A 39 29.072 -2.924 6.957 1.00 0.00 O ATOM 2792 CG2 THR A 39 30.744 -2.946 8.699 1.00 0.00 C ATOM 0 H THR A 39 27.355 -3.160 8.565 1.00 0.00 H new ATOM 0 HA THR A 39 29.156 -1.141 9.777 1.00 0.00 H new ATOM 0 HB THR A 39 30.222 -1.287 7.438 1.00 0.00 H new ATOM 0 HG1 THR A 39 28.256 -2.478 6.647 1.00 0.00 H new ATOM 0 HG21 THR A 39 31.486 -3.338 8.003 1.00 0.00 H new ATOM 0 HG22 THR A 39 31.238 -2.319 9.441 1.00 0.00 H new ATOM 0 HG23 THR A 39 30.243 -3.775 9.200 1.00 0.00 H new ATOM 2800 N PRO A 40 28.095 0.801 8.522 1.00 0.00 N ATOM 2801 CA PRO A 40 27.352 1.925 7.884 1.00 0.00 C ATOM 2802 C PRO A 40 27.846 2.222 6.475 1.00 0.00 C ATOM 2803 O PRO A 40 29.047 2.195 6.211 1.00 0.00 O ATOM 2804 CB PRO A 40 27.617 3.104 8.822 1.00 0.00 C ATOM 2805 CG PRO A 40 28.941 2.818 9.444 1.00 0.00 C ATOM 2806 CD PRO A 40 29.072 1.294 9.513 1.00 0.00 C ATOM 0 HA PRO A 40 26.293 1.700 7.761 1.00 0.00 H new ATOM 0 HB2 PRO A 40 27.634 4.047 8.275 1.00 0.00 H new ATOM 0 HB3 PRO A 40 26.837 3.189 9.578 1.00 0.00 H new ATOM 0 HG2 PRO A 40 29.748 3.250 8.853 1.00 0.00 H new ATOM 0 HG3 PRO A 40 29.005 3.258 10.439 1.00 0.00 H new ATOM 0 HD2 PRO A 40 30.084 0.970 9.270 1.00 0.00 H new ATOM 0 HD3 PRO A 40 28.849 0.920 10.512 1.00 0.00 H new ATOM 2814 N ASP A 41 26.917 2.527 5.579 1.00 0.00 N ATOM 2815 CA ASP A 41 27.286 2.848 4.211 1.00 0.00 C ATOM 2816 C ASP A 41 27.334 4.357 4.040 1.00 0.00 C ATOM 2817 O ASP A 41 26.553 5.088 4.650 1.00 0.00 O ATOM 2818 CB ASP A 41 26.287 2.244 3.220 1.00 0.00 C ATOM 2819 CG ASP A 41 26.955 2.033 1.866 1.00 0.00 C ATOM 2820 OD1 ASP A 41 28.099 2.435 1.719 1.00 0.00 O ATOM 2821 OD2 ASP A 41 26.314 1.469 0.995 1.00 0.00 O1- ATOM 0 H ASP A 41 25.916 2.558 5.773 1.00 0.00 H new ATOM 0 HA ASP A 41 28.269 2.424 4.007 1.00 0.00 H new ATOM 0 HB2 ASP A 41 25.913 1.294 3.602 1.00 0.00 H new ATOM 0 HB3 ASP A 41 25.427 2.904 3.111 1.00 0.00 H new ATOM 2826 N LYS A 42 28.257 4.815 3.216 1.00 0.00 N ATOM 2827 CA LYS A 42 28.413 6.240 2.975 1.00 0.00 C ATOM 2828 C LYS A 42 27.388 6.741 1.960 1.00 0.00 C ATOM 2829 O LYS A 42 27.306 7.942 1.710 1.00 0.00 O ATOM 2830 CB LYS A 42 29.824 6.536 2.458 1.00 0.00 C ATOM 2831 CG LYS A 42 30.872 6.071 3.473 1.00 0.00 C ATOM 2832 CD LYS A 42 30.794 6.917 4.748 1.00 0.00 C ATOM 2833 CE LYS A 42 31.913 6.493 5.704 1.00 0.00 C ATOM 2834 NZ LYS A 42 31.856 7.317 6.945 1.00 0.00 N1+ ATOM 0 H LYS A 42 28.910 4.224 2.702 1.00 0.00 H new ATOM 0 HA LYS A 42 28.252 6.759 3.920 1.00 0.00 H new ATOM 0 HB2 LYS A 42 29.982 6.031 1.505 1.00 0.00 H new ATOM 0 HB3 LYS A 42 29.935 7.605 2.275 1.00 0.00 H new ATOM 0 HG2 LYS A 42 30.711 5.021 3.716 1.00 0.00 H new ATOM 0 HG3 LYS A 42 31.868 6.149 3.038 1.00 0.00 H new ATOM 0 HD2 LYS A 42 30.890 7.975 4.503 1.00 0.00 H new ATOM 0 HD3 LYS A 42 29.823 6.787 5.226 1.00 0.00 H new ATOM 0 HE2 LYS A 42 31.810 5.437 5.953 1.00 0.00 H new ATOM 0 HE3 LYS A 42 32.882 6.614 5.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 32.820 7.590 7.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 31.291 8.172 6.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 31.417 6.764 7.709 1.00 0.00 H new ATOM 2848 N ARG A 43 26.617 5.822 1.369 1.00 0.00 N ATOM 2849 CA ARG A 43 25.615 6.192 0.388 1.00 0.00 C ATOM 2850 C ARG A 43 24.427 6.843 1.083 1.00 0.00 C ATOM 2851 O ARG A 43 23.321 6.301 1.088 1.00 0.00 O ATOM 2852 CB ARG A 43 25.166 4.936 -0.354 1.00 0.00 C ATOM 2853 CG ARG A 43 26.067 4.712 -1.573 1.00 0.00 C ATOM 2854 CD ARG A 43 26.303 3.212 -1.774 1.00 0.00 C ATOM 2855 NE ARG A 43 25.086 2.464 -1.489 1.00 0.00 N ATOM 2856 CZ ARG A 43 24.084 2.393 -2.366 1.00 0.00 C ATOM 2857 NH1 ARG A 43 24.162 3.008 -3.520 1.00 0.00 N1+ ATOM 2858 NH2 ARG A 43 23.015 1.707 -2.073 1.00 0.00 N ATOM 0 H ARG A 43 26.674 4.821 1.558 1.00 0.00 H new ATOM 0 HA ARG A 43 26.035 6.905 -0.321 1.00 0.00 H new ATOM 0 HB2 ARG A 43 25.213 4.073 0.310 1.00 0.00 H new ATOM 0 HB3 ARG A 43 24.128 5.039 -0.670 1.00 0.00 H new ATOM 0 HG2 ARG A 43 25.604 5.139 -2.463 1.00 0.00 H new ATOM 0 HG3 ARG A 43 27.019 5.224 -1.432 1.00 0.00 H new ATOM 0 HD2 ARG A 43 26.623 3.022 -2.798 1.00 0.00 H new ATOM 0 HD3 ARG A 43 27.107 2.873 -1.121 1.00 0.00 H new ATOM 0 HE ARG A 43 24.998 1.982 -0.595 1.00 0.00 H new ATOM 0 HH11 ARG A 43 24.995 3.548 -3.755 1.00 0.00 H new ATOM 0 HH12 ARG A 43 23.390 2.947 -4.184 1.00 0.00 H new ATOM 0 HH21 ARG A 43 22.947 1.227 -1.176 1.00 0.00 H new ATOM 0 HH22 ARG A 43 22.246 1.650 -2.741 1.00 0.00 H new ATOM 2872 N LYS A 44 24.670 8.010 1.670 1.00 0.00 N ATOM 2873 CA LYS A 44 23.627 8.739 2.370 1.00 0.00 C ATOM 2874 C LYS A 44 22.398 8.843 1.489 1.00 0.00 C ATOM 2875 O LYS A 44 22.503 9.182 0.317 1.00 0.00 O ATOM 2876 CB LYS A 44 24.118 10.143 2.738 1.00 0.00 C ATOM 2877 CG LYS A 44 24.843 10.753 1.539 1.00 0.00 C ATOM 2878 CD LYS A 44 25.175 12.220 1.818 1.00 0.00 C ATOM 2879 CE LYS A 44 26.409 12.305 2.717 1.00 0.00 C ATOM 2880 NZ LYS A 44 26.777 13.735 2.922 1.00 0.00 N1+ ATOM 0 H LYS A 44 25.581 8.469 1.673 1.00 0.00 H new ATOM 0 HA LYS A 44 23.374 8.202 3.284 1.00 0.00 H new ATOM 0 HB2 LYS A 44 23.276 10.772 3.027 1.00 0.00 H new ATOM 0 HB3 LYS A 44 24.788 10.093 3.596 1.00 0.00 H new ATOM 0 HG2 LYS A 44 25.758 10.197 1.336 1.00 0.00 H new ATOM 0 HG3 LYS A 44 24.219 10.676 0.649 1.00 0.00 H new ATOM 0 HD2 LYS A 44 25.358 12.746 0.881 1.00 0.00 H new ATOM 0 HD3 LYS A 44 24.328 12.710 2.299 1.00 0.00 H new ATOM 0 HE2 LYS A 44 26.206 11.829 3.677 1.00 0.00 H new ATOM 0 HE3 LYS A 44 27.241 11.766 2.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 27.705 13.920 2.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 26.061 14.345 2.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 26.821 13.939 3.941 1.00 0.00 H new ATOM 2894 N GLY A 45 21.238 8.534 2.050 1.00 0.00 N ATOM 2895 CA GLY A 45 20.007 8.594 1.283 1.00 0.00 C ATOM 2896 C GLY A 45 18.927 9.342 2.040 1.00 0.00 C ATOM 2897 O GLY A 45 19.205 10.131 2.942 1.00 0.00 O ATOM 0 H GLY A 45 21.125 8.243 3.021 1.00 0.00 H new ATOM 0 HA2 GLY A 45 20.193 9.086 0.328 1.00 0.00 H new ATOM 0 HA3 GLY A 45 19.665 7.584 1.059 1.00 0.00 H new ATOM 2901 N LEU A 46 17.691 9.070 1.663 1.00 0.00 N ATOM 2902 CA LEU A 46 16.544 9.690 2.292 1.00 0.00 C ATOM 2903 C LEU A 46 15.475 8.637 2.483 1.00 0.00 C ATOM 2904 O LEU A 46 15.093 7.959 1.529 1.00 0.00 O ATOM 2905 CB LEU A 46 15.982 10.805 1.411 1.00 0.00 C ATOM 2906 CG LEU A 46 15.078 11.717 2.247 1.00 0.00 C ATOM 2907 CD1 LEU A 46 15.897 12.882 2.810 1.00 0.00 C ATOM 2908 CD2 LEU A 46 13.949 12.261 1.369 1.00 0.00 C ATOM 0 H LEU A 46 17.457 8.416 0.916 1.00 0.00 H new ATOM 0 HA LEU A 46 16.849 10.116 3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.797 11.384 0.976 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.417 10.377 0.582 1.00 0.00 H new ATOM 0 HG LEU A 46 14.653 11.145 3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 46 15.250 13.528 3.404 1.00 0.00 H new ATOM 0 HD12 LEU A 46 16.698 12.493 3.439 1.00 0.00 H new ATOM 0 HD13 LEU A 46 16.327 13.455 1.988 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.306 12.910 1.964 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.373 12.830 0.542 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.362 11.431 0.975 1.00 0.00 H new ATOM 2920 N VAL A 47 14.978 8.511 3.695 1.00 0.00 N ATOM 2921 CA VAL A 47 13.939 7.544 3.947 1.00 0.00 C ATOM 2922 C VAL A 47 12.605 8.240 3.969 1.00 0.00 C ATOM 2923 O VAL A 47 12.315 9.010 4.884 1.00 0.00 O ATOM 2924 CB VAL A 47 14.160 6.831 5.274 1.00 0.00 C ATOM 2925 CG1 VAL A 47 12.865 6.120 5.674 1.00 0.00 C ATOM 2926 CG2 VAL A 47 15.276 5.795 5.119 1.00 0.00 C ATOM 0 H VAL A 47 15.272 9.056 4.506 1.00 0.00 H new ATOM 0 HA VAL A 47 13.962 6.800 3.151 1.00 0.00 H new ATOM 0 HB VAL A 47 14.442 7.555 6.039 1.00 0.00 H new ATOM 0 HG11 VAL A 47 13.011 5.605 6.624 1.00 0.00 H new ATOM 0 HG12 VAL A 47 12.065 6.853 5.778 1.00 0.00 H new ATOM 0 HG13 VAL A 47 12.596 5.395 4.906 1.00 0.00 H new ATOM 0 HG21 VAL A 47 15.434 5.285 6.069 1.00 0.00 H new ATOM 0 HG22 VAL A 47 14.993 5.067 4.359 1.00 0.00 H new ATOM 0 HG23 VAL A 47 16.197 6.294 4.818 1.00 0.00 H new ATOM 2936 N TYR A 48 11.791 7.978 2.962 1.00 0.00 N ATOM 2937 CA TYR A 48 10.488 8.617 2.911 1.00 0.00 C ATOM 2938 C TYR A 48 9.388 7.608 2.601 1.00 0.00 C ATOM 2939 O TYR A 48 9.626 6.561 1.999 1.00 0.00 O ATOM 2940 CB TYR A 48 10.489 9.749 1.877 1.00 0.00 C ATOM 2941 CG TYR A 48 10.585 9.200 0.477 1.00 0.00 C ATOM 2942 CD1 TYR A 48 9.418 8.853 -0.205 1.00 0.00 C ATOM 2943 CD2 TYR A 48 11.833 9.077 -0.152 1.00 0.00 C ATOM 2944 CE1 TYR A 48 9.489 8.384 -1.521 1.00 0.00 C ATOM 2945 CE2 TYR A 48 11.909 8.602 -1.468 1.00 0.00 C ATOM 2946 CZ TYR A 48 10.738 8.259 -2.154 1.00 0.00 C ATOM 2947 OH TYR A 48 10.812 7.796 -3.452 1.00 0.00 O ATOM 0 H TYR A 48 12.000 7.346 2.189 1.00 0.00 H new ATOM 0 HA TYR A 48 10.282 9.041 3.894 1.00 0.00 H new ATOM 0 HB2 TYR A 48 9.579 10.340 1.978 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.327 10.419 2.067 1.00 0.00 H new ATOM 0 HD1 TYR A 48 8.459 8.947 0.284 1.00 0.00 H new ATOM 0 HD2 TYR A 48 12.734 9.348 0.378 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.586 8.118 -2.050 1.00 0.00 H new ATOM 0 HE2 TYR A 48 12.869 8.501 -1.952 1.00 0.00 H new ATOM 0 HH TYR A 48 10.447 8.471 -4.061 1.00 0.00 H new ATOM 2957 N ILE A 49 8.181 7.940 3.041 1.00 0.00 N ATOM 2958 CA ILE A 49 7.024 7.087 2.849 1.00 0.00 C ATOM 2959 C ILE A 49 5.993 7.789 1.996 1.00 0.00 C ATOM 2960 O ILE A 49 5.753 8.970 2.184 1.00 0.00 O ATOM 2961 CB ILE A 49 6.418 6.734 4.196 1.00 0.00 C ATOM 2962 CG1 ILE A 49 7.402 5.880 4.996 1.00 0.00 C ATOM 2963 CG2 ILE A 49 5.142 5.947 3.953 1.00 0.00 C ATOM 2964 CD1 ILE A 49 6.875 5.709 6.421 1.00 0.00 C ATOM 0 H ILE A 49 7.981 8.807 3.540 1.00 0.00 H new ATOM 0 HA ILE A 49 7.339 6.175 2.343 1.00 0.00 H new ATOM 0 HB ILE A 49 6.200 7.642 4.759 1.00 0.00 H new ATOM 0 HG12 ILE A 49 7.526 4.906 4.522 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.383 6.354 5.013 1.00 0.00 H new ATOM 0 HG21 ILE A 49 4.690 5.683 4.909 1.00 0.00 H new ATOM 0 HG22 ILE A 49 4.444 6.554 3.377 1.00 0.00 H new ATOM 0 HG23 ILE A 49 5.375 5.038 3.398 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.573 5.101 6.996 1.00 0.00 H new ATOM 0 HD12 ILE A 49 6.773 6.687 6.891 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.903 5.217 6.393 1.00 0.00 H new ATOM 2976 N GLN A 50 5.399 7.052 1.058 1.00 0.00 N ATOM 2977 CA GLN A 50 4.385 7.620 0.177 1.00 0.00 C ATOM 2978 C GLN A 50 3.205 6.666 0.057 1.00 0.00 C ATOM 2979 O GLN A 50 3.382 5.485 -0.197 1.00 0.00 O ATOM 2980 CB GLN A 50 4.963 7.869 -1.214 1.00 0.00 C ATOM 2981 CG GLN A 50 3.870 8.459 -2.106 1.00 0.00 C ATOM 2982 CD GLN A 50 3.607 7.547 -3.296 1.00 0.00 C ATOM 2983 OE1 GLN A 50 2.457 7.244 -3.600 1.00 0.00 O ATOM 2984 NE2 GLN A 50 4.606 7.090 -3.991 1.00 0.00 N ATOM 0 H GLN A 50 5.602 6.067 0.891 1.00 0.00 H new ATOM 0 HA GLN A 50 4.054 8.566 0.605 1.00 0.00 H new ATOM 0 HB2 GLN A 50 5.810 8.552 -1.153 1.00 0.00 H new ATOM 0 HB3 GLN A 50 5.335 6.937 -1.640 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.954 8.590 -1.531 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.171 9.447 -2.456 1.00 0.00 H new ATOM 0 HE21 GLN A 50 5.561 7.342 -3.738 1.00 0.00 H new ATOM 0 HE22 GLN A 50 4.435 6.479 -4.790 1.00 0.00 H new ATOM 2993 N GLN A 51 2.000 7.186 0.214 1.00 0.00 N ATOM 2994 CA GLN A 51 0.815 6.360 0.100 1.00 0.00 C ATOM 2995 C GLN A 51 0.183 6.547 -1.262 1.00 0.00 C ATOM 2996 O GLN A 51 -0.139 7.664 -1.660 1.00 0.00 O ATOM 2997 CB GLN A 51 -0.186 6.727 1.189 1.00 0.00 C ATOM 2998 CG GLN A 51 -1.465 5.910 1.005 1.00 0.00 C ATOM 2999 CD GLN A 51 -2.468 6.286 2.081 1.00 0.00 C ATOM 3000 OE1 GLN A 51 -2.858 7.449 2.195 1.00 0.00 O ATOM 3001 NE2 GLN A 51 -2.906 5.363 2.879 1.00 0.00 N ATOM 0 H GLN A 51 1.819 8.169 0.419 1.00 0.00 H new ATOM 0 HA GLN A 51 1.102 5.315 0.220 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.243 6.533 2.172 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -0.413 7.792 1.145 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.888 6.096 0.018 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.239 4.845 1.060 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.577 4.403 2.777 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -3.579 5.597 3.609 1.00 0.00 H new ATOM 3010 N THR A 52 -0.003 5.451 -1.969 1.00 0.00 N ATOM 3011 CA THR A 52 -0.608 5.515 -3.287 1.00 0.00 C ATOM 3012 C THR A 52 -2.115 5.484 -3.205 1.00 0.00 C ATOM 3013 O THR A 52 -2.688 5.237 -2.145 1.00 0.00 O ATOM 3014 CB THR A 52 -0.087 4.391 -4.167 1.00 0.00 C ATOM 3015 OG1 THR A 52 -0.125 3.161 -3.453 1.00 0.00 O ATOM 3016 CG2 THR A 52 1.340 4.741 -4.583 1.00 0.00 C ATOM 0 H THR A 52 0.252 4.513 -1.659 1.00 0.00 H new ATOM 0 HA THR A 52 -0.326 6.466 -3.740 1.00 0.00 H new ATOM 0 HB THR A 52 -0.708 4.276 -5.056 1.00 0.00 H new ATOM 0 HG1 THR A 52 0.663 2.625 -3.682 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.739 3.949 -5.217 1.00 0.00 H new ATOM 0 HG22 THR A 52 1.338 5.681 -5.135 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.963 4.843 -3.695 1.00 0.00 H new ATOM 3024 N ASP A 53 -2.753 5.738 -4.335 1.00 0.00 N ATOM 3025 CA ASP A 53 -4.202 5.727 -4.392 1.00 0.00 C ATOM 3026 C ASP A 53 -4.727 4.339 -4.043 1.00 0.00 C ATOM 3027 O ASP A 53 -5.918 4.165 -3.787 1.00 0.00 O ATOM 3028 CB ASP A 53 -4.682 6.126 -5.789 1.00 0.00 C ATOM 3029 CG ASP A 53 -6.172 6.442 -5.754 1.00 0.00 C ATOM 3030 OD1 ASP A 53 -6.717 6.516 -4.664 1.00 0.00 O ATOM 3031 OD2 ASP A 53 -6.749 6.608 -6.816 1.00 0.00 O1- ATOM 0 H ASP A 53 -2.293 5.953 -5.219 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.585 6.447 -3.669 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -4.125 6.995 -6.140 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -4.489 5.317 -6.494 1.00 0.00 H new ATOM 3036 N ASP A 54 -3.830 3.352 -4.024 1.00 0.00 N ATOM 3037 CA ASP A 54 -4.229 1.992 -3.693 1.00 0.00 C ATOM 3038 C ASP A 54 -4.244 1.795 -2.177 1.00 0.00 C ATOM 3039 O ASP A 54 -4.539 0.703 -1.693 1.00 0.00 O ATOM 3040 CB ASP A 54 -3.263 1.000 -4.340 1.00 0.00 C ATOM 3041 CG ASP A 54 -3.904 -0.380 -4.413 1.00 0.00 C ATOM 3042 OD1 ASP A 54 -5.065 -0.493 -4.052 1.00 0.00 O ATOM 3043 OD2 ASP A 54 -3.228 -1.304 -4.833 1.00 0.00 O1- ATOM 0 H ASP A 54 -2.838 3.470 -4.231 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.235 1.816 -4.075 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -2.997 1.340 -5.341 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -2.339 0.951 -3.764 1.00 0.00 H new ATOM 3048 N SER A 55 -3.909 2.857 -1.436 1.00 0.00 N ATOM 3049 CA SER A 55 -3.873 2.795 0.018 1.00 0.00 C ATOM 3050 C SER A 55 -2.726 1.911 0.482 1.00 0.00 C ATOM 3051 O SER A 55 -2.710 1.433 1.617 1.00 0.00 O ATOM 3052 CB SER A 55 -5.193 2.257 0.560 1.00 0.00 C ATOM 3053 OG SER A 55 -5.376 2.713 1.895 1.00 0.00 O ATOM 0 H SER A 55 -3.660 3.767 -1.825 1.00 0.00 H new ATOM 0 HA SER A 55 -3.719 3.804 0.401 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.020 2.591 -0.067 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.193 1.167 0.533 1.00 0.00 H new ATOM 0 HG SER A 55 -4.586 2.486 2.429 1.00 0.00 H new ATOM 3059 N LEU A 56 -1.758 1.719 -0.401 1.00 0.00 N ATOM 3060 CA LEU A 56 -0.597 0.927 -0.099 1.00 0.00 C ATOM 3061 C LEU A 56 0.533 1.865 0.245 1.00 0.00 C ATOM 3062 O LEU A 56 0.849 2.776 -0.512 1.00 0.00 O ATOM 3063 CB LEU A 56 -0.239 0.078 -1.312 1.00 0.00 C ATOM 3064 CG LEU A 56 -1.453 -0.759 -1.710 1.00 0.00 C ATOM 3065 CD1 LEU A 56 -1.105 -1.609 -2.931 1.00 0.00 C ATOM 3066 CD2 LEU A 56 -1.856 -1.668 -0.547 1.00 0.00 C ATOM 0 H LEU A 56 -1.764 2.111 -1.343 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.788 0.261 0.743 1.00 0.00 H new ATOM 0 HB2 LEU A 56 0.066 0.716 -2.141 1.00 0.00 H new ATOM 0 HB3 LEU A 56 0.606 -0.571 -1.081 1.00 0.00 H new ATOM 0 HG LEU A 56 -2.285 -0.099 -1.953 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.970 -2.207 -3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.824 -0.958 -3.759 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.272 -2.269 -2.689 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.722 -2.264 -0.834 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.027 -2.330 -0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.106 -1.059 0.321 1.00 0.00 H new ATOM 3078 N ILE A 57 1.116 1.657 1.401 1.00 0.00 N ATOM 3079 CA ILE A 57 2.190 2.509 1.842 1.00 0.00 C ATOM 3080 C ILE A 57 3.472 2.086 1.172 1.00 0.00 C ATOM 3081 O ILE A 57 3.867 0.934 1.248 1.00 0.00 O ATOM 3082 CB ILE A 57 2.321 2.402 3.355 1.00 0.00 C ATOM 3083 CG1 ILE A 57 0.997 2.781 4.009 1.00 0.00 C ATOM 3084 CG2 ILE A 57 3.429 3.316 3.860 1.00 0.00 C ATOM 3085 CD1 ILE A 57 0.578 4.194 3.590 1.00 0.00 C ATOM 0 H ILE A 57 0.866 0.910 2.049 1.00 0.00 H new ATOM 0 HA ILE A 57 1.980 3.545 1.575 1.00 0.00 H new ATOM 0 HB ILE A 57 2.574 1.374 3.616 1.00 0.00 H new ATOM 0 HG12 ILE A 57 0.225 2.066 3.723 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.092 2.730 5.094 1.00 0.00 H new ATOM 0 HG21 ILE A 57 3.509 3.227 4.943 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.375 3.028 3.402 1.00 0.00 H new ATOM 0 HG23 ILE A 57 3.197 4.348 3.597 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.369 4.449 4.066 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.343 4.907 3.899 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.462 4.233 2.507 1.00 0.00 H new ATOM 3097 N HIS A 58 4.102 3.031 0.506 1.00 0.00 N ATOM 3098 CA HIS A 58 5.335 2.753 -0.203 1.00 0.00 C ATOM 3099 C HIS A 58 6.540 3.227 0.601 1.00 0.00 C ATOM 3100 O HIS A 58 6.721 4.425 0.821 1.00 0.00 O ATOM 3101 CB HIS A 58 5.304 3.461 -1.561 1.00 0.00 C ATOM 3102 CG HIS A 58 4.239 2.843 -2.433 1.00 0.00 C ATOM 3103 ND1 HIS A 58 4.540 1.937 -3.439 1.00 0.00 N ATOM 3104 CD2 HIS A 58 2.870 2.985 -2.462 1.00 0.00 C ATOM 3105 CE1 HIS A 58 3.378 1.576 -4.019 1.00 0.00 C ATOM 3106 NE2 HIS A 58 2.335 2.182 -3.459 1.00 0.00 N ATOM 0 H HIS A 58 3.782 3.997 0.440 1.00 0.00 H new ATOM 0 HA HIS A 58 5.425 1.676 -0.348 1.00 0.00 H new ATOM 0 HB2 HIS A 58 5.103 4.524 -1.423 1.00 0.00 H new ATOM 0 HB3 HIS A 58 6.277 3.380 -2.046 1.00 0.00 H new ATOM 0 HD1 HIS A 58 5.470 1.605 -3.693 1.00 0.00 H new ATOM 0 HD2 HIS A 58 2.298 3.625 -1.807 1.00 0.00 H new ATOM 0 HE1 HIS A 58 3.303 0.878 -4.840 1.00 0.00 H new ATOM 3114 N PHE A 59 7.375 2.278 1.010 1.00 0.00 N ATOM 3115 CA PHE A 59 8.579 2.601 1.754 1.00 0.00 C ATOM 3116 C PHE A 59 9.716 2.725 0.768 1.00 0.00 C ATOM 3117 O PHE A 59 10.144 1.730 0.189 1.00 0.00 O ATOM 3118 CB PHE A 59 8.889 1.498 2.770 1.00 0.00 C ATOM 3119 CG PHE A 59 10.142 1.851 3.542 1.00 0.00 C ATOM 3120 CD1 PHE A 59 10.047 2.559 4.750 1.00 0.00 C ATOM 3121 CD2 PHE A 59 11.398 1.472 3.050 1.00 0.00 C ATOM 3122 CE1 PHE A 59 11.210 2.882 5.466 1.00 0.00 C ATOM 3123 CE2 PHE A 59 12.558 1.799 3.765 1.00 0.00 C ATOM 3124 CZ PHE A 59 12.463 2.503 4.972 1.00 0.00 C ATOM 0 H PHE A 59 7.238 1.282 0.838 1.00 0.00 H new ATOM 0 HA PHE A 59 8.442 3.535 2.299 1.00 0.00 H new ATOM 0 HB2 PHE A 59 8.050 1.376 3.456 1.00 0.00 H new ATOM 0 HB3 PHE A 59 9.023 0.545 2.257 1.00 0.00 H new ATOM 0 HD1 PHE A 59 9.080 2.855 5.128 1.00 0.00 H new ATOM 0 HD2 PHE A 59 11.472 0.928 2.120 1.00 0.00 H new ATOM 0 HE1 PHE A 59 11.138 3.423 6.398 1.00 0.00 H new ATOM 0 HE2 PHE A 59 13.526 1.508 3.385 1.00 0.00 H new ATOM 0 HZ PHE A 59 13.358 2.754 5.522 1.00 0.00 H new ATOM 3134 N CYS A 60 10.179 3.940 0.547 1.00 0.00 N ATOM 3135 CA CYS A 60 11.244 4.149 -0.421 1.00 0.00 C ATOM 3136 C CYS A 60 12.481 4.782 0.193 1.00 0.00 C ATOM 3137 O CYS A 60 12.405 5.590 1.120 1.00 0.00 O ATOM 3138 CB CYS A 60 10.725 5.027 -1.553 1.00 0.00 C ATOM 3139 SG CYS A 60 9.400 4.171 -2.438 1.00 0.00 S ATOM 0 H CYS A 60 9.844 4.784 1.013 1.00 0.00 H new ATOM 0 HA CYS A 60 11.542 3.171 -0.798 1.00 0.00 H new ATOM 0 HB2 CYS A 60 10.356 5.971 -1.153 1.00 0.00 H new ATOM 0 HB3 CYS A 60 11.537 5.268 -2.240 1.00 0.00 H new ATOM 0 HG CYS A 60 8.962 4.927 -3.400 1.00 0.00 H new ATOM 3145 N TRP A 61 13.623 4.405 -0.371 1.00 0.00 N ATOM 3146 CA TRP A 61 14.910 4.919 0.060 1.00 0.00 C ATOM 3147 C TRP A 61 15.637 5.463 -1.156 1.00 0.00 C ATOM 3148 O TRP A 61 15.984 4.723 -2.076 1.00 0.00 O ATOM 3149 CB TRP A 61 15.742 3.814 0.706 1.00 0.00 C ATOM 3150 CG TRP A 61 17.049 4.360 1.160 1.00 0.00 C ATOM 3151 CD1 TRP A 61 17.286 4.911 2.368 1.00 0.00 C ATOM 3152 CD2 TRP A 61 18.303 4.408 0.429 1.00 0.00 C ATOM 3153 NE1 TRP A 61 18.617 5.279 2.433 1.00 0.00 N ATOM 3154 CE2 TRP A 61 19.281 4.999 1.255 1.00 0.00 C ATOM 3155 CE3 TRP A 61 18.681 3.998 -0.860 1.00 0.00 C ATOM 3156 CZ2 TRP A 61 20.591 5.178 0.822 1.00 0.00 C ATOM 3157 CZ3 TRP A 61 19.999 4.170 -1.304 1.00 0.00 C ATOM 3158 CH2 TRP A 61 20.959 4.765 -0.462 1.00 0.00 C ATOM 0 H TRP A 61 13.679 3.735 -1.138 1.00 0.00 H new ATOM 0 HA TRP A 61 14.760 5.706 0.799 1.00 0.00 H new ATOM 0 HB2 TRP A 61 15.202 3.389 1.552 1.00 0.00 H new ATOM 0 HB3 TRP A 61 15.904 3.006 -0.007 1.00 0.00 H new ATOM 0 HD1 TRP A 61 16.557 5.043 3.154 1.00 0.00 H new ATOM 0 HE1 TRP A 61 19.055 5.705 3.250 1.00 0.00 H new ATOM 0 HE3 TRP A 61 17.950 3.546 -1.514 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 21.320 5.634 1.475 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 20.280 3.845 -2.295 1.00 0.00 H new ATOM 0 HH2 TRP A 61 21.973 4.901 -0.806 1.00 0.00 H new ATOM 3169 N LYS A 62 15.844 6.759 -1.160 1.00 0.00 N ATOM 3170 CA LYS A 62 16.501 7.408 -2.274 1.00 0.00 C ATOM 3171 C LYS A 62 17.908 7.838 -1.899 1.00 0.00 C ATOM 3172 O LYS A 62 18.126 8.442 -0.853 1.00 0.00 O ATOM 3173 CB LYS A 62 15.660 8.612 -2.710 1.00 0.00 C ATOM 3174 CG LYS A 62 16.554 9.752 -3.205 1.00 0.00 C ATOM 3175 CD LYS A 62 15.674 10.885 -3.728 1.00 0.00 C ATOM 3176 CE LYS A 62 15.001 11.587 -2.554 1.00 0.00 C ATOM 3177 NZ LYS A 62 14.269 12.786 -3.048 1.00 0.00 N1+ ATOM 0 H LYS A 62 15.567 7.386 -0.405 1.00 0.00 H new ATOM 0 HA LYS A 62 16.587 6.705 -3.103 1.00 0.00 H new ATOM 0 HB2 LYS A 62 14.973 8.313 -3.502 1.00 0.00 H new ATOM 0 HB3 LYS A 62 15.052 8.958 -1.874 1.00 0.00 H new ATOM 0 HG2 LYS A 62 17.188 10.112 -2.395 1.00 0.00 H new ATOM 0 HG3 LYS A 62 17.216 9.395 -3.994 1.00 0.00 H new ATOM 0 HD2 LYS A 62 16.276 11.596 -4.294 1.00 0.00 H new ATOM 0 HD3 LYS A 62 14.921 10.490 -4.410 1.00 0.00 H new ATOM 0 HE2 LYS A 62 14.311 10.906 -2.056 1.00 0.00 H new ATOM 0 HE3 LYS A 62 15.747 11.881 -1.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 13.809 13.266 -2.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 14.939 13.438 -3.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 13.547 12.493 -3.737 1.00 0.00 H new ATOM 3191 N ASP A 63 18.856 7.535 -2.769 1.00 0.00 N ATOM 3192 CA ASP A 63 20.237 7.916 -2.522 1.00 0.00 C ATOM 3193 C ASP A 63 20.396 9.415 -2.739 1.00 0.00 C ATOM 3194 O ASP A 63 19.928 9.952 -3.734 1.00 0.00 O ATOM 3195 CB ASP A 63 21.183 7.150 -3.444 1.00 0.00 C ATOM 3196 CG ASP A 63 22.627 7.394 -3.018 1.00 0.00 C ATOM 3197 OD1 ASP A 63 22.827 8.115 -2.055 1.00 0.00 O ATOM 3198 OD2 ASP A 63 23.513 6.853 -3.660 1.00 0.00 O1- ATOM 0 H ASP A 63 18.699 7.032 -3.643 1.00 0.00 H new ATOM 0 HA ASP A 63 20.491 7.668 -1.492 1.00 0.00 H new ATOM 0 HB2 ASP A 63 20.958 6.084 -3.407 1.00 0.00 H new ATOM 0 HB3 ASP A 63 21.039 7.471 -4.476 1.00 0.00 H new ATOM 3203 N ARG A 64 21.055 10.081 -1.803 1.00 0.00 N ATOM 3204 CA ARG A 64 21.267 11.521 -1.907 1.00 0.00 C ATOM 3205 C ARG A 64 22.334 11.838 -2.952 1.00 0.00 C ATOM 3206 O ARG A 64 22.429 12.965 -3.435 1.00 0.00 O ATOM 3207 CB ARG A 64 21.685 12.095 -0.551 1.00 0.00 C ATOM 3208 CG ARG A 64 20.488 12.103 0.406 1.00 0.00 C ATOM 3209 CD ARG A 64 19.572 13.285 0.076 1.00 0.00 C ATOM 3210 NE ARG A 64 20.254 14.545 0.361 1.00 0.00 N ATOM 3211 CZ ARG A 64 19.721 15.720 0.032 1.00 0.00 C ATOM 3212 NH1 ARG A 64 18.558 15.786 -0.566 1.00 0.00 N1+ ATOM 3213 NH2 ARG A 64 20.366 16.820 0.310 1.00 0.00 N ATOM 0 H ARG A 64 21.451 9.653 -0.966 1.00 0.00 H new ATOM 0 HA ARG A 64 20.328 11.980 -2.217 1.00 0.00 H new ATOM 0 HB2 ARG A 64 22.495 11.500 -0.129 1.00 0.00 H new ATOM 0 HB3 ARG A 64 22.067 13.108 -0.678 1.00 0.00 H new ATOM 0 HG2 ARG A 64 19.935 11.167 0.321 1.00 0.00 H new ATOM 0 HG3 ARG A 64 20.835 12.176 1.437 1.00 0.00 H new ATOM 0 HD2 ARG A 64 19.283 13.249 -0.974 1.00 0.00 H new ATOM 0 HD3 ARG A 64 18.655 13.219 0.661 1.00 0.00 H new ATOM 0 HE ARG A 64 21.162 14.524 0.824 1.00 0.00 H new ATOM 0 HH11 ARG A 64 18.048 14.930 -0.786 1.00 0.00 H new ATOM 0 HH12 ARG A 64 18.162 16.693 -0.812 1.00 0.00 H new ATOM 0 HH21 ARG A 64 21.272 16.776 0.776 1.00 0.00 H new ATOM 0 HH22 ARG A 64 19.964 17.724 0.061 1.00 0.00 H new ATOM 3227 N THR A 65 23.135 10.834 -3.288 1.00 0.00 N ATOM 3228 CA THR A 65 24.195 10.999 -4.261 1.00 0.00 C ATOM 3229 C THR A 65 23.652 11.426 -5.620 1.00 0.00 C ATOM 3230 O THR A 65 24.178 12.345 -6.247 1.00 0.00 O ATOM 3231 CB THR A 65 24.939 9.676 -4.398 1.00 0.00 C ATOM 3232 OG1 THR A 65 25.608 9.378 -3.182 1.00 0.00 O ATOM 3233 CG2 THR A 65 25.936 9.771 -5.539 1.00 0.00 C ATOM 0 H THR A 65 23.066 9.895 -2.896 1.00 0.00 H new ATOM 0 HA THR A 65 24.866 11.785 -3.915 1.00 0.00 H new ATOM 0 HB THR A 65 24.230 8.877 -4.614 1.00 0.00 H new ATOM 0 HG1 THR A 65 24.983 8.948 -2.562 1.00 0.00 H new ATOM 0 HG21 THR A 65 26.468 8.825 -5.637 1.00 0.00 H new ATOM 0 HG22 THR A 65 25.407 9.988 -6.467 1.00 0.00 H new ATOM 0 HG23 THR A 65 26.650 10.569 -5.333 1.00 0.00 H new ATOM 3241 N SER A 66 22.598 10.761 -6.066 1.00 0.00 N ATOM 3242 CA SER A 66 21.987 11.087 -7.347 1.00 0.00 C ATOM 3243 C SER A 66 20.563 11.580 -7.135 1.00 0.00 C ATOM 3244 O SER A 66 19.951 12.158 -8.033 1.00 0.00 O ATOM 3245 CB SER A 66 21.977 9.855 -8.251 1.00 0.00 C ATOM 3246 OG SER A 66 23.316 9.485 -8.552 1.00 0.00 O ATOM 0 H SER A 66 22.149 9.996 -5.563 1.00 0.00 H new ATOM 0 HA SER A 66 22.570 11.875 -7.824 1.00 0.00 H new ATOM 0 HB2 SER A 66 21.462 9.031 -7.757 1.00 0.00 H new ATOM 0 HB3 SER A 66 21.431 10.068 -9.170 1.00 0.00 H new ATOM 0 HG SER A 66 23.315 8.694 -9.130 1.00 0.00 H new ATOM 3252 N GLY A 67 20.042 11.339 -5.937 1.00 0.00 N ATOM 3253 CA GLY A 67 18.689 11.752 -5.607 1.00 0.00 C ATOM 3254 C GLY A 67 17.663 10.855 -6.296 1.00 0.00 C ATOM 3255 O GLY A 67 16.512 11.244 -6.495 1.00 0.00 O ATOM 0 H GLY A 67 20.536 10.862 -5.183 1.00 0.00 H new ATOM 0 HA2 GLY A 67 18.546 11.713 -4.527 1.00 0.00 H new ATOM 0 HA3 GLY A 67 18.536 12.787 -5.912 1.00 0.00 H new ATOM 3259 N ASN A 68 18.093 9.650 -6.656 1.00 0.00 N ATOM 3260 CA ASN A 68 17.212 8.696 -7.313 1.00 0.00 C ATOM 3261 C ASN A 68 16.729 7.655 -6.318 1.00 0.00 C ATOM 3262 O ASN A 68 17.465 7.249 -5.420 1.00 0.00 O ATOM 3263 CB ASN A 68 17.940 8.005 -8.461 1.00 0.00 C ATOM 3264 CG ASN A 68 17.012 7.002 -9.136 1.00 0.00 C ATOM 3265 OD1 ASN A 68 15.967 7.380 -9.666 1.00 0.00 O ATOM 3266 ND2 ASN A 68 17.331 5.737 -9.142 1.00 0.00 N ATOM 0 H ASN A 68 19.044 9.313 -6.504 1.00 0.00 H new ATOM 0 HA ASN A 68 16.354 9.238 -7.710 1.00 0.00 H new ATOM 0 HB2 ASN A 68 18.279 8.745 -9.186 1.00 0.00 H new ATOM 0 HB3 ASN A 68 18.828 7.496 -8.086 1.00 0.00 H new ATOM 0 HD21 ASN A 68 16.714 5.058 -9.587 1.00 0.00 H new ATOM 0 HD22 ASN A 68 18.198 5.427 -8.702 1.00 0.00 H new ATOM 3273 N VAL A 69 15.489 7.222 -6.484 1.00 0.00 N ATOM 3274 CA VAL A 69 14.929 6.223 -5.589 1.00 0.00 C ATOM 3275 C VAL A 69 15.524 4.862 -5.909 1.00 0.00 C ATOM 3276 O VAL A 69 15.228 4.272 -6.949 1.00 0.00 O ATOM 3277 CB VAL A 69 13.416 6.179 -5.753 1.00 0.00 C ATOM 3278 CG1 VAL A 69 12.830 5.128 -4.810 1.00 0.00 C ATOM 3279 CG2 VAL A 69 12.841 7.556 -5.418 1.00 0.00 C ATOM 0 H VAL A 69 14.859 7.542 -7.220 1.00 0.00 H new ATOM 0 HA VAL A 69 15.168 6.485 -4.558 1.00 0.00 H new ATOM 0 HB VAL A 69 13.161 5.916 -6.780 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.747 5.097 -4.928 1.00 0.00 H new ATOM 0 HG12 VAL A 69 13.249 4.151 -5.049 1.00 0.00 H new ATOM 0 HG13 VAL A 69 13.076 5.386 -3.780 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.757 7.535 -5.532 1.00 0.00 H new ATOM 0 HG22 VAL A 69 13.092 7.815 -4.389 1.00 0.00 H new ATOM 0 HG23 VAL A 69 13.263 8.301 -6.093 1.00 0.00 H new ATOM 3289 N GLU A 70 16.376 4.373 -5.016 1.00 0.00 N ATOM 3290 CA GLU A 70 17.014 3.081 -5.231 1.00 0.00 C ATOM 3291 C GLU A 70 16.163 1.959 -4.658 1.00 0.00 C ATOM 3292 O GLU A 70 16.241 0.820 -5.119 1.00 0.00 O ATOM 3293 CB GLU A 70 18.400 3.048 -4.588 1.00 0.00 C ATOM 3294 CG GLU A 70 19.262 4.167 -5.172 1.00 0.00 C ATOM 3295 CD GLU A 70 20.723 3.962 -4.784 1.00 0.00 C ATOM 3296 OE1 GLU A 70 21.005 2.987 -4.108 1.00 0.00 O ATOM 3297 OE2 GLU A 70 21.542 4.779 -5.178 1.00 0.00 O1- ATOM 0 H GLU A 70 16.638 4.843 -4.149 1.00 0.00 H new ATOM 0 HA GLU A 70 17.117 2.936 -6.306 1.00 0.00 H new ATOM 0 HB2 GLU A 70 18.314 3.167 -3.508 1.00 0.00 H new ATOM 0 HB3 GLU A 70 18.872 2.081 -4.765 1.00 0.00 H new ATOM 0 HG2 GLU A 70 19.165 4.182 -6.258 1.00 0.00 H new ATOM 0 HG3 GLU A 70 18.913 5.133 -4.807 1.00 0.00 H new ATOM 3304 N ASP A 71 15.353 2.276 -3.650 1.00 0.00 N ATOM 3305 CA ASP A 71 14.502 1.253 -3.040 1.00 0.00 C ATOM 3306 C ASP A 71 13.044 1.706 -2.988 1.00 0.00 C ATOM 3307 O ASP A 71 12.760 2.881 -2.760 1.00 0.00 O ATOM 3308 CB ASP A 71 14.965 0.944 -1.621 1.00 0.00 C ATOM 3309 CG ASP A 71 16.453 0.620 -1.613 1.00 0.00 C ATOM 3310 OD1 ASP A 71 16.861 -0.215 -2.401 1.00 0.00 O ATOM 3311 OD2 ASP A 71 17.164 1.213 -0.818 1.00 0.00 O1- ATOM 0 H ASP A 71 15.267 3.208 -3.245 1.00 0.00 H new ATOM 0 HA ASP A 71 14.580 0.359 -3.658 1.00 0.00 H new ATOM 0 HB2 ASP A 71 14.768 1.797 -0.972 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.400 0.102 -1.221 1.00 0.00 H new ATOM 3316 N ASP A 72 12.126 0.762 -3.187 1.00 0.00 N ATOM 3317 CA ASP A 72 10.696 1.066 -3.147 1.00 0.00 C ATOM 3318 C ASP A 72 9.892 -0.199 -2.870 1.00 0.00 C ATOM 3319 O ASP A 72 9.635 -0.993 -3.775 1.00 0.00 O ATOM 3320 CB ASP A 72 10.258 1.684 -4.478 1.00 0.00 C ATOM 3321 CG ASP A 72 10.963 0.989 -5.639 1.00 0.00 C ATOM 3322 OD1 ASP A 72 11.261 -0.187 -5.510 1.00 0.00 O ATOM 3323 OD2 ASP A 72 11.197 1.644 -6.643 1.00 0.00 O1- ATOM 0 H ASP A 72 12.345 -0.216 -3.377 1.00 0.00 H new ATOM 0 HA ASP A 72 10.511 1.779 -2.343 1.00 0.00 H new ATOM 0 HB2 ASP A 72 9.178 1.593 -4.592 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.490 2.749 -4.487 1.00 0.00 H new ATOM 3328 N LEU A 73 9.505 -0.391 -1.611 1.00 0.00 N ATOM 3329 CA LEU A 73 8.745 -1.578 -1.235 1.00 0.00 C ATOM 3330 C LEU A 73 7.484 -1.194 -0.479 1.00 0.00 C ATOM 3331 O LEU A 73 7.522 -0.388 0.444 1.00 0.00 O ATOM 3332 CB LEU A 73 9.607 -2.473 -0.338 1.00 0.00 C ATOM 3333 CG LEU A 73 10.998 -2.648 -0.939 1.00 0.00 C ATOM 3334 CD1 LEU A 73 11.824 -3.560 -0.031 1.00 0.00 C ATOM 3335 CD2 LEU A 73 10.894 -3.272 -2.333 1.00 0.00 C ATOM 0 H LEU A 73 9.702 0.251 -0.844 1.00 0.00 H new ATOM 0 HA LEU A 73 8.465 -2.110 -2.144 1.00 0.00 H new ATOM 0 HB2 LEU A 73 9.686 -2.033 0.656 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.130 -3.446 -0.219 1.00 0.00 H new ATOM 0 HG LEU A 73 11.480 -1.674 -1.024 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.820 -3.690 -0.455 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.906 -3.110 0.959 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.335 -4.531 0.051 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.893 -3.393 -2.753 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.411 -4.246 -2.260 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.304 -2.622 -2.980 1.00 0.00 H new ATOM 3347 N ILE A 74 6.371 -1.799 -0.859 1.00 0.00 N ATOM 3348 CA ILE A 74 5.111 -1.528 -0.198 1.00 0.00 C ATOM 3349 C ILE A 74 5.066 -2.216 1.155 1.00 0.00 C ATOM 3350 O ILE A 74 5.280 -3.420 1.259 1.00 0.00 O ATOM 3351 CB ILE A 74 3.975 -2.023 -1.076 1.00 0.00 C ATOM 3352 CG1 ILE A 74 3.943 -1.197 -2.352 1.00 0.00 C ATOM 3353 CG2 ILE A 74 2.642 -1.872 -0.357 1.00 0.00 C ATOM 3354 CD1 ILE A 74 2.970 -1.836 -3.332 1.00 0.00 C ATOM 0 H ILE A 74 6.317 -2.478 -1.619 1.00 0.00 H new ATOM 0 HA ILE A 74 5.008 -0.455 -0.039 1.00 0.00 H new ATOM 0 HB ILE A 74 4.137 -3.076 -1.306 1.00 0.00 H new ATOM 0 HG12 ILE A 74 3.637 -0.174 -2.131 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.939 -1.144 -2.791 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.839 -2.231 -1.000 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.657 -2.455 0.564 1.00 0.00 H new ATOM 0 HG23 ILE A 74 2.474 -0.822 -0.119 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.941 -1.250 -4.250 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.297 -2.851 -3.560 1.00 0.00 H new ATOM 0 HD13 ILE A 74 1.975 -1.866 -2.889 1.00 0.00 H new ATOM 3366 N ILE A 75 4.792 -1.443 2.194 1.00 0.00 N ATOM 3367 CA ILE A 75 4.738 -2.000 3.530 1.00 0.00 C ATOM 3368 C ILE A 75 3.318 -1.950 4.081 1.00 0.00 C ATOM 3369 O ILE A 75 2.687 -0.894 4.131 1.00 0.00 O ATOM 3370 CB ILE A 75 5.667 -1.219 4.445 1.00 0.00 C ATOM 3371 CG1 ILE A 75 7.038 -1.062 3.782 1.00 0.00 C ATOM 3372 CG2 ILE A 75 5.816 -1.959 5.772 1.00 0.00 C ATOM 3373 CD1 ILE A 75 7.591 -2.420 3.344 1.00 0.00 C ATOM 0 H ILE A 75 4.606 -0.442 2.137 1.00 0.00 H new ATOM 0 HA ILE A 75 5.055 -3.042 3.484 1.00 0.00 H new ATOM 0 HB ILE A 75 5.246 -0.231 4.628 1.00 0.00 H new ATOM 0 HG12 ILE A 75 6.955 -0.403 2.918 1.00 0.00 H new ATOM 0 HG13 ILE A 75 7.731 -0.590 4.478 1.00 0.00 H new ATOM 0 HG21 ILE A 75 6.482 -1.399 6.428 1.00 0.00 H new ATOM 0 HG22 ILE A 75 4.839 -2.058 6.245 1.00 0.00 H new ATOM 0 HG23 ILE A 75 6.233 -2.950 5.591 1.00 0.00 H new ATOM 0 HD11 ILE A 75 8.566 -2.282 2.876 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.695 -3.068 4.214 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.907 -2.878 2.630 1.00 0.00 H new ATOM 3385 N PHE A 76 2.830 -3.113 4.487 1.00 0.00 N ATOM 3386 CA PHE A 76 1.478 -3.235 5.037 1.00 0.00 C ATOM 3387 C PHE A 76 1.479 -3.071 6.554 1.00 0.00 C ATOM 3388 O PHE A 76 2.520 -3.184 7.196 1.00 0.00 O ATOM 3389 CB PHE A 76 0.889 -4.597 4.674 1.00 0.00 C ATOM 3390 CG PHE A 76 0.561 -4.620 3.204 1.00 0.00 C ATOM 3391 CD1 PHE A 76 1.544 -4.966 2.270 1.00 0.00 C ATOM 3392 CD2 PHE A 76 -0.728 -4.293 2.777 1.00 0.00 C ATOM 3393 CE1 PHE A 76 1.233 -4.981 0.907 1.00 0.00 C ATOM 3394 CE2 PHE A 76 -1.041 -4.310 1.413 1.00 0.00 C ATOM 3395 CZ PHE A 76 -0.059 -4.654 0.478 1.00 0.00 C ATOM 0 H PHE A 76 3.348 -3.991 4.448 1.00 0.00 H new ATOM 0 HA PHE A 76 0.868 -2.441 4.605 1.00 0.00 H new ATOM 0 HB2 PHE A 76 1.599 -5.389 4.913 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.009 -4.786 5.262 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.540 -5.221 2.601 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.484 -4.027 3.500 1.00 0.00 H new ATOM 0 HE1 PHE A 76 1.991 -5.245 0.184 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.038 -4.058 1.083 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.298 -4.667 -0.575 1.00 0.00 H new ATOM 3405 N PRO A 77 0.339 -2.808 7.143 1.00 0.00 N ATOM 3406 CA PRO A 77 0.233 -2.640 8.621 1.00 0.00 C ATOM 3407 C PRO A 77 0.757 -3.864 9.359 1.00 0.00 C ATOM 3408 O PRO A 77 0.479 -5.000 8.974 1.00 0.00 O ATOM 3409 CB PRO A 77 -1.267 -2.462 8.864 1.00 0.00 C ATOM 3410 CG PRO A 77 -1.794 -1.943 7.574 1.00 0.00 C ATOM 3411 CD PRO A 77 -0.969 -2.633 6.489 1.00 0.00 C ATOM 0 HA PRO A 77 0.826 -1.801 8.985 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -1.740 -3.406 9.135 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.457 -1.765 9.680 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.855 -2.169 7.464 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -1.691 -0.859 7.516 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -1.405 -3.587 6.193 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.894 -2.024 5.588 1.00 0.00 H new ATOM 3419 N ASP A 78 1.519 -3.619 10.415 1.00 0.00 N ATOM 3420 CA ASP A 78 2.095 -4.695 11.214 1.00 0.00 C ATOM 3421 C ASP A 78 3.028 -5.583 10.378 1.00 0.00 C ATOM 3422 O ASP A 78 3.484 -6.621 10.854 1.00 0.00 O ATOM 3423 CB ASP A 78 0.973 -5.551 11.810 1.00 0.00 C ATOM 3424 CG ASP A 78 0.027 -4.674 12.626 1.00 0.00 C ATOM 3425 OD1 ASP A 78 0.514 -3.910 13.442 1.00 0.00 O ATOM 3426 OD2 ASP A 78 -1.170 -4.781 12.422 1.00 0.00 O1- ATOM 0 H ASP A 78 1.754 -2.681 10.741 1.00 0.00 H new ATOM 0 HA ASP A 78 2.684 -4.242 12.011 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.423 -6.051 11.013 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.396 -6.331 12.443 1.00 0.00 H new ATOM 3431 N ASP A 79 3.320 -5.173 9.140 1.00 0.00 N ATOM 3432 CA ASP A 79 4.207 -5.947 8.278 1.00 0.00 C ATOM 3433 C ASP A 79 5.647 -5.829 8.741 1.00 0.00 C ATOM 3434 O ASP A 79 6.416 -6.786 8.656 1.00 0.00 O ATOM 3435 CB ASP A 79 4.087 -5.481 6.828 1.00 0.00 C ATOM 3436 CG ASP A 79 4.807 -6.452 5.898 1.00 0.00 C ATOM 3437 OD1 ASP A 79 5.507 -7.316 6.401 1.00 0.00 O ATOM 3438 OD2 ASP A 79 4.647 -6.319 4.698 1.00 0.00 O1- ATOM 0 H ASP A 79 2.957 -4.318 8.719 1.00 0.00 H new ATOM 0 HA ASP A 79 3.906 -6.993 8.339 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.036 -5.410 6.548 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.513 -4.483 6.723 1.00 0.00 H new ATOM 3443 N CYS A 80 6.007 -4.646 9.219 1.00 0.00 N ATOM 3444 CA CYS A 80 7.362 -4.415 9.685 1.00 0.00 C ATOM 3445 C CYS A 80 7.355 -3.489 10.885 1.00 0.00 C ATOM 3446 O CYS A 80 6.354 -2.841 11.190 1.00 0.00 O ATOM 3447 CB CYS A 80 8.204 -3.785 8.583 1.00 0.00 C ATOM 3448 SG CYS A 80 7.647 -2.092 8.362 1.00 0.00 S ATOM 0 H CYS A 80 5.385 -3.841 9.293 1.00 0.00 H new ATOM 0 HA CYS A 80 7.790 -5.377 9.966 1.00 0.00 H new ATOM 0 HB2 CYS A 80 9.261 -3.807 8.850 1.00 0.00 H new ATOM 0 HB3 CYS A 80 8.098 -4.346 7.654 1.00 0.00 H new ATOM 0 HG CYS A 80 8.349 -1.523 7.427 1.00 0.00 H new ATOM 3454 N GLU A 81 8.483 -3.452 11.563 1.00 0.00 N ATOM 3455 CA GLU A 81 8.637 -2.633 12.746 1.00 0.00 C ATOM 3456 C GLU A 81 9.846 -1.711 12.628 1.00 0.00 C ATOM 3457 O GLU A 81 10.953 -2.154 12.348 1.00 0.00 O ATOM 3458 CB GLU A 81 8.783 -3.562 13.950 1.00 0.00 C ATOM 3459 CG GLU A 81 9.533 -2.874 15.077 1.00 0.00 C ATOM 3460 CD GLU A 81 8.823 -1.582 15.457 1.00 0.00 C ATOM 3461 OE1 GLU A 81 7.654 -1.453 15.127 1.00 0.00 O ATOM 3462 OE2 GLU A 81 9.455 -0.736 16.068 1.00 0.00 O1- ATOM 0 H GLU A 81 9.315 -3.986 11.311 1.00 0.00 H new ATOM 0 HA GLU A 81 7.761 -1.995 12.866 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.797 -3.870 14.299 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.313 -4.467 13.654 1.00 0.00 H new ATOM 0 HG2 GLU A 81 9.593 -3.534 15.942 1.00 0.00 H new ATOM 0 HG3 GLU A 81 10.556 -2.660 14.768 1.00 0.00 H new ATOM 3469 N PHE A 82 9.630 -0.428 12.863 1.00 0.00 N ATOM 3470 CA PHE A 82 10.720 0.539 12.801 1.00 0.00 C ATOM 3471 C PHE A 82 11.144 0.895 14.221 1.00 0.00 C ATOM 3472 O PHE A 82 10.333 1.371 15.015 1.00 0.00 O ATOM 3473 CB PHE A 82 10.262 1.797 12.042 1.00 0.00 C ATOM 3474 CG PHE A 82 11.451 2.682 11.744 1.00 0.00 C ATOM 3475 CD1 PHE A 82 12.441 2.224 10.870 1.00 0.00 C ATOM 3476 CD2 PHE A 82 11.564 3.957 12.330 1.00 0.00 C ATOM 3477 CE1 PHE A 82 13.544 3.026 10.578 1.00 0.00 C ATOM 3478 CE2 PHE A 82 12.672 4.758 12.036 1.00 0.00 C ATOM 3479 CZ PHE A 82 13.663 4.294 11.162 1.00 0.00 C ATOM 0 H PHE A 82 8.720 -0.031 13.097 1.00 0.00 H new ATOM 0 HA PHE A 82 11.569 0.110 12.269 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.768 1.512 11.113 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.531 2.344 12.636 1.00 0.00 H new ATOM 0 HD1 PHE A 82 12.352 1.246 10.420 1.00 0.00 H new ATOM 0 HD2 PHE A 82 10.799 4.315 13.003 1.00 0.00 H new ATOM 0 HE1 PHE A 82 14.307 2.670 9.901 1.00 0.00 H new ATOM 0 HE2 PHE A 82 12.764 5.736 12.484 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.519 4.914 10.938 1.00 0.00 H new ATOM 3489 N LYS A 83 12.405 0.630 14.551 1.00 0.00 N ATOM 3490 CA LYS A 83 12.886 0.899 15.905 1.00 0.00 C ATOM 3491 C LYS A 83 14.359 1.284 15.918 1.00 0.00 C ATOM 3492 O LYS A 83 15.065 1.100 14.940 1.00 0.00 O ATOM 3493 CB LYS A 83 12.691 -0.346 16.767 1.00 0.00 C ATOM 3494 CG LYS A 83 13.585 -1.482 16.266 1.00 0.00 C ATOM 3495 CD LYS A 83 13.364 -2.717 17.144 1.00 0.00 C ATOM 3496 CE LYS A 83 14.251 -3.863 16.656 1.00 0.00 C ATOM 3497 NZ LYS A 83 14.037 -5.058 17.521 1.00 0.00 N1+ ATOM 0 H LYS A 83 13.100 0.238 13.916 1.00 0.00 H new ATOM 0 HA LYS A 83 12.313 1.737 16.301 1.00 0.00 H new ATOM 0 HB2 LYS A 83 12.928 -0.118 17.806 1.00 0.00 H new ATOM 0 HB3 LYS A 83 11.646 -0.656 16.739 1.00 0.00 H new ATOM 0 HG2 LYS A 83 13.353 -1.713 15.226 1.00 0.00 H new ATOM 0 HG3 LYS A 83 14.632 -1.179 16.299 1.00 0.00 H new ATOM 0 HD2 LYS A 83 13.596 -2.482 18.183 1.00 0.00 H new ATOM 0 HD3 LYS A 83 12.316 -3.016 17.111 1.00 0.00 H new ATOM 0 HE2 LYS A 83 14.015 -4.104 15.619 1.00 0.00 H new ATOM 0 HE3 LYS A 83 15.299 -3.564 16.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 14.652 -5.833 17.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 14.266 -4.819 18.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 13.043 -5.357 17.460 1.00 0.00 H new ATOM 3511 N ARG A 84 14.818 1.808 17.049 1.00 0.00 N ATOM 3512 CA ARG A 84 16.215 2.189 17.185 1.00 0.00 C ATOM 3513 C ARG A 84 17.068 0.959 17.478 1.00 0.00 C ATOM 3514 O ARG A 84 16.559 -0.069 17.925 1.00 0.00 O ATOM 3515 CB ARG A 84 16.378 3.223 18.298 1.00 0.00 C ATOM 3516 CG ARG A 84 16.055 2.585 19.649 1.00 0.00 C ATOM 3517 CD ARG A 84 16.164 3.647 20.742 1.00 0.00 C ATOM 3518 NE ARG A 84 15.865 3.066 22.047 1.00 0.00 N ATOM 3519 CZ ARG A 84 15.855 3.806 23.155 1.00 0.00 C ATOM 3520 NH1 ARG A 84 16.114 5.089 23.108 1.00 0.00 N1+ ATOM 3521 NH2 ARG A 84 15.583 3.246 24.302 1.00 0.00 N ATOM 0 H ARG A 84 14.247 1.977 17.877 1.00 0.00 H new ATOM 0 HA ARG A 84 16.549 2.633 16.247 1.00 0.00 H new ATOM 0 HB2 ARG A 84 17.397 3.609 18.302 1.00 0.00 H new ATOM 0 HB3 ARG A 84 15.717 4.071 18.119 1.00 0.00 H new ATOM 0 HG2 ARG A 84 15.051 2.162 19.635 1.00 0.00 H new ATOM 0 HG3 ARG A 84 16.744 1.765 19.852 1.00 0.00 H new ATOM 0 HD2 ARG A 84 17.168 4.071 20.747 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.474 4.464 20.534 1.00 0.00 H new ATOM 0 HE ARG A 84 15.659 2.069 22.112 1.00 0.00 H new ATOM 0 HH11 ARG A 84 16.327 5.534 22.215 1.00 0.00 H new ATOM 0 HH12 ARG A 84 16.103 5.643 23.964 1.00 0.00 H new ATOM 0 HH21 ARG A 84 15.380 2.247 24.347 1.00 0.00 H new ATOM 0 HH22 ARG A 84 15.574 3.807 25.154 1.00 0.00 H new ATOM 3535 N VAL A 85 18.365 1.070 17.221 1.00 0.00 N ATOM 3536 CA VAL A 85 19.280 -0.042 17.457 1.00 0.00 C ATOM 3537 C VAL A 85 20.229 0.301 18.607 1.00 0.00 C ATOM 3538 O VAL A 85 21.301 0.863 18.378 1.00 0.00 O ATOM 3539 CB VAL A 85 20.117 -0.302 16.203 1.00 0.00 C ATOM 3540 CG1 VAL A 85 20.930 -1.586 16.383 1.00 0.00 C ATOM 3541 CG2 VAL A 85 19.197 -0.443 14.989 1.00 0.00 C ATOM 0 H VAL A 85 18.806 1.912 16.852 1.00 0.00 H new ATOM 0 HA VAL A 85 18.694 -0.927 17.706 1.00 0.00 H new ATOM 0 HB VAL A 85 20.796 0.536 16.045 1.00 0.00 H new ATOM 0 HG11 VAL A 85 21.525 -1.768 15.488 1.00 0.00 H new ATOM 0 HG12 VAL A 85 21.591 -1.480 17.243 1.00 0.00 H new ATOM 0 HG13 VAL A 85 20.254 -2.425 16.546 1.00 0.00 H new ATOM 0 HG21 VAL A 85 19.797 -0.628 14.098 1.00 0.00 H new ATOM 0 HG22 VAL A 85 18.513 -1.277 15.146 1.00 0.00 H new ATOM 0 HG23 VAL A 85 18.625 0.476 14.857 1.00 0.00 H new ATOM 3551 N PRO A 86 19.868 -0.014 19.828 1.00 0.00 N ATOM 3552 CA PRO A 86 20.728 0.286 21.006 1.00 0.00 C ATOM 3553 C PRO A 86 21.873 -0.711 21.160 1.00 0.00 C ATOM 3554 O PRO A 86 21.986 -1.395 22.178 1.00 0.00 O ATOM 3555 CB PRO A 86 19.753 0.196 22.180 1.00 0.00 C ATOM 3556 CG PRO A 86 18.719 -0.793 21.749 1.00 0.00 C ATOM 3557 CD PRO A 86 18.612 -0.677 20.226 1.00 0.00 C ATOM 0 HA PRO A 86 21.221 1.255 20.924 1.00 0.00 H new ATOM 0 HB2 PRO A 86 20.258 -0.132 23.088 1.00 0.00 H new ATOM 0 HB3 PRO A 86 19.305 1.166 22.397 1.00 0.00 H new ATOM 0 HG2 PRO A 86 19.004 -1.804 22.042 1.00 0.00 H new ATOM 0 HG3 PRO A 86 17.760 -0.582 22.222 1.00 0.00 H new ATOM 0 HD2 PRO A 86 18.512 -1.656 19.757 1.00 0.00 H new ATOM 0 HD3 PRO A 86 17.741 -0.092 19.931 1.00 0.00 H new ATOM 3565 N GLN A 87 22.733 -0.773 20.148 1.00 0.00 N ATOM 3566 CA GLN A 87 23.881 -1.668 20.183 1.00 0.00 C ATOM 3567 C GLN A 87 25.175 -0.866 20.228 1.00 0.00 C ATOM 3568 O GLN A 87 26.117 -1.224 20.933 1.00 0.00 O ATOM 3569 CB GLN A 87 23.884 -2.582 18.956 1.00 0.00 C ATOM 3570 CG GLN A 87 23.701 -4.033 19.398 1.00 0.00 C ATOM 3571 CD GLN A 87 22.218 -4.337 19.578 1.00 0.00 C ATOM 3572 OE1 GLN A 87 21.405 -3.421 19.702 1.00 0.00 O ATOM 3573 NE2 GLN A 87 21.817 -5.577 19.596 1.00 0.00 N ATOM 0 H GLN A 87 22.656 -0.216 19.297 1.00 0.00 H new ATOM 0 HA GLN A 87 23.810 -2.281 21.081 1.00 0.00 H new ATOM 0 HB2 GLN A 87 23.083 -2.295 18.274 1.00 0.00 H new ATOM 0 HB3 GLN A 87 24.821 -2.473 18.411 1.00 0.00 H new ATOM 0 HG2 GLN A 87 24.132 -4.705 18.656 1.00 0.00 H new ATOM 0 HG3 GLN A 87 24.233 -4.207 20.333 1.00 0.00 H new ATOM 0 HE21 GLN A 87 22.494 -6.333 19.493 1.00 0.00 H new ATOM 0 HE22 GLN A 87 20.827 -5.791 19.713 1.00 0.00 H new ATOM 3582 N CYS A 88 25.211 0.225 19.468 1.00 0.00 N ATOM 3583 CA CYS A 88 26.397 1.073 19.424 1.00 0.00 C ATOM 3584 C CYS A 88 26.023 2.533 19.646 1.00 0.00 C ATOM 3585 O CYS A 88 25.970 3.318 18.699 1.00 0.00 O ATOM 3586 CB CYS A 88 27.094 0.931 18.071 1.00 0.00 C ATOM 3587 SG CYS A 88 28.693 1.780 18.124 1.00 0.00 S ATOM 0 H CYS A 88 24.440 0.540 18.879 1.00 0.00 H new ATOM 0 HA CYS A 88 27.072 0.755 20.218 1.00 0.00 H new ATOM 0 HB2 CYS A 88 27.237 -0.123 17.833 1.00 0.00 H new ATOM 0 HB3 CYS A 88 26.471 1.354 17.283 1.00 0.00 H new ATOM 0 HG CYS A 88 29.287 1.658 16.974 1.00 0.00 H new ATOM 3593 N PRO A 89 25.768 2.910 20.870 1.00 0.00 N ATOM 3594 CA PRO A 89 25.396 4.314 21.213 1.00 0.00 C ATOM 3595 C PRO A 89 26.439 5.306 20.713 1.00 0.00 C ATOM 3596 O PRO A 89 27.635 5.131 20.955 1.00 0.00 O ATOM 3597 CB PRO A 89 25.342 4.306 22.744 1.00 0.00 C ATOM 3598 CG PRO A 89 25.073 2.885 23.111 1.00 0.00 C ATOM 3599 CD PRO A 89 25.797 2.047 22.062 1.00 0.00 C ATOM 0 HA PRO A 89 24.458 4.622 20.752 1.00 0.00 H new ATOM 0 HB2 PRO A 89 26.281 4.654 23.174 1.00 0.00 H new ATOM 0 HB3 PRO A 89 24.557 4.965 23.115 1.00 0.00 H new ATOM 0 HG2 PRO A 89 25.441 2.662 24.113 1.00 0.00 H new ATOM 0 HG3 PRO A 89 24.003 2.676 23.110 1.00 0.00 H new ATOM 0 HD2 PRO A 89 26.817 1.813 22.366 1.00 0.00 H new ATOM 0 HD3 PRO A 89 25.292 1.098 21.885 1.00 0.00 H new ATOM 3607 N SER A 90 25.968 6.345 20.024 1.00 0.00 N ATOM 3608 CA SER A 90 26.846 7.379 19.481 1.00 0.00 C ATOM 3609 C SER A 90 26.073 8.266 18.516 1.00 0.00 C ATOM 3610 O SER A 90 26.207 9.490 18.536 1.00 0.00 O ATOM 3611 CB SER A 90 28.025 6.751 18.736 1.00 0.00 C ATOM 3612 OG SER A 90 29.153 6.696 19.599 1.00 0.00 O ATOM 0 H SER A 90 24.978 6.492 19.828 1.00 0.00 H new ATOM 0 HA SER A 90 27.222 7.974 20.314 1.00 0.00 H new ATOM 0 HB2 SER A 90 27.763 5.749 18.397 1.00 0.00 H new ATOM 0 HB3 SER A 90 28.261 7.336 17.847 1.00 0.00 H new ATOM 0 HG SER A 90 29.024 5.985 20.261 1.00 0.00 H new ATOM 3618 N GLY A 91 25.268 7.637 17.664 1.00 0.00 N ATOM 3619 CA GLY A 91 24.483 8.380 16.683 1.00 0.00 C ATOM 3620 C GLY A 91 23.048 7.870 16.617 1.00 0.00 C ATOM 3621 O GLY A 91 22.567 7.213 17.540 1.00 0.00 O ATOM 0 H GLY A 91 25.143 6.625 17.632 1.00 0.00 H new ATOM 0 HA2 GLY A 91 24.483 9.439 16.942 1.00 0.00 H new ATOM 0 HA3 GLY A 91 24.948 8.292 15.701 1.00 0.00 H new ATOM 3625 N ARG A 92 22.368 8.180 15.516 1.00 0.00 N ATOM 3626 CA ARG A 92 20.987 7.749 15.336 1.00 0.00 C ATOM 3627 C ARG A 92 20.918 6.561 14.379 1.00 0.00 C ATOM 3628 O ARG A 92 21.086 6.714 13.170 1.00 0.00 O ATOM 3629 CB ARG A 92 20.146 8.899 14.776 1.00 0.00 C ATOM 3630 CG ARG A 92 20.420 10.178 15.572 1.00 0.00 C ATOM 3631 CD ARG A 92 21.409 11.058 14.806 1.00 0.00 C ATOM 3632 NE ARG A 92 21.515 12.370 15.439 1.00 0.00 N ATOM 3633 CZ ARG A 92 22.261 12.562 16.527 1.00 0.00 C ATOM 3634 NH1 ARG A 92 22.918 11.570 17.071 1.00 0.00 N1+ ATOM 3635 NH2 ARG A 92 22.340 13.752 17.057 1.00 0.00 N ATOM 0 H ARG A 92 22.748 8.724 14.741 1.00 0.00 H new ATOM 0 HA ARG A 92 20.593 7.449 16.307 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.384 9.057 13.724 1.00 0.00 H new ATOM 0 HB3 ARG A 92 19.087 8.647 14.829 1.00 0.00 H new ATOM 0 HG2 ARG A 92 19.489 10.720 15.739 1.00 0.00 H new ATOM 0 HG3 ARG A 92 20.824 9.928 16.553 1.00 0.00 H new ATOM 0 HD2 ARG A 92 22.388 10.579 14.780 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.081 11.171 13.773 1.00 0.00 H new ATOM 0 HE ARG A 92 21.006 13.158 15.039 1.00 0.00 H new ATOM 0 HH11 ARG A 92 22.863 10.637 16.663 1.00 0.00 H new ATOM 0 HH12 ARG A 92 23.485 11.730 17.903 1.00 0.00 H new ATOM 0 HH21 ARG A 92 21.832 14.531 16.639 1.00 0.00 H new ATOM 0 HH22 ARG A 92 22.910 13.903 17.889 1.00 0.00 H new ATOM 3649 N VAL A 93 20.666 5.379 14.931 1.00 0.00 N ATOM 3650 CA VAL A 93 20.574 4.168 14.122 1.00 0.00 C ATOM 3651 C VAL A 93 19.244 3.464 14.353 1.00 0.00 C ATOM 3652 O VAL A 93 18.855 3.206 15.492 1.00 0.00 O ATOM 3653 CB VAL A 93 21.725 3.224 14.469 1.00 0.00 C ATOM 3654 CG1 VAL A 93 21.598 1.941 13.646 1.00 0.00 C ATOM 3655 CG2 VAL A 93 23.055 3.905 14.147 1.00 0.00 C ATOM 0 H VAL A 93 20.522 5.233 15.930 1.00 0.00 H new ATOM 0 HA VAL A 93 20.639 4.450 13.071 1.00 0.00 H new ATOM 0 HB VAL A 93 21.688 2.980 15.531 1.00 0.00 H new ATOM 0 HG11 VAL A 93 22.419 1.267 13.893 1.00 0.00 H new ATOM 0 HG12 VAL A 93 20.649 1.455 13.873 1.00 0.00 H new ATOM 0 HG13 VAL A 93 21.636 2.185 12.584 1.00 0.00 H new ATOM 0 HG21 VAL A 93 23.877 3.233 14.394 1.00 0.00 H new ATOM 0 HG22 VAL A 93 23.092 4.148 13.085 1.00 0.00 H new ATOM 0 HG23 VAL A 93 23.146 4.820 14.732 1.00 0.00 H new ATOM 3665 N TYR A 94 18.555 3.160 13.261 1.00 0.00 N ATOM 3666 CA TYR A 94 17.269 2.483 13.328 1.00 0.00 C ATOM 3667 C TYR A 94 17.271 1.246 12.442 1.00 0.00 C ATOM 3668 O TYR A 94 17.998 1.178 11.455 1.00 0.00 O ATOM 3669 CB TYR A 94 16.150 3.430 12.894 1.00 0.00 C ATOM 3670 CG TYR A 94 16.076 4.596 13.849 1.00 0.00 C ATOM 3671 CD1 TYR A 94 16.821 5.752 13.599 1.00 0.00 C ATOM 3672 CD2 TYR A 94 15.258 4.521 14.983 1.00 0.00 C ATOM 3673 CE1 TYR A 94 16.750 6.834 14.484 1.00 0.00 C ATOM 3674 CE2 TYR A 94 15.188 5.604 15.867 1.00 0.00 C ATOM 3675 CZ TYR A 94 15.933 6.761 15.617 1.00 0.00 C ATOM 3676 OH TYR A 94 15.863 7.829 16.489 1.00 0.00 O ATOM 0 H TYR A 94 18.868 3.373 12.314 1.00 0.00 H new ATOM 0 HA TYR A 94 17.096 2.176 14.359 1.00 0.00 H new ATOM 0 HB2 TYR A 94 16.335 3.788 11.881 1.00 0.00 H new ATOM 0 HB3 TYR A 94 15.198 2.900 12.876 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.451 5.810 12.724 1.00 0.00 H new ATOM 0 HD2 TYR A 94 14.682 3.628 15.175 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.327 7.727 14.292 1.00 0.00 H new ATOM 0 HE2 TYR A 94 14.558 5.546 16.743 1.00 0.00 H new ATOM 0 HH TYR A 94 15.249 7.613 17.222 1.00 0.00 H new ATOM 3686 N VAL A 95 16.456 0.265 12.808 1.00 0.00 N ATOM 3687 CA VAL A 95 16.377 -0.964 12.048 1.00 0.00 C ATOM 3688 C VAL A 95 14.931 -1.276 11.695 1.00 0.00 C ATOM 3689 O VAL A 95 14.031 -1.118 12.522 1.00 0.00 O ATOM 3690 CB VAL A 95 16.959 -2.116 12.873 1.00 0.00 C ATOM 3691 CG1 VAL A 95 16.109 -2.321 14.132 1.00 0.00 C ATOM 3692 CG2 VAL A 95 16.957 -3.405 12.045 1.00 0.00 C ATOM 0 H VAL A 95 15.845 0.301 13.624 1.00 0.00 H new ATOM 0 HA VAL A 95 16.948 -0.845 11.128 1.00 0.00 H new ATOM 0 HB VAL A 95 17.983 -1.872 13.155 1.00 0.00 H new ATOM 0 HG11 VAL A 95 16.522 -3.141 14.720 1.00 0.00 H new ATOM 0 HG12 VAL A 95 16.115 -1.408 14.727 1.00 0.00 H new ATOM 0 HG13 VAL A 95 15.085 -2.560 13.845 1.00 0.00 H new ATOM 0 HG21 VAL A 95 17.372 -4.219 12.639 1.00 0.00 H new ATOM 0 HG22 VAL A 95 15.935 -3.651 11.757 1.00 0.00 H new ATOM 0 HG23 VAL A 95 17.562 -3.263 11.150 1.00 0.00 H new ATOM 3702 N LEU A 96 14.715 -1.728 10.471 1.00 0.00 N ATOM 3703 CA LEU A 96 13.379 -2.076 10.031 1.00 0.00 C ATOM 3704 C LEU A 96 13.237 -3.585 10.099 1.00 0.00 C ATOM 3705 O LEU A 96 13.942 -4.309 9.406 1.00 0.00 O ATOM 3706 CB LEU A 96 13.168 -1.584 8.597 1.00 0.00 C ATOM 3707 CG LEU A 96 11.759 -1.930 8.110 1.00 0.00 C ATOM 3708 CD1 LEU A 96 10.717 -1.206 8.973 1.00 0.00 C ATOM 3709 CD2 LEU A 96 11.618 -1.480 6.653 1.00 0.00 C ATOM 0 H LEU A 96 15.444 -1.861 9.770 1.00 0.00 H new ATOM 0 HA LEU A 96 12.630 -1.606 10.669 1.00 0.00 H new ATOM 0 HB2 LEU A 96 13.320 -0.506 8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 96 13.908 -2.039 7.938 1.00 0.00 H new ATOM 0 HG LEU A 96 11.597 -3.005 8.187 1.00 0.00 H new ATOM 0 HD11 LEU A 96 9.716 -1.456 8.621 1.00 0.00 H new ATOM 0 HD12 LEU A 96 10.825 -1.518 10.012 1.00 0.00 H new ATOM 0 HD13 LEU A 96 10.869 -0.129 8.900 1.00 0.00 H new ATOM 0 HD21 LEU A 96 10.618 -1.721 6.293 1.00 0.00 H new ATOM 0 HD22 LEU A 96 11.778 -0.404 6.587 1.00 0.00 H new ATOM 0 HD23 LEU A 96 12.358 -1.995 6.040 1.00 0.00 H new ATOM 3721 N LYS A 97 12.339 -4.049 10.950 1.00 0.00 N ATOM 3722 CA LYS A 97 12.133 -5.479 11.121 1.00 0.00 C ATOM 3723 C LYS A 97 10.869 -5.926 10.433 1.00 0.00 C ATOM 3724 O LYS A 97 9.780 -5.668 10.918 1.00 0.00 O ATOM 3725 CB LYS A 97 12.006 -5.809 12.601 1.00 0.00 C ATOM 3726 CG LYS A 97 13.372 -6.138 13.164 1.00 0.00 C ATOM 3727 CD LYS A 97 13.241 -6.415 14.659 1.00 0.00 C ATOM 3728 CE LYS A 97 12.665 -7.817 14.876 1.00 0.00 C ATOM 3729 NZ LYS A 97 13.625 -8.833 14.359 1.00 0.00 N1+ ATOM 0 H LYS A 97 11.742 -3.461 11.532 1.00 0.00 H new ATOM 0 HA LYS A 97 12.989 -5.994 10.684 1.00 0.00 H new ATOM 0 HB2 LYS A 97 11.574 -4.964 13.137 1.00 0.00 H new ATOM 0 HB3 LYS A 97 11.331 -6.653 12.740 1.00 0.00 H new ATOM 0 HG2 LYS A 97 13.789 -7.007 12.655 1.00 0.00 H new ATOM 0 HG3 LYS A 97 14.059 -5.309 12.994 1.00 0.00 H new ATOM 0 HD2 LYS A 97 14.215 -6.333 15.140 1.00 0.00 H new ATOM 0 HD3 LYS A 97 12.594 -5.670 15.121 1.00 0.00 H new ATOM 0 HE2 LYS A 97 12.477 -7.985 15.937 1.00 0.00 H new ATOM 0 HE3 LYS A 97 11.707 -7.912 14.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 13.668 -9.637 15.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 13.309 -9.166 13.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 14.569 -8.406 14.272 1.00 0.00 H new ATOM 3743 N PHE A 98 11.014 -6.631 9.334 1.00 0.00 N ATOM 3744 CA PHE A 98 9.857 -7.130 8.630 1.00 0.00 C ATOM 3745 C PHE A 98 9.312 -8.310 9.394 1.00 0.00 C ATOM 3746 O PHE A 98 9.894 -9.394 9.394 1.00 0.00 O ATOM 3747 CB PHE A 98 10.247 -7.546 7.222 1.00 0.00 C ATOM 3748 CG PHE A 98 10.505 -6.316 6.397 1.00 0.00 C ATOM 3749 CD1 PHE A 98 11.723 -5.643 6.515 1.00 0.00 C ATOM 3750 CD2 PHE A 98 9.526 -5.853 5.512 1.00 0.00 C ATOM 3751 CE1 PHE A 98 11.966 -4.503 5.748 1.00 0.00 C ATOM 3752 CE2 PHE A 98 9.766 -4.712 4.743 1.00 0.00 C ATOM 3753 CZ PHE A 98 10.988 -4.034 4.860 1.00 0.00 C ATOM 0 H PHE A 98 11.912 -6.869 8.913 1.00 0.00 H new ATOM 0 HA PHE A 98 9.096 -6.353 8.556 1.00 0.00 H new ATOM 0 HB2 PHE A 98 11.138 -8.174 7.249 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.452 -8.140 6.772 1.00 0.00 H new ATOM 0 HD1 PHE A 98 12.476 -6.005 7.199 1.00 0.00 H new ATOM 0 HD2 PHE A 98 8.586 -6.377 5.423 1.00 0.00 H new ATOM 0 HE1 PHE A 98 12.908 -3.982 5.838 1.00 0.00 H new ATOM 0 HE2 PHE A 98 9.011 -4.352 4.059 1.00 0.00 H new ATOM 0 HZ PHE A 98 11.175 -3.151 4.267 1.00 0.00 H new ATOM 3763 N LYS A 99 8.198 -8.086 10.062 1.00 0.00 N ATOM 3764 CA LYS A 99 7.597 -9.135 10.851 1.00 0.00 C ATOM 3765 C LYS A 99 7.222 -10.312 9.971 1.00 0.00 C ATOM 3766 O LYS A 99 7.343 -11.467 10.377 1.00 0.00 O ATOM 3767 CB LYS A 99 6.348 -8.618 11.565 1.00 0.00 C ATOM 3768 CG LYS A 99 6.756 -7.648 12.670 1.00 0.00 C ATOM 3769 CD LYS A 99 5.506 -7.138 13.386 1.00 0.00 C ATOM 3770 CE LYS A 99 5.904 -6.170 14.499 1.00 0.00 C ATOM 3771 NZ LYS A 99 4.678 -5.670 15.184 1.00 0.00 N1+ ATOM 0 H LYS A 99 7.698 -7.197 10.073 1.00 0.00 H new ATOM 0 HA LYS A 99 8.326 -9.460 11.593 1.00 0.00 H new ATOM 0 HB2 LYS A 99 5.690 -8.119 10.853 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.787 -9.451 11.987 1.00 0.00 H new ATOM 0 HG2 LYS A 99 7.417 -8.145 13.380 1.00 0.00 H new ATOM 0 HG3 LYS A 99 7.313 -6.812 12.247 1.00 0.00 H new ATOM 0 HD2 LYS A 99 4.848 -6.638 12.676 1.00 0.00 H new ATOM 0 HD3 LYS A 99 4.948 -7.976 13.803 1.00 0.00 H new ATOM 0 HE2 LYS A 99 6.555 -6.671 15.215 1.00 0.00 H new ATOM 0 HE3 LYS A 99 6.468 -5.335 14.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.948 -5.011 15.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 4.073 -5.178 14.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 4.157 -6.472 15.592 1.00 0.00 H new ATOM 3785 N ALA A 100 6.750 -10.014 8.767 1.00 0.00 N ATOM 3786 CA ALA A 100 6.348 -11.081 7.854 1.00 0.00 C ATOM 3787 C ALA A 100 7.383 -11.304 6.754 1.00 0.00 C ATOM 3788 O ALA A 100 7.443 -12.379 6.157 1.00 0.00 O ATOM 3789 CB ALA A 100 4.992 -10.763 7.220 1.00 0.00 C ATOM 0 H ALA A 100 6.637 -9.067 8.404 1.00 0.00 H new ATOM 0 HA ALA A 100 6.271 -11.995 8.442 1.00 0.00 H new ATOM 0 HB1 ALA A 100 4.709 -11.569 6.543 1.00 0.00 H new ATOM 0 HB2 ALA A 100 4.239 -10.665 8.002 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.061 -9.829 6.663 1.00 0.00 H new ATOM 3795 N GLY A 101 8.191 -10.286 6.488 1.00 0.00 N ATOM 3796 CA GLY A 101 9.215 -10.391 5.449 1.00 0.00 C ATOM 3797 C GLY A 101 10.432 -11.175 5.935 1.00 0.00 C ATOM 3798 O GLY A 101 11.269 -11.589 5.134 1.00 0.00 O ATOM 0 H GLY A 101 8.161 -9.387 6.969 1.00 0.00 H new ATOM 0 HA2 GLY A 101 8.794 -10.880 4.571 1.00 0.00 H new ATOM 0 HA3 GLY A 101 9.524 -9.392 5.140 1.00 0.00 H new ATOM 3802 N SER A 102 10.529 -11.375 7.247 1.00 0.00 N ATOM 3803 CA SER A 102 11.654 -12.107 7.818 1.00 0.00 C ATOM 3804 C SER A 102 12.981 -11.465 7.411 1.00 0.00 C ATOM 3805 O SER A 102 14.030 -12.107 7.449 1.00 0.00 O ATOM 3806 CB SER A 102 11.624 -13.560 7.341 1.00 0.00 C ATOM 3807 OG SER A 102 10.399 -14.160 7.740 1.00 0.00 O ATOM 0 H SER A 102 9.847 -11.043 7.929 1.00 0.00 H new ATOM 0 HA SER A 102 11.568 -12.075 8.904 1.00 0.00 H new ATOM 0 HB2 SER A 102 11.726 -13.601 6.257 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.466 -14.110 7.761 1.00 0.00 H new ATOM 0 HG SER A 102 10.376 -15.091 7.434 1.00 0.00 H new ATOM 3813 N LYS A 103 12.924 -10.193 7.027 1.00 0.00 N ATOM 3814 CA LYS A 103 14.118 -9.462 6.621 1.00 0.00 C ATOM 3815 C LYS A 103 14.340 -8.261 7.533 1.00 0.00 C ATOM 3816 O LYS A 103 13.393 -7.724 8.107 1.00 0.00 O ATOM 3817 CB LYS A 103 13.974 -8.977 5.177 1.00 0.00 C ATOM 3818 CG LYS A 103 15.363 -8.742 4.583 1.00 0.00 C ATOM 3819 CD LYS A 103 15.486 -7.282 4.150 1.00 0.00 C ATOM 3820 CE LYS A 103 14.885 -7.109 2.755 1.00 0.00 C ATOM 3821 NZ LYS A 103 15.911 -7.447 1.728 1.00 0.00 N1+ ATOM 0 H LYS A 103 12.063 -9.648 6.989 1.00 0.00 H new ATOM 0 HA LYS A 103 14.973 -10.134 6.696 1.00 0.00 H new ATOM 0 HB2 LYS A 103 13.433 -9.715 4.585 1.00 0.00 H new ATOM 0 HB3 LYS A 103 13.392 -8.056 5.147 1.00 0.00 H new ATOM 0 HG2 LYS A 103 16.131 -8.981 5.319 1.00 0.00 H new ATOM 0 HG3 LYS A 103 15.523 -9.401 3.730 1.00 0.00 H new ATOM 0 HD2 LYS A 103 14.971 -6.636 4.862 1.00 0.00 H new ATOM 0 HD3 LYS A 103 16.533 -6.980 4.146 1.00 0.00 H new ATOM 0 HE2 LYS A 103 14.014 -7.754 2.640 1.00 0.00 H new ATOM 0 HE3 LYS A 103 14.543 -6.083 2.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 15.503 -7.330 0.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 16.730 -6.814 1.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 16.217 -8.433 1.854 1.00 0.00 H new ATOM 3835 N ARG A 104 15.596 -7.842 7.665 1.00 0.00 N ATOM 3836 CA ARG A 104 15.915 -6.700 8.512 1.00 0.00 C ATOM 3837 C ARG A 104 16.810 -5.711 7.769 1.00 0.00 C ATOM 3838 O ARG A 104 17.762 -6.106 7.098 1.00 0.00 O ATOM 3839 CB ARG A 104 16.609 -7.173 9.788 1.00 0.00 C ATOM 3840 CG ARG A 104 15.663 -8.090 10.566 1.00 0.00 C ATOM 3841 CD ARG A 104 16.364 -8.588 11.827 1.00 0.00 C ATOM 3842 NE ARG A 104 15.563 -9.615 12.487 1.00 0.00 N ATOM 3843 CZ ARG A 104 16.047 -10.332 13.506 1.00 0.00 C ATOM 3844 NH1 ARG A 104 17.265 -10.138 13.942 1.00 0.00 N1+ ATOM 3845 NH2 ARG A 104 15.297 -11.238 14.072 1.00 0.00 N ATOM 0 H ARG A 104 16.398 -8.270 7.203 1.00 0.00 H new ATOM 0 HA ARG A 104 14.985 -6.196 8.775 1.00 0.00 H new ATOM 0 HB2 ARG A 104 17.528 -7.705 9.541 1.00 0.00 H new ATOM 0 HB3 ARG A 104 16.891 -6.317 10.401 1.00 0.00 H new ATOM 0 HG2 ARG A 104 14.753 -7.552 10.831 1.00 0.00 H new ATOM 0 HG3 ARG A 104 15.365 -8.934 9.945 1.00 0.00 H new ATOM 0 HD2 ARG A 104 17.343 -8.992 11.570 1.00 0.00 H new ATOM 0 HD3 ARG A 104 16.532 -7.755 12.510 1.00 0.00 H new ATOM 0 HE ARG A 104 14.612 -9.789 12.163 1.00 0.00 H new ATOM 0 HH11 ARG A 104 17.857 -9.433 13.504 1.00 0.00 H new ATOM 0 HH12 ARG A 104 17.622 -10.692 14.720 1.00 0.00 H new ATOM 0 HH21 ARG A 104 14.347 -11.396 13.736 1.00 0.00 H new ATOM 0 HH22 ARG A 104 15.661 -11.788 14.850 1.00 0.00 H new ATOM 3859 N LEU A 105 16.497 -4.423 7.898 1.00 0.00 N ATOM 3860 CA LEU A 105 17.280 -3.382 7.238 1.00 0.00 C ATOM 3861 C LEU A 105 17.863 -2.430 8.271 1.00 0.00 C ATOM 3862 O LEU A 105 17.248 -2.179 9.302 1.00 0.00 O ATOM 3863 CB LEU A 105 16.397 -2.593 6.269 1.00 0.00 C ATOM 3864 CG LEU A 105 15.689 -3.557 5.321 1.00 0.00 C ATOM 3865 CD1 LEU A 105 14.803 -2.767 4.357 1.00 0.00 C ATOM 3866 CD2 LEU A 105 16.724 -4.355 4.525 1.00 0.00 C ATOM 0 H LEU A 105 15.712 -4.077 8.450 1.00 0.00 H new ATOM 0 HA LEU A 105 18.090 -3.858 6.685 1.00 0.00 H new ATOM 0 HB2 LEU A 105 15.663 -2.008 6.824 1.00 0.00 H new ATOM 0 HB3 LEU A 105 17.003 -1.888 5.701 1.00 0.00 H new ATOM 0 HG LEU A 105 15.074 -4.244 5.902 1.00 0.00 H new ATOM 0 HD11 LEU A 105 14.297 -3.456 3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 105 14.061 -2.204 4.923 1.00 0.00 H new ATOM 0 HD13 LEU A 105 15.418 -2.077 3.780 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.213 -5.042 3.850 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.344 -3.671 3.946 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.353 -4.922 5.212 1.00 0.00 H new ATOM 3878 N PHE A 106 19.047 -1.897 7.987 1.00 0.00 N ATOM 3879 CA PHE A 106 19.695 -0.971 8.910 1.00 0.00 C ATOM 3880 C PHE A 106 19.815 0.419 8.292 1.00 0.00 C ATOM 3881 O PHE A 106 20.251 0.565 7.150 1.00 0.00 O ATOM 3882 CB PHE A 106 21.084 -1.493 9.265 1.00 0.00 C ATOM 3883 CG PHE A 106 20.955 -2.789 10.026 1.00 0.00 C ATOM 3884 CD1 PHE A 106 20.864 -4.000 9.329 1.00 0.00 C ATOM 3885 CD2 PHE A 106 20.929 -2.781 11.425 1.00 0.00 C ATOM 3886 CE1 PHE A 106 20.745 -5.204 10.033 1.00 0.00 C ATOM 3887 CE2 PHE A 106 20.811 -3.985 12.129 1.00 0.00 C ATOM 3888 CZ PHE A 106 20.719 -5.197 11.433 1.00 0.00 C ATOM 0 H PHE A 106 19.573 -2.087 7.134 1.00 0.00 H new ATOM 0 HA PHE A 106 19.085 -0.897 9.811 1.00 0.00 H new ATOM 0 HB2 PHE A 106 21.669 -1.648 8.358 1.00 0.00 H new ATOM 0 HB3 PHE A 106 21.618 -0.757 9.867 1.00 0.00 H new ATOM 0 HD1 PHE A 106 20.886 -4.005 8.249 1.00 0.00 H new ATOM 0 HD2 PHE A 106 21.000 -1.846 11.961 1.00 0.00 H new ATOM 0 HE1 PHE A 106 20.673 -6.138 9.496 1.00 0.00 H new ATOM 0 HE2 PHE A 106 20.791 -3.979 13.209 1.00 0.00 H new ATOM 0 HZ PHE A 106 20.628 -6.126 11.976 1.00 0.00 H new ATOM 3898 N PHE A 107 19.435 1.438 9.058 1.00 0.00 N ATOM 3899 CA PHE A 107 19.508 2.811 8.592 1.00 0.00 C ATOM 3900 C PHE A 107 20.052 3.719 9.673 1.00 0.00 C ATOM 3901 O PHE A 107 19.923 3.443 10.860 1.00 0.00 O ATOM 3902 CB PHE A 107 18.129 3.321 8.183 1.00 0.00 C ATOM 3903 CG PHE A 107 17.663 2.592 6.958 1.00 0.00 C ATOM 3904 CD1 PHE A 107 16.881 1.439 7.084 1.00 0.00 C ATOM 3905 CD2 PHE A 107 18.004 3.080 5.693 1.00 0.00 C ATOM 3906 CE1 PHE A 107 16.436 0.771 5.941 1.00 0.00 C ATOM 3907 CE2 PHE A 107 17.560 2.413 4.551 1.00 0.00 C ATOM 3908 CZ PHE A 107 16.772 1.255 4.673 1.00 0.00 C ATOM 0 H PHE A 107 19.073 1.334 10.006 1.00 0.00 H new ATOM 0 HA PHE A 107 20.175 2.824 7.730 1.00 0.00 H new ATOM 0 HB2 PHE A 107 17.420 3.173 8.997 1.00 0.00 H new ATOM 0 HB3 PHE A 107 18.170 4.392 7.987 1.00 0.00 H new ATOM 0 HD1 PHE A 107 16.622 1.066 8.064 1.00 0.00 H new ATOM 0 HD2 PHE A 107 18.609 3.970 5.600 1.00 0.00 H new ATOM 0 HE1 PHE A 107 15.832 -0.119 6.037 1.00 0.00 H new ATOM 0 HE2 PHE A 107 17.822 2.787 3.572 1.00 0.00 H new ATOM 0 HZ PHE A 107 16.427 0.740 3.789 1.00 0.00 H new ATOM 3918 N TRP A 108 20.626 4.825 9.248 1.00 0.00 N ATOM 3919 CA TRP A 108 21.146 5.807 10.185 1.00 0.00 C ATOM 3920 C TRP A 108 20.700 7.187 9.741 1.00 0.00 C ATOM 3921 O TRP A 108 20.743 7.496 8.561 1.00 0.00 O ATOM 3922 CB TRP A 108 22.669 5.720 10.254 1.00 0.00 C ATOM 3923 CG TRP A 108 23.277 5.977 8.911 1.00 0.00 C ATOM 3924 CD1 TRP A 108 23.442 5.047 7.943 1.00 0.00 C ATOM 3925 CD2 TRP A 108 23.848 7.213 8.390 1.00 0.00 C ATOM 3926 NE1 TRP A 108 24.065 5.630 6.859 1.00 0.00 N ATOM 3927 CE2 TRP A 108 24.336 6.966 7.084 1.00 0.00 C ATOM 3928 CE3 TRP A 108 23.977 8.511 8.913 1.00 0.00 C ATOM 3929 CZ2 TRP A 108 24.943 7.970 6.327 1.00 0.00 C ATOM 3930 CZ3 TRP A 108 24.585 9.527 8.156 1.00 0.00 C ATOM 3931 CH2 TRP A 108 25.067 9.257 6.864 1.00 0.00 C ATOM 0 H TRP A 108 20.746 5.069 8.265 1.00 0.00 H new ATOM 0 HA TRP A 108 20.759 5.608 11.184 1.00 0.00 H new ATOM 0 HB2 TRP A 108 23.047 6.446 10.974 1.00 0.00 H new ATOM 0 HB3 TRP A 108 22.966 4.733 10.610 1.00 0.00 H new ATOM 0 HD1 TRP A 108 23.135 4.014 8.008 1.00 0.00 H new ATOM 0 HE1 TRP A 108 24.297 5.136 5.997 1.00 0.00 H new ATOM 0 HE3 TRP A 108 23.606 8.729 9.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 25.314 7.756 5.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 24.682 10.520 8.569 1.00 0.00 H new ATOM 0 HH2 TRP A 108 25.533 10.041 6.286 1.00 0.00 H new ATOM 3942 N MET A 109 20.242 8.003 10.678 1.00 0.00 N ATOM 3943 CA MET A 109 19.753 9.329 10.324 1.00 0.00 C ATOM 3944 C MET A 109 20.891 10.332 10.215 1.00 0.00 C ATOM 3945 O MET A 109 21.788 10.372 11.060 1.00 0.00 O ATOM 3946 CB MET A 109 18.750 9.817 11.367 1.00 0.00 C ATOM 3947 CG MET A 109 17.700 8.734 11.611 1.00 0.00 C ATOM 3948 SD MET A 109 16.378 9.398 12.652 1.00 0.00 S ATOM 3949 CE MET A 109 15.493 10.270 11.344 1.00 0.00 C ATOM 0 H MET A 109 20.198 7.778 11.672 1.00 0.00 H new ATOM 0 HA MET A 109 19.267 9.251 9.352 1.00 0.00 H new ATOM 0 HB2 MET A 109 19.264 10.056 12.298 1.00 0.00 H new ATOM 0 HB3 MET A 109 18.270 10.733 11.024 1.00 0.00 H new ATOM 0 HG2 MET A 109 17.291 8.389 10.661 1.00 0.00 H new ATOM 0 HG3 MET A 109 18.158 7.871 12.093 1.00 0.00 H new ATOM 0 HE1 MET A 109 15.190 11.253 11.703 1.00 0.00 H new ATOM 0 HE2 MET A 109 16.145 10.385 10.478 1.00 0.00 H new ATOM 0 HE3 MET A 109 14.609 9.699 11.060 1.00 0.00 H new ATOM 3959 N GLN A 110 20.830 11.153 9.175 1.00 0.00 N ATOM 3960 CA GLN A 110 21.837 12.174 8.956 1.00 0.00 C ATOM 3961 C GLN A 110 21.325 13.536 9.416 1.00 0.00 C ATOM 3962 O GLN A 110 21.921 14.567 9.104 1.00 0.00 O ATOM 3963 CB GLN A 110 22.216 12.239 7.480 1.00 0.00 C ATOM 3964 CG GLN A 110 23.605 12.863 7.354 1.00 0.00 C ATOM 3965 CD GLN A 110 24.095 12.752 5.918 1.00 0.00 C ATOM 3966 OE1 GLN A 110 25.061 12.042 5.645 1.00 0.00 O ATOM 3967 NE2 GLN A 110 23.475 13.408 4.981 1.00 0.00 N ATOM 0 H GLN A 110 20.092 11.129 8.471 1.00 0.00 H new ATOM 0 HA GLN A 110 22.720 11.912 9.539 1.00 0.00 H new ATOM 0 HB2 GLN A 110 22.211 11.240 7.045 1.00 0.00 H new ATOM 0 HB3 GLN A 110 21.485 12.831 6.929 1.00 0.00 H new ATOM 0 HG2 GLN A 110 23.572 13.910 7.656 1.00 0.00 H new ATOM 0 HG3 GLN A 110 24.301 12.360 8.025 1.00 0.00 H new ATOM 0 HE21 GLN A 110 22.674 13.995 5.214 1.00 0.00 H new ATOM 0 HE22 GLN A 110 23.790 13.335 4.014 1.00 0.00 H new ATOM 3976 N GLU A 111 20.220 13.548 10.153 1.00 0.00 N ATOM 3977 CA GLU A 111 19.668 14.805 10.633 1.00 0.00 C ATOM 3978 C GLU A 111 20.589 15.406 11.707 1.00 0.00 C ATOM 3979 O GLU A 111 20.961 14.708 12.650 1.00 0.00 O ATOM 3980 CB GLU A 111 18.279 14.564 11.222 1.00 0.00 C ATOM 3981 CG GLU A 111 17.340 14.083 10.116 1.00 0.00 C ATOM 3982 CD GLU A 111 17.096 15.208 9.114 1.00 0.00 C ATOM 3983 OE1 GLU A 111 17.372 16.348 9.453 1.00 0.00 O ATOM 3984 OE2 GLU A 111 16.636 14.912 8.025 1.00 0.00 O1- ATOM 0 H GLU A 111 19.698 12.716 10.426 1.00 0.00 H new ATOM 0 HA GLU A 111 19.591 15.503 9.799 1.00 0.00 H new ATOM 0 HB2 GLU A 111 18.332 13.822 12.018 1.00 0.00 H new ATOM 0 HB3 GLU A 111 17.896 15.482 11.667 1.00 0.00 H new ATOM 0 HG2 GLU A 111 17.773 13.221 9.609 1.00 0.00 H new ATOM 0 HG3 GLU A 111 16.393 13.757 10.547 1.00 0.00 H new ATOM 3991 N PRO A 112 20.971 16.665 11.600 1.00 0.00 N ATOM 3992 CA PRO A 112 21.872 17.304 12.608 1.00 0.00 C ATOM 3993 C PRO A 112 21.316 17.201 14.021 1.00 0.00 C ATOM 3994 O PRO A 112 22.058 17.010 14.983 1.00 0.00 O ATOM 3995 CB PRO A 112 21.934 18.770 12.169 1.00 0.00 C ATOM 3996 CG PRO A 112 21.589 18.761 10.723 1.00 0.00 C ATOM 3997 CD PRO A 112 20.606 17.614 10.529 1.00 0.00 C ATOM 0 HA PRO A 112 22.847 16.818 12.642 1.00 0.00 H new ATOM 0 HB2 PRO A 112 21.232 19.381 12.737 1.00 0.00 H new ATOM 0 HB3 PRO A 112 22.927 19.188 12.334 1.00 0.00 H new ATOM 0 HG2 PRO A 112 21.144 19.710 10.423 1.00 0.00 H new ATOM 0 HG3 PRO A 112 22.480 18.618 10.111 1.00 0.00 H new ATOM 0 HD2 PRO A 112 19.573 17.950 10.624 1.00 0.00 H new ATOM 0 HD3 PRO A 112 20.705 17.163 9.542 1.00 0.00 H new ATOM 4005 N LYS A 113 20.002 17.337 14.136 1.00 0.00 N ATOM 4006 CA LYS A 113 19.350 17.270 15.438 1.00 0.00 C ATOM 4007 C LYS A 113 18.360 16.114 15.489 1.00 0.00 C ATOM 4008 O LYS A 113 17.701 15.800 14.496 1.00 0.00 O ATOM 4009 CB LYS A 113 18.614 18.581 15.714 1.00 0.00 C ATOM 4010 CG LYS A 113 19.587 19.763 15.599 1.00 0.00 C ATOM 4011 CD LYS A 113 20.696 19.656 16.650 1.00 0.00 C ATOM 4012 CE LYS A 113 21.615 20.872 16.533 1.00 0.00 C ATOM 4013 NZ LYS A 113 22.708 20.773 17.541 1.00 0.00 N1+ ATOM 0 H LYS A 113 19.370 17.493 13.351 1.00 0.00 H new ATOM 0 HA LYS A 113 20.115 17.108 16.197 1.00 0.00 H new ATOM 0 HB2 LYS A 113 17.794 18.704 15.006 1.00 0.00 H new ATOM 0 HB3 LYS A 113 18.173 18.558 16.711 1.00 0.00 H new ATOM 0 HG2 LYS A 113 20.026 19.784 14.601 1.00 0.00 H new ATOM 0 HG3 LYS A 113 19.046 20.700 15.729 1.00 0.00 H new ATOM 0 HD2 LYS A 113 20.263 19.606 17.649 1.00 0.00 H new ATOM 0 HD3 LYS A 113 21.266 18.738 16.503 1.00 0.00 H new ATOM 0 HE2 LYS A 113 22.036 20.926 15.529 1.00 0.00 H new ATOM 0 HE3 LYS A 113 21.045 21.788 16.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 23.332 21.601 17.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 22.298 20.741 18.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 23.259 19.907 17.372 1.00 0.00 H new ATOM 4027 N THR A 114 18.255 15.493 16.659 1.00 0.00 N ATOM 4028 CA THR A 114 17.334 14.380 16.841 1.00 0.00 C ATOM 4029 C THR A 114 15.973 14.869 17.320 1.00 0.00 C ATOM 4030 O THR A 114 15.057 14.065 17.539 1.00 0.00 O ATOM 4031 CB THR A 114 17.884 13.392 17.858 1.00 0.00 C ATOM 4032 OG1 THR A 114 18.074 14.048 19.104 1.00 0.00 O ATOM 4033 CG2 THR A 114 19.214 12.822 17.363 1.00 0.00 C ATOM 0 H THR A 114 18.793 15.740 17.490 1.00 0.00 H new ATOM 0 HA THR A 114 17.220 13.889 15.874 1.00 0.00 H new ATOM 0 HB THR A 114 17.174 12.575 17.986 1.00 0.00 H new ATOM 0 HG1 THR A 114 18.427 13.410 19.759 1.00 0.00 H new ATOM 0 HG21 THR A 114 19.602 12.115 18.096 1.00 0.00 H new ATOM 0 HG22 THR A 114 19.060 12.311 16.413 1.00 0.00 H new ATOM 0 HG23 THR A 114 19.929 13.633 17.227 1.00 0.00 H new ATOM 4041 N ASP A 115 15.841 16.185 17.476 1.00 0.00 N ATOM 4042 CA ASP A 115 14.588 16.765 17.926 1.00 0.00 C ATOM 4043 C ASP A 115 13.466 16.402 16.965 1.00 0.00 C ATOM 4044 O ASP A 115 12.289 16.443 17.324 1.00 0.00 O ATOM 4045 CB ASP A 115 14.729 18.287 18.004 1.00 0.00 C ATOM 4046 CG ASP A 115 15.598 18.670 19.198 1.00 0.00 C ATOM 4047 OD1 ASP A 115 15.846 17.807 20.024 1.00 0.00 O ATOM 4048 OD2 ASP A 115 15.998 19.819 19.269 1.00 0.00 O1- ATOM 0 H ASP A 115 16.583 16.861 17.298 1.00 0.00 H new ATOM 0 HA ASP A 115 14.347 16.370 18.913 1.00 0.00 H new ATOM 0 HB2 ASP A 115 15.173 18.667 17.084 1.00 0.00 H new ATOM 0 HB3 ASP A 115 13.745 18.747 18.097 1.00 0.00 H new ATOM 4053 N GLN A 116 13.837 16.035 15.743 1.00 0.00 N ATOM 4054 CA GLN A 116 12.851 15.656 14.740 1.00 0.00 C ATOM 4055 C GLN A 116 12.983 14.178 14.382 1.00 0.00 C ATOM 4056 O GLN A 116 12.077 13.594 13.785 1.00 0.00 O ATOM 4057 CB GLN A 116 13.033 16.500 13.481 1.00 0.00 C ATOM 4058 CG GLN A 116 12.871 17.981 13.828 1.00 0.00 C ATOM 4059 CD GLN A 116 11.486 18.231 14.411 1.00 0.00 C ATOM 4060 OE1 GLN A 116 10.478 17.944 13.766 1.00 0.00 O ATOM 4061 NE2 GLN A 116 11.373 18.751 15.603 1.00 0.00 N ATOM 0 H GLN A 116 14.805 15.992 15.426 1.00 0.00 H new ATOM 0 HA GLN A 116 11.859 15.830 15.157 1.00 0.00 H new ATOM 0 HB2 GLN A 116 14.019 16.323 13.051 1.00 0.00 H new ATOM 0 HB3 GLN A 116 12.300 16.210 12.728 1.00 0.00 H new ATOM 0 HG2 GLN A 116 13.636 18.281 14.544 1.00 0.00 H new ATOM 0 HG3 GLN A 116 13.014 18.590 12.935 1.00 0.00 H new ATOM 0 HE21 GLN A 116 12.209 18.989 16.137 1.00 0.00 H new ATOM 0 HE22 GLN A 116 10.449 18.920 16.000 1.00 0.00 H new ATOM 4070 N ASP A 117 14.113 13.576 14.744 1.00 0.00 N ATOM 4071 CA ASP A 117 14.341 12.169 14.447 1.00 0.00 C ATOM 4072 C ASP A 117 13.303 11.301 15.133 1.00 0.00 C ATOM 4073 O ASP A 117 12.807 10.334 14.556 1.00 0.00 O ATOM 4074 CB ASP A 117 15.741 11.756 14.906 1.00 0.00 C ATOM 4075 CG ASP A 117 16.793 12.339 13.968 1.00 0.00 C ATOM 4076 OD1 ASP A 117 16.415 12.820 12.913 1.00 0.00 O ATOM 4077 OD2 ASP A 117 17.961 12.296 14.320 1.00 0.00 O1- ATOM 0 H ASP A 117 14.877 14.037 15.239 1.00 0.00 H new ATOM 0 HA ASP A 117 14.257 12.029 13.369 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.916 12.105 15.924 1.00 0.00 H new ATOM 0 HB3 ASP A 117 15.821 10.669 14.924 1.00 0.00 H new ATOM 4082 N GLU A 118 12.973 11.647 16.366 1.00 0.00 N ATOM 4083 CA GLU A 118 11.989 10.875 17.109 1.00 0.00 C ATOM 4084 C GLU A 118 10.628 10.932 16.433 1.00 0.00 C ATOM 4085 O GLU A 118 9.920 9.930 16.348 1.00 0.00 O ATOM 4086 CB GLU A 118 11.871 11.434 18.518 1.00 0.00 C ATOM 4087 CG GLU A 118 13.145 11.109 19.295 1.00 0.00 C ATOM 4088 CD GLU A 118 13.128 11.800 20.655 1.00 0.00 C ATOM 4089 OE1 GLU A 118 12.288 12.665 20.850 1.00 0.00 O ATOM 4090 OE2 GLU A 118 13.955 11.455 21.483 1.00 0.00 O1- ATOM 0 H GLU A 118 13.364 12.444 16.868 1.00 0.00 H new ATOM 0 HA GLU A 118 12.318 9.836 17.141 1.00 0.00 H new ATOM 0 HB2 GLU A 118 11.717 12.513 18.483 1.00 0.00 H new ATOM 0 HB3 GLU A 118 11.004 11.005 19.021 1.00 0.00 H new ATOM 0 HG2 GLU A 118 13.232 10.031 19.429 1.00 0.00 H new ATOM 0 HG3 GLU A 118 14.018 11.431 18.727 1.00 0.00 H new ATOM 4097 N GLU A 119 10.268 12.110 15.956 1.00 0.00 N ATOM 4098 CA GLU A 119 9.000 12.297 15.292 1.00 0.00 C ATOM 4099 C GLU A 119 8.944 11.499 14.001 1.00 0.00 C ATOM 4100 O GLU A 119 7.932 10.883 13.682 1.00 0.00 O ATOM 4101 CB GLU A 119 8.819 13.773 14.996 1.00 0.00 C ATOM 4102 CG GLU A 119 7.463 13.989 14.353 1.00 0.00 C ATOM 4103 CD GLU A 119 7.231 15.474 14.094 1.00 0.00 C ATOM 4104 OE1 GLU A 119 8.109 16.257 14.418 1.00 0.00 O ATOM 4105 OE2 GLU A 119 6.178 15.808 13.576 1.00 0.00 O1- ATOM 0 H GLU A 119 10.841 12.951 16.019 1.00 0.00 H new ATOM 0 HA GLU A 119 8.199 11.944 15.941 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.895 14.353 15.916 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.610 14.123 14.332 1.00 0.00 H new ATOM 0 HG2 GLU A 119 7.405 13.436 13.416 1.00 0.00 H new ATOM 0 HG3 GLU A 119 6.679 13.599 15.002 1.00 0.00 H new ATOM 4112 N HIS A 120 10.045 11.519 13.263 1.00 0.00 N ATOM 4113 CA HIS A 120 10.134 10.802 12.007 1.00 0.00 C ATOM 4114 C HIS A 120 10.023 9.324 12.268 1.00 0.00 C ATOM 4115 O HIS A 120 9.359 8.586 11.542 1.00 0.00 O ATOM 4116 CB HIS A 120 11.481 11.107 11.373 1.00 0.00 C ATOM 4117 CG HIS A 120 11.488 12.560 11.046 1.00 0.00 C ATOM 4118 ND1 HIS A 120 12.622 13.242 10.650 1.00 0.00 N ATOM 4119 CD2 HIS A 120 10.483 13.479 11.095 1.00 0.00 C ATOM 4120 CE1 HIS A 120 12.274 14.531 10.482 1.00 0.00 C ATOM 4121 NE2 HIS A 120 10.974 14.732 10.738 1.00 0.00 N ATOM 0 H HIS A 120 10.891 12.028 13.518 1.00 0.00 H new ATOM 0 HA HIS A 120 9.329 11.109 11.339 1.00 0.00 H new ATOM 0 HB2 HIS A 120 12.294 10.861 12.057 1.00 0.00 H new ATOM 0 HB3 HIS A 120 11.629 10.508 10.474 1.00 0.00 H new ATOM 0 HD2 HIS A 120 9.460 13.267 11.369 1.00 0.00 H new ATOM 0 HE1 HIS A 120 12.959 15.309 10.178 1.00 0.00 H new ATOM 0 HE2 HIS A 120 10.458 15.610 10.683 1.00 0.00 H new ATOM 4129 N CYS A 121 10.672 8.916 13.334 1.00 0.00 N ATOM 4130 CA CYS A 121 10.656 7.540 13.747 1.00 0.00 C ATOM 4131 C CYS A 121 9.231 7.139 14.087 1.00 0.00 C ATOM 4132 O CYS A 121 8.758 6.074 13.690 1.00 0.00 O ATOM 4133 CB CYS A 121 11.557 7.371 14.969 1.00 0.00 C ATOM 4134 SG CYS A 121 11.605 5.628 15.455 1.00 0.00 S ATOM 0 H CYS A 121 11.223 9.530 13.935 1.00 0.00 H new ATOM 0 HA CYS A 121 11.024 6.903 12.943 1.00 0.00 H new ATOM 0 HB2 CYS A 121 12.563 7.723 14.742 1.00 0.00 H new ATOM 0 HB3 CYS A 121 11.185 7.978 15.794 1.00 0.00 H new ATOM 0 HG CYS A 121 11.845 4.893 14.410 1.00 0.00 H new ATOM 4140 N ARG A 122 8.545 8.013 14.827 1.00 0.00 N ATOM 4141 CA ARG A 122 7.166 7.741 15.216 1.00 0.00 C ATOM 4142 C ARG A 122 6.268 7.678 13.987 1.00 0.00 C ATOM 4143 O ARG A 122 5.427 6.788 13.864 1.00 0.00 O ATOM 4144 CB ARG A 122 6.661 8.819 16.177 1.00 0.00 C ATOM 4145 CG ARG A 122 5.233 8.481 16.609 1.00 0.00 C ATOM 4146 CD ARG A 122 4.760 9.496 17.648 1.00 0.00 C ATOM 4147 NE ARG A 122 3.381 9.220 18.039 1.00 0.00 N ATOM 4148 CZ ARG A 122 2.752 9.966 18.946 1.00 0.00 C ATOM 4149 NH1 ARG A 122 3.358 10.973 19.522 1.00 0.00 N1+ ATOM 4150 NH2 ARG A 122 1.515 9.695 19.262 1.00 0.00 N ATOM 0 H ARG A 122 8.918 8.901 15.163 1.00 0.00 H new ATOM 0 HA ARG A 122 7.136 6.776 15.722 1.00 0.00 H new ATOM 0 HB2 ARG A 122 7.312 8.880 17.049 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.685 9.795 15.692 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.568 8.493 15.745 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.197 7.474 17.026 1.00 0.00 H new ATOM 0 HD2 ARG A 122 5.408 9.458 18.524 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.834 10.504 17.241 1.00 0.00 H new ATOM 0 HE ARG A 122 2.888 8.438 17.608 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.323 11.195 19.278 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.865 11.536 20.215 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.034 8.915 18.815 1.00 0.00 H new ATOM 0 HH22 ARG A 122 1.030 10.264 19.956 1.00 0.00 H new ATOM 4164 N LYS A 123 6.460 8.623 13.077 1.00 0.00 N ATOM 4165 CA LYS A 123 5.677 8.671 11.855 1.00 0.00 C ATOM 4166 C LYS A 123 5.903 7.430 11.017 1.00 0.00 C ATOM 4167 O LYS A 123 4.970 6.880 10.447 1.00 0.00 O ATOM 4168 CB LYS A 123 6.061 9.906 11.053 1.00 0.00 C ATOM 4169 CG LYS A 123 5.493 11.147 11.729 1.00 0.00 C ATOM 4170 CD LYS A 123 5.981 12.379 10.982 1.00 0.00 C ATOM 4171 CE LYS A 123 5.321 13.627 11.568 1.00 0.00 C ATOM 4172 NZ LYS A 123 5.843 14.834 10.870 1.00 0.00 N1+ ATOM 0 H LYS A 123 7.153 9.367 13.164 1.00 0.00 H new ATOM 0 HA LYS A 123 4.621 8.717 12.123 1.00 0.00 H new ATOM 0 HB2 LYS A 123 7.146 9.983 10.980 1.00 0.00 H new ATOM 0 HB3 LYS A 123 5.678 9.826 10.036 1.00 0.00 H new ATOM 0 HG2 LYS A 123 4.404 11.112 11.728 1.00 0.00 H new ATOM 0 HG3 LYS A 123 5.810 11.187 12.771 1.00 0.00 H new ATOM 0 HD2 LYS A 123 7.065 12.458 11.059 1.00 0.00 H new ATOM 0 HD3 LYS A 123 5.742 12.293 9.922 1.00 0.00 H new ATOM 0 HE2 LYS A 123 4.239 13.567 11.455 1.00 0.00 H new ATOM 0 HE3 LYS A 123 5.527 13.693 12.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 6.119 15.549 11.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 6.671 14.573 10.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 5.104 15.224 10.252 1.00 0.00 H new ATOM 4186 N VAL A 124 7.139 6.984 10.940 1.00 0.00 N ATOM 4187 CA VAL A 124 7.430 5.803 10.155 1.00 0.00 C ATOM 4188 C VAL A 124 6.629 4.619 10.685 1.00 0.00 C ATOM 4189 O VAL A 124 5.974 3.910 9.925 1.00 0.00 O ATOM 4190 CB VAL A 124 8.914 5.494 10.262 1.00 0.00 C ATOM 4191 CG1 VAL A 124 9.207 4.135 9.627 1.00 0.00 C ATOM 4192 CG2 VAL A 124 9.719 6.580 9.543 1.00 0.00 C ATOM 0 H VAL A 124 7.943 7.410 11.401 1.00 0.00 H new ATOM 0 HA VAL A 124 7.159 5.981 9.114 1.00 0.00 H new ATOM 0 HB VAL A 124 9.199 5.468 11.314 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.272 3.918 9.706 1.00 0.00 H new ATOM 0 HG12 VAL A 124 8.640 3.362 10.145 1.00 0.00 H new ATOM 0 HG13 VAL A 124 8.918 4.155 8.576 1.00 0.00 H new ATOM 0 HG21 VAL A 124 10.783 6.356 9.621 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.431 6.611 8.492 1.00 0.00 H new ATOM 0 HG23 VAL A 124 9.517 7.547 10.003 1.00 0.00 H new ATOM 4202 N ASN A 125 6.670 4.420 11.996 1.00 0.00 N ATOM 4203 CA ASN A 125 5.932 3.324 12.612 1.00 0.00 C ATOM 4204 C ASN A 125 4.436 3.521 12.469 1.00 0.00 C ATOM 4205 O ASN A 125 3.692 2.565 12.269 1.00 0.00 O ATOM 4206 CB ASN A 125 6.276 3.212 14.099 1.00 0.00 C ATOM 4207 CG ASN A 125 7.675 2.642 14.281 1.00 0.00 C ATOM 4208 OD1 ASN A 125 7.883 1.438 14.120 1.00 0.00 O ATOM 4209 ND2 ASN A 125 8.656 3.435 14.612 1.00 0.00 N ATOM 0 H ASN A 125 7.201 4.997 12.649 1.00 0.00 H new ATOM 0 HA ASN A 125 6.222 2.408 12.097 1.00 0.00 H new ATOM 0 HB2 ASN A 125 6.213 4.194 14.568 1.00 0.00 H new ATOM 0 HB3 ASN A 125 5.549 2.573 14.599 1.00 0.00 H new ATOM 0 HD21 ASN A 125 9.596 3.059 14.738 1.00 0.00 H new ATOM 0 HD22 ASN A 125 8.484 4.431 14.745 1.00 0.00 H new ATOM 4216 N GLU A 126 3.992 4.758 12.604 1.00 0.00 N ATOM 4217 CA GLU A 126 2.563 5.035 12.525 1.00 0.00 C ATOM 4218 C GLU A 126 2.064 4.995 11.091 1.00 0.00 C ATOM 4219 O GLU A 126 0.885 4.784 10.847 1.00 0.00 O ATOM 4220 CB GLU A 126 2.240 6.397 13.143 1.00 0.00 C ATOM 4221 CG GLU A 126 2.139 7.464 12.050 1.00 0.00 C ATOM 4222 CD GLU A 126 2.150 8.853 12.677 1.00 0.00 C ATOM 4223 OE1 GLU A 126 1.769 8.966 13.831 1.00 0.00 O ATOM 4224 OE2 GLU A 126 2.540 9.786 11.995 1.00 0.00 O1- ATOM 0 H GLU A 126 4.583 5.573 12.766 1.00 0.00 H new ATOM 0 HA GLU A 126 2.052 4.254 13.088 1.00 0.00 H new ATOM 0 HB2 GLU A 126 1.301 6.341 13.694 1.00 0.00 H new ATOM 0 HB3 GLU A 126 3.014 6.672 13.859 1.00 0.00 H new ATOM 0 HG2 GLU A 126 2.972 7.363 11.354 1.00 0.00 H new ATOM 0 HG3 GLU A 126 1.224 7.322 11.475 1.00 0.00 H new ATOM 4231 N TYR A 127 2.956 5.192 10.140 1.00 0.00 N ATOM 4232 CA TYR A 127 2.551 5.162 8.744 1.00 0.00 C ATOM 4233 C TYR A 127 2.660 3.753 8.188 1.00 0.00 C ATOM 4234 O TYR A 127 1.935 3.382 7.266 1.00 0.00 O ATOM 4235 CB TYR A 127 3.405 6.125 7.913 1.00 0.00 C ATOM 4236 CG TYR A 127 2.954 7.554 8.137 1.00 0.00 C ATOM 4237 CD1 TYR A 127 3.886 8.543 8.478 1.00 0.00 C ATOM 4238 CD2 TYR A 127 1.604 7.899 7.978 1.00 0.00 C ATOM 4239 CE1 TYR A 127 3.468 9.866 8.661 1.00 0.00 C ATOM 4240 CE2 TYR A 127 1.188 9.221 8.165 1.00 0.00 C ATOM 4241 CZ TYR A 127 2.119 10.204 8.506 1.00 0.00 C ATOM 4242 OH TYR A 127 1.708 11.507 8.689 1.00 0.00 O ATOM 0 H TYR A 127 3.947 5.371 10.300 1.00 0.00 H new ATOM 0 HA TYR A 127 1.511 5.481 8.685 1.00 0.00 H new ATOM 0 HB2 TYR A 127 4.455 6.020 8.187 1.00 0.00 H new ATOM 0 HB3 TYR A 127 3.325 5.873 6.856 1.00 0.00 H new ATOM 0 HD1 TYR A 127 4.927 8.284 8.600 1.00 0.00 H new ATOM 0 HD2 TYR A 127 0.883 7.141 7.710 1.00 0.00 H new ATOM 0 HE1 TYR A 127 4.188 10.627 8.922 1.00 0.00 H new ATOM 0 HE2 TYR A 127 0.147 9.482 8.046 1.00 0.00 H new ATOM 0 HH TYR A 127 0.741 11.569 8.542 1.00 0.00 H new ATOM 4252 N LEU A 128 3.570 2.972 8.747 1.00 0.00 N ATOM 4253 CA LEU A 128 3.760 1.605 8.285 1.00 0.00 C ATOM 4254 C LEU A 128 2.918 0.622 9.090 1.00 0.00 C ATOM 4255 O LEU A 128 2.684 -0.503 8.648 1.00 0.00 O ATOM 4256 CB LEU A 128 5.231 1.225 8.403 1.00 0.00 C ATOM 4257 CG LEU A 128 6.070 2.173 7.544 1.00 0.00 C ATOM 4258 CD1 LEU A 128 7.557 1.938 7.819 1.00 0.00 C ATOM 4259 CD2 LEU A 128 5.792 1.915 6.062 1.00 0.00 C ATOM 0 H LEU A 128 4.182 3.255 9.512 1.00 0.00 H new ATOM 0 HA LEU A 128 3.441 1.554 7.244 1.00 0.00 H new ATOM 0 HB2 LEU A 128 5.550 1.281 9.444 1.00 0.00 H new ATOM 0 HB3 LEU A 128 5.379 0.195 8.079 1.00 0.00 H new ATOM 0 HG LEU A 128 5.806 3.201 7.792 1.00 0.00 H new ATOM 0 HD11 LEU A 128 8.152 2.615 7.206 1.00 0.00 H new ATOM 0 HD12 LEU A 128 7.766 2.124 8.872 1.00 0.00 H new ATOM 0 HD13 LEU A 128 7.814 0.907 7.575 1.00 0.00 H new ATOM 0 HD21 LEU A 128 6.392 2.593 5.456 1.00 0.00 H new ATOM 0 HD22 LEU A 128 6.050 0.885 5.817 1.00 0.00 H new ATOM 0 HD23 LEU A 128 4.735 2.083 5.855 1.00 0.00 H new ATOM 4271 N ASN A 129 2.460 1.046 10.265 1.00 0.00 N ATOM 4272 CA ASN A 129 1.642 0.179 11.099 1.00 0.00 C ATOM 4273 C ASN A 129 0.257 0.779 11.283 1.00 0.00 C ATOM 4274 O ASN A 129 -0.677 0.083 11.677 1.00 0.00 O ATOM 4275 CB ASN A 129 2.294 -0.008 12.470 1.00 0.00 C ATOM 4276 CG ASN A 129 3.728 -0.497 12.304 1.00 0.00 C ATOM 4277 OD1 ASN A 129 4.699 0.179 12.852 1.00 0.00 O flip ATOM 4278 ND2 ASN A 129 3.970 -1.512 11.650 1.00 0.00 N flip ATOM 0 H ASN A 129 2.639 1.971 10.654 1.00 0.00 H new ATOM 0 HA ASN A 129 1.555 -0.788 10.604 1.00 0.00 H new ATOM 0 HB2 ASN A 129 2.284 0.934 13.018 1.00 0.00 H new ATOM 0 HB3 ASN A 129 1.722 -0.726 13.059 1.00 0.00 H new ATOM 0 HD21 ASN A 129 3.207 -2.038 11.223 1.00 0.00 H new ATOM 0 HD22 ASN A 129 4.933 -1.827 11.535 1.00 0.00 H new ATOM 4285 N ASN A 130 0.123 2.073 10.997 1.00 0.00 N ATOM 4286 CA ASN A 130 -1.178 2.726 11.148 1.00 0.00 C ATOM 4287 C ASN A 130 -1.444 3.695 10.004 1.00 0.00 C ATOM 4288 O ASN A 130 -1.533 4.907 10.207 1.00 0.00 O ATOM 4289 CB ASN A 130 -1.263 3.465 12.490 1.00 0.00 C ATOM 4290 CG ASN A 130 -1.138 2.478 13.647 1.00 0.00 C ATOM 4291 OD1 ASN A 130 -1.672 1.372 13.583 1.00 0.00 O ATOM 4292 ND2 ASN A 130 -0.462 2.817 14.711 1.00 0.00 N ATOM 0 H ASN A 130 0.876 2.677 10.668 1.00 0.00 H new ATOM 0 HA ASN A 130 -1.941 1.948 11.125 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -0.471 4.211 12.553 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -2.211 3.999 12.559 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -0.376 2.164 15.490 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -0.019 3.735 14.763 1.00 0.00 H new ATOM 4299 N PRO A 131 -1.569 3.185 8.816 1.00 0.00 N ATOM 4300 CA PRO A 131 -1.829 4.013 7.605 1.00 0.00 C ATOM 4301 C PRO A 131 -3.238 4.607 7.598 1.00 0.00 C ATOM 4302 O PRO A 131 -4.141 4.079 8.248 1.00 0.00 O ATOM 4303 CB PRO A 131 -1.639 3.031 6.452 1.00 0.00 C ATOM 4304 CG PRO A 131 -1.912 1.687 7.037 1.00 0.00 C ATOM 4305 CD PRO A 131 -1.479 1.754 8.497 1.00 0.00 C ATOM 0 HA PRO A 131 -1.166 4.876 7.549 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -2.322 3.250 5.631 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -0.628 3.087 6.049 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -2.970 1.437 6.957 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -1.360 0.913 6.504 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -2.130 1.158 9.137 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -0.466 1.375 8.633 1.00 0.00 H new ATOM 4313 N PRO A 132 -3.441 5.691 6.889 1.00 0.00 N ATOM 4314 CA PRO A 132 -4.770 6.360 6.811 1.00 0.00 C ATOM 4315 C PRO A 132 -5.735 5.623 5.886 1.00 0.00 C ATOM 4316 O PRO A 132 -5.367 5.382 4.749 1.00 0.00 O ATOM 4317 CB PRO A 132 -4.442 7.749 6.262 1.00 0.00 C ATOM 4318 CG PRO A 132 -3.184 7.578 5.472 1.00 0.00 C ATOM 4319 CD PRO A 132 -2.430 6.394 6.081 1.00 0.00 C ATOM 0 HA PRO A 132 -5.273 6.385 7.778 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -5.251 8.125 5.636 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -4.304 8.468 7.070 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -3.410 7.392 4.422 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -2.578 8.483 5.512 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -2.018 5.745 5.308 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -1.594 6.729 6.695 1.00 0.00 H new ATOM 4328 N GLN B 940 26.511 21.956 8.234 1.00 0.00 N ATOM 4329 CA GLN B 940 26.107 21.351 9.535 1.00 0.00 C ATOM 4330 C GLN B 940 25.487 19.978 9.289 1.00 0.00 C ATOM 4331 O GLN B 940 24.264 19.831 9.305 1.00 0.00 O ATOM 4332 CB GLN B 940 25.086 22.259 10.221 1.00 0.00 C ATOM 4333 CG GLN B 940 25.813 23.365 10.988 1.00 0.00 C ATOM 4334 CD GLN B 940 26.459 24.340 10.010 1.00 0.00 C ATOM 4335 OE1 GLN B 940 25.800 24.831 9.094 1.00 0.00 O ATOM 4336 NE2 GLN B 940 27.718 24.651 10.150 1.00 0.00 N ATOM 0 HA GLN B 940 26.983 21.242 10.174 1.00 0.00 H new ATOM 0 HB2 GLN B 940 24.418 22.696 9.479 1.00 0.00 H new ATOM 0 HB3 GLN B 940 24.467 21.676 10.903 1.00 0.00 H new ATOM 0 HG2 GLN B 940 25.111 23.895 11.632 1.00 0.00 H new ATOM 0 HG3 GLN B 940 26.574 22.930 11.636 1.00 0.00 H new ATOM 0 HE21 GLN B 940 28.263 24.243 10.910 1.00 0.00 H new ATOM 0 HE22 GLN B 940 28.158 25.302 9.500 1.00 0.00 H new ATOM 4345 N GLU B 941 26.332 18.976 9.060 1.00 0.00 N ATOM 4346 CA GLU B 941 25.847 17.621 8.813 1.00 0.00 C ATOM 4347 C GLU B 941 26.534 16.624 9.760 1.00 0.00 C ATOM 4348 O GLU B 941 27.759 16.641 9.879 1.00 0.00 O ATOM 4349 CB GLU B 941 26.138 17.222 7.365 1.00 0.00 C ATOM 4350 CG GLU B 941 25.621 15.805 7.111 1.00 0.00 C ATOM 4351 CD GLU B 941 25.899 15.401 5.669 1.00 0.00 C ATOM 4352 OE1 GLU B 941 25.682 16.219 4.789 1.00 0.00 O ATOM 4353 OE2 GLU B 941 26.332 14.279 5.466 1.00 0.00 O1- ATOM 0 H GLU B 941 27.347 19.075 9.040 1.00 0.00 H new ATOM 0 HA GLU B 941 24.772 17.600 8.992 1.00 0.00 H new ATOM 0 HB2 GLU B 941 25.660 17.923 6.681 1.00 0.00 H new ATOM 0 HB3 GLU B 941 27.210 17.269 7.172 1.00 0.00 H new ATOM 0 HG2 GLU B 941 26.104 15.105 7.793 1.00 0.00 H new ATOM 0 HG3 GLU B 941 24.550 15.758 7.311 1.00 0.00 H new ATOM 4360 N PRO B 942 25.796 15.763 10.435 1.00 0.00 N ATOM 4361 CA PRO B 942 26.399 14.769 11.368 1.00 0.00 C ATOM 4362 C PRO B 942 27.096 13.636 10.622 1.00 0.00 C ATOM 4363 O PRO B 942 26.655 13.226 9.547 1.00 0.00 O ATOM 4364 CB PRO B 942 25.206 14.248 12.167 1.00 0.00 C ATOM 4365 CG PRO B 942 24.032 14.412 11.265 1.00 0.00 C ATOM 4366 CD PRO B 942 24.327 15.624 10.381 1.00 0.00 C ATOM 0 HA PRO B 942 27.172 15.212 11.996 1.00 0.00 H new ATOM 0 HB2 PRO B 942 25.345 13.204 12.447 1.00 0.00 H new ATOM 0 HB3 PRO B 942 25.075 14.811 13.091 1.00 0.00 H new ATOM 0 HG2 PRO B 942 23.881 13.518 10.660 1.00 0.00 H new ATOM 0 HG3 PRO B 942 23.119 14.565 11.841 1.00 0.00 H new ATOM 0 HD2 PRO B 942 23.979 15.466 9.360 1.00 0.00 H new ATOM 0 HD3 PRO B 942 23.828 16.519 10.753 1.00 0.00 H new ATOM 4374 N GLU B 943 28.178 13.126 11.198 1.00 0.00 N ATOM 4375 CA GLU B 943 28.912 12.035 10.574 1.00 0.00 C ATOM 4376 C GLU B 943 28.138 10.721 10.737 1.00 0.00 C ATOM 4377 O GLU B 943 27.365 10.572 11.681 1.00 0.00 O ATOM 4378 CB GLU B 943 30.302 11.909 11.206 1.00 0.00 C ATOM 4379 CG GLU B 943 31.134 13.150 10.868 1.00 0.00 C ATOM 4380 CD GLU B 943 31.397 13.211 9.367 1.00 0.00 C ATOM 4381 OE1 GLU B 943 31.332 12.171 8.732 1.00 0.00 O ATOM 4382 OE2 GLU B 943 31.659 14.297 8.873 1.00 0.00 O1- ATOM 0 H GLU B 943 28.562 13.447 12.087 1.00 0.00 H new ATOM 0 HA GLU B 943 29.026 12.247 9.511 1.00 0.00 H new ATOM 0 HB2 GLU B 943 30.213 11.802 12.287 1.00 0.00 H new ATOM 0 HB3 GLU B 943 30.801 11.013 10.837 1.00 0.00 H new ATOM 0 HG2 GLU B 943 30.608 14.049 11.190 1.00 0.00 H new ATOM 0 HG3 GLU B 943 32.079 13.122 11.410 1.00 0.00 H new ATOM 4389 N PRO B 944 28.323 9.775 9.844 1.00 0.00 N ATOM 4390 CA PRO B 944 27.611 8.462 9.909 1.00 0.00 C ATOM 4391 C PRO B 944 28.119 7.587 11.058 1.00 0.00 C ATOM 4392 O PRO B 944 29.237 7.775 11.535 1.00 0.00 O ATOM 4393 CB PRO B 944 27.924 7.814 8.558 1.00 0.00 C ATOM 4394 CG PRO B 944 29.215 8.423 8.128 1.00 0.00 C ATOM 4395 CD PRO B 944 29.221 9.847 8.679 1.00 0.00 C ATOM 0 HA PRO B 944 26.544 8.585 10.094 1.00 0.00 H new ATOM 0 HB2 PRO B 944 28.010 6.731 8.650 1.00 0.00 H new ATOM 0 HB3 PRO B 944 27.134 8.011 7.833 1.00 0.00 H new ATOM 0 HG2 PRO B 944 30.061 7.853 8.513 1.00 0.00 H new ATOM 0 HG3 PRO B 944 29.301 8.426 7.041 1.00 0.00 H new ATOM 0 HD2 PRO B 944 30.225 10.161 8.966 1.00 0.00 H new ATOM 0 HD3 PRO B 944 28.862 10.564 7.940 1.00 0.00 H new ATOM 4403 N PRO B 945 27.332 6.638 11.510 1.00 0.00 N ATOM 4404 CA PRO B 945 27.737 5.729 12.623 1.00 0.00 C ATOM 4405 C PRO B 945 29.018 4.965 12.294 1.00 0.00 C ATOM 4406 O PRO B 945 29.668 5.235 11.284 1.00 0.00 O ATOM 4407 CB PRO B 945 26.556 4.760 12.775 1.00 0.00 C ATOM 4408 CG PRO B 945 25.398 5.420 12.105 1.00 0.00 C ATOM 4409 CD PRO B 945 25.979 6.322 11.016 1.00 0.00 C ATOM 0 HA PRO B 945 27.951 6.283 13.537 1.00 0.00 H new ATOM 0 HB2 PRO B 945 26.778 3.798 12.313 1.00 0.00 H new ATOM 0 HB3 PRO B 945 26.341 4.567 13.826 1.00 0.00 H new ATOM 0 HG2 PRO B 945 24.725 4.678 11.675 1.00 0.00 H new ATOM 0 HG3 PRO B 945 24.817 6.002 12.820 1.00 0.00 H new ATOM 0 HD2 PRO B 945 26.013 5.815 10.052 1.00 0.00 H new ATOM 0 HD3 PRO B 945 25.381 7.223 10.881 1.00 0.00 H new ATOM 4417 N GLU B 946 29.373 4.016 13.154 1.00 0.00 N ATOM 4418 CA GLU B 946 30.574 3.216 12.943 1.00 0.00 C ATOM 4419 C GLU B 946 30.229 1.729 13.054 1.00 0.00 C ATOM 4420 O GLU B 946 29.216 1.374 13.656 1.00 0.00 O ATOM 4421 CB GLU B 946 31.642 3.581 13.979 1.00 0.00 C ATOM 4422 CG GLU B 946 31.117 3.277 15.384 1.00 0.00 C ATOM 4423 CD GLU B 946 32.187 3.600 16.422 1.00 0.00 C ATOM 4424 OE1 GLU B 946 33.281 3.967 16.024 1.00 0.00 O ATOM 4425 OE2 GLU B 946 31.896 3.479 17.601 1.00 0.00 O1- ATOM 0 H GLU B 946 28.850 3.783 13.998 1.00 0.00 H new ATOM 0 HA GLU B 946 30.966 3.422 11.947 1.00 0.00 H new ATOM 0 HB2 GLU B 946 32.555 3.016 13.790 1.00 0.00 H new ATOM 0 HB3 GLU B 946 31.898 4.637 13.896 1.00 0.00 H new ATOM 0 HG2 GLU B 946 30.219 3.863 15.580 1.00 0.00 H new ATOM 0 HG3 GLU B 946 30.834 2.227 15.456 1.00 0.00 H new ATOM 4432 N PRO B 947 31.029 0.860 12.487 1.00 0.00 N ATOM 4433 CA PRO B 947 30.766 -0.610 12.534 1.00 0.00 C ATOM 4434 C PRO B 947 30.665 -1.135 13.962 1.00 0.00 C ATOM 4435 O PRO B 947 31.403 -0.701 14.848 1.00 0.00 O ATOM 4436 CB PRO B 947 31.969 -1.224 11.819 1.00 0.00 C ATOM 4437 CG PRO B 947 32.509 -0.129 10.967 1.00 0.00 C ATOM 4438 CD PRO B 947 32.261 1.160 11.739 1.00 0.00 C ATOM 0 HA PRO B 947 29.813 -0.863 12.069 1.00 0.00 H new ATOM 0 HB2 PRO B 947 32.715 -1.574 12.532 1.00 0.00 H new ATOM 0 HB3 PRO B 947 31.674 -2.084 11.217 1.00 0.00 H new ATOM 0 HG2 PRO B 947 33.573 -0.271 10.775 1.00 0.00 H new ATOM 0 HG3 PRO B 947 32.011 -0.106 9.998 1.00 0.00 H new ATOM 0 HD2 PRO B 947 33.090 1.399 12.405 1.00 0.00 H new ATOM 0 HD3 PRO B 947 32.132 2.012 11.072 1.00 0.00 H new ATOM 4446 N PHE B 948 29.748 -2.069 14.178 1.00 0.00 N ATOM 4447 CA PHE B 948 29.558 -2.646 15.505 1.00 0.00 C ATOM 4448 C PHE B 948 28.916 -4.026 15.403 1.00 0.00 C ATOM 4449 O PHE B 948 28.386 -4.398 14.356 1.00 0.00 O ATOM 4450 CB PHE B 948 28.670 -1.735 16.352 1.00 0.00 C ATOM 4451 CG PHE B 948 27.288 -1.683 15.750 1.00 0.00 C ATOM 4452 CD1 PHE B 948 26.308 -2.587 16.176 1.00 0.00 C ATOM 4453 CD2 PHE B 948 26.987 -0.735 14.765 1.00 0.00 C ATOM 4454 CE1 PHE B 948 25.025 -2.544 15.617 1.00 0.00 C ATOM 4455 CE2 PHE B 948 25.704 -0.692 14.206 1.00 0.00 C ATOM 4456 CZ PHE B 948 24.723 -1.595 14.632 1.00 0.00 C ATOM 0 H PHE B 948 29.128 -2.442 13.459 1.00 0.00 H new ATOM 0 HA PHE B 948 30.535 -2.743 15.978 1.00 0.00 H new ATOM 0 HB2 PHE B 948 28.619 -2.107 17.375 1.00 0.00 H new ATOM 0 HB3 PHE B 948 29.097 -0.733 16.398 1.00 0.00 H new ATOM 0 HD1 PHE B 948 26.542 -3.318 16.936 1.00 0.00 H new ATOM 0 HD2 PHE B 948 27.743 -0.038 14.437 1.00 0.00 H new ATOM 0 HE1 PHE B 948 24.269 -3.242 15.945 1.00 0.00 H new ATOM 0 HE2 PHE B 948 25.471 0.039 13.445 1.00 0.00 H new ATOM 0 HZ PHE B 948 23.733 -1.560 14.201 1.00 0.00 H new ATOM 4466 N GLU B 949 28.960 -4.780 16.495 1.00 0.00 N ATOM 4467 CA GLU B 949 28.371 -6.111 16.507 1.00 0.00 C ATOM 4468 C GLU B 949 26.886 -6.036 16.846 1.00 0.00 C ATOM 4469 O GLU B 949 26.480 -5.324 17.765 1.00 0.00 O ATOM 4470 CB GLU B 949 29.077 -6.995 17.539 1.00 0.00 C ATOM 4471 CG GLU B 949 30.537 -7.209 17.134 1.00 0.00 C ATOM 4472 CD GLU B 949 30.612 -7.886 15.769 1.00 0.00 C ATOM 4473 OE1 GLU B 949 29.876 -8.838 15.563 1.00 0.00 O ATOM 4474 OE2 GLU B 949 31.399 -7.442 14.951 1.00 0.00 O1- ATOM 0 H GLU B 949 29.393 -4.496 17.374 1.00 0.00 H new ATOM 0 HA GLU B 949 28.492 -6.543 15.514 1.00 0.00 H new ATOM 0 HB2 GLU B 949 29.029 -6.529 18.523 1.00 0.00 H new ATOM 0 HB3 GLU B 949 28.568 -7.956 17.616 1.00 0.00 H new ATOM 0 HG2 GLU B 949 31.057 -6.252 17.102 1.00 0.00 H new ATOM 0 HG3 GLU B 949 31.043 -7.822 17.880 1.00 0.00 H new ATOM 4481 N TYR B 950 26.086 -6.787 16.102 1.00 0.00 N ATOM 4482 CA TYR B 950 24.649 -6.826 16.319 1.00 0.00 C ATOM 4483 C TYR B 950 24.225 -8.213 16.762 1.00 0.00 C ATOM 4484 O TYR B 950 24.560 -9.211 16.123 1.00 0.00 O ATOM 4485 CB TYR B 950 23.907 -6.451 15.040 1.00 0.00 C ATOM 4486 CG TYR B 950 22.480 -6.940 15.129 1.00 0.00 C ATOM 4487 CD1 TYR B 950 21.678 -6.581 16.220 1.00 0.00 C ATOM 4488 CD2 TYR B 950 21.958 -7.746 14.113 1.00 0.00 C ATOM 4489 CE1 TYR B 950 20.355 -7.029 16.291 1.00 0.00 C ATOM 4490 CE2 TYR B 950 20.635 -8.196 14.184 1.00 0.00 C ATOM 4491 CZ TYR B 950 19.833 -7.838 15.274 1.00 0.00 C ATOM 4492 OH TYR B 950 18.528 -8.279 15.345 1.00 0.00 O ATOM 0 H TYR B 950 26.412 -7.380 15.339 1.00 0.00 H new ATOM 0 HA TYR B 950 24.400 -6.106 17.099 1.00 0.00 H new ATOM 0 HB2 TYR B 950 23.925 -5.370 14.899 1.00 0.00 H new ATOM 0 HB3 TYR B 950 24.402 -6.894 14.176 1.00 0.00 H new ATOM 0 HD1 TYR B 950 22.081 -5.959 17.006 1.00 0.00 H new ATOM 0 HD2 TYR B 950 22.577 -8.022 13.272 1.00 0.00 H new ATOM 0 HE1 TYR B 950 19.735 -6.751 17.131 1.00 0.00 H new ATOM 0 HE2 TYR B 950 20.233 -8.819 13.399 1.00 0.00 H new ATOM 0 HH TYR B 950 17.962 -7.718 14.774 1.00 0.00 H new ATOM 4502 N ILE B 951 23.488 -8.271 17.857 1.00 0.00 N ATOM 4503 CA ILE B 951 23.028 -9.540 18.377 1.00 0.00 C ATOM 4504 C ILE B 951 21.556 -9.428 18.738 1.00 0.00 C ATOM 4505 O ILE B 951 21.171 -8.574 19.535 1.00 0.00 O ATOM 4506 CB ILE B 951 23.840 -9.918 19.618 1.00 0.00 C ATOM 4507 CG1 ILE B 951 25.280 -9.433 19.444 1.00 0.00 C ATOM 4508 CG2 ILE B 951 23.840 -11.438 19.777 1.00 0.00 C ATOM 4509 CD1 ILE B 951 26.135 -9.925 20.610 1.00 0.00 C ATOM 0 H ILE B 951 23.198 -7.457 18.399 1.00 0.00 H new ATOM 0 HA ILE B 951 23.160 -10.313 17.620 1.00 0.00 H new ATOM 0 HB ILE B 951 23.398 -9.455 20.500 1.00 0.00 H new ATOM 0 HG12 ILE B 951 25.686 -9.801 18.502 1.00 0.00 H new ATOM 0 HG13 ILE B 951 25.304 -8.344 19.397 1.00 0.00 H new ATOM 0 HG21 ILE B 951 24.418 -11.711 20.660 1.00 0.00 H new ATOM 0 HG22 ILE B 951 22.815 -11.792 19.890 1.00 0.00 H new ATOM 0 HG23 ILE B 951 24.287 -11.896 18.895 1.00 0.00 H new ATOM 0 HD11 ILE B 951 27.160 -9.577 20.482 1.00 0.00 H new ATOM 0 HD12 ILE B 951 25.734 -9.535 21.545 1.00 0.00 H new ATOM 0 HD13 ILE B 951 26.122 -11.015 20.636 1.00 0.00 H new ATOM 4521 N ASP B 952 20.734 -10.279 18.148 1.00 0.00 N ATOM 4522 CA ASP B 952 19.311 -10.230 18.429 1.00 0.00 C ATOM 4523 C ASP B 952 19.012 -10.943 19.742 1.00 0.00 C ATOM 4524 O ASP B 952 18.669 -12.126 19.756 1.00 0.00 O ATOM 4525 CB ASP B 952 18.527 -10.889 17.291 1.00 0.00 C ATOM 4526 CG ASP B 952 17.025 -10.744 17.525 1.00 0.00 C ATOM 4527 OD1 ASP B 952 16.649 -10.250 18.575 1.00 0.00 O ATOM 4528 OD2 ASP B 952 16.271 -11.133 16.648 1.00 0.00 O1- ATOM 0 H ASP B 952 21.020 -10.999 17.484 1.00 0.00 H new ATOM 0 HA ASP B 952 19.006 -9.187 18.513 1.00 0.00 H new ATOM 0 HB2 ASP B 952 18.799 -10.431 16.340 1.00 0.00 H new ATOM 0 HB3 ASP B 952 18.791 -11.944 17.223 1.00 0.00 H new ATOM 4533 N ASP B 953 19.142 -10.208 20.841 1.00 0.00 N ATOM 4534 CA ASP B 953 18.881 -10.771 22.162 1.00 0.00 C ATOM 4535 C ASP B 953 17.534 -10.291 22.694 1.00 0.00 C ATOM 4536 O ASP B 953 17.014 -9.330 22.151 1.00 0.00 O ATOM 4537 CB ASP B 953 19.991 -10.370 23.135 1.00 0.00 C ATOM 4538 CG ASP B 953 20.058 -8.849 23.264 1.00 0.00 C ATOM 4539 OD1 ASP B 953 19.275 -8.184 22.607 1.00 0.00 O ATOM 4540 OD2 ASP B 953 20.891 -8.376 24.019 1.00 0.00 O1- ATOM 4541 OXT ASP B 953 17.043 -10.891 23.635 1.00 0.00 O ATOM 0 H ASP B 953 19.424 -9.228 20.845 1.00 0.00 H new ATOM 0 HA ASP B 953 18.857 -11.857 22.072 1.00 0.00 H new ATOM 0 HB2 ASP B 953 19.807 -10.817 24.112 1.00 0.00 H new ATOM 0 HB3 ASP B 953 20.948 -10.755 22.784 1.00 0.00 H new