USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 887 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 3 MET CE :methyl -176:sc= -0.564 (180deg=-0.388) USER MOD Set 1.2: A 70 GLN : amide:sc= 0.832 K(o=0.27,f=-7.2!) USER MOD Set 2.1: A 32 SER OG : rot 135:sc= 1.39 USER MOD Set 2.2: A 36 GLN : amide:sc= 0.466 K(o=3.3,f=-0.81) USER MOD Set 2.3: A 57 LYS NZ :NH3+ 172:sc= 1.43 (180deg=0.876) USER MOD Set 3.1: A 26 SER OG : rot 90:sc= 1.32 USER MOD Set 3.2: A 75 TYR OH : rot 147:sc= 0.0283 USER MOD Set 4.1: A 13 ASN : amide:sc= 1.85 K(o=2.9,f=-7!) USER MOD Set 4.2: A 77 LYS NZ :NH3+ -159:sc= 1.07 (180deg=0) USER MOD Set 5.1: A 10 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 12 ASN : amide:sc= 0.385 K(o=1.8,f=1) USER MOD Set 5.3: A 51 GLN : amide:sc= 1.4 K(o=1.8,f=-0.69) USER MOD Set 6.1: A 6 ASN : amide:sc= 0.853 K(o=0.64,f=-0.21) USER MOD Set 6.2: A 84 SER OG : rot 140:sc= -0.213 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= 0.815 K(o=0.82,f=-0.39) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= 0.938 K(o=0.94,f=-5.5!) USER MOD Single : A 17 LYS NZ :NH3+ -110:sc= 1.19 (180deg=0.539) USER MOD Single : A 19 LYS NZ :NH3+ -166:sc= 1.31 (180deg=1.2) USER MOD Single : A 20 LYS NZ :NH3+ -177:sc= 1.31 (180deg=1.29) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0.891 K(o=0.89,f=-0.23) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.032 USER MOD Single : A 47 LYS NZ :NH3+ -169:sc= 1.31 (180deg=1.12) USER MOD Single : A 48 MET CE :methyl -165:sc= -0.404 (180deg=-1.22) USER MOD Single : A 61 SER OG : rot 180:sc=0.000887 USER MOD Single : A 63 SER OG : rot 160:sc= 0.797 USER MOD Single : A 64 ASN : amide:sc= 1.11 K(o=1.1,f=-0.0072) USER MOD Single : A 68 THR OG1 : rot 97:sc= 1.22 USER MOD Single : A 69 MET CE :methyl 173:sc= -1.48 (180deg=-1.61) USER MOD Single : A 79 MET CE :methyl -124:sc= -0.108 (180deg=-0.881) USER MOD Single : A 80 GLN : amide:sc= 0.983 K(o=0.98,f=-0.032) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 80:sc= 1.27 USER MOD Single : A 88 SER OG : rot 180:sc= 0.00541 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 158:sc= 2.37 (180deg=1.45) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.0162 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -174:sc= 1.28 (180deg=1.11) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.359 -17.192 3.187 1.00 0.00 N ATOM 2 CA MET A 1 1.419 -16.859 4.168 1.00 0.00 C ATOM 3 C MET A 1 2.502 -15.997 3.507 1.00 0.00 C ATOM 4 O MET A 1 2.507 -14.778 3.696 1.00 0.00 O ATOM 5 CB MET A 1 1.978 -18.119 4.870 1.00 0.00 C ATOM 6 CG MET A 1 2.968 -17.781 5.994 1.00 0.00 C ATOM 7 SD MET A 1 2.288 -16.758 7.333 1.00 0.00 S ATOM 8 CE MET A 1 3.755 -16.638 8.393 1.00 0.00 C ATOM 0 H1 MET A 1 -0.368 -17.776 3.647 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.074 -16.315 2.833 1.00 0.00 H new ATOM 0 H3 MET A 1 0.774 -17.719 2.392 1.00 0.00 H new ATOM 0 HA MET A 1 0.979 -16.262 4.967 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.151 -18.698 5.282 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.473 -18.751 4.133 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.341 -18.712 6.422 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.824 -17.264 5.561 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.520 -16.039 9.273 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.061 -17.637 8.705 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.567 -16.166 7.839 1.00 0.00 H new ATOM 20 N GLU A 2 3.414 -16.591 2.727 1.00 0.00 N ATOM 21 CA GLU A 2 4.463 -15.895 1.984 1.00 0.00 C ATOM 22 C GLU A 2 4.789 -16.705 0.720 1.00 0.00 C ATOM 23 O GLU A 2 4.292 -17.822 0.552 1.00 0.00 O ATOM 24 CB GLU A 2 5.696 -15.656 2.882 1.00 0.00 C ATOM 25 CG GLU A 2 6.371 -16.932 3.407 1.00 0.00 C ATOM 26 CD GLU A 2 7.499 -16.597 4.397 1.00 0.00 C ATOM 27 OE1 GLU A 2 7.229 -16.439 5.610 1.00 0.00 O ATOM 28 OE2 GLU A 2 8.673 -16.524 3.970 1.00 0.00 O ATOM 0 H GLU A 2 3.440 -17.602 2.594 1.00 0.00 H new ATOM 0 HA GLU A 2 4.122 -14.908 1.673 1.00 0.00 H new ATOM 0 HB2 GLU A 2 6.430 -15.079 2.320 1.00 0.00 H new ATOM 0 HB3 GLU A 2 5.395 -15.045 3.733 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.630 -17.564 3.896 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.775 -17.503 2.571 1.00 0.00 H new ATOM 35 N MET A 3 5.581 -16.119 -0.181 1.00 0.00 N ATOM 36 CA MET A 3 5.879 -16.654 -1.508 1.00 0.00 C ATOM 37 C MET A 3 6.594 -18.010 -1.425 1.00 0.00 C ATOM 38 O MET A 3 7.313 -18.288 -0.462 1.00 0.00 O ATOM 39 CB MET A 3 6.730 -15.639 -2.297 1.00 0.00 C ATOM 40 CG MET A 3 5.990 -14.343 -2.678 1.00 0.00 C ATOM 41 SD MET A 3 5.429 -13.223 -1.351 1.00 0.00 S ATOM 42 CE MET A 3 6.978 -12.824 -0.491 1.00 0.00 C ATOM 0 H MET A 3 6.047 -15.230 0.001 1.00 0.00 H new ATOM 0 HA MET A 3 4.936 -16.818 -2.030 1.00 0.00 H new ATOM 0 HB2 MET A 3 7.607 -15.380 -1.703 1.00 0.00 H new ATOM 0 HB3 MET A 3 7.091 -16.117 -3.208 1.00 0.00 H new ATOM 0 HG2 MET A 3 6.644 -13.772 -3.336 1.00 0.00 H new ATOM 0 HG3 MET A 3 5.115 -14.624 -3.264 1.00 0.00 H new ATOM 0 HE1 MET A 3 6.762 -12.206 0.380 1.00 0.00 H new ATOM 0 HE2 MET A 3 7.464 -13.746 -0.171 1.00 0.00 H new ATOM 0 HE3 MET A 3 7.639 -12.281 -1.166 1.00 0.00 H new ATOM 52 N LEU A 4 6.428 -18.837 -2.465 1.00 0.00 N ATOM 53 CA LEU A 4 7.030 -20.168 -2.567 1.00 0.00 C ATOM 54 C LEU A 4 8.212 -20.131 -3.548 1.00 0.00 C ATOM 55 O LEU A 4 8.227 -19.283 -4.445 1.00 0.00 O ATOM 56 CB LEU A 4 5.996 -21.202 -3.065 1.00 0.00 C ATOM 57 CG LEU A 4 5.143 -21.840 -1.953 1.00 0.00 C ATOM 58 CD1 LEU A 4 4.137 -20.864 -1.335 1.00 0.00 C ATOM 59 CD2 LEU A 4 4.389 -23.049 -2.517 1.00 0.00 C ATOM 0 H LEU A 4 5.859 -18.592 -3.275 1.00 0.00 H new ATOM 0 HA LEU A 4 7.376 -20.461 -1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.333 -20.717 -3.781 1.00 0.00 H new ATOM 0 HB3 LEU A 4 6.521 -21.992 -3.601 1.00 0.00 H new ATOM 0 HG LEU A 4 5.829 -22.143 -1.161 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.566 -21.373 -0.558 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.670 -20.019 -0.899 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.457 -20.504 -2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.785 -23.501 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 4 3.741 -22.726 -3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 4 5.104 -23.782 -2.891 1.00 0.00 H new ATOM 71 N PRO A 5 9.187 -21.052 -3.419 1.00 0.00 N ATOM 72 CA PRO A 5 10.248 -21.252 -4.399 1.00 0.00 C ATOM 73 C PRO A 5 9.734 -21.456 -5.828 1.00 0.00 C ATOM 74 O PRO A 5 8.768 -22.187 -6.067 1.00 0.00 O ATOM 75 CB PRO A 5 11.023 -22.487 -3.924 1.00 0.00 C ATOM 76 CG PRO A 5 10.779 -22.515 -2.419 1.00 0.00 C ATOM 77 CD PRO A 5 9.361 -21.967 -2.297 1.00 0.00 C ATOM 0 HA PRO A 5 10.870 -20.358 -4.454 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.661 -23.396 -4.405 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.085 -22.406 -4.155 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.859 -23.524 -2.015 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.499 -21.898 -1.881 1.00 0.00 H new ATOM 0 HD2 PRO A 5 8.627 -22.772 -2.332 1.00 0.00 H new ATOM 0 HD3 PRO A 5 9.222 -21.451 -1.347 1.00 0.00 H new ATOM 85 N ASN A 6 10.440 -20.847 -6.781 1.00 0.00 N ATOM 86 CA ASN A 6 10.324 -21.021 -8.227 1.00 0.00 C ATOM 87 C ASN A 6 11.622 -20.451 -8.798 1.00 0.00 C ATOM 88 O ASN A 6 12.126 -19.488 -8.226 1.00 0.00 O ATOM 89 CB ASN A 6 9.142 -20.215 -8.781 1.00 0.00 C ATOM 90 CG ASN A 6 8.998 -20.413 -10.285 1.00 0.00 C ATOM 91 OD1 ASN A 6 8.742 -21.518 -10.750 1.00 0.00 O ATOM 92 ND2 ASN A 6 9.183 -19.371 -11.077 1.00 0.00 N ATOM 0 H ASN A 6 11.163 -20.168 -6.543 1.00 0.00 H new ATOM 0 HA ASN A 6 10.161 -22.066 -8.489 1.00 0.00 H new ATOM 0 HB2 ASN A 6 8.223 -20.522 -8.281 1.00 0.00 H new ATOM 0 HB3 ASN A 6 9.286 -19.157 -8.563 1.00 0.00 H new ATOM 0 HD21 ASN A 6 9.113 -19.481 -12.089 1.00 0.00 H new ATOM 0 HD22 ASN A 6 9.395 -18.457 -10.676 1.00 0.00 H new ATOM 99 N GLN A 7 12.178 -20.993 -9.885 1.00 0.00 N ATOM 100 CA GLN A 7 13.519 -20.597 -10.344 1.00 0.00 C ATOM 101 C GLN A 7 13.586 -19.130 -10.813 1.00 0.00 C ATOM 102 O GLN A 7 14.677 -18.561 -10.908 1.00 0.00 O ATOM 103 CB GLN A 7 14.005 -21.574 -11.433 1.00 0.00 C ATOM 104 CG GLN A 7 15.516 -21.436 -11.689 1.00 0.00 C ATOM 105 CD GLN A 7 16.109 -22.458 -12.658 1.00 0.00 C ATOM 106 OE1 GLN A 7 15.464 -23.400 -13.114 1.00 0.00 O ATOM 107 NE2 GLN A 7 17.376 -22.277 -12.995 1.00 0.00 N ATOM 0 H GLN A 7 11.727 -21.703 -10.462 1.00 0.00 H new ATOM 0 HA GLN A 7 14.194 -20.657 -9.490 1.00 0.00 H new ATOM 0 HB2 GLN A 7 13.779 -22.597 -11.131 1.00 0.00 H new ATOM 0 HB3 GLN A 7 13.461 -21.387 -12.359 1.00 0.00 H new ATOM 0 HG2 GLN A 7 15.713 -20.436 -12.076 1.00 0.00 H new ATOM 0 HG3 GLN A 7 16.038 -21.517 -10.736 1.00 0.00 H new ATOM 0 HE21 GLN A 7 17.899 -21.491 -12.609 1.00 0.00 H new ATOM 0 HE22 GLN A 7 17.829 -22.923 -13.641 1.00 0.00 H new ATOM 116 N THR A 8 12.437 -18.508 -11.073 1.00 0.00 N ATOM 117 CA THR A 8 12.334 -17.194 -11.680 1.00 0.00 C ATOM 118 C THR A 8 11.329 -16.375 -10.867 1.00 0.00 C ATOM 119 O THR A 8 10.324 -16.905 -10.372 1.00 0.00 O ATOM 120 CB THR A 8 11.929 -17.387 -13.153 1.00 0.00 C ATOM 121 OG1 THR A 8 12.833 -18.278 -13.784 1.00 0.00 O ATOM 122 CG2 THR A 8 11.882 -16.085 -13.960 1.00 0.00 C ATOM 0 H THR A 8 11.529 -18.921 -10.859 1.00 0.00 H new ATOM 0 HA THR A 8 13.275 -16.644 -11.672 1.00 0.00 H new ATOM 0 HB THR A 8 10.916 -17.790 -13.135 1.00 0.00 H new ATOM 0 HG1 THR A 8 12.572 -18.400 -14.721 1.00 0.00 H new ATOM 0 HG21 THR A 8 11.589 -16.304 -14.987 1.00 0.00 H new ATOM 0 HG22 THR A 8 11.156 -15.406 -13.513 1.00 0.00 H new ATOM 0 HG23 THR A 8 12.867 -15.618 -13.955 1.00 0.00 H new ATOM 130 N ILE A 9 11.594 -15.078 -10.723 1.00 0.00 N ATOM 131 CA ILE A 9 10.768 -14.151 -9.956 1.00 0.00 C ATOM 132 C ILE A 9 10.452 -12.962 -10.865 1.00 0.00 C ATOM 133 O ILE A 9 11.155 -12.726 -11.851 1.00 0.00 O ATOM 134 CB ILE A 9 11.438 -13.764 -8.605 1.00 0.00 C ATOM 135 CG1 ILE A 9 12.422 -12.589 -8.780 1.00 0.00 C ATOM 136 CG2 ILE A 9 12.100 -14.986 -7.930 1.00 0.00 C ATOM 137 CD1 ILE A 9 13.288 -12.253 -7.561 1.00 0.00 C ATOM 0 H ILE A 9 12.408 -14.633 -11.147 1.00 0.00 H new ATOM 0 HA ILE A 9 9.829 -14.616 -9.656 1.00 0.00 H new ATOM 0 HB ILE A 9 10.652 -13.421 -7.932 1.00 0.00 H new ATOM 0 HG12 ILE A 9 13.081 -12.814 -9.618 1.00 0.00 H new ATOM 0 HG13 ILE A 9 11.852 -11.701 -9.052 1.00 0.00 H new ATOM 0 HG21 ILE A 9 12.558 -14.679 -6.990 1.00 0.00 H new ATOM 0 HG22 ILE A 9 11.345 -15.747 -7.734 1.00 0.00 H new ATOM 0 HG23 ILE A 9 12.865 -15.395 -8.589 1.00 0.00 H new ATOM 0 HD11 ILE A 9 13.940 -11.413 -7.799 1.00 0.00 H new ATOM 0 HD12 ILE A 9 12.646 -11.988 -6.721 1.00 0.00 H new ATOM 0 HD13 ILE A 9 13.894 -13.119 -7.296 1.00 0.00 H new ATOM 149 N TYR A 10 9.412 -12.212 -10.523 1.00 0.00 N ATOM 150 CA TYR A 10 8.821 -11.156 -11.325 1.00 0.00 C ATOM 151 C TYR A 10 8.660 -9.961 -10.399 1.00 0.00 C ATOM 152 O TYR A 10 8.039 -10.069 -9.344 1.00 0.00 O ATOM 153 CB TYR A 10 7.484 -11.661 -11.882 1.00 0.00 C ATOM 154 CG TYR A 10 6.651 -10.680 -12.690 1.00 0.00 C ATOM 155 CD1 TYR A 10 7.231 -9.928 -13.733 1.00 0.00 C ATOM 156 CD2 TYR A 10 5.260 -10.607 -12.475 1.00 0.00 C ATOM 157 CE1 TYR A 10 6.429 -9.132 -14.570 1.00 0.00 C ATOM 158 CE2 TYR A 10 4.450 -9.816 -13.310 1.00 0.00 C ATOM 159 CZ TYR A 10 5.030 -9.092 -14.377 1.00 0.00 C ATOM 160 OH TYR A 10 4.256 -8.356 -15.221 1.00 0.00 O ATOM 0 H TYR A 10 8.935 -12.333 -9.630 1.00 0.00 H new ATOM 0 HA TYR A 10 9.432 -10.866 -12.180 1.00 0.00 H new ATOM 0 HB2 TYR A 10 7.686 -12.529 -12.510 1.00 0.00 H new ATOM 0 HB3 TYR A 10 6.879 -12.008 -11.044 1.00 0.00 H new ATOM 0 HD1 TYR A 10 8.299 -9.964 -13.890 1.00 0.00 H new ATOM 0 HD2 TYR A 10 4.813 -11.162 -11.664 1.00 0.00 H new ATOM 0 HE1 TYR A 10 6.882 -8.552 -15.360 1.00 0.00 H new ATOM 0 HE2 TYR A 10 3.385 -9.762 -13.136 1.00 0.00 H new ATOM 0 HH TYR A 10 3.316 -8.433 -14.954 1.00 0.00 H new ATOM 170 N ILE A 11 9.283 -8.853 -10.781 1.00 0.00 N ATOM 171 CA ILE A 11 9.420 -7.615 -10.033 1.00 0.00 C ATOM 172 C ILE A 11 8.471 -6.658 -10.760 1.00 0.00 C ATOM 173 O ILE A 11 8.484 -6.609 -11.994 1.00 0.00 O ATOM 174 CB ILE A 11 10.917 -7.200 -10.055 1.00 0.00 C ATOM 175 CG1 ILE A 11 11.801 -8.260 -9.341 1.00 0.00 C ATOM 176 CG2 ILE A 11 11.122 -5.817 -9.412 1.00 0.00 C ATOM 177 CD1 ILE A 11 13.300 -8.190 -9.654 1.00 0.00 C ATOM 0 H ILE A 11 9.739 -8.795 -11.691 1.00 0.00 H new ATOM 0 HA ILE A 11 9.157 -7.657 -8.976 1.00 0.00 H new ATOM 0 HB ILE A 11 11.223 -7.141 -11.099 1.00 0.00 H new ATOM 0 HG12 ILE A 11 11.667 -8.153 -8.265 1.00 0.00 H new ATOM 0 HG13 ILE A 11 11.437 -9.252 -9.611 1.00 0.00 H new ATOM 0 HG21 ILE A 11 12.180 -5.555 -9.443 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.547 -5.071 -9.961 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.785 -5.844 -8.376 1.00 0.00 H new ATOM 0 HD11 ILE A 11 13.823 -8.973 -9.105 1.00 0.00 H new ATOM 0 HD12 ILE A 11 13.455 -8.331 -10.724 1.00 0.00 H new ATOM 0 HD13 ILE A 11 13.689 -7.216 -9.357 1.00 0.00 H new ATOM 189 N ASN A 12 7.645 -5.902 -10.025 1.00 0.00 N ATOM 190 CA ASN A 12 6.538 -5.153 -10.630 1.00 0.00 C ATOM 191 C ASN A 12 6.365 -3.714 -10.133 1.00 0.00 C ATOM 192 O ASN A 12 5.277 -3.151 -10.271 1.00 0.00 O ATOM 193 CB ASN A 12 5.245 -5.978 -10.445 1.00 0.00 C ATOM 194 CG ASN A 12 4.299 -5.747 -11.617 1.00 0.00 C ATOM 195 OD1 ASN A 12 3.274 -5.078 -11.514 1.00 0.00 O ATOM 196 ND2 ASN A 12 4.645 -6.309 -12.760 1.00 0.00 N ATOM 0 H ASN A 12 7.723 -5.794 -9.014 1.00 0.00 H new ATOM 0 HA ASN A 12 6.779 -5.023 -11.685 1.00 0.00 H new ATOM 0 HB2 ASN A 12 5.489 -7.038 -10.369 1.00 0.00 H new ATOM 0 HB3 ASN A 12 4.756 -5.696 -9.513 1.00 0.00 H new ATOM 0 HD21 ASN A 12 4.056 -6.193 -13.584 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.502 -6.860 -12.819 1.00 0.00 H new ATOM 203 N ASN A 13 7.396 -3.101 -9.536 1.00 0.00 N ATOM 204 CA ASN A 13 7.325 -1.719 -9.056 1.00 0.00 C ATOM 205 C ASN A 13 8.658 -0.985 -9.238 1.00 0.00 C ATOM 206 O ASN A 13 9.120 -0.288 -8.337 1.00 0.00 O ATOM 207 CB ASN A 13 6.808 -1.669 -7.604 1.00 0.00 C ATOM 208 CG ASN A 13 6.386 -0.259 -7.188 1.00 0.00 C ATOM 209 OD1 ASN A 13 5.795 0.491 -7.963 1.00 0.00 O ATOM 210 ND2 ASN A 13 6.641 0.132 -5.953 1.00 0.00 N ATOM 0 H ASN A 13 8.298 -3.549 -9.374 1.00 0.00 H new ATOM 0 HA ASN A 13 6.602 -1.183 -9.670 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.960 -2.346 -7.499 1.00 0.00 H new ATOM 0 HB3 ASN A 13 7.587 -2.027 -6.931 1.00 0.00 H new ATOM 0 HD21 ASN A 13 6.348 1.058 -5.640 1.00 0.00 H new ATOM 0 HD22 ASN A 13 7.131 -0.491 -5.312 1.00 0.00 H new ATOM 217 N LEU A 14 9.323 -1.182 -10.381 1.00 0.00 N ATOM 218 CA LEU A 14 10.487 -0.371 -10.744 1.00 0.00 C ATOM 219 C LEU A 14 9.986 0.996 -11.203 1.00 0.00 C ATOM 220 O LEU A 14 8.982 1.080 -11.914 1.00 0.00 O ATOM 221 CB LEU A 14 11.299 -1.041 -11.868 1.00 0.00 C ATOM 222 CG LEU A 14 12.070 -2.297 -11.417 1.00 0.00 C ATOM 223 CD1 LEU A 14 12.486 -3.125 -12.637 1.00 0.00 C ATOM 224 CD2 LEU A 14 13.305 -1.941 -10.587 1.00 0.00 C ATOM 0 H LEU A 14 9.075 -1.894 -11.068 1.00 0.00 H new ATOM 0 HA LEU A 14 11.144 -0.268 -9.881 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.623 -1.313 -12.679 1.00 0.00 H new ATOM 0 HB3 LEU A 14 12.007 -0.318 -12.272 1.00 0.00 H new ATOM 0 HG LEU A 14 11.402 -2.883 -10.786 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.030 -4.010 -12.308 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.598 -3.430 -13.190 1.00 0.00 H new ATOM 0 HD13 LEU A 14 13.127 -2.525 -13.283 1.00 0.00 H new ATOM 0 HD21 LEU A 14 13.819 -2.855 -10.290 1.00 0.00 H new ATOM 0 HD22 LEU A 14 13.978 -1.323 -11.182 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.999 -1.391 -9.697 1.00 0.00 H new ATOM 236 N ASN A 15 10.691 2.066 -10.823 1.00 0.00 N ATOM 237 CA ASN A 15 10.432 3.391 -11.381 1.00 0.00 C ATOM 238 C ASN A 15 10.933 3.368 -12.824 1.00 0.00 C ATOM 239 O ASN A 15 12.089 3.013 -13.059 1.00 0.00 O ATOM 240 CB ASN A 15 11.133 4.487 -10.559 1.00 0.00 C ATOM 241 CG ASN A 15 10.656 5.882 -10.961 1.00 0.00 C ATOM 242 OD1 ASN A 15 10.448 6.174 -12.135 1.00 0.00 O ATOM 243 ND2 ASN A 15 10.459 6.776 -10.008 1.00 0.00 N ATOM 0 H ASN A 15 11.442 2.038 -10.134 1.00 0.00 H new ATOM 0 HA ASN A 15 9.368 3.624 -11.349 1.00 0.00 H new ATOM 0 HB2 ASN A 15 10.940 4.327 -9.498 1.00 0.00 H new ATOM 0 HB3 ASN A 15 12.211 4.415 -10.701 1.00 0.00 H new ATOM 0 HD21 ASN A 15 10.133 7.713 -10.247 1.00 0.00 H new ATOM 0 HD22 ASN A 15 10.633 6.530 -9.034 1.00 0.00 H new ATOM 250 N GLU A 16 10.087 3.725 -13.792 1.00 0.00 N ATOM 251 CA GLU A 16 10.418 3.627 -15.213 1.00 0.00 C ATOM 252 C GLU A 16 11.702 4.371 -15.604 1.00 0.00 C ATOM 253 O GLU A 16 12.367 3.965 -16.557 1.00 0.00 O ATOM 254 CB GLU A 16 9.238 4.068 -16.094 1.00 0.00 C ATOM 255 CG GLU A 16 8.891 5.565 -16.024 1.00 0.00 C ATOM 256 CD GLU A 16 7.848 5.946 -17.087 1.00 0.00 C ATOM 257 OE1 GLU A 16 8.215 6.038 -18.282 1.00 0.00 O ATOM 258 OE2 GLU A 16 6.664 6.161 -16.739 1.00 0.00 O ATOM 0 H GLU A 16 9.152 4.091 -13.612 1.00 0.00 H new ATOM 0 HA GLU A 16 10.616 2.571 -15.394 1.00 0.00 H new ATOM 0 HB2 GLU A 16 9.463 3.812 -17.129 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.357 3.494 -15.808 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.508 5.806 -15.032 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.794 6.157 -16.169 1.00 0.00 H new ATOM 265 N LYS A 17 12.072 5.430 -14.870 1.00 0.00 N ATOM 266 CA LYS A 17 13.283 6.206 -15.135 1.00 0.00 C ATOM 267 C LYS A 17 14.568 5.394 -14.951 1.00 0.00 C ATOM 268 O LYS A 17 15.609 5.810 -15.460 1.00 0.00 O ATOM 269 CB LYS A 17 13.286 7.497 -14.293 1.00 0.00 C ATOM 270 CG LYS A 17 13.386 7.274 -12.772 1.00 0.00 C ATOM 271 CD LYS A 17 14.796 7.480 -12.195 1.00 0.00 C ATOM 272 CE LYS A 17 14.836 7.080 -10.712 1.00 0.00 C ATOM 273 NZ LYS A 17 14.015 7.959 -9.844 1.00 0.00 N ATOM 0 H LYS A 17 11.534 5.771 -14.073 1.00 0.00 H new ATOM 0 HA LYS A 17 13.267 6.484 -16.189 1.00 0.00 H new ATOM 0 HB2 LYS A 17 14.122 8.120 -14.611 1.00 0.00 H new ATOM 0 HB3 LYS A 17 12.374 8.055 -14.505 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.698 7.954 -12.271 1.00 0.00 H new ATOM 0 HG3 LYS A 17 13.056 6.261 -12.542 1.00 0.00 H new ATOM 0 HD2 LYS A 17 15.516 6.885 -12.757 1.00 0.00 H new ATOM 0 HD3 LYS A 17 15.091 8.524 -12.304 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.487 6.052 -10.611 1.00 0.00 H new ATOM 0 HE3 LYS A 17 15.869 7.101 -10.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 14.639 8.535 -9.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 13.431 8.583 -10.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 13.399 7.376 -9.243 1.00 0.00 H new ATOM 287 N ILE A 18 14.531 4.273 -14.223 1.00 0.00 N ATOM 288 CA ILE A 18 15.676 3.379 -14.096 1.00 0.00 C ATOM 289 C ILE A 18 15.942 2.791 -15.484 1.00 0.00 C ATOM 290 O ILE A 18 15.072 2.129 -16.061 1.00 0.00 O ATOM 291 CB ILE A 18 15.410 2.306 -13.008 1.00 0.00 C ATOM 292 CG1 ILE A 18 15.128 2.933 -11.622 1.00 0.00 C ATOM 293 CG2 ILE A 18 16.572 1.303 -12.888 1.00 0.00 C ATOM 294 CD1 ILE A 18 16.220 3.871 -11.089 1.00 0.00 C ATOM 0 H ILE A 18 13.706 3.965 -13.708 1.00 0.00 H new ATOM 0 HA ILE A 18 16.569 3.907 -13.762 1.00 0.00 H new ATOM 0 HB ILE A 18 14.518 1.772 -13.335 1.00 0.00 H new ATOM 0 HG12 ILE A 18 14.191 3.488 -11.677 1.00 0.00 H new ATOM 0 HG13 ILE A 18 14.980 2.129 -10.901 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.342 0.570 -12.114 1.00 0.00 H new ATOM 0 HG22 ILE A 18 16.712 0.793 -13.841 1.00 0.00 H new ATOM 0 HG23 ILE A 18 17.486 1.835 -12.624 1.00 0.00 H new ATOM 0 HD11 ILE A 18 15.924 4.256 -10.113 1.00 0.00 H new ATOM 0 HD12 ILE A 18 17.157 3.322 -10.994 1.00 0.00 H new ATOM 0 HD13 ILE A 18 16.355 4.702 -11.781 1.00 0.00 H new ATOM 306 N LYS A 19 17.143 3.048 -16.020 1.00 0.00 N ATOM 307 CA LYS A 19 17.627 2.419 -17.246 1.00 0.00 C ATOM 308 C LYS A 19 17.714 0.921 -16.988 1.00 0.00 C ATOM 309 O LYS A 19 18.108 0.501 -15.901 1.00 0.00 O ATOM 310 CB LYS A 19 18.997 3.016 -17.627 1.00 0.00 C ATOM 311 CG LYS A 19 19.463 2.582 -19.028 1.00 0.00 C ATOM 312 CD LYS A 19 20.897 3.043 -19.317 1.00 0.00 C ATOM 313 CE LYS A 19 21.293 2.644 -20.747 1.00 0.00 C ATOM 314 NZ LYS A 19 22.738 2.853 -21.006 1.00 0.00 N ATOM 0 H LYS A 19 17.807 3.704 -15.608 1.00 0.00 H new ATOM 0 HA LYS A 19 16.953 2.601 -18.083 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.939 4.104 -17.588 1.00 0.00 H new ATOM 0 HB3 LYS A 19 19.740 2.710 -16.890 1.00 0.00 H new ATOM 0 HG2 LYS A 19 19.406 1.497 -19.110 1.00 0.00 H new ATOM 0 HG3 LYS A 19 18.790 2.994 -19.779 1.00 0.00 H new ATOM 0 HD2 LYS A 19 20.973 4.124 -19.197 1.00 0.00 H new ATOM 0 HD3 LYS A 19 21.585 2.594 -18.601 1.00 0.00 H new ATOM 0 HE2 LYS A 19 21.044 1.596 -20.912 1.00 0.00 H new ATOM 0 HE3 LYS A 19 20.710 3.227 -21.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 22.918 2.801 -22.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 23.023 3.788 -20.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 23.288 2.116 -20.520 1.00 0.00 H new ATOM 328 N LYS A 20 17.390 0.083 -17.971 1.00 0.00 N ATOM 329 CA LYS A 20 17.293 -1.354 -17.705 1.00 0.00 C ATOM 330 C LYS A 20 18.673 -1.986 -17.529 1.00 0.00 C ATOM 331 O LYS A 20 18.795 -3.023 -16.886 1.00 0.00 O ATOM 332 CB LYS A 20 16.397 -2.043 -18.743 1.00 0.00 C ATOM 333 CG LYS A 20 14.906 -1.920 -18.349 1.00 0.00 C ATOM 334 CD LYS A 20 14.357 -0.487 -18.235 1.00 0.00 C ATOM 335 CE LYS A 20 12.909 -0.437 -17.733 1.00 0.00 C ATOM 336 NZ LYS A 20 12.521 0.952 -17.367 1.00 0.00 N ATOM 0 H LYS A 20 17.195 0.361 -18.933 1.00 0.00 H new ATOM 0 HA LYS A 20 16.796 -1.507 -16.747 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.557 -1.594 -19.723 1.00 0.00 H new ATOM 0 HB3 LYS A 20 16.671 -3.095 -18.825 1.00 0.00 H new ATOM 0 HG2 LYS A 20 14.310 -2.459 -19.085 1.00 0.00 H new ATOM 0 HG3 LYS A 20 14.760 -2.421 -17.392 1.00 0.00 H new ATOM 0 HD2 LYS A 20 14.990 0.086 -17.558 1.00 0.00 H new ATOM 0 HD3 LYS A 20 14.414 -0.003 -19.210 1.00 0.00 H new ATOM 0 HE2 LYS A 20 12.239 -0.814 -18.506 1.00 0.00 H new ATOM 0 HE3 LYS A 20 12.797 -1.090 -16.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.555 0.953 -16.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 13.179 1.319 -16.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 12.558 1.557 -18.212 1.00 0.00 H new ATOM 350 N GLU A 21 19.728 -1.337 -18.014 1.00 0.00 N ATOM 351 CA GLU A 21 21.095 -1.728 -17.702 1.00 0.00 C ATOM 352 C GLU A 21 21.406 -1.434 -16.226 1.00 0.00 C ATOM 353 O GLU A 21 22.127 -2.205 -15.601 1.00 0.00 O ATOM 354 CB GLU A 21 22.031 -1.017 -18.683 1.00 0.00 C ATOM 355 CG GLU A 21 23.500 -0.926 -18.249 1.00 0.00 C ATOM 356 CD GLU A 21 24.365 -0.285 -19.348 1.00 0.00 C ATOM 357 OE1 GLU A 21 24.188 0.921 -19.637 1.00 0.00 O ATOM 358 OE2 GLU A 21 25.233 -0.978 -19.928 1.00 0.00 O ATOM 0 H GLU A 21 19.658 -0.529 -18.632 1.00 0.00 H new ATOM 0 HA GLU A 21 21.241 -2.801 -17.824 1.00 0.00 H new ATOM 0 HB2 GLU A 21 21.985 -1.535 -19.641 1.00 0.00 H new ATOM 0 HB3 GLU A 21 21.656 -0.007 -18.848 1.00 0.00 H new ATOM 0 HG2 GLU A 21 23.576 -0.339 -17.334 1.00 0.00 H new ATOM 0 HG3 GLU A 21 23.877 -1.923 -18.021 1.00 0.00 H new ATOM 365 N GLU A 22 20.835 -0.383 -15.630 1.00 0.00 N ATOM 366 CA GLU A 22 21.002 -0.123 -14.201 1.00 0.00 C ATOM 367 C GLU A 22 20.220 -1.161 -13.390 1.00 0.00 C ATOM 368 O GLU A 22 20.714 -1.604 -12.357 1.00 0.00 O ATOM 369 CB GLU A 22 20.593 1.314 -13.840 1.00 0.00 C ATOM 370 CG GLU A 22 21.524 2.373 -14.454 1.00 0.00 C ATOM 371 CD GLU A 22 22.901 2.416 -13.766 1.00 0.00 C ATOM 372 OE1 GLU A 22 23.054 3.130 -12.748 1.00 0.00 O ATOM 373 OE2 GLU A 22 23.853 1.764 -14.252 1.00 0.00 O ATOM 0 H GLU A 22 20.254 0.300 -16.116 1.00 0.00 H new ATOM 0 HA GLU A 22 22.058 -0.217 -13.948 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.573 1.493 -14.181 1.00 0.00 H new ATOM 0 HB3 GLU A 22 20.591 1.424 -12.756 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.658 2.163 -15.515 1.00 0.00 H new ATOM 0 HG3 GLU A 22 21.053 3.353 -14.380 1.00 0.00 H new ATOM 380 N LEU A 23 19.049 -1.609 -13.866 1.00 0.00 N ATOM 381 CA LEU A 23 18.330 -2.757 -13.295 1.00 0.00 C ATOM 382 C LEU A 23 19.249 -3.982 -13.335 1.00 0.00 C ATOM 383 O LEU A 23 19.439 -4.631 -12.305 1.00 0.00 O ATOM 384 CB LEU A 23 16.980 -2.947 -14.042 1.00 0.00 C ATOM 385 CG LEU A 23 16.177 -4.265 -13.925 1.00 0.00 C ATOM 386 CD1 LEU A 23 16.805 -5.461 -14.643 1.00 0.00 C ATOM 387 CD2 LEU A 23 15.865 -4.605 -12.465 1.00 0.00 C ATOM 0 H LEU A 23 18.572 -1.183 -14.661 1.00 0.00 H new ATOM 0 HA LEU A 23 18.072 -2.592 -12.249 1.00 0.00 H new ATOM 0 HB2 LEU A 23 16.320 -2.143 -13.717 1.00 0.00 H new ATOM 0 HB3 LEU A 23 17.178 -2.788 -15.102 1.00 0.00 H new ATOM 0 HG LEU A 23 15.243 -4.069 -14.451 1.00 0.00 H new ATOM 0 HD11 LEU A 23 16.174 -6.339 -14.507 1.00 0.00 H new ATOM 0 HD12 LEU A 23 16.895 -5.240 -15.707 1.00 0.00 H new ATOM 0 HD13 LEU A 23 17.794 -5.657 -14.228 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.300 -5.536 -12.421 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.797 -4.719 -11.911 1.00 0.00 H new ATOM 0 HD23 LEU A 23 15.275 -3.802 -12.022 1.00 0.00 H new ATOM 399 N LYS A 24 19.867 -4.273 -14.488 1.00 0.00 N ATOM 400 CA LYS A 24 20.777 -5.410 -14.641 1.00 0.00 C ATOM 401 C LYS A 24 21.930 -5.310 -13.643 1.00 0.00 C ATOM 402 O LYS A 24 22.159 -6.246 -12.874 1.00 0.00 O ATOM 403 CB LYS A 24 21.274 -5.505 -16.099 1.00 0.00 C ATOM 404 CG LYS A 24 20.211 -6.144 -17.011 1.00 0.00 C ATOM 405 CD LYS A 24 20.558 -6.073 -18.506 1.00 0.00 C ATOM 406 CE LYS A 24 21.836 -6.856 -18.848 1.00 0.00 C ATOM 407 NZ LYS A 24 22.128 -6.845 -20.305 1.00 0.00 N ATOM 0 H LYS A 24 19.748 -3.725 -15.340 1.00 0.00 H new ATOM 0 HA LYS A 24 20.239 -6.332 -14.420 1.00 0.00 H new ATOM 0 HB2 LYS A 24 21.521 -4.509 -16.467 1.00 0.00 H new ATOM 0 HB3 LYS A 24 22.190 -6.095 -16.136 1.00 0.00 H new ATOM 0 HG2 LYS A 24 20.081 -7.188 -16.726 1.00 0.00 H new ATOM 0 HG3 LYS A 24 19.255 -5.647 -16.845 1.00 0.00 H new ATOM 0 HD2 LYS A 24 19.726 -6.468 -19.089 1.00 0.00 H new ATOM 0 HD3 LYS A 24 20.685 -5.030 -18.798 1.00 0.00 H new ATOM 0 HE2 LYS A 24 22.679 -6.426 -18.307 1.00 0.00 H new ATOM 0 HE3 LYS A 24 21.731 -7.886 -18.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 22.998 -7.385 -20.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 21.336 -7.279 -20.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 22.255 -5.864 -20.626 1.00 0.00 H new ATOM 421 N LYS A 25 22.628 -4.172 -13.609 1.00 0.00 N ATOM 422 CA LYS A 25 23.748 -3.966 -12.696 1.00 0.00 C ATOM 423 C LYS A 25 23.297 -4.092 -11.245 1.00 0.00 C ATOM 424 O LYS A 25 23.995 -4.736 -10.468 1.00 0.00 O ATOM 425 CB LYS A 25 24.414 -2.601 -12.947 1.00 0.00 C ATOM 426 CG LYS A 25 25.212 -2.518 -14.263 1.00 0.00 C ATOM 427 CD LYS A 25 26.489 -3.375 -14.303 1.00 0.00 C ATOM 428 CE LYS A 25 27.530 -2.927 -13.264 1.00 0.00 C ATOM 429 NZ LYS A 25 28.796 -3.694 -13.371 1.00 0.00 N ATOM 0 H LYS A 25 22.432 -3.373 -14.212 1.00 0.00 H new ATOM 0 HA LYS A 25 24.488 -4.744 -12.887 1.00 0.00 H new ATOM 0 HB2 LYS A 25 23.644 -1.830 -12.953 1.00 0.00 H new ATOM 0 HB3 LYS A 25 25.082 -2.377 -12.116 1.00 0.00 H new ATOM 0 HG2 LYS A 25 24.563 -2.822 -15.084 1.00 0.00 H new ATOM 0 HG3 LYS A 25 25.485 -1.478 -14.440 1.00 0.00 H new ATOM 0 HD2 LYS A 25 26.228 -4.418 -14.125 1.00 0.00 H new ATOM 0 HD3 LYS A 25 26.928 -3.321 -15.299 1.00 0.00 H new ATOM 0 HE2 LYS A 25 27.738 -1.865 -13.396 1.00 0.00 H new ATOM 0 HE3 LYS A 25 27.117 -3.049 -12.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 29.467 -3.358 -12.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 28.603 -4.705 -13.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 29.206 -3.558 -14.317 1.00 0.00 H new ATOM 443 N SER A 26 22.149 -3.529 -10.873 1.00 0.00 N ATOM 444 CA SER A 26 21.657 -3.584 -9.500 1.00 0.00 C ATOM 445 C SER A 26 21.375 -5.025 -9.078 1.00 0.00 C ATOM 446 O SER A 26 21.765 -5.437 -7.985 1.00 0.00 O ATOM 447 CB SER A 26 20.414 -2.703 -9.348 1.00 0.00 C ATOM 448 OG SER A 26 20.711 -1.368 -9.702 1.00 0.00 O ATOM 0 H SER A 26 21.536 -3.024 -11.513 1.00 0.00 H new ATOM 0 HA SER A 26 22.431 -3.197 -8.837 1.00 0.00 H new ATOM 0 HB2 SER A 26 19.611 -3.084 -9.980 1.00 0.00 H new ATOM 0 HB3 SER A 26 20.056 -2.742 -8.319 1.00 0.00 H new ATOM 0 HG SER A 26 20.547 -1.239 -10.660 1.00 0.00 H new ATOM 454 N LEU A 27 20.755 -5.819 -9.952 1.00 0.00 N ATOM 455 CA LEU A 27 20.500 -7.228 -9.672 1.00 0.00 C ATOM 456 C LEU A 27 21.825 -7.960 -9.455 1.00 0.00 C ATOM 457 O LEU A 27 21.994 -8.624 -8.430 1.00 0.00 O ATOM 458 CB LEU A 27 19.703 -7.875 -10.814 1.00 0.00 C ATOM 459 CG LEU A 27 18.208 -7.506 -10.839 1.00 0.00 C ATOM 460 CD1 LEU A 27 17.569 -8.030 -12.119 1.00 0.00 C ATOM 461 CD2 LEU A 27 17.437 -8.106 -9.668 1.00 0.00 C ATOM 0 H LEU A 27 20.420 -5.506 -10.863 1.00 0.00 H new ATOM 0 HA LEU A 27 19.902 -7.303 -8.764 1.00 0.00 H new ATOM 0 HB2 LEU A 27 20.152 -7.584 -11.764 1.00 0.00 H new ATOM 0 HB3 LEU A 27 19.796 -8.958 -10.736 1.00 0.00 H new ATOM 0 HG LEU A 27 18.157 -6.419 -10.777 1.00 0.00 H new ATOM 0 HD11 LEU A 27 16.511 -7.766 -12.132 1.00 0.00 H new ATOM 0 HD12 LEU A 27 18.065 -7.585 -12.982 1.00 0.00 H new ATOM 0 HD13 LEU A 27 17.673 -9.114 -12.160 1.00 0.00 H new ATOM 0 HD21 LEU A 27 16.389 -7.814 -9.735 1.00 0.00 H new ATOM 0 HD22 LEU A 27 17.514 -9.193 -9.700 1.00 0.00 H new ATOM 0 HD23 LEU A 27 17.856 -7.740 -8.731 1.00 0.00 H new ATOM 473 N TYR A 28 22.792 -7.797 -10.363 1.00 0.00 N ATOM 474 CA TYR A 28 24.098 -8.427 -10.196 1.00 0.00 C ATOM 475 C TYR A 28 24.831 -7.929 -8.941 1.00 0.00 C ATOM 476 O TYR A 28 25.604 -8.693 -8.361 1.00 0.00 O ATOM 477 CB TYR A 28 24.969 -8.225 -11.446 1.00 0.00 C ATOM 478 CG TYR A 28 24.532 -9.004 -12.678 1.00 0.00 C ATOM 479 CD1 TYR A 28 24.404 -10.408 -12.619 1.00 0.00 C ATOM 480 CD2 TYR A 28 24.307 -8.339 -13.899 1.00 0.00 C ATOM 481 CE1 TYR A 28 24.028 -11.136 -13.762 1.00 0.00 C ATOM 482 CE2 TYR A 28 23.938 -9.060 -15.048 1.00 0.00 C ATOM 483 CZ TYR A 28 23.788 -10.465 -14.982 1.00 0.00 C ATOM 484 OH TYR A 28 23.422 -11.184 -16.081 1.00 0.00 O ATOM 0 H TYR A 28 22.694 -7.240 -11.212 1.00 0.00 H new ATOM 0 HA TYR A 28 23.919 -9.494 -10.063 1.00 0.00 H new ATOM 0 HB2 TYR A 28 24.980 -7.163 -11.693 1.00 0.00 H new ATOM 0 HB3 TYR A 28 25.994 -8.506 -11.204 1.00 0.00 H new ATOM 0 HD1 TYR A 28 24.596 -10.926 -11.691 1.00 0.00 H new ATOM 0 HD2 TYR A 28 24.419 -7.266 -13.953 1.00 0.00 H new ATOM 0 HE1 TYR A 28 23.923 -12.209 -13.707 1.00 0.00 H new ATOM 0 HE2 TYR A 28 23.769 -8.542 -15.980 1.00 0.00 H new ATOM 0 HH TYR A 28 23.293 -10.578 -16.840 1.00 0.00 H new ATOM 494 N ALA A 29 24.609 -6.682 -8.512 1.00 0.00 N ATOM 495 CA ALA A 29 25.319 -6.079 -7.389 1.00 0.00 C ATOM 496 C ALA A 29 24.783 -6.545 -6.032 1.00 0.00 C ATOM 497 O ALA A 29 25.586 -6.815 -5.137 1.00 0.00 O ATOM 498 CB ALA A 29 25.232 -4.550 -7.478 1.00 0.00 C ATOM 0 H ALA A 29 23.924 -6.060 -8.942 1.00 0.00 H new ATOM 0 HA ALA A 29 26.357 -6.404 -7.457 1.00 0.00 H new ATOM 0 HB1 ALA A 29 25.764 -4.106 -6.637 1.00 0.00 H new ATOM 0 HB2 ALA A 29 25.683 -4.214 -8.411 1.00 0.00 H new ATOM 0 HB3 ALA A 29 24.187 -4.243 -7.449 1.00 0.00 H new ATOM 504 N ILE A 30 23.457 -6.633 -5.859 1.00 0.00 N ATOM 505 CA ILE A 30 22.854 -6.858 -4.540 1.00 0.00 C ATOM 506 C ILE A 30 21.944 -8.079 -4.482 1.00 0.00 C ATOM 507 O ILE A 30 22.037 -8.822 -3.507 1.00 0.00 O ATOM 508 CB ILE A 30 22.154 -5.595 -3.986 1.00 0.00 C ATOM 509 CG1 ILE A 30 21.240 -4.859 -4.990 1.00 0.00 C ATOM 510 CG2 ILE A 30 23.214 -4.635 -3.413 1.00 0.00 C ATOM 511 CD1 ILE A 30 20.311 -3.831 -4.332 1.00 0.00 C ATOM 0 H ILE A 30 22.781 -6.551 -6.618 1.00 0.00 H new ATOM 0 HA ILE A 30 23.693 -7.080 -3.880 1.00 0.00 H new ATOM 0 HB ILE A 30 21.479 -5.943 -3.204 1.00 0.00 H new ATOM 0 HG12 ILE A 30 21.860 -4.355 -5.731 1.00 0.00 H new ATOM 0 HG13 ILE A 30 20.637 -5.592 -5.525 1.00 0.00 H new ATOM 0 HG21 ILE A 30 22.724 -3.744 -3.022 1.00 0.00 H new ATOM 0 HG22 ILE A 30 23.759 -5.132 -2.610 1.00 0.00 H new ATOM 0 HG23 ILE A 30 23.910 -4.350 -4.201 1.00 0.00 H new ATOM 0 HD11 ILE A 30 19.698 -3.353 -5.096 1.00 0.00 H new ATOM 0 HD12 ILE A 30 19.666 -4.333 -3.611 1.00 0.00 H new ATOM 0 HD13 ILE A 30 20.908 -3.076 -3.821 1.00 0.00 H new ATOM 523 N PHE A 31 21.132 -8.365 -5.503 1.00 0.00 N ATOM 524 CA PHE A 31 20.364 -9.614 -5.511 1.00 0.00 C ATOM 525 C PHE A 31 21.303 -10.822 -5.467 1.00 0.00 C ATOM 526 O PHE A 31 21.005 -11.769 -4.737 1.00 0.00 O ATOM 527 CB PHE A 31 19.385 -9.721 -6.686 1.00 0.00 C ATOM 528 CG PHE A 31 18.005 -9.170 -6.406 1.00 0.00 C ATOM 529 CD1 PHE A 31 17.813 -7.797 -6.176 1.00 0.00 C ATOM 530 CD2 PHE A 31 16.898 -10.039 -6.402 1.00 0.00 C ATOM 531 CE1 PHE A 31 16.516 -7.296 -5.983 1.00 0.00 C ATOM 532 CE2 PHE A 31 15.607 -9.543 -6.164 1.00 0.00 C ATOM 533 CZ PHE A 31 15.413 -8.168 -5.975 1.00 0.00 C ATOM 0 H PHE A 31 20.990 -7.766 -6.316 1.00 0.00 H new ATOM 0 HA PHE A 31 19.750 -9.605 -4.610 1.00 0.00 H new ATOM 0 HB2 PHE A 31 19.806 -9.194 -7.542 1.00 0.00 H new ATOM 0 HB3 PHE A 31 19.293 -10.769 -6.971 1.00 0.00 H new ATOM 0 HD1 PHE A 31 18.661 -7.129 -6.148 1.00 0.00 H new ATOM 0 HD2 PHE A 31 17.043 -11.094 -6.583 1.00 0.00 H new ATOM 0 HE1 PHE A 31 16.365 -6.236 -5.840 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.765 -10.219 -6.127 1.00 0.00 H new ATOM 0 HZ PHE A 31 14.417 -7.778 -5.823 1.00 0.00 H new ATOM 543 N SER A 32 22.470 -10.762 -6.124 1.00 0.00 N ATOM 544 CA SER A 32 23.485 -11.812 -6.036 1.00 0.00 C ATOM 545 C SER A 32 23.846 -12.204 -4.601 1.00 0.00 C ATOM 546 O SER A 32 24.190 -13.359 -4.351 1.00 0.00 O ATOM 547 CB SER A 32 24.766 -11.373 -6.744 1.00 0.00 C ATOM 548 OG SER A 32 24.562 -11.267 -8.135 1.00 0.00 O ATOM 0 H SER A 32 22.733 -9.984 -6.729 1.00 0.00 H new ATOM 0 HA SER A 32 23.042 -12.684 -6.518 1.00 0.00 H new ATOM 0 HB2 SER A 32 25.095 -10.413 -6.347 1.00 0.00 H new ATOM 0 HB3 SER A 32 25.561 -12.091 -6.543 1.00 0.00 H new ATOM 0 HG SER A 32 24.959 -10.432 -8.461 1.00 0.00 H new ATOM 554 N GLN A 33 23.768 -11.258 -3.662 1.00 0.00 N ATOM 555 CA GLN A 33 24.148 -11.474 -2.268 1.00 0.00 C ATOM 556 C GLN A 33 23.114 -12.334 -1.518 1.00 0.00 C ATOM 557 O GLN A 33 23.399 -12.780 -0.406 1.00 0.00 O ATOM 558 CB GLN A 33 24.381 -10.126 -1.559 1.00 0.00 C ATOM 559 CG GLN A 33 25.444 -9.264 -2.270 1.00 0.00 C ATOM 560 CD GLN A 33 25.746 -7.948 -1.548 1.00 0.00 C ATOM 561 OE1 GLN A 33 25.769 -7.868 -0.321 1.00 0.00 O ATOM 562 NE2 GLN A 33 26.000 -6.879 -2.287 1.00 0.00 N ATOM 0 H GLN A 33 23.436 -10.312 -3.852 1.00 0.00 H new ATOM 0 HA GLN A 33 25.085 -12.031 -2.260 1.00 0.00 H new ATOM 0 HB2 GLN A 33 23.441 -9.575 -1.514 1.00 0.00 H new ATOM 0 HB3 GLN A 33 24.693 -10.309 -0.531 1.00 0.00 H new ATOM 0 HG2 GLN A 33 26.365 -9.839 -2.361 1.00 0.00 H new ATOM 0 HG3 GLN A 33 25.104 -9.044 -3.282 1.00 0.00 H new ATOM 0 HE21 GLN A 33 25.981 -6.946 -3.305 1.00 0.00 H new ATOM 0 HE22 GLN A 33 26.215 -5.988 -1.839 1.00 0.00 H new ATOM 571 N PHE A 34 21.944 -12.598 -2.116 1.00 0.00 N ATOM 572 CA PHE A 34 20.860 -13.373 -1.513 1.00 0.00 C ATOM 573 C PHE A 34 20.366 -14.492 -2.428 1.00 0.00 C ATOM 574 O PHE A 34 19.807 -15.473 -1.937 1.00 0.00 O ATOM 575 CB PHE A 34 19.710 -12.429 -1.123 1.00 0.00 C ATOM 576 CG PHE A 34 20.139 -11.213 -0.319 1.00 0.00 C ATOM 577 CD1 PHE A 34 20.599 -11.365 1.004 1.00 0.00 C ATOM 578 CD2 PHE A 34 20.118 -9.933 -0.907 1.00 0.00 C ATOM 579 CE1 PHE A 34 21.031 -10.242 1.735 1.00 0.00 C ATOM 580 CE2 PHE A 34 20.549 -8.812 -0.175 1.00 0.00 C ATOM 581 CZ PHE A 34 21.004 -8.965 1.146 1.00 0.00 C ATOM 0 H PHE A 34 21.724 -12.269 -3.056 1.00 0.00 H new ATOM 0 HA PHE A 34 21.250 -13.858 -0.618 1.00 0.00 H new ATOM 0 HB2 PHE A 34 19.210 -12.091 -2.031 1.00 0.00 H new ATOM 0 HB3 PHE A 34 18.976 -12.990 -0.545 1.00 0.00 H new ATOM 0 HD1 PHE A 34 20.620 -12.345 1.458 1.00 0.00 H new ATOM 0 HD2 PHE A 34 19.770 -9.812 -1.922 1.00 0.00 H new ATOM 0 HE1 PHE A 34 21.383 -10.361 2.749 1.00 0.00 H new ATOM 0 HE2 PHE A 34 20.530 -7.832 -0.629 1.00 0.00 H new ATOM 0 HZ PHE A 34 21.332 -8.103 1.708 1.00 0.00 H new ATOM 591 N GLY A 35 20.617 -14.396 -3.729 1.00 0.00 N ATOM 592 CA GLY A 35 20.407 -15.453 -4.689 1.00 0.00 C ATOM 593 C GLY A 35 21.232 -15.089 -5.907 1.00 0.00 C ATOM 594 O GLY A 35 20.899 -14.141 -6.615 1.00 0.00 O ATOM 0 H GLY A 35 20.986 -13.544 -4.151 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.717 -16.415 -4.282 1.00 0.00 H new ATOM 0 HA3 GLY A 35 19.351 -15.541 -4.946 1.00 0.00 H new ATOM 598 N GLN A 36 22.352 -15.779 -6.114 1.00 0.00 N ATOM 599 CA GLN A 36 23.181 -15.543 -7.290 1.00 0.00 C ATOM 600 C GLN A 36 22.366 -15.814 -8.566 1.00 0.00 C ATOM 601 O GLN A 36 21.629 -16.799 -8.681 1.00 0.00 O ATOM 602 CB GLN A 36 24.519 -16.296 -7.200 1.00 0.00 C ATOM 603 CG GLN A 36 25.717 -15.418 -7.623 1.00 0.00 C ATOM 604 CD GLN A 36 25.717 -15.031 -9.104 1.00 0.00 C ATOM 605 OE1 GLN A 36 25.990 -15.861 -9.966 1.00 0.00 O ATOM 606 NE2 GLN A 36 25.397 -13.792 -9.457 1.00 0.00 N ATOM 0 H GLN A 36 22.703 -16.502 -5.486 1.00 0.00 H new ATOM 0 HA GLN A 36 23.471 -14.493 -7.335 1.00 0.00 H new ATOM 0 HB2 GLN A 36 24.669 -16.643 -6.178 1.00 0.00 H new ATOM 0 HB3 GLN A 36 24.478 -17.181 -7.835 1.00 0.00 H new ATOM 0 HG2 GLN A 36 25.718 -14.509 -7.021 1.00 0.00 H new ATOM 0 HG3 GLN A 36 26.641 -15.950 -7.398 1.00 0.00 H new ATOM 0 HE21 GLN A 36 25.170 -13.101 -8.742 1.00 0.00 H new ATOM 0 HE22 GLN A 36 25.378 -13.531 -10.443 1.00 0.00 H new ATOM 615 N ILE A 37 22.482 -14.869 -9.492 1.00 0.00 N ATOM 616 CA ILE A 37 21.697 -14.723 -10.708 1.00 0.00 C ATOM 617 C ILE A 37 22.066 -15.829 -11.711 1.00 0.00 C ATOM 618 O ILE A 37 23.146 -16.420 -11.634 1.00 0.00 O ATOM 619 CB ILE A 37 21.979 -13.300 -11.270 1.00 0.00 C ATOM 620 CG1 ILE A 37 21.866 -12.158 -10.221 1.00 0.00 C ATOM 621 CG2 ILE A 37 21.090 -12.960 -12.478 1.00 0.00 C ATOM 622 CD1 ILE A 37 20.481 -11.986 -9.599 1.00 0.00 C ATOM 0 H ILE A 37 23.180 -14.131 -9.404 1.00 0.00 H new ATOM 0 HA ILE A 37 20.630 -14.829 -10.511 1.00 0.00 H new ATOM 0 HB ILE A 37 23.022 -13.351 -11.584 1.00 0.00 H new ATOM 0 HG12 ILE A 37 22.585 -12.345 -9.423 1.00 0.00 H new ATOM 0 HG13 ILE A 37 22.154 -11.220 -10.695 1.00 0.00 H new ATOM 0 HG21 ILE A 37 21.326 -11.957 -12.832 1.00 0.00 H new ATOM 0 HG22 ILE A 37 21.271 -13.679 -13.277 1.00 0.00 H new ATOM 0 HG23 ILE A 37 20.042 -13.003 -12.182 1.00 0.00 H new ATOM 0 HD11 ILE A 37 20.504 -11.166 -8.881 1.00 0.00 H new ATOM 0 HD12 ILE A 37 19.756 -11.763 -10.382 1.00 0.00 H new ATOM 0 HD13 ILE A 37 20.194 -12.906 -9.090 1.00 0.00 H new ATOM 634 N LEU A 38 21.187 -16.083 -12.684 1.00 0.00 N ATOM 635 CA LEU A 38 21.445 -16.924 -13.842 1.00 0.00 C ATOM 636 C LEU A 38 21.078 -16.172 -15.128 1.00 0.00 C ATOM 637 O LEU A 38 21.836 -16.261 -16.093 1.00 0.00 O ATOM 638 CB LEU A 38 20.671 -18.244 -13.706 1.00 0.00 C ATOM 639 CG LEU A 38 20.879 -19.222 -14.880 1.00 0.00 C ATOM 640 CD1 LEU A 38 22.348 -19.627 -15.039 1.00 0.00 C ATOM 641 CD2 LEU A 38 20.037 -20.478 -14.645 1.00 0.00 C ATOM 0 H LEU A 38 20.245 -15.692 -12.681 1.00 0.00 H new ATOM 0 HA LEU A 38 22.507 -17.165 -13.896 1.00 0.00 H new ATOM 0 HB2 LEU A 38 20.972 -18.735 -12.781 1.00 0.00 H new ATOM 0 HB3 LEU A 38 19.608 -18.021 -13.617 1.00 0.00 H new ATOM 0 HG LEU A 38 20.571 -18.714 -15.794 1.00 0.00 H new ATOM 0 HD11 LEU A 38 22.447 -20.316 -15.878 1.00 0.00 H new ATOM 0 HD12 LEU A 38 22.952 -18.739 -15.226 1.00 0.00 H new ATOM 0 HD13 LEU A 38 22.692 -20.114 -14.127 1.00 0.00 H new ATOM 0 HD21 LEU A 38 20.181 -21.173 -15.473 1.00 0.00 H new ATOM 0 HD22 LEU A 38 20.345 -20.954 -13.714 1.00 0.00 H new ATOM 0 HD23 LEU A 38 18.984 -20.203 -14.581 1.00 0.00 H new ATOM 653 N ASP A 39 19.983 -15.397 -15.154 1.00 0.00 N ATOM 654 CA ASP A 39 19.636 -14.534 -16.299 1.00 0.00 C ATOM 655 C ASP A 39 18.683 -13.413 -15.862 1.00 0.00 C ATOM 656 O ASP A 39 18.074 -13.524 -14.802 1.00 0.00 O ATOM 657 CB ASP A 39 19.013 -15.369 -17.437 1.00 0.00 C ATOM 658 CG ASP A 39 18.756 -14.549 -18.713 1.00 0.00 C ATOM 659 OD1 ASP A 39 19.556 -13.640 -19.028 1.00 0.00 O ATOM 660 OD2 ASP A 39 17.766 -14.836 -19.421 1.00 0.00 O ATOM 0 H ASP A 39 19.314 -15.349 -14.386 1.00 0.00 H new ATOM 0 HA ASP A 39 20.551 -14.075 -16.674 1.00 0.00 H new ATOM 0 HB2 ASP A 39 19.676 -16.201 -17.674 1.00 0.00 H new ATOM 0 HB3 ASP A 39 18.072 -15.798 -17.092 1.00 0.00 H new ATOM 665 N ILE A 40 18.534 -12.342 -16.646 1.00 0.00 N ATOM 666 CA ILE A 40 17.742 -11.151 -16.326 1.00 0.00 C ATOM 667 C ILE A 40 17.009 -10.729 -17.605 1.00 0.00 C ATOM 668 O ILE A 40 17.595 -10.769 -18.690 1.00 0.00 O ATOM 669 CB ILE A 40 18.660 -10.000 -15.827 1.00 0.00 C ATOM 670 CG1 ILE A 40 19.533 -10.407 -14.614 1.00 0.00 C ATOM 671 CG2 ILE A 40 17.811 -8.757 -15.492 1.00 0.00 C ATOM 672 CD1 ILE A 40 20.530 -9.332 -14.159 1.00 0.00 C ATOM 0 H ILE A 40 18.981 -12.278 -17.561 1.00 0.00 H new ATOM 0 HA ILE A 40 17.031 -11.372 -15.530 1.00 0.00 H new ATOM 0 HB ILE A 40 19.349 -9.765 -16.638 1.00 0.00 H new ATOM 0 HG12 ILE A 40 18.879 -10.655 -13.778 1.00 0.00 H new ATOM 0 HG13 ILE A 40 20.084 -11.313 -14.867 1.00 0.00 H new ATOM 0 HG21 ILE A 40 18.462 -7.955 -15.143 1.00 0.00 H new ATOM 0 HG22 ILE A 40 17.278 -8.429 -16.384 1.00 0.00 H new ATOM 0 HG23 ILE A 40 17.092 -9.007 -14.711 1.00 0.00 H new ATOM 0 HD11 ILE A 40 21.099 -9.701 -13.306 1.00 0.00 H new ATOM 0 HD12 ILE A 40 21.212 -9.099 -14.977 1.00 0.00 H new ATOM 0 HD13 ILE A 40 19.988 -8.431 -13.871 1.00 0.00 H new ATOM 684 N VAL A 41 15.757 -10.273 -17.477 1.00 0.00 N ATOM 685 CA VAL A 41 14.937 -9.788 -18.578 1.00 0.00 C ATOM 686 C VAL A 41 14.149 -8.554 -18.104 1.00 0.00 C ATOM 687 O VAL A 41 13.219 -8.663 -17.303 1.00 0.00 O ATOM 688 CB VAL A 41 14.006 -10.917 -19.093 1.00 0.00 C ATOM 689 CG1 VAL A 41 13.255 -10.461 -20.356 1.00 0.00 C ATOM 690 CG2 VAL A 41 14.752 -12.217 -19.445 1.00 0.00 C ATOM 0 H VAL A 41 15.279 -10.233 -16.577 1.00 0.00 H new ATOM 0 HA VAL A 41 15.566 -9.491 -19.417 1.00 0.00 H new ATOM 0 HB VAL A 41 13.322 -11.123 -18.270 1.00 0.00 H new ATOM 0 HG11 VAL A 41 12.606 -11.265 -20.704 1.00 0.00 H new ATOM 0 HG12 VAL A 41 12.652 -9.583 -20.124 1.00 0.00 H new ATOM 0 HG13 VAL A 41 13.974 -10.211 -21.136 1.00 0.00 H new ATOM 0 HG21 VAL A 41 14.039 -12.962 -19.798 1.00 0.00 H new ATOM 0 HG22 VAL A 41 15.484 -12.016 -20.227 1.00 0.00 H new ATOM 0 HG23 VAL A 41 15.263 -12.595 -18.559 1.00 0.00 H new ATOM 700 N ALA A 42 14.535 -7.369 -18.587 1.00 0.00 N ATOM 701 CA ALA A 42 13.815 -6.109 -18.463 1.00 0.00 C ATOM 702 C ALA A 42 14.077 -5.333 -19.761 1.00 0.00 C ATOM 703 O ALA A 42 15.143 -5.496 -20.359 1.00 0.00 O ATOM 704 CB ALA A 42 14.324 -5.328 -17.251 1.00 0.00 C ATOM 0 H ALA A 42 15.408 -7.263 -19.103 1.00 0.00 H new ATOM 0 HA ALA A 42 12.747 -6.271 -18.315 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.778 -4.388 -17.169 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.170 -5.918 -16.347 1.00 0.00 H new ATOM 0 HB3 ALA A 42 15.387 -5.121 -17.372 1.00 0.00 H new ATOM 710 N LEU A 43 13.142 -4.481 -20.193 1.00 0.00 N ATOM 711 CA LEU A 43 13.241 -3.681 -21.421 1.00 0.00 C ATOM 712 C LEU A 43 12.590 -2.318 -21.170 1.00 0.00 C ATOM 713 O LEU A 43 11.741 -2.194 -20.291 1.00 0.00 O ATOM 714 CB LEU A 43 12.515 -4.381 -22.590 1.00 0.00 C ATOM 715 CG LEU A 43 13.120 -5.716 -23.066 1.00 0.00 C ATOM 716 CD1 LEU A 43 12.163 -6.386 -24.056 1.00 0.00 C ATOM 717 CD2 LEU A 43 14.487 -5.518 -23.734 1.00 0.00 C ATOM 0 H LEU A 43 12.271 -4.323 -19.686 1.00 0.00 H new ATOM 0 HA LEU A 43 14.292 -3.563 -21.686 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.482 -4.560 -22.293 1.00 0.00 H new ATOM 0 HB3 LEU A 43 12.489 -3.695 -23.437 1.00 0.00 H new ATOM 0 HG LEU A 43 13.264 -6.348 -22.190 1.00 0.00 H new ATOM 0 HD11 LEU A 43 12.591 -7.330 -24.393 1.00 0.00 H new ATOM 0 HD12 LEU A 43 11.207 -6.574 -23.567 1.00 0.00 H new ATOM 0 HD13 LEU A 43 12.009 -5.731 -24.913 1.00 0.00 H new ATOM 0 HD21 LEU A 43 14.878 -6.483 -24.055 1.00 0.00 H new ATOM 0 HD22 LEU A 43 14.378 -4.865 -24.600 1.00 0.00 H new ATOM 0 HD23 LEU A 43 15.177 -5.065 -23.023 1.00 0.00 H new ATOM 729 N LYS A 44 12.964 -1.286 -21.933 1.00 0.00 N ATOM 730 CA LYS A 44 12.341 0.044 -21.829 1.00 0.00 C ATOM 731 C LYS A 44 11.034 0.156 -22.614 1.00 0.00 C ATOM 732 O LYS A 44 10.369 1.191 -22.524 1.00 0.00 O ATOM 733 CB LYS A 44 13.349 1.144 -22.222 1.00 0.00 C ATOM 734 CG LYS A 44 13.828 1.055 -23.685 1.00 0.00 C ATOM 735 CD LYS A 44 14.688 2.255 -24.116 1.00 0.00 C ATOM 736 CE LYS A 44 16.017 2.356 -23.350 1.00 0.00 C ATOM 737 NZ LYS A 44 16.847 3.489 -23.831 1.00 0.00 N ATOM 0 H LYS A 44 13.701 -1.344 -22.636 1.00 0.00 H new ATOM 0 HA LYS A 44 12.065 0.190 -20.785 1.00 0.00 H new ATOM 0 HB2 LYS A 44 12.891 2.119 -22.058 1.00 0.00 H new ATOM 0 HB3 LYS A 44 14.214 1.084 -21.562 1.00 0.00 H new ATOM 0 HG2 LYS A 44 14.403 0.138 -23.817 1.00 0.00 H new ATOM 0 HG3 LYS A 44 12.960 0.984 -24.341 1.00 0.00 H new ATOM 0 HD2 LYS A 44 14.896 2.179 -25.183 1.00 0.00 H new ATOM 0 HD3 LYS A 44 14.120 3.173 -23.967 1.00 0.00 H new ATOM 0 HE2 LYS A 44 15.815 2.480 -22.286 1.00 0.00 H new ATOM 0 HE3 LYS A 44 16.573 1.425 -23.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 17.734 3.523 -23.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 17.062 3.358 -24.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 16.327 4.380 -23.700 1.00 0.00 H new ATOM 751 N THR A 45 10.671 -0.870 -23.382 1.00 0.00 N ATOM 752 CA THR A 45 9.386 -0.961 -24.048 1.00 0.00 C ATOM 753 C THR A 45 8.268 -0.984 -23.000 1.00 0.00 C ATOM 754 O THR A 45 8.483 -1.355 -21.842 1.00 0.00 O ATOM 755 CB THR A 45 9.384 -2.223 -24.934 1.00 0.00 C ATOM 756 OG1 THR A 45 9.898 -3.328 -24.213 1.00 0.00 O ATOM 757 CG2 THR A 45 10.263 -2.029 -26.174 1.00 0.00 C ATOM 0 H THR A 45 11.277 -1.672 -23.558 1.00 0.00 H new ATOM 0 HA THR A 45 9.212 -0.095 -24.687 1.00 0.00 H new ATOM 0 HB THR A 45 8.352 -2.404 -25.236 1.00 0.00 H new ATOM 0 HG1 THR A 45 9.890 -4.124 -24.785 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.242 -2.935 -26.780 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.885 -1.191 -26.760 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.288 -1.822 -25.865 1.00 0.00 H new ATOM 765 N LEU A 46 7.048 -0.618 -23.411 1.00 0.00 N ATOM 766 CA LEU A 46 5.877 -0.568 -22.536 1.00 0.00 C ATOM 767 C LEU A 46 5.653 -1.898 -21.808 1.00 0.00 C ATOM 768 O LEU A 46 5.303 -1.899 -20.627 1.00 0.00 O ATOM 769 CB LEU A 46 4.671 -0.110 -23.368 1.00 0.00 C ATOM 770 CG LEU A 46 3.352 0.042 -22.575 1.00 0.00 C ATOM 771 CD1 LEU A 46 2.492 1.142 -23.208 1.00 0.00 C ATOM 772 CD2 LEU A 46 2.517 -1.248 -22.550 1.00 0.00 C ATOM 0 H LEU A 46 6.847 -0.345 -24.373 1.00 0.00 H new ATOM 0 HA LEU A 46 6.035 0.157 -21.737 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.911 0.846 -23.832 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.512 -0.825 -24.175 1.00 0.00 H new ATOM 0 HG LEU A 46 3.635 0.290 -21.552 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.564 1.246 -22.647 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.036 2.086 -23.188 1.00 0.00 H new ATOM 0 HD13 LEU A 46 2.264 0.877 -24.240 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.604 -1.079 -21.979 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.260 -1.535 -23.570 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.094 -2.046 -22.083 1.00 0.00 H new ATOM 784 N LYS A 47 5.929 -3.023 -22.481 1.00 0.00 N ATOM 785 CA LYS A 47 5.829 -4.378 -21.932 1.00 0.00 C ATOM 786 C LYS A 47 6.583 -4.544 -20.608 1.00 0.00 C ATOM 787 O LYS A 47 6.158 -5.344 -19.777 1.00 0.00 O ATOM 788 CB LYS A 47 6.338 -5.371 -23.001 1.00 0.00 C ATOM 789 CG LYS A 47 6.334 -6.859 -22.596 1.00 0.00 C ATOM 790 CD LYS A 47 4.970 -7.432 -22.181 1.00 0.00 C ATOM 791 CE LYS A 47 3.966 -7.438 -23.342 1.00 0.00 C ATOM 792 NZ LYS A 47 2.679 -8.055 -22.944 1.00 0.00 N ATOM 0 H LYS A 47 6.238 -3.013 -23.453 1.00 0.00 H new ATOM 0 HA LYS A 47 4.785 -4.582 -21.694 1.00 0.00 H new ATOM 0 HB2 LYS A 47 5.726 -5.257 -23.896 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.356 -5.091 -23.273 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.715 -7.445 -23.432 1.00 0.00 H new ATOM 0 HG3 LYS A 47 7.031 -6.993 -21.769 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.102 -8.449 -21.812 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.566 -6.844 -21.357 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.792 -6.416 -23.679 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.387 -7.985 -24.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.094 -8.213 -23.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 2.861 -8.965 -22.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 2.178 -7.421 -22.290 1.00 0.00 H new ATOM 806 N MET A 48 7.681 -3.818 -20.385 1.00 0.00 N ATOM 807 CA MET A 48 8.552 -3.995 -19.221 1.00 0.00 C ATOM 808 C MET A 48 8.915 -2.638 -18.598 1.00 0.00 C ATOM 809 O MET A 48 9.919 -2.508 -17.897 1.00 0.00 O ATOM 810 CB MET A 48 9.781 -4.822 -19.624 1.00 0.00 C ATOM 811 CG MET A 48 9.419 -6.200 -20.194 1.00 0.00 C ATOM 812 SD MET A 48 10.616 -7.503 -19.826 1.00 0.00 S ATOM 813 CE MET A 48 9.978 -8.001 -18.201 1.00 0.00 C ATOM 0 H MET A 48 7.994 -3.081 -21.016 1.00 0.00 H new ATOM 0 HA MET A 48 8.025 -4.549 -18.444 1.00 0.00 H new ATOM 0 HB2 MET A 48 10.357 -4.268 -20.366 1.00 0.00 H new ATOM 0 HB3 MET A 48 10.425 -4.953 -18.754 1.00 0.00 H new ATOM 0 HG2 MET A 48 8.446 -6.497 -19.802 1.00 0.00 H new ATOM 0 HG3 MET A 48 9.314 -6.115 -21.276 1.00 0.00 H new ATOM 0 HE1 MET A 48 10.725 -8.605 -17.686 1.00 0.00 H new ATOM 0 HE2 MET A 48 9.758 -7.113 -17.609 1.00 0.00 H new ATOM 0 HE3 MET A 48 9.067 -8.585 -18.331 1.00 0.00 H new ATOM 823 N ARG A 49 8.087 -1.612 -18.831 1.00 0.00 N ATOM 824 CA ARG A 49 8.399 -0.221 -18.498 1.00 0.00 C ATOM 825 C ARG A 49 8.802 -0.020 -17.038 1.00 0.00 C ATOM 826 O ARG A 49 9.752 0.721 -16.779 1.00 0.00 O ATOM 827 CB ARG A 49 7.193 0.652 -18.891 1.00 0.00 C ATOM 828 CG ARG A 49 7.492 2.153 -18.966 1.00 0.00 C ATOM 829 CD ARG A 49 8.507 2.504 -20.063 1.00 0.00 C ATOM 830 NE ARG A 49 8.801 3.940 -20.045 1.00 0.00 N ATOM 831 CZ ARG A 49 9.604 4.606 -20.874 1.00 0.00 C ATOM 832 NH1 ARG A 49 10.226 3.998 -21.885 1.00 0.00 N ATOM 833 NH2 ARG A 49 9.758 5.902 -20.645 1.00 0.00 N ATOM 0 H ARG A 49 7.170 -1.729 -19.262 1.00 0.00 H new ATOM 0 HA ARG A 49 9.279 0.081 -19.066 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.821 0.320 -19.860 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.393 0.490 -18.169 1.00 0.00 H new ATOM 0 HG2 ARG A 49 6.564 2.695 -19.149 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.874 2.491 -18.003 1.00 0.00 H new ATOM 0 HD2 ARG A 49 9.425 1.936 -19.913 1.00 0.00 H new ATOM 0 HD3 ARG A 49 8.112 2.219 -21.038 1.00 0.00 H new ATOM 0 HE ARG A 49 8.341 4.489 -19.319 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.092 2.999 -22.039 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.835 4.532 -22.504 1.00 0.00 H new ATOM 0 HH21 ARG A 49 9.273 6.343 -19.864 1.00 0.00 H new ATOM 0 HH22 ARG A 49 10.362 6.459 -21.250 1.00 0.00 H new ATOM 847 N GLY A 50 8.133 -0.703 -16.110 1.00 0.00 N ATOM 848 CA GLY A 50 8.424 -0.662 -14.679 1.00 0.00 C ATOM 849 C GLY A 50 8.336 -2.056 -14.058 1.00 0.00 C ATOM 850 O GLY A 50 7.989 -2.187 -12.882 1.00 0.00 O ATOM 0 H GLY A 50 7.352 -1.317 -16.340 1.00 0.00 H new ATOM 0 HA2 GLY A 50 9.421 -0.252 -14.519 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.721 0.006 -14.181 1.00 0.00 H new ATOM 854 N GLN A 51 8.616 -3.102 -14.842 1.00 0.00 N ATOM 855 CA GLN A 51 8.519 -4.495 -14.422 1.00 0.00 C ATOM 856 C GLN A 51 9.613 -5.300 -15.130 1.00 0.00 C ATOM 857 O GLN A 51 10.065 -4.916 -16.206 1.00 0.00 O ATOM 858 CB GLN A 51 7.091 -5.027 -14.661 1.00 0.00 C ATOM 859 CG GLN A 51 6.572 -4.956 -16.111 1.00 0.00 C ATOM 860 CD GLN A 51 5.072 -5.264 -16.248 1.00 0.00 C ATOM 861 OE1 GLN A 51 4.285 -5.140 -15.311 1.00 0.00 O ATOM 862 NE2 GLN A 51 4.622 -5.646 -17.431 1.00 0.00 N ATOM 0 H GLN A 51 8.923 -2.996 -15.809 1.00 0.00 H new ATOM 0 HA GLN A 51 8.691 -4.595 -13.350 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.053 -6.066 -14.334 1.00 0.00 H new ATOM 0 HB3 GLN A 51 6.406 -4.468 -14.024 1.00 0.00 H new ATOM 0 HG2 GLN A 51 6.767 -3.960 -16.509 1.00 0.00 H new ATOM 0 HG3 GLN A 51 7.135 -5.660 -16.724 1.00 0.00 H new ATOM 0 HE21 GLN A 51 5.268 -5.751 -18.213 1.00 0.00 H new ATOM 0 HE22 GLN A 51 3.628 -5.836 -17.562 1.00 0.00 H new ATOM 871 N ALA A 52 10.058 -6.395 -14.522 1.00 0.00 N ATOM 872 CA ALA A 52 11.227 -7.169 -14.921 1.00 0.00 C ATOM 873 C ALA A 52 11.077 -8.580 -14.364 1.00 0.00 C ATOM 874 O ALA A 52 10.362 -8.770 -13.380 1.00 0.00 O ATOM 875 CB ALA A 52 12.481 -6.530 -14.307 1.00 0.00 C ATOM 0 H ALA A 52 9.593 -6.784 -13.702 1.00 0.00 H new ATOM 0 HA ALA A 52 11.315 -7.191 -16.007 1.00 0.00 H new ATOM 0 HB1 ALA A 52 13.361 -7.102 -14.600 1.00 0.00 H new ATOM 0 HB2 ALA A 52 12.579 -5.505 -14.664 1.00 0.00 H new ATOM 0 HB3 ALA A 52 12.394 -6.529 -13.220 1.00 0.00 H new ATOM 881 N PHE A 53 11.776 -9.558 -14.930 1.00 0.00 N ATOM 882 CA PHE A 53 11.880 -10.883 -14.335 1.00 0.00 C ATOM 883 C PHE A 53 13.330 -11.343 -14.408 1.00 0.00 C ATOM 884 O PHE A 53 14.107 -10.884 -15.247 1.00 0.00 O ATOM 885 CB PHE A 53 10.864 -11.884 -14.917 1.00 0.00 C ATOM 886 CG PHE A 53 10.928 -12.197 -16.399 1.00 0.00 C ATOM 887 CD1 PHE A 53 11.709 -13.276 -16.859 1.00 0.00 C ATOM 888 CD2 PHE A 53 10.112 -11.492 -17.305 1.00 0.00 C ATOM 889 CE1 PHE A 53 11.674 -13.645 -18.215 1.00 0.00 C ATOM 890 CE2 PHE A 53 10.085 -11.854 -18.663 1.00 0.00 C ATOM 891 CZ PHE A 53 10.861 -12.936 -19.118 1.00 0.00 C ATOM 0 H PHE A 53 12.283 -9.455 -15.809 1.00 0.00 H new ATOM 0 HA PHE A 53 11.601 -10.830 -13.283 1.00 0.00 H new ATOM 0 HB2 PHE A 53 10.975 -12.823 -14.374 1.00 0.00 H new ATOM 0 HB3 PHE A 53 9.865 -11.507 -14.700 1.00 0.00 H new ATOM 0 HD1 PHE A 53 12.336 -13.821 -16.168 1.00 0.00 H new ATOM 0 HD2 PHE A 53 9.505 -10.670 -16.955 1.00 0.00 H new ATOM 0 HE1 PHE A 53 12.272 -14.474 -18.564 1.00 0.00 H new ATOM 0 HE2 PHE A 53 9.469 -11.302 -19.357 1.00 0.00 H new ATOM 0 HZ PHE A 53 10.833 -13.222 -20.159 1.00 0.00 H new ATOM 901 N VAL A 54 13.717 -12.208 -13.480 1.00 0.00 N ATOM 902 CA VAL A 54 15.103 -12.603 -13.270 1.00 0.00 C ATOM 903 C VAL A 54 15.088 -14.053 -12.803 1.00 0.00 C ATOM 904 O VAL A 54 14.205 -14.476 -12.049 1.00 0.00 O ATOM 905 CB VAL A 54 15.831 -11.587 -12.350 1.00 0.00 C ATOM 906 CG1 VAL A 54 15.022 -11.097 -11.139 1.00 0.00 C ATOM 907 CG2 VAL A 54 17.182 -12.092 -11.825 1.00 0.00 C ATOM 0 H VAL A 54 13.065 -12.663 -12.841 1.00 0.00 H new ATOM 0 HA VAL A 54 15.698 -12.572 -14.183 1.00 0.00 H new ATOM 0 HB VAL A 54 15.977 -10.747 -13.029 1.00 0.00 H new ATOM 0 HG11 VAL A 54 15.621 -10.392 -10.563 1.00 0.00 H new ATOM 0 HG12 VAL A 54 14.113 -10.604 -11.484 1.00 0.00 H new ATOM 0 HG13 VAL A 54 14.757 -11.947 -10.510 1.00 0.00 H new ATOM 0 HG21 VAL A 54 17.633 -11.330 -11.189 1.00 0.00 H new ATOM 0 HG22 VAL A 54 17.030 -13.003 -11.247 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.844 -12.302 -12.665 1.00 0.00 H new ATOM 917 N ILE A 55 16.043 -14.808 -13.332 1.00 0.00 N ATOM 918 CA ILE A 55 16.180 -16.245 -13.257 1.00 0.00 C ATOM 919 C ILE A 55 17.428 -16.466 -12.404 1.00 0.00 C ATOM 920 O ILE A 55 18.430 -15.765 -12.591 1.00 0.00 O ATOM 921 CB ILE A 55 16.373 -16.833 -14.684 1.00 0.00 C ATOM 922 CG1 ILE A 55 15.278 -16.533 -15.744 1.00 0.00 C ATOM 923 CG2 ILE A 55 16.508 -18.363 -14.592 1.00 0.00 C ATOM 924 CD1 ILE A 55 15.132 -15.083 -16.234 1.00 0.00 C ATOM 0 H ILE A 55 16.802 -14.388 -13.868 1.00 0.00 H new ATOM 0 HA ILE A 55 15.303 -16.733 -12.831 1.00 0.00 H new ATOM 0 HB ILE A 55 17.268 -16.322 -15.040 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.472 -17.162 -16.613 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.318 -16.845 -15.332 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.643 -18.777 -15.591 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.370 -18.616 -13.975 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.606 -18.782 -14.145 1.00 0.00 H new ATOM 0 HD11 ILE A 55 14.330 -15.027 -16.970 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.896 -14.436 -15.390 1.00 0.00 H new ATOM 0 HD13 ILE A 55 16.067 -14.757 -16.690 1.00 0.00 H new ATOM 936 N PHE A 56 17.394 -17.459 -11.516 1.00 0.00 N ATOM 937 CA PHE A 56 18.467 -17.769 -10.576 1.00 0.00 C ATOM 938 C PHE A 56 18.919 -19.214 -10.788 1.00 0.00 C ATOM 939 O PHE A 56 18.300 -19.968 -11.545 1.00 0.00 O ATOM 940 CB PHE A 56 17.981 -17.539 -9.138 1.00 0.00 C ATOM 941 CG PHE A 56 17.476 -16.131 -8.852 1.00 0.00 C ATOM 942 CD1 PHE A 56 16.202 -15.708 -9.281 1.00 0.00 C ATOM 943 CD2 PHE A 56 18.305 -15.225 -8.168 1.00 0.00 C ATOM 944 CE1 PHE A 56 15.789 -14.382 -9.065 1.00 0.00 C ATOM 945 CE2 PHE A 56 17.877 -13.909 -7.921 1.00 0.00 C ATOM 946 CZ PHE A 56 16.623 -13.482 -8.385 1.00 0.00 C ATOM 0 H PHE A 56 16.595 -18.087 -11.429 1.00 0.00 H new ATOM 0 HA PHE A 56 19.319 -17.112 -10.750 1.00 0.00 H new ATOM 0 HB2 PHE A 56 17.181 -18.248 -8.922 1.00 0.00 H new ATOM 0 HB3 PHE A 56 18.799 -17.763 -8.453 1.00 0.00 H new ATOM 0 HD1 PHE A 56 15.542 -16.404 -9.777 1.00 0.00 H new ATOM 0 HD2 PHE A 56 19.280 -15.543 -7.829 1.00 0.00 H new ATOM 0 HE1 PHE A 56 14.825 -14.054 -9.424 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.512 -13.227 -7.375 1.00 0.00 H new ATOM 0 HZ PHE A 56 16.301 -12.464 -8.219 1.00 0.00 H new ATOM 956 N LYS A 57 20.019 -19.616 -10.145 1.00 0.00 N ATOM 957 CA LYS A 57 20.578 -20.952 -10.367 1.00 0.00 C ATOM 958 C LYS A 57 19.708 -22.051 -9.752 1.00 0.00 C ATOM 959 O LYS A 57 19.704 -23.166 -10.274 1.00 0.00 O ATOM 960 CB LYS A 57 22.017 -21.051 -9.838 1.00 0.00 C ATOM 961 CG LYS A 57 22.932 -19.945 -10.391 1.00 0.00 C ATOM 962 CD LYS A 57 24.410 -20.263 -10.124 1.00 0.00 C ATOM 963 CE LYS A 57 25.278 -19.000 -10.075 1.00 0.00 C ATOM 964 NZ LYS A 57 25.284 -18.207 -11.328 1.00 0.00 N ATOM 0 H LYS A 57 20.534 -19.044 -9.475 1.00 0.00 H new ATOM 0 HA LYS A 57 20.594 -21.108 -11.446 1.00 0.00 H new ATOM 0 HB2 LYS A 57 22.004 -20.995 -8.750 1.00 0.00 H new ATOM 0 HB3 LYS A 57 22.430 -22.024 -10.102 1.00 0.00 H new ATOM 0 HG2 LYS A 57 22.769 -19.836 -11.463 1.00 0.00 H new ATOM 0 HG3 LYS A 57 22.673 -18.991 -9.931 1.00 0.00 H new ATOM 0 HD2 LYS A 57 24.499 -20.799 -9.179 1.00 0.00 H new ATOM 0 HD3 LYS A 57 24.783 -20.927 -10.904 1.00 0.00 H new ATOM 0 HE2 LYS A 57 24.928 -18.366 -9.261 1.00 0.00 H new ATOM 0 HE3 LYS A 57 26.302 -19.288 -9.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 25.781 -17.308 -11.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 25.770 -18.742 -12.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 24.305 -18.014 -11.621 1.00 0.00 H new ATOM 978 N GLU A 58 18.977 -21.763 -8.671 1.00 0.00 N ATOM 979 CA GLU A 58 18.177 -22.738 -7.932 1.00 0.00 C ATOM 980 C GLU A 58 16.929 -22.047 -7.378 1.00 0.00 C ATOM 981 O GLU A 58 16.945 -20.839 -7.118 1.00 0.00 O ATOM 982 CB GLU A 58 18.987 -23.335 -6.763 1.00 0.00 C ATOM 983 CG GLU A 58 20.187 -24.188 -7.199 1.00 0.00 C ATOM 984 CD GLU A 58 20.871 -24.859 -5.995 1.00 0.00 C ATOM 985 OE1 GLU A 58 20.443 -25.961 -5.579 1.00 0.00 O ATOM 986 OE2 GLU A 58 21.861 -24.307 -5.462 1.00 0.00 O ATOM 0 H GLU A 58 18.925 -20.823 -8.278 1.00 0.00 H new ATOM 0 HA GLU A 58 17.894 -23.544 -8.609 1.00 0.00 H new ATOM 0 HB2 GLU A 58 19.344 -22.522 -6.131 1.00 0.00 H new ATOM 0 HB3 GLU A 58 18.324 -23.947 -6.151 1.00 0.00 H new ATOM 0 HG2 GLU A 58 19.855 -24.952 -7.902 1.00 0.00 H new ATOM 0 HG3 GLU A 58 20.907 -23.562 -7.725 1.00 0.00 H new ATOM 993 N ILE A 59 15.863 -22.822 -7.152 1.00 0.00 N ATOM 994 CA ILE A 59 14.597 -22.321 -6.614 1.00 0.00 C ATOM 995 C ILE A 59 14.769 -21.731 -5.210 1.00 0.00 C ATOM 996 O ILE A 59 14.098 -20.756 -4.875 1.00 0.00 O ATOM 997 CB ILE A 59 13.499 -23.416 -6.652 1.00 0.00 C ATOM 998 CG1 ILE A 59 13.745 -24.584 -5.665 1.00 0.00 C ATOM 999 CG2 ILE A 59 13.314 -23.943 -8.083 1.00 0.00 C ATOM 1000 CD1 ILE A 59 12.665 -25.673 -5.692 1.00 0.00 C ATOM 0 H ILE A 59 15.856 -23.825 -7.340 1.00 0.00 H new ATOM 0 HA ILE A 59 14.266 -21.506 -7.258 1.00 0.00 H new ATOM 0 HB ILE A 59 12.580 -22.934 -6.320 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.709 -25.039 -5.893 1.00 0.00 H new ATOM 0 HG13 ILE A 59 13.813 -24.182 -4.654 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.540 -24.710 -8.091 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.019 -23.123 -8.737 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.252 -24.370 -8.438 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.915 -26.452 -4.972 1.00 0.00 H new ATOM 0 HD12 ILE A 59 11.701 -25.236 -5.433 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.610 -26.107 -6.691 1.00 0.00 H new ATOM 1012 N GLY A 60 15.672 -22.291 -4.395 1.00 0.00 N ATOM 1013 CA GLY A 60 15.905 -21.817 -3.037 1.00 0.00 C ATOM 1014 C GLY A 60 16.545 -20.436 -3.068 1.00 0.00 C ATOM 1015 O GLY A 60 16.083 -19.528 -2.378 1.00 0.00 O ATOM 0 H GLY A 60 16.257 -23.083 -4.663 1.00 0.00 H new ATOM 0 HA2 GLY A 60 14.963 -21.778 -2.491 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.553 -22.515 -2.506 1.00 0.00 H new ATOM 1019 N SER A 61 17.551 -20.248 -3.924 1.00 0.00 N ATOM 1020 CA SER A 61 18.219 -18.971 -4.125 1.00 0.00 C ATOM 1021 C SER A 61 17.227 -17.919 -4.622 1.00 0.00 C ATOM 1022 O SER A 61 17.198 -16.808 -4.092 1.00 0.00 O ATOM 1023 CB SER A 61 19.367 -19.166 -5.124 1.00 0.00 C ATOM 1024 OG SER A 61 20.185 -20.257 -4.730 1.00 0.00 O ATOM 0 H SER A 61 17.928 -20.996 -4.506 1.00 0.00 H new ATOM 0 HA SER A 61 18.625 -18.613 -3.179 1.00 0.00 H new ATOM 0 HB2 SER A 61 18.964 -19.347 -6.120 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.965 -18.257 -5.182 1.00 0.00 H new ATOM 0 HG SER A 61 20.912 -20.371 -5.377 1.00 0.00 H new ATOM 1030 N ALA A 62 16.375 -18.281 -5.590 1.00 0.00 N ATOM 1031 CA ALA A 62 15.339 -17.393 -6.094 1.00 0.00 C ATOM 1032 C ALA A 62 14.374 -16.988 -4.978 1.00 0.00 C ATOM 1033 O ALA A 62 14.081 -15.803 -4.831 1.00 0.00 O ATOM 1034 CB ALA A 62 14.573 -18.093 -7.213 1.00 0.00 C ATOM 0 H ALA A 62 16.391 -19.196 -6.040 1.00 0.00 H new ATOM 0 HA ALA A 62 15.811 -16.489 -6.479 1.00 0.00 H new ATOM 0 HB1 ALA A 62 13.796 -17.429 -7.592 1.00 0.00 H new ATOM 0 HB2 ALA A 62 15.260 -18.347 -8.021 1.00 0.00 H new ATOM 0 HB3 ALA A 62 14.115 -19.004 -6.826 1.00 0.00 H new ATOM 1040 N SER A 63 13.902 -17.947 -4.175 1.00 0.00 N ATOM 1041 CA SER A 63 12.980 -17.670 -3.080 1.00 0.00 C ATOM 1042 C SER A 63 13.635 -16.748 -2.055 1.00 0.00 C ATOM 1043 O SER A 63 13.021 -15.778 -1.613 1.00 0.00 O ATOM 1044 CB SER A 63 12.529 -18.982 -2.425 1.00 0.00 C ATOM 1045 OG SER A 63 11.246 -18.831 -1.836 1.00 0.00 O ATOM 0 H SER A 63 14.150 -18.932 -4.269 1.00 0.00 H new ATOM 0 HA SER A 63 12.100 -17.164 -3.478 1.00 0.00 H new ATOM 0 HB2 SER A 63 12.502 -19.776 -3.171 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.251 -19.283 -1.665 1.00 0.00 H new ATOM 0 HG SER A 63 10.837 -19.713 -1.713 1.00 0.00 H new ATOM 1051 N ASN A 64 14.889 -17.024 -1.696 1.00 0.00 N ATOM 1052 CA ASN A 64 15.597 -16.251 -0.687 1.00 0.00 C ATOM 1053 C ASN A 64 15.804 -14.817 -1.158 1.00 0.00 C ATOM 1054 O ASN A 64 15.560 -13.885 -0.394 1.00 0.00 O ATOM 1055 CB ASN A 64 16.932 -16.910 -0.327 1.00 0.00 C ATOM 1056 CG ASN A 64 17.572 -16.188 0.856 1.00 0.00 C ATOM 1057 OD1 ASN A 64 17.011 -16.147 1.948 1.00 0.00 O ATOM 1058 ND2 ASN A 64 18.749 -15.620 0.677 1.00 0.00 N ATOM 0 H ASN A 64 15.436 -17.786 -2.096 1.00 0.00 H new ATOM 0 HA ASN A 64 14.985 -16.227 0.215 1.00 0.00 H new ATOM 0 HB2 ASN A 64 16.773 -17.960 -0.080 1.00 0.00 H new ATOM 0 HB3 ASN A 64 17.603 -16.883 -1.186 1.00 0.00 H new ATOM 0 HD21 ASN A 64 19.206 -15.138 1.451 1.00 0.00 H new ATOM 0 HD22 ASN A 64 19.202 -15.663 -0.236 1.00 0.00 H new ATOM 1065 N ALA A 65 16.183 -14.633 -2.426 1.00 0.00 N ATOM 1066 CA ALA A 65 16.277 -13.330 -3.063 1.00 0.00 C ATOM 1067 C ALA A 65 14.934 -12.609 -2.979 1.00 0.00 C ATOM 1068 O ALA A 65 14.868 -11.507 -2.438 1.00 0.00 O ATOM 1069 CB ALA A 65 16.719 -13.496 -4.523 1.00 0.00 C ATOM 0 H ALA A 65 16.436 -15.404 -3.044 1.00 0.00 H new ATOM 0 HA ALA A 65 17.021 -12.726 -2.543 1.00 0.00 H new ATOM 0 HB1 ALA A 65 16.788 -12.516 -4.996 1.00 0.00 H new ATOM 0 HB2 ALA A 65 17.693 -13.984 -4.555 1.00 0.00 H new ATOM 0 HB3 ALA A 65 15.990 -14.106 -5.057 1.00 0.00 H new ATOM 1075 N LEU A 66 13.864 -13.249 -3.461 1.00 0.00 N ATOM 1076 CA LEU A 66 12.511 -12.700 -3.490 1.00 0.00 C ATOM 1077 C LEU A 66 12.126 -12.216 -2.096 1.00 0.00 C ATOM 1078 O LEU A 66 11.842 -11.038 -1.901 1.00 0.00 O ATOM 1079 CB LEU A 66 11.546 -13.791 -4.007 1.00 0.00 C ATOM 1080 CG LEU A 66 10.160 -13.331 -4.495 1.00 0.00 C ATOM 1081 CD1 LEU A 66 9.382 -14.563 -4.974 1.00 0.00 C ATOM 1082 CD2 LEU A 66 9.312 -12.612 -3.444 1.00 0.00 C ATOM 0 H LEU A 66 13.920 -14.189 -3.852 1.00 0.00 H new ATOM 0 HA LEU A 66 12.455 -11.843 -4.162 1.00 0.00 H new ATOM 0 HB2 LEU A 66 12.036 -14.314 -4.828 1.00 0.00 H new ATOM 0 HB3 LEU A 66 11.399 -14.518 -3.208 1.00 0.00 H new ATOM 0 HG LEU A 66 10.345 -12.606 -5.288 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.396 -14.257 -5.324 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.924 -15.041 -5.790 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.272 -15.267 -4.149 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.355 -12.327 -3.881 1.00 0.00 H new ATOM 0 HD22 LEU A 66 9.140 -13.277 -2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.835 -11.719 -3.103 1.00 0.00 H new ATOM 1094 N ARG A 67 12.144 -13.109 -1.109 1.00 0.00 N ATOM 1095 CA ARG A 67 11.592 -12.828 0.211 1.00 0.00 C ATOM 1096 C ARG A 67 12.478 -11.869 1.005 1.00 0.00 C ATOM 1097 O ARG A 67 11.940 -11.119 1.820 1.00 0.00 O ATOM 1098 CB ARG A 67 11.335 -14.166 0.934 1.00 0.00 C ATOM 1099 CG ARG A 67 10.134 -14.900 0.295 1.00 0.00 C ATOM 1100 CD ARG A 67 10.271 -16.430 0.256 1.00 0.00 C ATOM 1101 NE ARG A 67 10.074 -17.058 1.567 1.00 0.00 N ATOM 1102 CZ ARG A 67 10.343 -18.331 1.873 1.00 0.00 C ATOM 1103 NH1 ARG A 67 10.853 -19.178 0.980 1.00 0.00 N ATOM 1104 NH2 ARG A 67 10.088 -18.732 3.110 1.00 0.00 N ATOM 0 H ARG A 67 12.541 -14.044 -1.203 1.00 0.00 H new ATOM 0 HA ARG A 67 10.640 -12.308 0.111 1.00 0.00 H new ATOM 0 HB2 ARG A 67 12.225 -14.794 0.879 1.00 0.00 H new ATOM 0 HB3 ARG A 67 11.138 -13.984 1.991 1.00 0.00 H new ATOM 0 HG2 ARG A 67 9.231 -14.643 0.848 1.00 0.00 H new ATOM 0 HG3 ARG A 67 10.000 -14.534 -0.723 1.00 0.00 H new ATOM 0 HD2 ARG A 67 9.545 -16.836 -0.448 1.00 0.00 H new ATOM 0 HD3 ARG A 67 11.260 -16.691 -0.121 1.00 0.00 H new ATOM 0 HE ARG A 67 9.698 -16.471 2.312 1.00 0.00 H new ATOM 0 HH11 ARG A 67 11.050 -18.861 0.031 1.00 0.00 H new ATOM 0 HH12 ARG A 67 11.047 -20.144 1.246 1.00 0.00 H new ATOM 0 HH21 ARG A 67 9.700 -18.077 3.789 1.00 0.00 H new ATOM 0 HH22 ARG A 67 10.279 -19.696 3.383 1.00 0.00 H new ATOM 1118 N THR A 68 13.791 -11.824 0.759 1.00 0.00 N ATOM 1119 CA THR A 68 14.645 -10.802 1.364 1.00 0.00 C ATOM 1120 C THR A 68 14.349 -9.429 0.745 1.00 0.00 C ATOM 1121 O THR A 68 14.266 -8.433 1.466 1.00 0.00 O ATOM 1122 CB THR A 68 16.130 -11.184 1.210 1.00 0.00 C ATOM 1123 OG1 THR A 68 16.355 -12.480 1.725 1.00 0.00 O ATOM 1124 CG2 THR A 68 17.058 -10.223 1.960 1.00 0.00 C ATOM 0 H THR A 68 14.281 -12.479 0.150 1.00 0.00 H new ATOM 0 HA THR A 68 14.428 -10.742 2.430 1.00 0.00 H new ATOM 0 HB THR A 68 16.352 -11.137 0.144 1.00 0.00 H new ATOM 0 HG1 THR A 68 16.338 -13.131 0.992 1.00 0.00 H new ATOM 0 HG21 THR A 68 18.093 -10.534 1.821 1.00 0.00 H new ATOM 0 HG22 THR A 68 16.927 -9.213 1.571 1.00 0.00 H new ATOM 0 HG23 THR A 68 16.815 -10.237 3.022 1.00 0.00 H new ATOM 1132 N MET A 69 14.173 -9.364 -0.577 1.00 0.00 N ATOM 1133 CA MET A 69 14.100 -8.102 -1.312 1.00 0.00 C ATOM 1134 C MET A 69 12.669 -7.564 -1.422 1.00 0.00 C ATOM 1135 O MET A 69 12.476 -6.413 -1.805 1.00 0.00 O ATOM 1136 CB MET A 69 14.748 -8.283 -2.694 1.00 0.00 C ATOM 1137 CG MET A 69 16.248 -8.625 -2.597 1.00 0.00 C ATOM 1138 SD MET A 69 17.283 -7.397 -1.745 1.00 0.00 S ATOM 1139 CE MET A 69 17.164 -5.993 -2.888 1.00 0.00 C ATOM 0 H MET A 69 14.077 -10.189 -1.169 1.00 0.00 H new ATOM 0 HA MET A 69 14.653 -7.348 -0.752 1.00 0.00 H new ATOM 0 HB2 MET A 69 14.231 -9.076 -3.234 1.00 0.00 H new ATOM 0 HB3 MET A 69 14.623 -7.369 -3.274 1.00 0.00 H new ATOM 0 HG2 MET A 69 16.351 -9.580 -2.082 1.00 0.00 H new ATOM 0 HG3 MET A 69 16.636 -8.763 -3.606 1.00 0.00 H new ATOM 0 HE1 MET A 69 17.644 -5.121 -2.444 1.00 0.00 H new ATOM 0 HE2 MET A 69 17.661 -6.243 -3.825 1.00 0.00 H new ATOM 0 HE3 MET A 69 16.115 -5.770 -3.083 1.00 0.00 H new ATOM 1149 N GLN A 70 11.657 -8.356 -1.066 1.00 0.00 N ATOM 1150 CA GLN A 70 10.263 -7.939 -1.006 1.00 0.00 C ATOM 1151 C GLN A 70 10.143 -6.692 -0.117 1.00 0.00 C ATOM 1152 O GLN A 70 10.550 -6.714 1.047 1.00 0.00 O ATOM 1153 CB GLN A 70 9.434 -9.135 -0.493 1.00 0.00 C ATOM 1154 CG GLN A 70 7.909 -8.960 -0.468 1.00 0.00 C ATOM 1155 CD GLN A 70 7.296 -8.927 -1.870 1.00 0.00 C ATOM 1156 OE1 GLN A 70 7.571 -8.034 -2.665 1.00 0.00 O ATOM 1157 NE2 GLN A 70 6.470 -9.900 -2.218 1.00 0.00 N ATOM 0 H GLN A 70 11.793 -9.333 -0.805 1.00 0.00 H new ATOM 0 HA GLN A 70 9.878 -7.658 -1.986 1.00 0.00 H new ATOM 0 HB2 GLN A 70 9.667 -10.001 -1.113 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.766 -9.369 0.518 1.00 0.00 H new ATOM 0 HG2 GLN A 70 7.463 -9.776 0.100 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.662 -8.036 0.054 1.00 0.00 H new ATOM 0 HE21 GLN A 70 6.245 -10.640 -1.553 1.00 0.00 H new ATOM 0 HE22 GLN A 70 6.058 -9.910 -3.151 1.00 0.00 H new ATOM 1166 N GLY A 71 9.601 -5.600 -0.667 1.00 0.00 N ATOM 1167 CA GLY A 71 9.434 -4.331 0.033 1.00 0.00 C ATOM 1168 C GLY A 71 10.737 -3.552 0.260 1.00 0.00 C ATOM 1169 O GLY A 71 10.702 -2.522 0.934 1.00 0.00 O ATOM 0 H GLY A 71 9.261 -5.578 -1.629 1.00 0.00 H new ATOM 0 HA2 GLY A 71 8.746 -3.705 -0.535 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.967 -4.522 0.999 1.00 0.00 H new ATOM 1173 N PHE A 72 11.882 -4.009 -0.264 1.00 0.00 N ATOM 1174 CA PHE A 72 13.159 -3.308 -0.103 1.00 0.00 C ATOM 1175 C PHE A 72 13.133 -1.984 -0.888 1.00 0.00 C ATOM 1176 O PHE A 72 12.568 -1.955 -1.982 1.00 0.00 O ATOM 1177 CB PHE A 72 14.296 -4.217 -0.596 1.00 0.00 C ATOM 1178 CG PHE A 72 15.691 -3.652 -0.413 1.00 0.00 C ATOM 1179 CD1 PHE A 72 16.355 -3.788 0.821 1.00 0.00 C ATOM 1180 CD2 PHE A 72 16.328 -2.990 -1.480 1.00 0.00 C ATOM 1181 CE1 PHE A 72 17.644 -3.252 0.990 1.00 0.00 C ATOM 1182 CE2 PHE A 72 17.616 -2.453 -1.310 1.00 0.00 C ATOM 1183 CZ PHE A 72 18.275 -2.583 -0.074 1.00 0.00 C ATOM 0 H PHE A 72 11.948 -4.870 -0.808 1.00 0.00 H new ATOM 0 HA PHE A 72 13.325 -3.074 0.948 1.00 0.00 H new ATOM 0 HB2 PHE A 72 14.234 -5.170 -0.070 1.00 0.00 H new ATOM 0 HB3 PHE A 72 14.141 -4.427 -1.654 1.00 0.00 H new ATOM 0 HD1 PHE A 72 15.874 -4.304 1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 72 15.826 -2.895 -2.431 1.00 0.00 H new ATOM 0 HE1 PHE A 72 18.150 -3.354 1.938 1.00 0.00 H new ATOM 0 HE2 PHE A 72 18.100 -1.941 -2.128 1.00 0.00 H new ATOM 0 HZ PHE A 72 19.264 -2.170 0.058 1.00 0.00 H new ATOM 1193 N PRO A 73 13.738 -0.885 -0.408 1.00 0.00 N ATOM 1194 CA PRO A 73 13.882 0.345 -1.182 1.00 0.00 C ATOM 1195 C PRO A 73 15.022 0.207 -2.207 1.00 0.00 C ATOM 1196 O PRO A 73 16.146 0.666 -1.986 1.00 0.00 O ATOM 1197 CB PRO A 73 14.108 1.437 -0.138 1.00 0.00 C ATOM 1198 CG PRO A 73 14.853 0.707 0.981 1.00 0.00 C ATOM 1199 CD PRO A 73 14.252 -0.699 0.942 1.00 0.00 C ATOM 0 HA PRO A 73 13.008 0.585 -1.788 1.00 0.00 H new ATOM 0 HB2 PRO A 73 14.695 2.262 -0.540 1.00 0.00 H new ATOM 0 HB3 PRO A 73 13.166 1.858 0.214 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.928 0.690 0.804 1.00 0.00 H new ATOM 0 HG3 PRO A 73 14.696 1.185 1.948 1.00 0.00 H new ATOM 0 HD2 PRO A 73 15.005 -1.451 1.179 1.00 0.00 H new ATOM 0 HD3 PRO A 73 13.456 -0.802 1.679 1.00 0.00 H new ATOM 1207 N PHE A 74 14.745 -0.472 -3.325 1.00 0.00 N ATOM 1208 CA PHE A 74 15.720 -0.722 -4.395 1.00 0.00 C ATOM 1209 C PHE A 74 16.157 0.599 -5.032 1.00 0.00 C ATOM 1210 O PHE A 74 17.337 0.802 -5.319 1.00 0.00 O ATOM 1211 CB PHE A 74 15.059 -1.658 -5.414 1.00 0.00 C ATOM 1212 CG PHE A 74 15.935 -2.307 -6.472 1.00 0.00 C ATOM 1213 CD1 PHE A 74 16.931 -3.228 -6.091 1.00 0.00 C ATOM 1214 CD2 PHE A 74 15.658 -2.114 -7.841 1.00 0.00 C ATOM 1215 CE1 PHE A 74 17.640 -3.950 -7.069 1.00 0.00 C ATOM 1216 CE2 PHE A 74 16.378 -2.827 -8.816 1.00 0.00 C ATOM 1217 CZ PHE A 74 17.356 -3.759 -8.431 1.00 0.00 C ATOM 0 H PHE A 74 13.825 -0.869 -3.516 1.00 0.00 H new ATOM 0 HA PHE A 74 16.621 -1.193 -4.003 1.00 0.00 H new ATOM 0 HB2 PHE A 74 14.562 -2.454 -4.860 1.00 0.00 H new ATOM 0 HB3 PHE A 74 14.281 -1.093 -5.928 1.00 0.00 H new ATOM 0 HD1 PHE A 74 17.151 -3.380 -5.045 1.00 0.00 H new ATOM 0 HD2 PHE A 74 14.890 -1.416 -8.142 1.00 0.00 H new ATOM 0 HE1 PHE A 74 18.404 -4.653 -6.771 1.00 0.00 H new ATOM 0 HE2 PHE A 74 16.179 -2.658 -9.864 1.00 0.00 H new ATOM 0 HZ PHE A 74 17.888 -4.327 -9.180 1.00 0.00 H new ATOM 1227 N TYR A 75 15.191 1.506 -5.173 1.00 0.00 N ATOM 1228 CA TYR A 75 15.317 2.904 -5.548 1.00 0.00 C ATOM 1229 C TYR A 75 14.195 3.629 -4.787 1.00 0.00 C ATOM 1230 O TYR A 75 13.708 3.121 -3.772 1.00 0.00 O ATOM 1231 CB TYR A 75 15.247 3.039 -7.085 1.00 0.00 C ATOM 1232 CG TYR A 75 16.547 2.696 -7.793 1.00 0.00 C ATOM 1233 CD1 TYR A 75 17.603 3.629 -7.779 1.00 0.00 C ATOM 1234 CD2 TYR A 75 16.704 1.473 -8.476 1.00 0.00 C ATOM 1235 CE1 TYR A 75 18.806 3.353 -8.451 1.00 0.00 C ATOM 1236 CE2 TYR A 75 17.910 1.184 -9.143 1.00 0.00 C ATOM 1237 CZ TYR A 75 18.962 2.130 -9.143 1.00 0.00 C ATOM 1238 OH TYR A 75 20.113 1.866 -9.823 1.00 0.00 O ATOM 0 H TYR A 75 14.216 1.253 -5.012 1.00 0.00 H new ATOM 0 HA TYR A 75 16.274 3.352 -5.279 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.457 2.389 -7.461 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.966 4.061 -7.338 1.00 0.00 H new ATOM 0 HD1 TYR A 75 17.487 4.562 -7.248 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.897 0.755 -8.488 1.00 0.00 H new ATOM 0 HE1 TYR A 75 19.610 4.074 -8.439 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.032 0.241 -9.654 1.00 0.00 H new ATOM 0 HH TYR A 75 20.304 0.906 -9.783 1.00 0.00 H new ATOM 1248 N ASP A 76 13.748 4.789 -5.267 1.00 0.00 N ATOM 1249 CA ASP A 76 12.640 5.582 -4.724 1.00 0.00 C ATOM 1250 C ASP A 76 11.276 4.861 -4.705 1.00 0.00 C ATOM 1251 O ASP A 76 10.273 5.473 -4.330 1.00 0.00 O ATOM 1252 CB ASP A 76 12.527 6.898 -5.509 1.00 0.00 C ATOM 1253 CG ASP A 76 12.065 6.666 -6.953 1.00 0.00 C ATOM 1254 OD1 ASP A 76 12.946 6.466 -7.818 1.00 0.00 O ATOM 1255 OD2 ASP A 76 10.850 6.699 -7.243 1.00 0.00 O ATOM 0 H ASP A 76 14.169 5.225 -6.087 1.00 0.00 H new ATOM 0 HA ASP A 76 12.884 5.764 -3.677 1.00 0.00 H new ATOM 0 HB2 ASP A 76 11.824 7.562 -5.005 1.00 0.00 H new ATOM 0 HB3 ASP A 76 13.494 7.402 -5.514 1.00 0.00 H new ATOM 1260 N LYS A 77 11.215 3.572 -5.059 1.00 0.00 N ATOM 1261 CA LYS A 77 10.014 2.750 -5.004 1.00 0.00 C ATOM 1262 C LYS A 77 10.366 1.456 -4.264 1.00 0.00 C ATOM 1263 O LYS A 77 11.321 0.788 -4.675 1.00 0.00 O ATOM 1264 CB LYS A 77 9.505 2.439 -6.423 1.00 0.00 C ATOM 1265 CG LYS A 77 8.443 3.439 -6.902 1.00 0.00 C ATOM 1266 CD LYS A 77 8.020 3.122 -8.344 1.00 0.00 C ATOM 1267 CE LYS A 77 6.755 3.863 -8.802 1.00 0.00 C ATOM 1268 NZ LYS A 77 5.521 3.340 -8.160 1.00 0.00 N ATOM 0 H LYS A 77 12.029 3.062 -5.402 1.00 0.00 H new ATOM 0 HA LYS A 77 9.219 3.280 -4.480 1.00 0.00 H new ATOM 0 HB2 LYS A 77 10.346 2.448 -7.117 1.00 0.00 H new ATOM 0 HB3 LYS A 77 9.086 1.433 -6.442 1.00 0.00 H new ATOM 0 HG2 LYS A 77 7.574 3.399 -6.245 1.00 0.00 H new ATOM 0 HG3 LYS A 77 8.838 4.453 -6.847 1.00 0.00 H new ATOM 0 HD2 LYS A 77 8.840 3.375 -9.016 1.00 0.00 H new ATOM 0 HD3 LYS A 77 7.853 2.049 -8.435 1.00 0.00 H new ATOM 0 HE2 LYS A 77 6.857 4.924 -8.573 1.00 0.00 H new ATOM 0 HE3 LYS A 77 6.661 3.778 -9.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.694 3.601 -8.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 5.579 2.304 -8.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 5.425 3.748 -7.208 1.00 0.00 H new ATOM 1282 N PRO A 78 9.650 1.097 -3.180 1.00 0.00 N ATOM 1283 CA PRO A 78 9.770 -0.214 -2.555 1.00 0.00 C ATOM 1284 C PRO A 78 9.477 -1.310 -3.581 1.00 0.00 C ATOM 1285 O PRO A 78 8.531 -1.181 -4.364 1.00 0.00 O ATOM 1286 CB PRO A 78 8.743 -0.238 -1.415 1.00 0.00 C ATOM 1287 CG PRO A 78 8.518 1.238 -1.100 1.00 0.00 C ATOM 1288 CD PRO A 78 8.683 1.910 -2.461 1.00 0.00 C ATOM 0 HA PRO A 78 10.776 -0.393 -2.175 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.818 -0.728 -1.719 1.00 0.00 H new ATOM 0 HB3 PRO A 78 9.120 -0.780 -0.548 1.00 0.00 H new ATOM 0 HG2 PRO A 78 7.528 1.414 -0.680 1.00 0.00 H new ATOM 0 HG3 PRO A 78 9.242 1.611 -0.376 1.00 0.00 H new ATOM 0 HD2 PRO A 78 7.734 1.954 -2.995 1.00 0.00 H new ATOM 0 HD3 PRO A 78 9.036 2.936 -2.352 1.00 0.00 H new ATOM 1296 N MET A 79 10.252 -2.395 -3.585 1.00 0.00 N ATOM 1297 CA MET A 79 10.022 -3.500 -4.510 1.00 0.00 C ATOM 1298 C MET A 79 8.693 -4.179 -4.199 1.00 0.00 C ATOM 1299 O MET A 79 8.272 -4.249 -3.042 1.00 0.00 O ATOM 1300 CB MET A 79 11.142 -4.546 -4.439 1.00 0.00 C ATOM 1301 CG MET A 79 12.520 -3.932 -4.659 1.00 0.00 C ATOM 1302 SD MET A 79 13.845 -5.120 -4.972 1.00 0.00 S ATOM 1303 CE MET A 79 13.727 -5.228 -6.775 1.00 0.00 C ATOM 0 H MET A 79 11.044 -2.530 -2.957 1.00 0.00 H new ATOM 0 HA MET A 79 10.004 -3.079 -5.515 1.00 0.00 H new ATOM 0 HB2 MET A 79 11.116 -5.037 -3.466 1.00 0.00 H new ATOM 0 HB3 MET A 79 10.965 -5.316 -5.190 1.00 0.00 H new ATOM 0 HG2 MET A 79 12.464 -3.243 -5.502 1.00 0.00 H new ATOM 0 HG3 MET A 79 12.782 -3.341 -3.781 1.00 0.00 H new ATOM 0 HE1 MET A 79 13.580 -6.267 -7.068 1.00 0.00 H new ATOM 0 HE2 MET A 79 12.884 -4.630 -7.121 1.00 0.00 H new ATOM 0 HE3 MET A 79 14.646 -4.851 -7.223 1.00 0.00 H new ATOM 1313 N GLN A 80 8.073 -4.751 -5.226 1.00 0.00 N ATOM 1314 CA GLN A 80 6.920 -5.627 -5.130 1.00 0.00 C ATOM 1315 C GLN A 80 7.284 -6.781 -6.052 1.00 0.00 C ATOM 1316 O GLN A 80 7.633 -6.542 -7.212 1.00 0.00 O ATOM 1317 CB GLN A 80 5.639 -4.905 -5.587 1.00 0.00 C ATOM 1318 CG GLN A 80 5.217 -3.731 -4.687 1.00 0.00 C ATOM 1319 CD GLN A 80 4.678 -4.191 -3.328 1.00 0.00 C ATOM 1320 OE1 GLN A 80 3.479 -4.400 -3.159 1.00 0.00 O ATOM 1321 NE2 GLN A 80 5.533 -4.362 -2.333 1.00 0.00 N ATOM 0 H GLN A 80 8.377 -4.608 -6.189 1.00 0.00 H new ATOM 0 HA GLN A 80 6.708 -5.957 -4.113 1.00 0.00 H new ATOM 0 HB2 GLN A 80 5.787 -4.535 -6.601 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.824 -5.627 -5.627 1.00 0.00 H new ATOM 0 HG2 GLN A 80 6.072 -3.073 -4.530 1.00 0.00 H new ATOM 0 HG3 GLN A 80 4.453 -3.144 -5.197 1.00 0.00 H new ATOM 0 HE21 GLN A 80 6.527 -4.187 -2.479 1.00 0.00 H new ATOM 0 HE22 GLN A 80 5.198 -4.669 -1.420 1.00 0.00 H new ATOM 1330 N ILE A 81 7.289 -8.003 -5.525 1.00 0.00 N ATOM 1331 CA ILE A 81 7.825 -9.172 -6.209 1.00 0.00 C ATOM 1332 C ILE A 81 6.870 -10.351 -5.991 1.00 0.00 C ATOM 1333 O ILE A 81 6.183 -10.419 -4.967 1.00 0.00 O ATOM 1334 CB ILE A 81 9.262 -9.500 -5.703 1.00 0.00 C ATOM 1335 CG1 ILE A 81 10.114 -8.262 -5.316 1.00 0.00 C ATOM 1336 CG2 ILE A 81 9.996 -10.336 -6.769 1.00 0.00 C ATOM 1337 CD1 ILE A 81 11.542 -8.570 -4.849 1.00 0.00 C ATOM 0 H ILE A 81 6.915 -8.209 -4.599 1.00 0.00 H new ATOM 0 HA ILE A 81 7.904 -8.970 -7.277 1.00 0.00 H new ATOM 0 HB ILE A 81 9.137 -10.062 -4.777 1.00 0.00 H new ATOM 0 HG12 ILE A 81 10.167 -7.594 -6.176 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.599 -7.720 -4.523 1.00 0.00 H new ATOM 0 HG21 ILE A 81 11.002 -10.568 -6.420 1.00 0.00 H new ATOM 0 HG22 ILE A 81 9.450 -11.263 -6.944 1.00 0.00 H new ATOM 0 HG23 ILE A 81 10.056 -9.769 -7.698 1.00 0.00 H new ATOM 0 HD11 ILE A 81 12.053 -7.639 -4.603 1.00 0.00 H new ATOM 0 HD12 ILE A 81 11.506 -9.209 -3.967 1.00 0.00 H new ATOM 0 HD13 ILE A 81 12.083 -9.081 -5.645 1.00 0.00 H new ATOM 1349 N ALA A 82 6.855 -11.297 -6.928 1.00 0.00 N ATOM 1350 CA ALA A 82 6.189 -12.591 -6.830 1.00 0.00 C ATOM 1351 C ALA A 82 6.995 -13.608 -7.648 1.00 0.00 C ATOM 1352 O ALA A 82 7.905 -13.226 -8.385 1.00 0.00 O ATOM 1353 CB ALA A 82 4.754 -12.473 -7.361 1.00 0.00 C ATOM 0 H ALA A 82 7.332 -11.174 -7.821 1.00 0.00 H new ATOM 0 HA ALA A 82 6.138 -12.921 -5.792 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.258 -13.441 -7.287 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.207 -11.739 -6.770 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.777 -12.156 -8.404 1.00 0.00 H new ATOM 1359 N TYR A 83 6.686 -14.900 -7.529 1.00 0.00 N ATOM 1360 CA TYR A 83 7.244 -15.914 -8.424 1.00 0.00 C ATOM 1361 C TYR A 83 6.614 -15.717 -9.808 1.00 0.00 C ATOM 1362 O TYR A 83 5.430 -15.380 -9.902 1.00 0.00 O ATOM 1363 CB TYR A 83 7.009 -17.325 -7.860 1.00 0.00 C ATOM 1364 CG TYR A 83 5.628 -17.592 -7.286 1.00 0.00 C ATOM 1365 CD1 TYR A 83 4.582 -18.011 -8.129 1.00 0.00 C ATOM 1366 CD2 TYR A 83 5.390 -17.418 -5.909 1.00 0.00 C ATOM 1367 CE1 TYR A 83 3.301 -18.251 -7.604 1.00 0.00 C ATOM 1368 CE2 TYR A 83 4.107 -17.646 -5.376 1.00 0.00 C ATOM 1369 CZ TYR A 83 3.055 -18.064 -6.225 1.00 0.00 C ATOM 1370 OH TYR A 83 1.805 -18.291 -5.729 1.00 0.00 O ATOM 0 H TYR A 83 6.052 -15.269 -6.821 1.00 0.00 H new ATOM 0 HA TYR A 83 8.325 -15.804 -8.511 1.00 0.00 H new ATOM 0 HB2 TYR A 83 7.197 -18.048 -8.654 1.00 0.00 H new ATOM 0 HB3 TYR A 83 7.747 -17.510 -7.080 1.00 0.00 H new ATOM 0 HD1 TYR A 83 4.765 -18.149 -9.184 1.00 0.00 H new ATOM 0 HD2 TYR A 83 6.195 -17.108 -5.259 1.00 0.00 H new ATOM 0 HE1 TYR A 83 2.504 -18.579 -8.255 1.00 0.00 H new ATOM 0 HE2 TYR A 83 3.926 -17.502 -4.321 1.00 0.00 H new ATOM 0 HH TYR A 83 1.800 -18.119 -4.764 1.00 0.00 H new ATOM 1380 N SER A 84 7.375 -15.927 -10.887 1.00 0.00 N ATOM 1381 CA SER A 84 6.946 -15.566 -12.240 1.00 0.00 C ATOM 1382 C SER A 84 5.672 -16.283 -12.697 1.00 0.00 C ATOM 1383 O SER A 84 4.892 -15.720 -13.466 1.00 0.00 O ATOM 1384 CB SER A 84 8.091 -15.824 -13.219 1.00 0.00 C ATOM 1385 OG SER A 84 8.596 -17.135 -13.028 1.00 0.00 O ATOM 0 H SER A 84 8.302 -16.350 -10.847 1.00 0.00 H new ATOM 0 HA SER A 84 6.694 -14.506 -12.222 1.00 0.00 H new ATOM 0 HB2 SER A 84 7.740 -15.705 -14.244 1.00 0.00 H new ATOM 0 HB3 SER A 84 8.884 -15.092 -13.067 1.00 0.00 H new ATOM 0 HG SER A 84 8.796 -17.538 -13.898 1.00 0.00 H new ATOM 1391 N LYS A 85 5.415 -17.496 -12.190 1.00 0.00 N ATOM 1392 CA LYS A 85 4.204 -18.262 -12.501 1.00 0.00 C ATOM 1393 C LYS A 85 2.915 -17.492 -12.160 1.00 0.00 C ATOM 1394 O LYS A 85 1.849 -17.839 -12.670 1.00 0.00 O ATOM 1395 CB LYS A 85 4.281 -19.642 -11.818 1.00 0.00 C ATOM 1396 CG LYS A 85 3.366 -20.689 -12.479 1.00 0.00 C ATOM 1397 CD LYS A 85 3.477 -22.079 -11.833 1.00 0.00 C ATOM 1398 CE LYS A 85 4.859 -22.719 -12.047 1.00 0.00 C ATOM 1399 NZ LYS A 85 4.932 -24.092 -11.487 1.00 0.00 N ATOM 0 H LYS A 85 6.047 -17.975 -11.548 1.00 0.00 H new ATOM 0 HA LYS A 85 4.156 -18.419 -13.579 1.00 0.00 H new ATOM 0 HB2 LYS A 85 5.311 -19.998 -11.845 1.00 0.00 H new ATOM 0 HB3 LYS A 85 4.007 -19.538 -10.768 1.00 0.00 H new ATOM 0 HG2 LYS A 85 2.332 -20.349 -12.420 1.00 0.00 H new ATOM 0 HG3 LYS A 85 3.616 -20.765 -13.537 1.00 0.00 H new ATOM 0 HD2 LYS A 85 3.280 -21.996 -10.764 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.709 -22.732 -12.249 1.00 0.00 H new ATOM 0 HE2 LYS A 85 5.082 -22.751 -13.113 1.00 0.00 H new ATOM 0 HE3 LYS A 85 5.622 -22.097 -11.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 5.880 -24.485 -11.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.745 -24.060 -10.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.222 -24.694 -11.950 1.00 0.00 H new ATOM 1413 N SER A 86 2.996 -16.442 -11.335 1.00 0.00 N ATOM 1414 CA SER A 86 1.878 -15.566 -11.008 1.00 0.00 C ATOM 1415 C SER A 86 1.307 -14.823 -12.229 1.00 0.00 C ATOM 1416 O SER A 86 0.181 -14.328 -12.135 1.00 0.00 O ATOM 1417 CB SER A 86 2.315 -14.543 -9.951 1.00 0.00 C ATOM 1418 OG SER A 86 2.957 -15.166 -8.854 1.00 0.00 O ATOM 0 H SER A 86 3.863 -16.176 -10.868 1.00 0.00 H new ATOM 0 HA SER A 86 1.083 -16.206 -10.624 1.00 0.00 H new ATOM 0 HB2 SER A 86 2.991 -13.818 -10.404 1.00 0.00 H new ATOM 0 HB3 SER A 86 1.445 -13.990 -9.597 1.00 0.00 H new ATOM 0 HG SER A 86 3.887 -15.367 -9.090 1.00 0.00 H new ATOM 1424 N ASP A 87 2.028 -14.717 -13.356 1.00 0.00 N ATOM 1425 CA ASP A 87 1.607 -13.903 -14.497 1.00 0.00 C ATOM 1426 C ASP A 87 1.657 -14.698 -15.795 1.00 0.00 C ATOM 1427 O ASP A 87 2.709 -15.160 -16.236 1.00 0.00 O ATOM 1428 CB ASP A 87 2.432 -12.617 -14.591 1.00 0.00 C ATOM 1429 CG ASP A 87 1.998 -11.806 -15.823 1.00 0.00 C ATOM 1430 OD1 ASP A 87 2.485 -12.085 -16.939 1.00 0.00 O ATOM 1431 OD2 ASP A 87 1.130 -10.915 -15.671 1.00 0.00 O ATOM 0 H ASP A 87 2.918 -15.195 -13.498 1.00 0.00 H new ATOM 0 HA ASP A 87 0.568 -13.615 -14.335 1.00 0.00 H new ATOM 0 HB2 ASP A 87 2.298 -12.022 -13.688 1.00 0.00 H new ATOM 0 HB3 ASP A 87 3.493 -12.859 -14.659 1.00 0.00 H new ATOM 1436 N SER A 88 0.484 -14.869 -16.401 1.00 0.00 N ATOM 1437 CA SER A 88 0.274 -15.705 -17.568 1.00 0.00 C ATOM 1438 C SER A 88 1.048 -15.222 -18.800 1.00 0.00 C ATOM 1439 O SER A 88 1.366 -16.035 -19.667 1.00 0.00 O ATOM 1440 CB SER A 88 -1.233 -15.740 -17.863 1.00 0.00 C ATOM 1441 OG SER A 88 -1.986 -15.939 -16.671 1.00 0.00 O ATOM 0 H SER A 88 -0.370 -14.413 -16.079 1.00 0.00 H new ATOM 0 HA SER A 88 0.655 -16.702 -17.348 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.536 -14.806 -18.336 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.449 -16.540 -18.571 1.00 0.00 H new ATOM 0 HG SER A 88 -2.942 -15.956 -16.887 1.00 0.00 H new ATOM 1447 N ASP A 89 1.359 -13.927 -18.914 1.00 0.00 N ATOM 1448 CA ASP A 89 1.930 -13.377 -20.141 1.00 0.00 C ATOM 1449 C ASP A 89 3.435 -13.590 -20.181 1.00 0.00 C ATOM 1450 O ASP A 89 3.964 -14.033 -21.201 1.00 0.00 O ATOM 1451 CB ASP A 89 1.588 -11.894 -20.295 1.00 0.00 C ATOM 1452 CG ASP A 89 2.092 -11.363 -21.645 1.00 0.00 C ATOM 1453 OD1 ASP A 89 1.537 -11.755 -22.694 1.00 0.00 O ATOM 1454 OD2 ASP A 89 2.991 -10.494 -21.656 1.00 0.00 O ATOM 0 H ASP A 89 1.224 -13.243 -18.170 1.00 0.00 H new ATOM 0 HA ASP A 89 1.487 -13.911 -20.982 1.00 0.00 H new ATOM 0 HB2 ASP A 89 0.509 -11.754 -20.222 1.00 0.00 H new ATOM 0 HB3 ASP A 89 2.039 -11.324 -19.482 1.00 0.00 H new ATOM 1459 N ILE A 90 4.127 -13.375 -19.060 1.00 0.00 N ATOM 1460 CA ILE A 90 5.536 -13.758 -18.973 1.00 0.00 C ATOM 1461 C ILE A 90 5.664 -15.281 -19.004 1.00 0.00 C ATOM 1462 O ILE A 90 6.621 -15.786 -19.589 1.00 0.00 O ATOM 1463 CB ILE A 90 6.274 -13.126 -17.775 1.00 0.00 C ATOM 1464 CG1 ILE A 90 5.820 -13.702 -16.419 1.00 0.00 C ATOM 1465 CG2 ILE A 90 6.141 -11.596 -17.854 1.00 0.00 C ATOM 1466 CD1 ILE A 90 6.475 -13.028 -15.213 1.00 0.00 C ATOM 0 H ILE A 90 3.744 -12.947 -18.217 1.00 0.00 H new ATOM 0 HA ILE A 90 6.040 -13.350 -19.849 1.00 0.00 H new ATOM 0 HB ILE A 90 7.331 -13.386 -17.838 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.738 -13.602 -16.336 1.00 0.00 H new ATOM 0 HG13 ILE A 90 6.044 -14.768 -16.394 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.660 -11.142 -17.010 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.581 -11.240 -18.785 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.087 -11.320 -17.822 1.00 0.00 H new ATOM 0 HD11 ILE A 90 6.106 -13.486 -14.295 1.00 0.00 H new ATOM 0 HD12 ILE A 90 7.557 -13.150 -15.271 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.230 -11.966 -15.212 1.00 0.00 H new ATOM 1478 N VAL A 91 4.694 -16.022 -18.450 1.00 0.00 N ATOM 1479 CA VAL A 91 4.671 -17.470 -18.586 1.00 0.00 C ATOM 1480 C VAL A 91 4.588 -17.842 -20.076 1.00 0.00 C ATOM 1481 O VAL A 91 5.352 -18.696 -20.526 1.00 0.00 O ATOM 1482 CB VAL A 91 3.563 -18.082 -17.700 1.00 0.00 C ATOM 1483 CG1 VAL A 91 3.235 -19.542 -18.052 1.00 0.00 C ATOM 1484 CG2 VAL A 91 4.005 -18.064 -16.229 1.00 0.00 C ATOM 0 H VAL A 91 3.921 -15.636 -17.907 1.00 0.00 H new ATOM 0 HA VAL A 91 5.598 -17.909 -18.216 1.00 0.00 H new ATOM 0 HB VAL A 91 2.675 -17.474 -17.874 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.449 -19.908 -17.391 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.895 -19.599 -19.086 1.00 0.00 H new ATOM 0 HG13 VAL A 91 4.128 -20.155 -17.929 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.220 -18.497 -15.608 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.919 -18.647 -16.117 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.189 -17.036 -15.917 1.00 0.00 H new ATOM 1494 N ALA A 92 3.742 -17.175 -20.871 1.00 0.00 N ATOM 1495 CA ALA A 92 3.666 -17.409 -22.310 1.00 0.00 C ATOM 1496 C ALA A 92 5.003 -17.090 -22.995 1.00 0.00 C ATOM 1497 O ALA A 92 5.463 -17.865 -23.837 1.00 0.00 O ATOM 1498 CB ALA A 92 2.514 -16.598 -22.916 1.00 0.00 C ATOM 0 H ALA A 92 3.096 -16.462 -20.532 1.00 0.00 H new ATOM 0 HA ALA A 92 3.464 -18.466 -22.480 1.00 0.00 H new ATOM 0 HB1 ALA A 92 2.466 -16.780 -23.990 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.574 -16.901 -22.455 1.00 0.00 H new ATOM 0 HB3 ALA A 92 2.682 -15.536 -22.735 1.00 0.00 H new ATOM 1504 N LYS A 93 5.672 -15.993 -22.614 1.00 0.00 N ATOM 1505 CA LYS A 93 6.987 -15.650 -23.159 1.00 0.00 C ATOM 1506 C LYS A 93 8.010 -16.751 -22.878 1.00 0.00 C ATOM 1507 O LYS A 93 8.692 -17.163 -23.815 1.00 0.00 O ATOM 1508 CB LYS A 93 7.489 -14.297 -22.617 1.00 0.00 C ATOM 1509 CG LYS A 93 6.765 -13.067 -23.193 1.00 0.00 C ATOM 1510 CD LYS A 93 6.971 -12.833 -24.703 1.00 0.00 C ATOM 1511 CE LYS A 93 8.437 -12.705 -25.155 1.00 0.00 C ATOM 1512 NZ LYS A 93 9.108 -11.489 -24.627 1.00 0.00 N ATOM 0 H LYS A 93 5.319 -15.327 -21.927 1.00 0.00 H new ATOM 0 HA LYS A 93 6.872 -15.559 -24.239 1.00 0.00 H new ATOM 0 HB2 LYS A 93 7.379 -14.292 -21.533 1.00 0.00 H new ATOM 0 HB3 LYS A 93 8.554 -14.208 -22.830 1.00 0.00 H new ATOM 0 HG2 LYS A 93 5.697 -13.170 -23.000 1.00 0.00 H new ATOM 0 HG3 LYS A 93 7.102 -12.181 -22.655 1.00 0.00 H new ATOM 0 HD2 LYS A 93 6.511 -13.657 -25.248 1.00 0.00 H new ATOM 0 HD3 LYS A 93 6.439 -11.926 -24.989 1.00 0.00 H new ATOM 0 HE2 LYS A 93 8.989 -13.587 -24.830 1.00 0.00 H new ATOM 0 HE3 LYS A 93 8.475 -12.689 -26.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 10.091 -11.460 -24.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 8.603 -10.642 -24.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 9.101 -11.512 -23.587 1.00 0.00 H new ATOM 1526 N ILE A 94 8.123 -17.249 -21.641 1.00 0.00 N ATOM 1527 CA ILE A 94 9.116 -18.285 -21.333 1.00 0.00 C ATOM 1528 C ILE A 94 8.719 -19.645 -21.926 1.00 0.00 C ATOM 1529 O ILE A 94 9.605 -20.434 -22.262 1.00 0.00 O ATOM 1530 CB ILE A 94 9.477 -18.348 -19.831 1.00 0.00 C ATOM 1531 CG1 ILE A 94 8.307 -18.841 -18.956 1.00 0.00 C ATOM 1532 CG2 ILE A 94 10.021 -16.981 -19.368 1.00 0.00 C ATOM 1533 CD1 ILE A 94 8.628 -18.952 -17.461 1.00 0.00 C ATOM 0 H ILE A 94 7.550 -16.958 -20.849 1.00 0.00 H new ATOM 0 HA ILE A 94 10.042 -17.994 -21.829 1.00 0.00 H new ATOM 0 HB ILE A 94 10.262 -19.093 -19.704 1.00 0.00 H new ATOM 0 HG12 ILE A 94 7.464 -18.161 -19.083 1.00 0.00 H new ATOM 0 HG13 ILE A 94 7.986 -19.818 -19.318 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.274 -17.030 -18.309 1.00 0.00 H new ATOM 0 HG22 ILE A 94 10.912 -16.730 -19.943 1.00 0.00 H new ATOM 0 HG23 ILE A 94 9.261 -16.215 -19.524 1.00 0.00 H new ATOM 0 HD11 ILE A 94 7.747 -19.306 -16.925 1.00 0.00 H new ATOM 0 HD12 ILE A 94 9.448 -19.656 -17.316 1.00 0.00 H new ATOM 0 HD13 ILE A 94 8.918 -17.974 -17.077 1.00 0.00 H new ATOM 1545 N LYS A 95 7.418 -19.921 -22.111 1.00 0.00 N ATOM 1546 CA LYS A 95 6.962 -21.090 -22.870 1.00 0.00 C ATOM 1547 C LYS A 95 7.481 -20.990 -24.306 1.00 0.00 C ATOM 1548 O LYS A 95 7.959 -21.991 -24.842 1.00 0.00 O ATOM 1549 CB LYS A 95 5.426 -21.210 -22.854 1.00 0.00 C ATOM 1550 CG LYS A 95 4.841 -21.893 -21.607 1.00 0.00 C ATOM 1551 CD LYS A 95 5.256 -23.374 -21.504 1.00 0.00 C ATOM 1552 CE LYS A 95 4.311 -24.223 -20.639 1.00 0.00 C ATOM 1553 NZ LYS A 95 2.966 -24.357 -21.247 1.00 0.00 N ATOM 0 H LYS A 95 6.662 -19.345 -21.742 1.00 0.00 H new ATOM 0 HA LYS A 95 7.359 -21.989 -22.399 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.998 -20.211 -22.937 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.111 -21.767 -23.736 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.173 -21.362 -20.715 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.754 -21.823 -21.633 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.298 -23.801 -22.506 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.263 -23.432 -21.090 1.00 0.00 H new ATOM 0 HE2 LYS A 95 4.743 -25.213 -20.496 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.218 -23.770 -19.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 2.493 -25.200 -20.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 2.400 -23.512 -21.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.059 -24.453 -22.278 1.00 0.00 H new ATOM 1567 N GLY A 96 7.424 -19.800 -24.910 1.00 0.00 N ATOM 1568 CA GLY A 96 8.080 -19.516 -26.180 1.00 0.00 C ATOM 1569 C GLY A 96 7.419 -18.394 -26.976 1.00 0.00 C ATOM 1570 O GLY A 96 8.108 -17.722 -27.746 1.00 0.00 O ATOM 0 H GLY A 96 6.916 -19.004 -24.525 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.120 -19.250 -25.990 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.088 -20.423 -26.785 1.00 0.00 H new ATOM 1574 N THR A 97 6.109 -18.172 -26.809 1.00 0.00 N ATOM 1575 CA THR A 97 5.333 -17.281 -27.667 1.00 0.00 C ATOM 1576 C THR A 97 4.216 -16.653 -26.832 1.00 0.00 C ATOM 1577 O THR A 97 3.405 -17.377 -26.260 1.00 0.00 O ATOM 1578 CB THR A 97 4.733 -18.096 -28.839 1.00 0.00 C ATOM 1579 OG1 THR A 97 5.656 -19.011 -29.407 1.00 0.00 O ATOM 1580 CG2 THR A 97 4.250 -17.186 -29.974 1.00 0.00 C ATOM 0 H THR A 97 5.559 -18.610 -26.070 1.00 0.00 H new ATOM 0 HA THR A 97 5.968 -16.495 -28.075 1.00 0.00 H new ATOM 0 HB THR A 97 3.900 -18.643 -28.397 1.00 0.00 H new ATOM 0 HG1 THR A 97 5.225 -19.498 -30.140 1.00 0.00 H new ATOM 0 HG21 THR A 97 3.836 -17.795 -30.777 1.00 0.00 H new ATOM 0 HG22 THR A 97 3.482 -16.511 -29.597 1.00 0.00 H new ATOM 0 HG23 THR A 97 5.089 -16.604 -30.356 1.00 0.00 H new ATOM 1588 N PHE A 98 4.125 -15.317 -26.799 1.00 0.00 N ATOM 1589 CA PHE A 98 3.056 -14.609 -26.085 1.00 0.00 C ATOM 1590 C PHE A 98 1.657 -14.983 -26.603 1.00 0.00 C ATOM 1591 O PHE A 98 0.693 -14.992 -25.839 1.00 0.00 O ATOM 1592 CB PHE A 98 3.278 -13.088 -26.154 1.00 0.00 C ATOM 1593 CG PHE A 98 3.303 -12.494 -27.554 1.00 0.00 C ATOM 1594 CD1 PHE A 98 2.101 -12.109 -28.183 1.00 0.00 C ATOM 1595 CD2 PHE A 98 4.526 -12.329 -28.236 1.00 0.00 C ATOM 1596 CE1 PHE A 98 2.119 -11.587 -29.488 1.00 0.00 C ATOM 1597 CE2 PHE A 98 4.543 -11.805 -29.541 1.00 0.00 C ATOM 1598 CZ PHE A 98 3.339 -11.438 -30.170 1.00 0.00 C ATOM 0 H PHE A 98 4.789 -14.699 -27.265 1.00 0.00 H new ATOM 0 HA PHE A 98 3.100 -14.925 -25.043 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.490 -12.597 -25.584 1.00 0.00 H new ATOM 0 HB3 PHE A 98 4.222 -12.853 -25.661 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.162 -12.216 -27.660 1.00 0.00 H new ATOM 0 HD2 PHE A 98 5.452 -12.606 -27.755 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.195 -11.300 -29.967 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.482 -11.684 -30.061 1.00 0.00 H new ATOM 0 HZ PHE A 98 3.352 -11.043 -31.175 1.00 0.00 H new ATOM 1608 N LYS A 99 1.546 -15.284 -27.902 1.00 0.00 N ATOM 1609 CA LYS A 99 0.287 -15.641 -28.556 1.00 0.00 C ATOM 1610 C LYS A 99 -0.226 -17.009 -28.092 1.00 0.00 C ATOM 1611 O LYS A 99 -1.437 -17.232 -28.079 1.00 0.00 O ATOM 1612 CB LYS A 99 0.510 -15.625 -30.080 1.00 0.00 C ATOM 1613 CG LYS A 99 -0.794 -15.752 -30.889 1.00 0.00 C ATOM 1614 CD LYS A 99 -0.559 -15.697 -32.407 1.00 0.00 C ATOM 1615 CE LYS A 99 0.231 -16.917 -32.910 1.00 0.00 C ATOM 1616 NZ LYS A 99 0.397 -16.906 -34.385 1.00 0.00 N ATOM 0 H LYS A 99 2.344 -15.286 -28.537 1.00 0.00 H new ATOM 0 HA LYS A 99 -0.478 -14.914 -28.283 1.00 0.00 H new ATOM 0 HB2 LYS A 99 1.012 -14.698 -30.357 1.00 0.00 H new ATOM 0 HB3 LYS A 99 1.178 -16.442 -30.351 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -1.284 -16.692 -30.635 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -1.474 -14.950 -30.602 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -1.519 -15.649 -32.921 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -0.017 -14.785 -32.658 1.00 0.00 H new ATOM 0 HE2 LYS A 99 1.212 -16.934 -32.435 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -0.284 -17.830 -32.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 0.935 -17.746 -34.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -0.538 -16.916 -34.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 0.911 -16.048 -34.670 1.00 0.00 H new ATOM 1630 N GLU A 100 0.675 -17.938 -27.757 1.00 0.00 N ATOM 1631 CA GLU A 100 0.307 -19.303 -27.400 1.00 0.00 C ATOM 1632 C GLU A 100 -0.415 -19.294 -26.047 1.00 0.00 C ATOM 1633 O GLU A 100 -0.114 -18.467 -25.182 1.00 0.00 O ATOM 1634 CB GLU A 100 1.577 -20.172 -27.401 1.00 0.00 C ATOM 1635 CG GLU A 100 1.350 -21.656 -27.079 1.00 0.00 C ATOM 1636 CD GLU A 100 0.369 -22.330 -28.048 1.00 0.00 C ATOM 1637 OE1 GLU A 100 -0.859 -22.177 -27.853 1.00 0.00 O ATOM 1638 OE2 GLU A 100 0.809 -23.030 -28.988 1.00 0.00 O ATOM 0 H GLU A 100 1.679 -17.760 -27.727 1.00 0.00 H new ATOM 0 HA GLU A 100 -0.384 -19.733 -28.125 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.049 -20.097 -28.380 1.00 0.00 H new ATOM 0 HB3 GLU A 100 2.280 -19.762 -26.676 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.305 -22.181 -27.112 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.970 -21.749 -26.061 1.00 0.00 H new ATOM 1645 N ARG A 101 -1.366 -20.215 -25.853 1.00 0.00 N ATOM 1646 CA ARG A 101 -2.069 -20.373 -24.581 1.00 0.00 C ATOM 1647 C ARG A 101 -1.040 -20.821 -23.533 1.00 0.00 C ATOM 1648 O ARG A 101 -0.455 -21.892 -23.704 1.00 0.00 O ATOM 1649 CB ARG A 101 -3.222 -21.379 -24.744 1.00 0.00 C ATOM 1650 CG ARG A 101 -4.043 -21.551 -23.452 1.00 0.00 C ATOM 1651 CD ARG A 101 -5.193 -22.554 -23.615 1.00 0.00 C ATOM 1652 NE ARG A 101 -6.220 -22.084 -24.565 1.00 0.00 N ATOM 1653 CZ ARG A 101 -7.273 -22.795 -24.991 1.00 0.00 C ATOM 1654 NH1 ARG A 101 -7.471 -24.040 -24.560 1.00 0.00 N ATOM 1655 NH2 ARG A 101 -8.130 -22.254 -25.851 1.00 0.00 N ATOM 0 H ARG A 101 -1.667 -20.870 -26.575 1.00 0.00 H new ATOM 0 HA ARG A 101 -2.519 -19.436 -24.253 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -3.880 -21.046 -25.547 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -2.817 -22.345 -25.044 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -3.385 -21.885 -22.649 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -4.448 -20.585 -23.151 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -4.793 -23.508 -23.959 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -5.655 -22.734 -22.644 1.00 0.00 H new ATOM 0 HE ARG A 101 -6.120 -21.136 -24.929 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -6.818 -24.461 -23.899 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -8.276 -24.572 -24.891 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -7.985 -21.301 -26.184 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -8.933 -22.792 -26.178 1.00 0.00 H new ATOM 1669 N PRO A 102 -0.803 -20.052 -22.455 1.00 0.00 N ATOM 1670 CA PRO A 102 0.309 -20.326 -21.554 1.00 0.00 C ATOM 1671 C PRO A 102 0.136 -21.631 -20.779 1.00 0.00 C ATOM 1672 O PRO A 102 1.100 -22.374 -20.607 1.00 0.00 O ATOM 1673 CB PRO A 102 0.393 -19.124 -20.604 1.00 0.00 C ATOM 1674 CG PRO A 102 -0.960 -18.424 -20.722 1.00 0.00 C ATOM 1675 CD PRO A 102 -1.451 -18.793 -22.117 1.00 0.00 C ATOM 0 HA PRO A 102 1.229 -20.457 -22.123 1.00 0.00 H new ATOM 0 HB2 PRO A 102 0.582 -19.444 -19.580 1.00 0.00 H new ATOM 0 HB3 PRO A 102 1.208 -18.456 -20.885 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -1.653 -18.765 -19.953 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -0.861 -17.345 -20.607 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -2.536 -18.897 -22.133 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -1.194 -18.017 -22.838 1.00 0.00 H new ATOM 1683 N LYS A 103 -1.086 -21.933 -20.332 1.00 0.00 N ATOM 1684 CA LYS A 103 -1.359 -23.030 -19.393 1.00 0.00 C ATOM 1685 C LYS A 103 -1.561 -24.389 -20.076 1.00 0.00 C ATOM 1686 O LYS A 103 -2.145 -25.303 -19.487 1.00 0.00 O ATOM 1687 CB LYS A 103 -2.535 -22.650 -18.469 1.00 0.00 C ATOM 1688 CG LYS A 103 -2.229 -21.412 -17.603 1.00 0.00 C ATOM 1689 CD LYS A 103 -3.399 -21.005 -16.694 1.00 0.00 C ATOM 1690 CE LYS A 103 -3.708 -22.066 -15.625 1.00 0.00 C ATOM 1691 NZ LYS A 103 -4.801 -21.642 -14.715 1.00 0.00 N ATOM 0 H LYS A 103 -1.922 -21.420 -20.613 1.00 0.00 H new ATOM 0 HA LYS A 103 -0.467 -23.165 -18.781 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -3.420 -22.456 -19.074 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -2.771 -23.494 -17.821 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -1.353 -21.615 -16.987 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.975 -20.575 -18.254 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.164 -20.059 -16.206 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.287 -20.837 -17.303 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -3.985 -23.001 -16.112 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -2.809 -22.265 -15.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.975 -22.387 -14.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -4.527 -20.764 -14.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -5.667 -21.477 -15.266 1.00 0.00 H new ATOM 1705 N LYS A 104 -1.108 -24.522 -21.321 1.00 0.00 N ATOM 1706 CA LYS A 104 -1.040 -25.818 -21.991 1.00 0.00 C ATOM 1707 C LYS A 104 -0.056 -26.696 -21.224 1.00 0.00 C ATOM 1708 O LYS A 104 0.994 -26.179 -20.785 1.00 0.00 O ATOM 1709 CB LYS A 104 -0.640 -25.658 -23.466 1.00 0.00 C ATOM 1710 CG LYS A 104 -1.855 -25.255 -24.317 1.00 0.00 C ATOM 1711 CD LYS A 104 -1.467 -25.017 -25.783 1.00 0.00 C ATOM 1712 CE LYS A 104 -2.727 -24.830 -26.642 1.00 0.00 C ATOM 1713 NZ LYS A 104 -2.400 -24.463 -28.041 1.00 0.00 N ATOM 1714 OXT LYS A 104 -0.334 -27.903 -21.066 1.00 0.00 O ATOM 0 H LYS A 104 -0.780 -23.741 -21.889 1.00 0.00 H new ATOM 0 HA LYS A 104 -2.021 -26.293 -21.993 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.141 -24.903 -23.557 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -0.223 -26.594 -23.839 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.612 -26.037 -24.263 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -2.302 -24.349 -23.907 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.831 -24.135 -25.860 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -0.887 -25.861 -26.155 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -3.309 -25.752 -26.636 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -3.354 -24.055 -26.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -3.277 -24.248 -28.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -1.782 -23.627 -28.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -1.912 -25.257 -28.503 1.00 0.00 H new TER 1728 LYS A 104