USER MOD reduce.3.24.130724 H: found=0, std=0, add=1300, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1298 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 179:sc= -0.488 (180deg=-0.488) USER MOD Set 1.2: A 168 MET CE :methyl -171:sc= -3.34! (180deg=-3.4) USER MOD Set 2.1: A 90 GLN : amide:sc= -1.54! K(o=-0.67!,f=0.93) USER MOD Set 2.2: A 148 ASN : amide:sc= -0.856 K(o=-0.67,f=-6.1) USER MOD Set 2.3: A 149 GLN : amide:sc= 1.73 K(o=-0.67,f=-6.1!) USER MOD Set 3.1: A 10 SER OG : rot -150:sc= -0.0182 USER MOD Set 3.2: A 62 GLN : amide:sc= 1.64 K(o=1.6,f=-4.4!) USER MOD Set 4.1: A 33 HIS : no HD1:sc= -0.0236 X(o=-0.024,f=-0.32) USER MOD Set 4.2: A 46 TYR OH : rot 166:sc= 0 USER MOD Set 5.1: A 9 SER OG : rot 78:sc= 0.3 USER MOD Set 5.2: A 14 THR OG1 : rot 156:sc= 0.899 USER MOD Single : A 1 MET CE :methyl -119:sc= -0.0756 (180deg=-0.105) USER MOD Single : A 1 MET N :NH3+ -148:sc= 0.057 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0.431 K(o=0.43,f=-0.073) USER MOD Single : A 7 TYR OH : rot 160:sc= 1.26 USER MOD Single : A 11 THR OG1 : rot 131:sc= 2.18 USER MOD Single : A 12 CYS SG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl -167:sc= -0.636 (180deg=-0.933) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 1.28 (180deg=1.28) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.136 K(o=-0.14,f=-9.2!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -155:sc= 1.22 (180deg=0.839) USER MOD Single : A 43 MET CE :methyl 167:sc= -0.407 (180deg=-0.789) USER MOD Single : A 45 GLN : amide:sc= 0.546 K(o=0.55,f=0) USER MOD Single : A 55 THR OG1 : rot 74:sc= 0.506 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.0052 X(o=-0.0052,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -165:sc= 2.23 (180deg=1.82) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 154:sc= -0.898 (180deg=-1.11) USER MOD Single : A 105 HIS : no HD1:sc= -1.4 K(o=-1.4,f=-4.1) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 177:sc= 1.65 (180deg=1.64) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -161:sc= 0.0922 USER MOD Single : A 127 THR OG1 : rot -38:sc= 0.0317 USER MOD Single : A 128 SER OG : rot 163:sc= 0.721 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 145:sc= 1.27 USER MOD Single : A 158 GLN : amide:sc= 0.957 K(o=0.96,f=0) USER MOD Single : A 159 SER OG : rot -85:sc= 0.258 USER MOD Single : A 161 CYS SG : rot 78:sc= -1.34! USER MOD Single : A 163 GLN : amide:sc= 1.41 K(o=1.4,f=-0.48) USER MOD Single : A 166 ASN : amide:sc= 0.892 K(o=0.89,f=0) USER MOD Single : A 171 HIS : no HD1:sc= -0.308 X(o=-0.31,f=-0.013) USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.537 0.647 -0.469 1.00 0.00 N ATOM 2 CA MET A 1 1.688 0.626 -1.428 1.00 0.00 C ATOM 3 C MET A 1 1.958 2.014 -2.006 1.00 0.00 C ATOM 4 O MET A 1 1.019 2.742 -2.310 1.00 0.00 O ATOM 5 CB MET A 1 1.525 -0.422 -2.571 1.00 0.00 C ATOM 6 CG MET A 1 0.580 -0.043 -3.734 1.00 0.00 C ATOM 7 SD MET A 1 -1.208 -0.167 -3.438 1.00 0.00 S ATOM 8 CE MET A 1 -1.448 -1.952 -3.665 1.00 0.00 C ATOM 0 H1 MET A 1 0.691 -0.065 0.273 1.00 0.00 H new ATOM 0 H2 MET A 1 0.464 1.589 -0.035 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.344 0.431 -0.979 1.00 0.00 H new ATOM 0 HA MET A 1 2.553 0.315 -0.842 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.511 -0.627 -2.988 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.166 -1.352 -2.131 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.802 0.983 -4.027 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.824 -0.677 -4.586 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.136 -2.124 -4.492 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.490 -2.423 -3.886 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.862 -2.382 -2.753 1.00 0.00 H new ATOM 20 N ASN A 2 3.226 2.359 -2.237 1.00 0.00 N ATOM 21 CA ASN A 2 3.582 3.552 -3.010 1.00 0.00 C ATOM 22 C ASN A 2 3.474 3.211 -4.499 1.00 0.00 C ATOM 23 O ASN A 2 3.813 2.098 -4.902 1.00 0.00 O ATOM 24 CB ASN A 2 4.953 4.113 -2.602 1.00 0.00 C ATOM 25 CG ASN A 2 6.143 3.147 -2.540 1.00 0.00 C ATOM 26 OD1 ASN A 2 7.027 3.316 -1.707 1.00 0.00 O ATOM 27 ND2 ASN A 2 6.217 2.125 -3.382 1.00 0.00 N ATOM 0 H ASN A 2 4.027 1.827 -1.898 1.00 0.00 H new ATOM 0 HA ASN A 2 2.885 4.361 -2.794 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.208 4.910 -3.300 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.846 4.572 -1.619 1.00 0.00 H new ATOM 0 HD21 ASN A 2 7.008 1.482 -3.336 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.483 1.982 -4.076 1.00 0.00 H new ATOM 34 N MET A 3 3.006 4.151 -5.312 1.00 0.00 N ATOM 35 CA MET A 3 2.628 3.983 -6.712 1.00 0.00 C ATOM 36 C MET A 3 3.286 5.091 -7.520 1.00 0.00 C ATOM 37 O MET A 3 3.414 6.215 -7.040 1.00 0.00 O ATOM 38 CB MET A 3 1.097 4.050 -6.864 1.00 0.00 C ATOM 39 CG MET A 3 0.398 3.103 -5.877 1.00 0.00 C ATOM 40 SD MET A 3 -1.303 2.603 -6.254 1.00 0.00 S ATOM 41 CE MET A 3 -2.136 4.186 -6.507 1.00 0.00 C ATOM 0 H MET A 3 2.872 5.110 -4.992 1.00 0.00 H new ATOM 0 HA MET A 3 2.960 3.010 -7.073 1.00 0.00 H new ATOM 0 HB2 MET A 3 0.757 5.072 -6.695 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.818 3.786 -7.884 1.00 0.00 H new ATOM 0 HG2 MET A 3 1.003 2.200 -5.793 1.00 0.00 H new ATOM 0 HG3 MET A 3 0.398 3.580 -4.897 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.181 4.011 -6.762 1.00 0.00 H new ATOM 0 HE2 MET A 3 -2.080 4.777 -5.593 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.650 4.727 -7.319 1.00 0.00 H new ATOM 51 N GLY A 4 3.663 4.801 -8.758 1.00 0.00 N ATOM 52 CA GLY A 4 4.363 5.771 -9.592 1.00 0.00 C ATOM 53 C GLY A 4 3.460 6.255 -10.712 1.00 0.00 C ATOM 54 O GLY A 4 3.057 5.439 -11.538 1.00 0.00 O ATOM 0 H GLY A 4 3.496 3.901 -9.208 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.685 6.617 -8.985 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.262 5.319 -10.011 1.00 0.00 H new ATOM 58 N LEU A 5 3.138 7.551 -10.767 1.00 0.00 N ATOM 59 CA LEU A 5 2.464 8.148 -11.916 1.00 0.00 C ATOM 60 C LEU A 5 3.514 8.642 -12.918 1.00 0.00 C ATOM 61 O LEU A 5 4.200 9.621 -12.648 1.00 0.00 O ATOM 62 CB LEU A 5 1.538 9.277 -11.417 1.00 0.00 C ATOM 63 CG LEU A 5 0.540 9.880 -12.428 1.00 0.00 C ATOM 64 CD1 LEU A 5 1.153 10.357 -13.736 1.00 0.00 C ATOM 65 CD2 LEU A 5 -0.531 8.872 -12.808 1.00 0.00 C ATOM 0 H LEU A 5 3.338 8.212 -10.016 1.00 0.00 H new ATOM 0 HA LEU A 5 1.844 7.416 -12.434 1.00 0.00 H new ATOM 0 HB2 LEU A 5 0.969 8.895 -10.570 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.166 10.085 -11.041 1.00 0.00 H new ATOM 0 HG LEU A 5 0.138 10.743 -11.898 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.371 10.763 -14.377 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.892 11.131 -13.530 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.636 9.519 -14.239 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.220 9.325 -13.521 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.063 7.997 -13.260 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -1.079 8.570 -11.916 1.00 0.00 H new ATOM 77 N PHE A 6 3.584 8.025 -14.092 1.00 0.00 N ATOM 78 CA PHE A 6 4.439 8.416 -15.215 1.00 0.00 C ATOM 79 C PHE A 6 3.619 8.977 -16.371 1.00 0.00 C ATOM 80 O PHE A 6 2.507 8.527 -16.630 1.00 0.00 O ATOM 81 CB PHE A 6 5.224 7.199 -15.698 1.00 0.00 C ATOM 82 CG PHE A 6 6.188 6.671 -14.669 1.00 0.00 C ATOM 83 CD1 PHE A 6 5.738 5.839 -13.631 1.00 0.00 C ATOM 84 CD2 PHE A 6 7.532 7.059 -14.723 1.00 0.00 C ATOM 85 CE1 PHE A 6 6.623 5.447 -12.621 1.00 0.00 C ATOM 86 CE2 PHE A 6 8.420 6.635 -13.731 1.00 0.00 C ATOM 87 CZ PHE A 6 7.970 5.844 -12.659 1.00 0.00 C ATOM 0 H PHE A 6 3.022 7.200 -14.300 1.00 0.00 H new ATOM 0 HA PHE A 6 5.119 9.195 -14.870 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.525 6.409 -15.972 1.00 0.00 H new ATOM 0 HB3 PHE A 6 5.775 7.464 -16.601 1.00 0.00 H new ATOM 0 HD1 PHE A 6 4.712 5.503 -13.613 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.882 7.685 -15.530 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.268 4.834 -11.806 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.461 6.917 -13.788 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.651 5.546 -11.875 1.00 0.00 H new ATOM 97 N TYR A 7 4.185 9.926 -17.105 1.00 0.00 N ATOM 98 CA TYR A 7 3.575 10.545 -18.283 1.00 0.00 C ATOM 99 C TYR A 7 4.641 11.286 -19.085 1.00 0.00 C ATOM 100 O TYR A 7 5.776 11.437 -18.634 1.00 0.00 O ATOM 101 CB TYR A 7 2.498 11.554 -17.843 1.00 0.00 C ATOM 102 CG TYR A 7 3.050 12.704 -17.022 1.00 0.00 C ATOM 103 CD1 TYR A 7 3.314 12.495 -15.659 1.00 0.00 C ATOM 104 CD2 TYR A 7 3.368 13.941 -17.614 1.00 0.00 C ATOM 105 CE1 TYR A 7 3.859 13.512 -14.865 1.00 0.00 C ATOM 106 CE2 TYR A 7 3.909 14.966 -16.818 1.00 0.00 C ATOM 107 CZ TYR A 7 4.149 14.763 -15.439 1.00 0.00 C ATOM 108 OH TYR A 7 4.678 15.741 -14.655 1.00 0.00 O ATOM 0 H TYR A 7 5.110 10.300 -16.894 1.00 0.00 H new ATOM 0 HA TYR A 7 3.123 9.765 -18.896 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.002 11.954 -18.728 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.739 11.033 -17.260 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.093 11.535 -15.216 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.198 14.101 -18.668 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.056 13.337 -13.818 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.144 15.920 -17.265 1.00 0.00 H new ATOM 0 HH TYR A 7 5.115 16.413 -15.220 1.00 0.00 H new ATOM 118 N GLY A 8 4.238 11.816 -20.241 1.00 0.00 N ATOM 119 CA GLY A 8 5.006 12.756 -21.045 1.00 0.00 C ATOM 120 C GLY A 8 3.995 13.699 -21.679 1.00 0.00 C ATOM 121 O GLY A 8 2.876 13.279 -21.974 1.00 0.00 O ATOM 0 H GLY A 8 3.333 11.591 -20.655 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.717 13.306 -20.428 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.583 12.234 -21.808 1.00 0.00 H new ATOM 125 N SER A 9 4.324 14.980 -21.810 1.00 0.00 N ATOM 126 CA SER A 9 3.463 15.973 -22.433 1.00 0.00 C ATOM 127 C SER A 9 4.280 17.068 -23.124 1.00 0.00 C ATOM 128 O SER A 9 5.313 17.502 -22.610 1.00 0.00 O ATOM 129 CB SER A 9 2.563 16.583 -21.362 1.00 0.00 C ATOM 130 OG SER A 9 1.409 17.126 -21.974 1.00 0.00 O ATOM 0 H SER A 9 5.211 15.361 -21.480 1.00 0.00 H new ATOM 0 HA SER A 9 2.859 15.486 -23.198 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.279 15.823 -20.634 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.100 17.360 -20.819 1.00 0.00 H new ATOM 0 HG SER A 9 0.786 16.403 -22.196 1.00 0.00 H new ATOM 136 N SER A 10 3.747 17.548 -24.254 1.00 0.00 N ATOM 137 CA SER A 10 4.234 18.725 -24.974 1.00 0.00 C ATOM 138 C SER A 10 3.440 19.985 -24.591 1.00 0.00 C ATOM 139 O SER A 10 4.027 21.060 -24.448 1.00 0.00 O ATOM 140 CB SER A 10 4.151 18.423 -26.478 1.00 0.00 C ATOM 141 OG SER A 10 5.008 17.332 -26.785 1.00 0.00 O ATOM 0 H SER A 10 2.941 17.113 -24.704 1.00 0.00 H new ATOM 0 HA SER A 10 5.269 18.933 -24.702 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.125 18.184 -26.757 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.441 19.302 -27.054 1.00 0.00 H new ATOM 0 HG SER A 10 5.337 17.423 -27.704 1.00 0.00 H new ATOM 147 N THR A 11 2.124 19.858 -24.387 1.00 0.00 N ATOM 148 CA THR A 11 1.235 20.972 -24.040 1.00 0.00 C ATOM 149 C THR A 11 1.031 21.081 -22.519 1.00 0.00 C ATOM 150 O THR A 11 0.435 22.053 -22.045 1.00 0.00 O ATOM 151 CB THR A 11 -0.107 20.743 -24.739 1.00 0.00 C ATOM 152 OG1 THR A 11 -0.569 19.503 -24.268 1.00 0.00 O ATOM 153 CG2 THR A 11 -0.017 20.649 -26.265 1.00 0.00 C ATOM 0 H THR A 11 1.639 18.964 -24.460 1.00 0.00 H new ATOM 0 HA THR A 11 1.686 21.908 -24.370 1.00 0.00 H new ATOM 0 HB THR A 11 -0.755 21.592 -24.521 1.00 0.00 H new ATOM 0 HG1 THR A 11 -1.499 19.591 -23.972 1.00 0.00 H new ATOM 0 HG21 THR A 11 -1.012 20.486 -26.679 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.394 21.577 -26.663 1.00 0.00 H new ATOM 0 HG23 THR A 11 0.631 19.817 -26.541 1.00 0.00 H new ATOM 161 N CYS A 12 1.512 20.079 -21.763 1.00 0.00 N ATOM 162 CA CYS A 12 1.268 19.864 -20.340 1.00 0.00 C ATOM 163 C CYS A 12 -0.158 19.402 -20.011 1.00 0.00 C ATOM 164 O CYS A 12 -0.512 19.368 -18.834 1.00 0.00 O ATOM 165 CB CYS A 12 1.793 21.027 -19.474 1.00 0.00 C ATOM 166 SG CYS A 12 3.552 21.335 -19.831 1.00 0.00 S ATOM 0 H CYS A 12 2.116 19.359 -22.159 1.00 0.00 H new ATOM 0 HA CYS A 12 1.873 19.003 -20.055 1.00 0.00 H new ATOM 0 HB2 CYS A 12 1.212 21.928 -19.671 1.00 0.00 H new ATOM 0 HB3 CYS A 12 1.665 20.790 -18.418 1.00 0.00 H new ATOM 0 HG CYS A 12 3.978 22.319 -19.096 1.00 0.00 H new ATOM 172 N TYR A 13 -0.963 18.942 -20.979 1.00 0.00 N ATOM 173 CA TYR A 13 -2.271 18.356 -20.652 1.00 0.00 C ATOM 174 C TYR A 13 -2.091 17.069 -19.853 1.00 0.00 C ATOM 175 O TYR A 13 -2.779 16.841 -18.859 1.00 0.00 O ATOM 176 CB TYR A 13 -3.119 18.050 -21.890 1.00 0.00 C ATOM 177 CG TYR A 13 -3.310 19.121 -22.942 1.00 0.00 C ATOM 178 CD1 TYR A 13 -3.397 20.483 -22.600 1.00 0.00 C ATOM 179 CD2 TYR A 13 -3.424 18.725 -24.288 1.00 0.00 C ATOM 180 CE1 TYR A 13 -3.597 21.453 -23.594 1.00 0.00 C ATOM 181 CE2 TYR A 13 -3.624 19.696 -25.290 1.00 0.00 C ATOM 182 CZ TYR A 13 -3.718 21.065 -24.946 1.00 0.00 C ATOM 183 OH TYR A 13 -3.909 22.019 -25.904 1.00 0.00 O ATOM 0 H TYR A 13 -0.739 18.963 -21.974 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.799 19.106 -20.063 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.679 17.183 -22.382 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.108 17.752 -21.543 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.309 20.784 -21.566 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -3.358 17.680 -24.552 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -3.658 22.497 -23.325 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.706 19.394 -26.324 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.972 21.591 -26.784 1.00 0.00 H new ATOM 193 N THR A 14 -1.132 16.238 -20.274 1.00 0.00 N ATOM 194 CA THR A 14 -0.853 14.952 -19.632 1.00 0.00 C ATOM 195 C THR A 14 -0.297 15.217 -18.233 1.00 0.00 C ATOM 196 O THR A 14 -0.605 14.494 -17.292 1.00 0.00 O ATOM 197 CB THR A 14 0.103 14.098 -20.487 1.00 0.00 C ATOM 198 OG1 THR A 14 0.158 14.604 -21.807 1.00 0.00 O ATOM 199 CG2 THR A 14 -0.326 12.644 -20.590 1.00 0.00 C ATOM 0 H THR A 14 -0.527 16.439 -21.070 1.00 0.00 H new ATOM 0 HA THR A 14 -1.773 14.375 -19.541 1.00 0.00 H new ATOM 0 HB THR A 14 1.071 14.148 -19.988 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.005 14.341 -22.223 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.388 12.097 -21.205 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.360 12.203 -19.594 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.315 12.588 -21.045 1.00 0.00 H new ATOM 207 N GLU A 15 0.457 16.311 -18.087 1.00 0.00 N ATOM 208 CA GLU A 15 0.984 16.751 -16.813 1.00 0.00 C ATOM 209 C GLU A 15 -0.158 17.132 -15.877 1.00 0.00 C ATOM 210 O GLU A 15 -0.206 16.662 -14.746 1.00 0.00 O ATOM 211 CB GLU A 15 1.984 17.892 -17.048 1.00 0.00 C ATOM 212 CG GLU A 15 2.655 18.334 -15.743 1.00 0.00 C ATOM 213 CD GLU A 15 4.101 18.817 -15.962 1.00 0.00 C ATOM 214 OE1 GLU A 15 5.017 17.954 -15.999 1.00 0.00 O ATOM 215 OE2 GLU A 15 4.332 20.045 -16.060 1.00 0.00 O1- ATOM 0 H GLU A 15 0.716 16.916 -18.866 1.00 0.00 H new ATOM 0 HA GLU A 15 1.525 15.943 -16.321 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.746 17.568 -17.758 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.469 18.741 -17.498 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.071 19.136 -15.291 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.655 17.503 -15.038 1.00 0.00 H new ATOM 222 N MET A 16 -1.129 17.908 -16.351 1.00 0.00 N ATOM 223 CA MET A 16 -2.272 18.302 -15.529 1.00 0.00 C ATOM 224 C MET A 16 -3.118 17.094 -15.128 1.00 0.00 C ATOM 225 O MET A 16 -3.523 16.980 -13.972 1.00 0.00 O ATOM 226 CB MET A 16 -3.105 19.385 -16.231 1.00 0.00 C ATOM 227 CG MET A 16 -2.335 20.710 -16.338 1.00 0.00 C ATOM 228 SD MET A 16 -3.216 22.062 -17.168 1.00 0.00 S ATOM 229 CE MET A 16 -3.251 21.433 -18.870 1.00 0.00 C ATOM 0 H MET A 16 -1.148 18.278 -17.302 1.00 0.00 H new ATOM 0 HA MET A 16 -1.889 18.735 -14.605 1.00 0.00 H new ATOM 0 HB2 MET A 16 -3.382 19.043 -17.228 1.00 0.00 H new ATOM 0 HB3 MET A 16 -4.032 19.546 -15.681 1.00 0.00 H new ATOM 0 HG2 MET A 16 -2.068 21.037 -15.333 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.403 20.526 -16.872 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.547 22.234 -19.548 1.00 0.00 H new ATOM 0 HE2 MET A 16 -2.260 21.073 -19.145 1.00 0.00 H new ATOM 0 HE3 MET A 16 -3.967 20.614 -18.941 1.00 0.00 H new ATOM 239 N ALA A 17 -3.335 16.152 -16.049 1.00 0.00 N ATOM 240 CA ALA A 17 -4.010 14.896 -15.748 1.00 0.00 C ATOM 241 C ALA A 17 -3.245 14.116 -14.680 1.00 0.00 C ATOM 242 O ALA A 17 -3.867 13.614 -13.747 1.00 0.00 O ATOM 243 CB ALA A 17 -4.221 14.069 -17.021 1.00 0.00 C ATOM 0 H ALA A 17 -3.046 16.242 -17.023 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.997 15.121 -15.344 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.726 13.137 -16.770 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.832 14.634 -17.725 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.255 13.847 -17.475 1.00 0.00 H new ATOM 249 N ALA A 18 -1.914 14.062 -14.764 1.00 0.00 N ATOM 250 CA ALA A 18 -1.066 13.415 -13.779 1.00 0.00 C ATOM 251 C ALA A 18 -1.310 13.991 -12.397 1.00 0.00 C ATOM 252 O ALA A 18 -1.494 13.228 -11.447 1.00 0.00 O ATOM 253 CB ALA A 18 0.404 13.585 -14.178 1.00 0.00 C ATOM 0 H ALA A 18 -1.392 14.477 -15.536 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.309 12.353 -13.748 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.040 13.099 -13.438 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.571 13.131 -15.155 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.648 14.646 -14.225 1.00 0.00 H new ATOM 259 N GLU A 19 -1.361 15.322 -12.285 1.00 0.00 N ATOM 260 CA GLU A 19 -1.586 15.982 -10.999 1.00 0.00 C ATOM 261 C GLU A 19 -2.896 15.517 -10.410 1.00 0.00 C ATOM 262 O GLU A 19 -2.941 15.179 -9.228 1.00 0.00 O ATOM 263 CB GLU A 19 -1.623 17.520 -11.055 1.00 0.00 C ATOM 264 CG GLU A 19 -0.483 18.137 -11.841 1.00 0.00 C ATOM 265 CD GLU A 19 -0.326 19.638 -11.538 1.00 0.00 C ATOM 266 OE1 GLU A 19 -0.972 20.471 -12.219 1.00 0.00 O ATOM 267 OE2 GLU A 19 0.444 19.990 -10.611 1.00 0.00 O1- ATOM 0 H GLU A 19 -1.249 15.962 -13.071 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.728 15.703 -10.388 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.568 17.834 -11.498 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.602 17.911 -10.038 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.446 17.619 -11.602 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.660 17.998 -12.908 1.00 0.00 H new ATOM 274 N LYS A 20 -3.929 15.477 -11.250 1.00 0.00 N ATOM 275 CA LYS A 20 -5.276 15.098 -10.881 1.00 0.00 C ATOM 276 C LYS A 20 -5.260 13.675 -10.388 1.00 0.00 C ATOM 277 O LYS A 20 -5.676 13.446 -9.265 1.00 0.00 O ATOM 278 CB LYS A 20 -6.228 15.329 -12.069 1.00 0.00 C ATOM 279 CG LYS A 20 -6.445 16.823 -12.356 1.00 0.00 C ATOM 280 CD LYS A 20 -7.157 16.962 -13.709 1.00 0.00 C ATOM 281 CE LYS A 20 -7.249 18.397 -14.229 1.00 0.00 C ATOM 282 NZ LYS A 20 -8.094 19.281 -13.376 1.00 0.00 N1+ ATOM 0 H LYS A 20 -3.840 15.717 -12.237 1.00 0.00 H new ATOM 0 HA LYS A 20 -5.652 15.718 -10.067 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.822 14.845 -12.957 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -7.188 14.858 -11.860 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.042 17.277 -11.566 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.490 17.347 -12.375 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.632 16.354 -14.446 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.164 16.556 -13.619 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.245 18.818 -14.294 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.655 18.384 -15.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.115 20.238 -13.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.061 18.901 -13.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.696 19.321 -12.416 1.00 0.00 H new ATOM 296 N ILE A 21 -4.739 12.733 -11.166 1.00 0.00 N ATOM 297 CA ILE A 21 -4.749 11.324 -10.780 1.00 0.00 C ATOM 298 C ILE A 21 -4.129 11.159 -9.399 1.00 0.00 C ATOM 299 O ILE A 21 -4.764 10.637 -8.486 1.00 0.00 O ATOM 300 CB ILE A 21 -4.002 10.490 -11.843 1.00 0.00 C ATOM 301 CG1 ILE A 21 -4.863 10.319 -13.105 1.00 0.00 C ATOM 302 CG2 ILE A 21 -3.644 9.101 -11.306 1.00 0.00 C ATOM 303 CD1 ILE A 21 -4.020 10.389 -14.378 1.00 0.00 C ATOM 0 H ILE A 21 -4.303 12.918 -12.069 1.00 0.00 H new ATOM 0 HA ILE A 21 -5.776 10.963 -10.728 1.00 0.00 H new ATOM 0 HB ILE A 21 -3.087 11.029 -12.089 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.382 9.361 -13.064 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.628 11.095 -13.132 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -3.119 8.537 -12.077 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -3.002 9.204 -10.431 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.556 8.572 -11.027 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.664 10.264 -15.248 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.522 11.357 -14.432 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.272 9.596 -14.363 1.00 0.00 H new ATOM 315 N ARG A 22 -2.887 11.618 -9.240 1.00 0.00 N ATOM 316 CA ARG A 22 -2.153 11.503 -7.987 1.00 0.00 C ATOM 317 C ARG A 22 -2.914 12.189 -6.858 1.00 0.00 C ATOM 318 O ARG A 22 -2.938 11.667 -5.755 1.00 0.00 O ATOM 319 CB ARG A 22 -0.742 12.067 -8.260 1.00 0.00 C ATOM 320 CG ARG A 22 0.136 12.343 -7.019 1.00 0.00 C ATOM 321 CD ARG A 22 0.714 13.763 -6.913 1.00 0.00 C ATOM 322 NE ARG A 22 -0.291 14.785 -7.247 1.00 0.00 N ATOM 323 CZ ARG A 22 -0.321 16.073 -6.864 1.00 0.00 C ATOM 324 NH1 ARG A 22 0.642 16.579 -6.102 1.00 0.00 N1+ ATOM 325 NH2 ARG A 22 -1.325 16.847 -7.263 1.00 0.00 N ATOM 0 H ARG A 22 -2.363 12.081 -9.982 1.00 0.00 H new ATOM 0 HA ARG A 22 -2.050 10.473 -7.646 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.212 11.366 -8.905 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.847 12.997 -8.818 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.457 12.144 -6.126 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.963 11.633 -7.017 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.082 13.932 -5.901 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.568 13.859 -7.583 1.00 0.00 H new ATOM 0 HE ARG A 22 -1.060 14.478 -7.843 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.417 15.988 -5.800 1.00 0.00 H new ATOM 0 HH12 ARG A 22 0.607 17.558 -5.819 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -2.062 16.462 -7.854 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.358 17.826 -6.979 1.00 0.00 H new ATOM 339 N ASP A 23 -3.544 13.319 -7.135 1.00 0.00 N ATOM 340 CA ASP A 23 -4.293 14.080 -6.134 1.00 0.00 C ATOM 341 C ASP A 23 -5.529 13.310 -5.664 1.00 0.00 C ATOM 342 O ASP A 23 -5.759 13.166 -4.461 1.00 0.00 O ATOM 343 CB ASP A 23 -4.725 15.452 -6.659 1.00 0.00 C ATOM 344 CG ASP A 23 -5.569 16.186 -5.603 1.00 0.00 C ATOM 345 OD1 ASP A 23 -4.987 16.697 -4.616 1.00 0.00 O ATOM 346 OD2 ASP A 23 -6.808 16.272 -5.767 1.00 0.00 O1- ATOM 0 H ASP A 23 -3.553 13.741 -8.064 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.617 14.229 -5.292 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.846 16.046 -6.909 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.301 15.333 -7.576 1.00 0.00 H new ATOM 351 N ILE A 24 -6.295 12.789 -6.624 1.00 0.00 N ATOM 352 CA ILE A 24 -7.549 12.099 -6.381 1.00 0.00 C ATOM 353 C ILE A 24 -7.254 10.812 -5.598 1.00 0.00 C ATOM 354 O ILE A 24 -7.919 10.520 -4.603 1.00 0.00 O ATOM 355 CB ILE A 24 -8.293 11.850 -7.721 1.00 0.00 C ATOM 356 CG1 ILE A 24 -8.775 13.159 -8.414 1.00 0.00 C ATOM 357 CG2 ILE A 24 -9.527 10.962 -7.466 1.00 0.00 C ATOM 358 CD1 ILE A 24 -8.737 13.089 -9.945 1.00 0.00 C ATOM 0 H ILE A 24 -6.049 12.840 -7.613 1.00 0.00 H new ATOM 0 HA ILE A 24 -8.220 12.708 -5.776 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.576 11.367 -8.385 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.794 13.377 -8.093 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -8.151 13.988 -8.080 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -10.050 10.787 -8.406 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.208 10.008 -7.045 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.197 11.462 -6.766 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -9.086 14.034 -10.361 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.715 12.902 -10.275 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -9.383 12.281 -10.288 1.00 0.00 H new ATOM 370 N ILE A 25 -6.255 10.051 -6.051 1.00 0.00 N ATOM 371 CA ILE A 25 -5.909 8.756 -5.477 1.00 0.00 C ATOM 372 C ILE A 25 -5.255 8.938 -4.105 1.00 0.00 C ATOM 373 O ILE A 25 -5.674 8.315 -3.128 1.00 0.00 O ATOM 374 CB ILE A 25 -5.041 7.981 -6.486 1.00 0.00 C ATOM 375 CG1 ILE A 25 -5.890 7.688 -7.736 1.00 0.00 C ATOM 376 CG2 ILE A 25 -4.477 6.672 -5.920 1.00 0.00 C ATOM 377 CD1 ILE A 25 -5.113 6.991 -8.841 1.00 0.00 C ATOM 0 H ILE A 25 -5.660 10.322 -6.834 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.803 8.159 -5.296 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.180 8.604 -6.730 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.740 7.067 -7.452 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.293 8.625 -8.120 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.875 6.176 -6.681 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.856 6.889 -5.051 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.299 6.019 -5.625 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.770 6.814 -9.692 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.279 7.620 -9.151 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.732 6.038 -8.473 1.00 0.00 H new ATOM 389 N GLY A 26 -4.247 9.804 -4.041 1.00 0.00 N ATOM 390 CA GLY A 26 -3.617 10.234 -2.803 1.00 0.00 C ATOM 391 C GLY A 26 -2.142 10.537 -3.033 1.00 0.00 C ATOM 392 O GLY A 26 -1.360 9.611 -3.250 1.00 0.00 O ATOM 0 H GLY A 26 -3.838 10.235 -4.870 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -4.121 11.121 -2.420 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.721 9.457 -2.046 1.00 0.00 H new ATOM 396 N PRO A 27 -1.699 11.800 -2.908 1.00 0.00 N ATOM 397 CA PRO A 27 -0.296 12.182 -3.081 1.00 0.00 C ATOM 398 C PRO A 27 0.596 11.714 -1.914 1.00 0.00 C ATOM 399 O PRO A 27 1.790 12.008 -1.883 1.00 0.00 O ATOM 400 CB PRO A 27 -0.339 13.706 -3.244 1.00 0.00 C ATOM 401 CG PRO A 27 -1.534 14.113 -2.389 1.00 0.00 C ATOM 402 CD PRO A 27 -2.512 12.970 -2.602 1.00 0.00 C ATOM 0 HA PRO A 27 0.162 11.700 -3.945 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.582 14.174 -2.898 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.472 13.996 -4.286 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.261 14.220 -1.339 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.953 15.067 -2.709 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -3.117 12.803 -1.711 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -3.200 13.192 -3.418 1.00 0.00 H new ATOM 410 N GLU A 28 0.023 10.969 -0.962 1.00 0.00 N ATOM 411 CA GLU A 28 0.729 10.336 0.140 1.00 0.00 C ATOM 412 C GLU A 28 1.530 9.146 -0.392 1.00 0.00 C ATOM 413 O GLU A 28 2.606 8.824 0.119 1.00 0.00 O ATOM 414 CB GLU A 28 -0.252 9.825 1.218 1.00 0.00 C ATOM 415 CG GLU A 28 -1.589 10.569 1.297 1.00 0.00 C ATOM 416 CD GLU A 28 -2.398 10.154 2.540 1.00 0.00 C ATOM 417 OE1 GLU A 28 -2.232 10.782 3.615 1.00 0.00 O ATOM 418 OE2 GLU A 28 -3.218 9.210 2.447 1.00 0.00 O1- ATOM 0 H GLU A 28 -0.981 10.788 -0.944 1.00 0.00 H new ATOM 0 HA GLU A 28 1.388 11.079 0.590 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.453 8.770 1.031 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.238 9.889 2.190 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.407 11.643 1.323 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.172 10.366 0.399 1.00 0.00 H new ATOM 425 N LEU A 29 0.963 8.478 -1.407 1.00 0.00 N ATOM 426 CA LEU A 29 1.413 7.209 -1.934 1.00 0.00 C ATOM 427 C LEU A 29 1.631 7.267 -3.440 1.00 0.00 C ATOM 428 O LEU A 29 2.386 6.442 -3.933 1.00 0.00 O ATOM 429 CB LEU A 29 0.433 6.103 -1.499 1.00 0.00 C ATOM 430 CG LEU A 29 -1.013 6.234 -2.037 1.00 0.00 C ATOM 431 CD1 LEU A 29 -1.428 4.945 -2.751 1.00 0.00 C ATOM 432 CD2 LEU A 29 -2.009 6.559 -0.921 1.00 0.00 C ATOM 0 H LEU A 29 0.142 8.835 -1.896 1.00 0.00 H new ATOM 0 HA LEU A 29 2.391 6.968 -1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.834 5.142 -1.820 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.395 6.085 -0.410 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.027 7.063 -2.745 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.446 5.048 -3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.752 4.757 -3.585 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.381 4.110 -2.051 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.011 6.642 -1.341 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.993 5.764 -0.176 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.733 7.503 -0.450 1.00 0.00 H new ATOM 444 N VAL A 30 1.034 8.206 -4.179 1.00 0.00 N ATOM 445 CA VAL A 30 1.344 8.377 -5.601 1.00 0.00 C ATOM 446 C VAL A 30 2.429 9.445 -5.750 1.00 0.00 C ATOM 447 O VAL A 30 2.350 10.481 -5.087 1.00 0.00 O ATOM 448 CB VAL A 30 0.074 8.702 -6.404 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.347 8.707 -7.921 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.066 7.726 -6.102 1.00 0.00 C ATOM 0 H VAL A 30 0.336 8.857 -3.818 1.00 0.00 H new ATOM 0 HA VAL A 30 1.730 7.445 -6.013 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.231 9.701 -6.092 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.574 8.940 -8.456 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.102 9.459 -8.152 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.706 7.725 -8.229 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.942 7.996 -6.692 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.755 6.713 -6.356 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.314 7.774 -5.042 1.00 0.00 H new ATOM 460 N THR A 31 3.367 9.242 -6.681 1.00 0.00 N ATOM 461 CA THR A 31 4.418 10.191 -7.005 1.00 0.00 C ATOM 462 C THR A 31 4.481 10.406 -8.520 1.00 0.00 C ATOM 463 O THR A 31 4.517 9.436 -9.268 1.00 0.00 O ATOM 464 CB THR A 31 5.749 9.706 -6.399 1.00 0.00 C ATOM 465 OG1 THR A 31 5.596 9.482 -5.005 1.00 0.00 O ATOM 466 CG2 THR A 31 6.875 10.722 -6.620 1.00 0.00 C ATOM 0 H THR A 31 3.411 8.390 -7.240 1.00 0.00 H new ATOM 0 HA THR A 31 4.204 11.166 -6.566 1.00 0.00 H new ATOM 0 HB THR A 31 6.017 8.777 -6.902 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.446 9.173 -4.628 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.797 10.345 -6.179 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.021 10.877 -7.689 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.609 11.668 -6.150 1.00 0.00 H new ATOM 474 N LEU A 32 4.451 11.667 -8.972 1.00 0.00 N ATOM 475 CA LEU A 32 4.619 12.036 -10.383 1.00 0.00 C ATOM 476 C LEU A 32 6.055 11.819 -10.870 1.00 0.00 C ATOM 477 O LEU A 32 7.002 12.067 -10.120 1.00 0.00 O ATOM 478 CB LEU A 32 4.270 13.516 -10.652 1.00 0.00 C ATOM 479 CG LEU A 32 2.853 13.999 -10.319 1.00 0.00 C ATOM 480 CD1 LEU A 32 2.511 15.250 -11.129 1.00 0.00 C ATOM 481 CD2 LEU A 32 1.795 12.927 -10.585 1.00 0.00 C ATOM 0 H LEU A 32 4.307 12.470 -8.359 1.00 0.00 H new ATOM 0 HA LEU A 32 3.932 11.385 -10.923 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.972 14.131 -10.089 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.449 13.713 -11.709 1.00 0.00 H new ATOM 0 HG LEU A 32 2.843 14.228 -9.253 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.502 15.580 -10.881 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.221 16.043 -10.891 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.566 15.021 -12.193 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.809 13.318 -10.333 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.817 12.648 -11.638 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.004 12.050 -9.973 1.00 0.00 H new ATOM 493 N HIS A 33 6.201 11.490 -12.157 1.00 0.00 N ATOM 494 CA HIS A 33 7.454 11.350 -12.863 1.00 0.00 C ATOM 495 C HIS A 33 7.228 11.828 -14.292 1.00 0.00 C ATOM 496 O HIS A 33 6.517 11.169 -15.058 1.00 0.00 O ATOM 497 CB HIS A 33 7.889 9.884 -12.871 1.00 0.00 C ATOM 498 CG HIS A 33 8.243 9.348 -11.507 1.00 0.00 C ATOM 499 ND1 HIS A 33 9.434 9.599 -10.816 1.00 0.00 N ATOM 500 CD2 HIS A 33 7.424 8.577 -10.732 1.00 0.00 C ATOM 501 CE1 HIS A 33 9.296 8.975 -9.633 1.00 0.00 C ATOM 502 NE2 HIS A 33 8.106 8.350 -9.559 1.00 0.00 N ATOM 0 H HIS A 33 5.397 11.307 -12.757 1.00 0.00 H new ATOM 0 HA HIS A 33 8.235 11.935 -12.378 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.086 9.279 -13.292 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.751 9.774 -13.530 1.00 0.00 H new ATOM 0 HD2 HIS A 33 6.438 8.218 -10.989 1.00 0.00 H new ATOM 0 HE1 HIS A 33 10.039 8.975 -8.849 1.00 0.00 H new ATOM 0 HE2 HIS A 33 7.768 7.802 -8.768 1.00 0.00 H new ATOM 510 N ASN A 34 7.796 12.972 -14.668 1.00 0.00 N ATOM 511 CA ASN A 34 7.747 13.425 -16.041 1.00 0.00 C ATOM 512 C ASN A 34 8.871 12.755 -16.816 1.00 0.00 C ATOM 513 O ASN A 34 10.046 13.072 -16.629 1.00 0.00 O ATOM 514 CB ASN A 34 7.843 14.940 -16.153 1.00 0.00 C ATOM 515 CG ASN A 34 7.428 15.324 -17.561 1.00 0.00 C ATOM 516 OD1 ASN A 34 7.795 14.699 -18.545 1.00 0.00 O ATOM 517 ND2 ASN A 34 6.643 16.358 -17.702 1.00 0.00 N ATOM 0 H ASN A 34 8.294 13.597 -14.034 1.00 0.00 H new ATOM 0 HA ASN A 34 6.782 13.146 -16.464 1.00 0.00 H new ATOM 0 HB2 ASN A 34 7.196 15.420 -15.419 1.00 0.00 H new ATOM 0 HB3 ASN A 34 8.860 15.275 -15.949 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.337 16.643 -18.632 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.336 16.881 -16.882 1.00 0.00 H new ATOM 524 N LEU A 35 8.500 11.876 -17.737 1.00 0.00 N ATOM 525 CA LEU A 35 9.443 11.080 -18.522 1.00 0.00 C ATOM 526 C LEU A 35 10.307 11.916 -19.475 1.00 0.00 C ATOM 527 O LEU A 35 11.286 11.389 -20.012 1.00 0.00 O ATOM 528 CB LEU A 35 8.706 9.969 -19.280 1.00 0.00 C ATOM 529 CG LEU A 35 8.249 8.837 -18.346 1.00 0.00 C ATOM 530 CD1 LEU A 35 7.290 7.939 -19.118 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.427 8.011 -17.810 1.00 0.00 C ATOM 0 H LEU A 35 7.523 11.691 -17.965 1.00 0.00 H new ATOM 0 HA LEU A 35 10.135 10.631 -17.810 1.00 0.00 H new ATOM 0 HB2 LEU A 35 7.839 10.391 -19.788 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.360 9.561 -20.051 1.00 0.00 H new ATOM 0 HG LEU A 35 7.756 9.279 -17.480 1.00 0.00 H new ATOM 0 HD11 LEU A 35 6.953 7.128 -18.473 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.430 8.523 -19.447 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.800 7.524 -19.987 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.052 7.224 -17.155 1.00 0.00 H new ATOM 0 HD22 LEU A 35 9.966 7.562 -18.644 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.101 8.659 -17.249 1.00 0.00 H new ATOM 543 N LYS A 36 10.001 13.208 -19.673 1.00 0.00 N ATOM 544 CA LYS A 36 10.909 14.112 -20.377 1.00 0.00 C ATOM 545 C LYS A 36 12.281 14.181 -19.690 1.00 0.00 C ATOM 546 O LYS A 36 13.284 14.443 -20.356 1.00 0.00 O ATOM 547 CB LYS A 36 10.279 15.482 -20.622 1.00 0.00 C ATOM 548 CG LYS A 36 10.422 16.332 -19.375 1.00 0.00 C ATOM 549 CD LYS A 36 9.554 17.581 -19.409 1.00 0.00 C ATOM 550 CE LYS A 36 9.611 17.980 -17.944 1.00 0.00 C ATOM 551 NZ LYS A 36 8.961 19.291 -17.656 1.00 0.00 N1+ ATOM 0 H LYS A 36 9.135 13.643 -19.355 1.00 0.00 H new ATOM 0 HA LYS A 36 11.090 13.695 -21.368 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.764 15.972 -21.467 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.226 15.369 -20.880 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.158 15.735 -18.502 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.466 16.624 -19.258 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.957 18.351 -20.067 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.538 17.374 -19.746 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.129 17.206 -17.346 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.653 18.024 -17.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.037 19.500 -16.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.435 20.040 -18.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 7.958 19.248 -17.927 1.00 0.00 H new ATOM 565 N ASP A 37 12.320 13.977 -18.368 1.00 0.00 N ATOM 566 CA ASP A 37 13.509 14.151 -17.537 1.00 0.00 C ATOM 567 C ASP A 37 13.763 12.941 -16.636 1.00 0.00 C ATOM 568 O ASP A 37 14.924 12.591 -16.403 1.00 0.00 O ATOM 569 CB ASP A 37 13.343 15.407 -16.676 1.00 0.00 C ATOM 570 CG ASP A 37 14.573 15.621 -15.777 1.00 0.00 C ATOM 571 OD1 ASP A 37 15.646 16.005 -16.304 1.00 0.00 O ATOM 572 OD2 ASP A 37 14.462 15.454 -14.540 1.00 0.00 O1- ATOM 0 H ASP A 37 11.502 13.679 -17.836 1.00 0.00 H new ATOM 0 HA ASP A 37 14.369 14.253 -18.199 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.200 16.277 -17.318 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.448 15.315 -16.060 1.00 0.00 H new ATOM 577 N ASP A 38 12.706 12.280 -16.152 1.00 0.00 N ATOM 578 CA ASP A 38 12.812 11.116 -15.290 1.00 0.00 C ATOM 579 C ASP A 38 13.047 9.884 -16.152 1.00 0.00 C ATOM 580 O ASP A 38 12.427 9.715 -17.206 1.00 0.00 O ATOM 581 CB ASP A 38 11.578 10.913 -14.400 1.00 0.00 C ATOM 582 CG ASP A 38 11.520 11.925 -13.244 1.00 0.00 C ATOM 583 OD1 ASP A 38 12.438 11.915 -12.388 1.00 0.00 O ATOM 584 OD2 ASP A 38 10.556 12.730 -13.190 1.00 0.00 O1- ATOM 0 H ASP A 38 11.743 12.549 -16.356 1.00 0.00 H new ATOM 0 HA ASP A 38 13.652 11.279 -14.615 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.677 11.005 -15.006 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.588 9.901 -13.994 1.00 0.00 H new ATOM 589 N SER A 39 13.913 8.998 -15.674 1.00 0.00 N ATOM 590 CA SER A 39 14.176 7.714 -16.301 1.00 0.00 C ATOM 591 C SER A 39 13.105 6.746 -15.814 1.00 0.00 C ATOM 592 O SER A 39 12.825 6.733 -14.620 1.00 0.00 O ATOM 593 CB SER A 39 15.583 7.218 -15.925 1.00 0.00 C ATOM 594 OG SER A 39 16.559 8.225 -16.162 1.00 0.00 O ATOM 0 H SER A 39 14.459 9.157 -14.827 1.00 0.00 H new ATOM 0 HA SER A 39 14.143 7.795 -17.387 1.00 0.00 H new ATOM 0 HB2 SER A 39 15.602 6.929 -14.874 1.00 0.00 H new ATOM 0 HB3 SER A 39 15.826 6.328 -16.505 1.00 0.00 H new ATOM 0 HG SER A 39 17.445 7.887 -15.914 1.00 0.00 H new ATOM 600 N PRO A 40 12.546 5.855 -16.647 1.00 0.00 N ATOM 601 CA PRO A 40 11.541 4.910 -16.183 1.00 0.00 C ATOM 602 C PRO A 40 12.157 3.818 -15.296 1.00 0.00 C ATOM 603 O PRO A 40 11.407 3.045 -14.728 1.00 0.00 O ATOM 604 CB PRO A 40 10.913 4.381 -17.472 1.00 0.00 C ATOM 605 CG PRO A 40 12.115 4.326 -18.408 1.00 0.00 C ATOM 606 CD PRO A 40 12.812 5.646 -18.063 1.00 0.00 C ATOM 0 HA PRO A 40 10.788 5.361 -15.536 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.459 3.400 -17.332 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.133 5.043 -17.848 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.750 3.461 -18.214 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.820 4.277 -19.456 1.00 0.00 H new ATOM 0 HD2 PRO A 40 13.883 5.590 -18.259 1.00 0.00 H new ATOM 0 HD3 PRO A 40 12.421 6.467 -18.663 1.00 0.00 H new ATOM 614 N LYS A 41 13.480 3.752 -15.099 1.00 0.00 N ATOM 615 CA LYS A 41 14.136 2.753 -14.241 1.00 0.00 C ATOM 616 C LYS A 41 13.546 2.750 -12.833 1.00 0.00 C ATOM 617 O LYS A 41 13.320 1.701 -12.248 1.00 0.00 O ATOM 618 CB LYS A 41 15.648 3.042 -14.174 1.00 0.00 C ATOM 619 CG LYS A 41 16.420 2.796 -15.485 1.00 0.00 C ATOM 620 CD LYS A 41 16.910 1.346 -15.649 1.00 0.00 C ATOM 621 CE LYS A 41 17.823 1.241 -16.883 1.00 0.00 C ATOM 622 NZ LYS A 41 18.432 -0.109 -17.045 1.00 0.00 N1+ ATOM 0 H LYS A 41 14.135 4.400 -15.537 1.00 0.00 H new ATOM 0 HA LYS A 41 13.966 1.768 -14.677 1.00 0.00 H new ATOM 0 HB2 LYS A 41 15.791 4.081 -13.876 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.086 2.423 -13.391 1.00 0.00 H new ATOM 0 HG2 LYS A 41 15.778 3.051 -16.328 1.00 0.00 H new ATOM 0 HG3 LYS A 41 17.278 3.467 -15.523 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.452 1.032 -14.757 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.058 0.675 -15.757 1.00 0.00 H new ATOM 0 HE2 LYS A 41 17.246 1.483 -17.776 1.00 0.00 H new ATOM 0 HE3 LYS A 41 18.616 1.984 -16.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 19.316 -0.028 -17.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.635 -0.513 -16.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.770 -0.730 -17.553 1.00 0.00 H new ATOM 636 N LEU A 42 13.189 3.921 -12.312 1.00 0.00 N ATOM 637 CA LEU A 42 12.548 4.036 -11.001 1.00 0.00 C ATOM 638 C LEU A 42 11.152 3.412 -10.949 1.00 0.00 C ATOM 639 O LEU A 42 10.692 3.020 -9.881 1.00 0.00 O ATOM 640 CB LEU A 42 12.577 5.472 -10.464 1.00 0.00 C ATOM 641 CG LEU A 42 12.656 6.666 -11.420 1.00 0.00 C ATOM 642 CD1 LEU A 42 11.313 6.851 -12.106 1.00 0.00 C ATOM 643 CD2 LEU A 42 13.028 7.947 -10.673 1.00 0.00 C ATOM 0 H LEU A 42 13.334 4.814 -12.783 1.00 0.00 H new ATOM 0 HA LEU A 42 13.154 3.437 -10.321 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.681 5.605 -9.859 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.431 5.545 -9.790 1.00 0.00 H new ATOM 0 HG LEU A 42 13.431 6.464 -12.160 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.366 7.700 -12.787 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.064 5.951 -12.668 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.544 7.035 -11.356 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.077 8.778 -11.377 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.274 8.158 -9.915 1.00 0.00 H new ATOM 0 HD23 LEU A 42 13.999 7.820 -10.194 1.00 0.00 H new ATOM 655 N MET A 43 10.503 3.228 -12.093 1.00 0.00 N ATOM 656 CA MET A 43 9.263 2.459 -12.225 1.00 0.00 C ATOM 657 C MET A 43 9.458 0.976 -11.865 1.00 0.00 C ATOM 658 O MET A 43 8.477 0.267 -11.671 1.00 0.00 O ATOM 659 CB MET A 43 8.577 2.740 -13.585 1.00 0.00 C ATOM 660 CG MET A 43 8.647 1.636 -14.648 1.00 0.00 C ATOM 661 SD MET A 43 7.755 1.932 -16.213 1.00 0.00 S ATOM 662 CE MET A 43 7.558 3.741 -16.284 1.00 0.00 C ATOM 0 H MET A 43 10.829 3.617 -12.978 1.00 0.00 H new ATOM 0 HA MET A 43 8.549 2.806 -11.479 1.00 0.00 H new ATOM 0 HB2 MET A 43 7.526 2.959 -13.394 1.00 0.00 H new ATOM 0 HB3 MET A 43 9.019 3.643 -14.006 1.00 0.00 H new ATOM 0 HG2 MET A 43 9.696 1.460 -14.885 1.00 0.00 H new ATOM 0 HG3 MET A 43 8.261 0.717 -14.207 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.243 4.034 -17.286 1.00 0.00 H new ATOM 0 HE2 MET A 43 6.805 4.054 -15.561 1.00 0.00 H new ATOM 0 HE3 MET A 43 8.508 4.220 -16.048 1.00 0.00 H new ATOM 672 N GLU A 44 10.695 0.490 -11.720 1.00 0.00 N ATOM 673 CA GLU A 44 10.974 -0.862 -11.242 1.00 0.00 C ATOM 674 C GLU A 44 10.735 -0.970 -9.728 1.00 0.00 C ATOM 675 O GLU A 44 10.427 -2.060 -9.251 1.00 0.00 O ATOM 676 CB GLU A 44 12.408 -1.274 -11.606 1.00 0.00 C ATOM 677 CG GLU A 44 12.634 -1.310 -13.123 1.00 0.00 C ATOM 678 CD GLU A 44 14.078 -1.713 -13.479 1.00 0.00 C ATOM 679 OE1 GLU A 44 15.038 -0.962 -13.181 1.00 0.00 O ATOM 680 OE2 GLU A 44 14.251 -2.792 -14.090 1.00 0.00 O1- ATOM 0 H GLU A 44 11.534 1.030 -11.933 1.00 0.00 H new ATOM 0 HA GLU A 44 10.286 -1.549 -11.735 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.111 -0.575 -11.152 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.619 -2.257 -11.186 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.938 -2.015 -13.577 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.416 -0.329 -13.546 1.00 0.00 H new ATOM 687 N GLN A 45 10.838 0.132 -8.969 1.00 0.00 N ATOM 688 CA GLN A 45 10.777 0.098 -7.504 1.00 0.00 C ATOM 689 C GLN A 45 9.331 -0.073 -7.040 1.00 0.00 C ATOM 690 O GLN A 45 9.011 -0.929 -6.217 1.00 0.00 O ATOM 691 CB GLN A 45 11.319 1.389 -6.858 1.00 0.00 C ATOM 692 CG GLN A 45 12.599 1.979 -7.466 1.00 0.00 C ATOM 693 CD GLN A 45 12.714 3.456 -7.090 1.00 0.00 C ATOM 694 OE1 GLN A 45 13.602 3.871 -6.349 1.00 0.00 O ATOM 695 NE2 GLN A 45 11.789 4.268 -7.589 1.00 0.00 N ATOM 0 H GLN A 45 10.965 1.068 -9.354 1.00 0.00 H new ATOM 0 HA GLN A 45 11.398 -0.742 -7.194 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.538 2.148 -6.907 1.00 0.00 H new ATOM 0 HB3 GLN A 45 11.504 1.190 -5.803 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.470 1.433 -7.104 1.00 0.00 H new ATOM 0 HG3 GLN A 45 12.582 1.870 -8.550 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.063 3.898 -8.202 1.00 0.00 H new ATOM 0 HE22 GLN A 45 11.805 5.262 -7.359 1.00 0.00 H new ATOM 704 N TYR A 46 8.472 0.801 -7.576 1.00 0.00 N ATOM 705 CA TYR A 46 7.101 0.986 -7.141 1.00 0.00 C ATOM 706 C TYR A 46 6.322 -0.280 -7.466 1.00 0.00 C ATOM 707 O TYR A 46 6.536 -0.905 -8.504 1.00 0.00 O ATOM 708 CB TYR A 46 6.489 2.228 -7.808 1.00 0.00 C ATOM 709 CG TYR A 46 7.233 3.530 -7.575 1.00 0.00 C ATOM 710 CD1 TYR A 46 7.154 4.194 -6.336 1.00 0.00 C ATOM 711 CD2 TYR A 46 8.018 4.079 -8.607 1.00 0.00 C ATOM 712 CE1 TYR A 46 7.884 5.377 -6.121 1.00 0.00 C ATOM 713 CE2 TYR A 46 8.743 5.264 -8.404 1.00 0.00 C ATOM 714 CZ TYR A 46 8.693 5.913 -7.150 1.00 0.00 C ATOM 715 OH TYR A 46 9.414 7.053 -6.957 1.00 0.00 O ATOM 0 H TYR A 46 8.729 1.415 -8.349 1.00 0.00 H new ATOM 0 HA TYR A 46 7.061 1.158 -6.065 1.00 0.00 H new ATOM 0 HB2 TYR A 46 6.431 2.050 -8.882 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.467 2.345 -7.449 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.532 3.794 -5.549 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.063 3.583 -9.565 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.827 5.878 -5.166 1.00 0.00 H new ATOM 0 HE2 TYR A 46 9.338 5.679 -9.205 1.00 0.00 H new ATOM 0 HH TYR A 46 10.076 7.146 -7.673 1.00 0.00 H new ATOM 725 N ASP A 47 5.416 -0.663 -6.579 1.00 0.00 N ATOM 726 CA ASP A 47 4.664 -1.919 -6.711 1.00 0.00 C ATOM 727 C ASP A 47 3.613 -1.806 -7.816 1.00 0.00 C ATOM 728 O ASP A 47 3.226 -2.801 -8.429 1.00 0.00 O ATOM 729 CB ASP A 47 3.981 -2.269 -5.381 1.00 0.00 C ATOM 730 CG ASP A 47 4.982 -2.682 -4.292 1.00 0.00 C ATOM 731 OD1 ASP A 47 5.727 -3.672 -4.486 1.00 0.00 O ATOM 732 OD2 ASP A 47 5.035 -1.999 -3.241 1.00 0.00 O1- ATOM 0 H ASP A 47 5.176 -0.121 -5.749 1.00 0.00 H new ATOM 0 HA ASP A 47 5.365 -2.711 -6.975 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.407 -1.409 -5.034 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.272 -3.081 -5.544 1.00 0.00 H new ATOM 737 N VAL A 48 3.140 -0.585 -8.064 1.00 0.00 N ATOM 738 CA VAL A 48 1.990 -0.290 -8.902 1.00 0.00 C ATOM 739 C VAL A 48 2.334 0.974 -9.678 1.00 0.00 C ATOM 740 O VAL A 48 2.974 1.864 -9.120 1.00 0.00 O ATOM 741 CB VAL A 48 0.802 -0.086 -7.956 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.368 0.539 -8.691 1.00 0.00 C ATOM 743 CG2 VAL A 48 0.375 -1.404 -7.301 1.00 0.00 C ATOM 0 H VAL A 48 3.567 0.253 -7.670 1.00 0.00 H new ATOM 0 HA VAL A 48 1.739 -1.078 -9.612 1.00 0.00 H new ATOM 0 HB VAL A 48 1.123 0.594 -7.167 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.201 0.675 -8.001 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.069 1.507 -9.094 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.676 -0.115 -9.507 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.470 -1.223 -6.636 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.083 -2.116 -8.073 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.207 -1.812 -6.727 1.00 0.00 H new ATOM 753 N LEU A 49 1.898 1.090 -10.931 1.00 0.00 N ATOM 754 CA LEU A 49 2.216 2.225 -11.777 1.00 0.00 C ATOM 755 C LEU A 49 0.977 2.700 -12.506 1.00 0.00 C ATOM 756 O LEU A 49 0.097 1.900 -12.809 1.00 0.00 O ATOM 757 CB LEU A 49 3.312 1.880 -12.801 1.00 0.00 C ATOM 758 CG LEU A 49 4.501 1.029 -12.322 1.00 0.00 C ATOM 759 CD1 LEU A 49 5.315 0.543 -13.522 1.00 0.00 C ATOM 760 CD2 LEU A 49 5.422 1.832 -11.408 1.00 0.00 C ATOM 0 H LEU A 49 1.310 0.391 -11.385 1.00 0.00 H new ATOM 0 HA LEU A 49 2.589 3.019 -11.131 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.840 1.357 -13.633 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.708 2.816 -13.196 1.00 0.00 H new ATOM 0 HG LEU A 49 4.097 0.181 -11.769 1.00 0.00 H new ATOM 0 HD11 LEU A 49 6.154 -0.058 -13.173 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.681 -0.061 -14.171 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.691 1.402 -14.079 1.00 0.00 H new ATOM 0 HD21 LEU A 49 6.253 1.204 -11.086 1.00 0.00 H new ATOM 0 HD22 LEU A 49 5.809 2.696 -11.949 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.864 2.171 -10.535 1.00 0.00 H new ATOM 772 N ILE A 50 0.929 3.980 -12.857 1.00 0.00 N ATOM 773 CA ILE A 50 -0.087 4.528 -13.745 1.00 0.00 C ATOM 774 C ILE A 50 0.681 5.292 -14.813 1.00 0.00 C ATOM 775 O ILE A 50 1.472 6.163 -14.461 1.00 0.00 O ATOM 776 CB ILE A 50 -1.079 5.384 -12.951 1.00 0.00 C ATOM 777 CG1 ILE A 50 -1.822 4.543 -11.893 1.00 0.00 C ATOM 778 CG2 ILE A 50 -2.115 6.053 -13.863 1.00 0.00 C ATOM 779 CD1 ILE A 50 -1.379 4.987 -10.508 1.00 0.00 C ATOM 0 H ILE A 50 1.602 4.673 -12.529 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.705 3.766 -14.219 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.489 6.156 -12.457 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.899 4.668 -12.002 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.608 3.484 -12.035 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.799 6.650 -13.260 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.606 6.697 -14.580 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.677 5.287 -14.398 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.899 4.398 -9.753 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.304 4.840 -10.405 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.616 6.042 -10.371 1.00 0.00 H new ATOM 791 N LEU A 51 0.522 4.939 -16.086 1.00 0.00 N ATOM 792 CA LEU A 51 1.318 5.475 -17.194 1.00 0.00 C ATOM 793 C LEU A 51 0.376 6.147 -18.184 1.00 0.00 C ATOM 794 O LEU A 51 -0.682 5.594 -18.482 1.00 0.00 O ATOM 795 CB LEU A 51 2.130 4.356 -17.876 1.00 0.00 C ATOM 796 CG LEU A 51 3.477 4.002 -17.230 1.00 0.00 C ATOM 797 CD1 LEU A 51 3.366 3.641 -15.755 1.00 0.00 C ATOM 798 CD2 LEU A 51 4.068 2.790 -17.942 1.00 0.00 C ATOM 0 H LEU A 51 -0.177 4.259 -16.385 1.00 0.00 H new ATOM 0 HA LEU A 51 2.032 6.206 -16.815 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.516 3.456 -17.903 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.313 4.648 -18.910 1.00 0.00 H new ATOM 0 HG LEU A 51 4.101 4.891 -17.320 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.355 3.402 -15.363 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.952 4.485 -15.204 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.712 2.777 -15.640 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.025 2.533 -17.489 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.385 1.946 -17.851 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.217 3.024 -18.996 1.00 0.00 H new ATOM 810 N GLY A 52 0.756 7.314 -18.703 1.00 0.00 N ATOM 811 CA GLY A 52 -0.114 8.132 -19.536 1.00 0.00 C ATOM 812 C GLY A 52 0.557 8.527 -20.833 1.00 0.00 C ATOM 813 O GLY A 52 1.557 9.238 -20.762 1.00 0.00 O ATOM 0 H GLY A 52 1.681 7.717 -18.555 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.030 7.583 -19.754 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.403 9.029 -18.988 1.00 0.00 H new ATOM 817 N ILE A 53 0.035 8.119 -21.995 1.00 0.00 N ATOM 818 CA ILE A 53 0.576 8.513 -23.304 1.00 0.00 C ATOM 819 C ILE A 53 -0.456 9.305 -24.122 1.00 0.00 C ATOM 820 O ILE A 53 -1.572 8.825 -24.311 1.00 0.00 O ATOM 821 CB ILE A 53 1.156 7.345 -24.139 1.00 0.00 C ATOM 822 CG1 ILE A 53 0.217 6.188 -24.497 1.00 0.00 C ATOM 823 CG2 ILE A 53 2.424 6.758 -23.513 1.00 0.00 C ATOM 824 CD1 ILE A 53 -0.222 5.348 -23.305 1.00 0.00 C ATOM 0 H ILE A 53 -0.777 7.505 -22.056 1.00 0.00 H new ATOM 0 HA ILE A 53 1.423 9.159 -23.073 1.00 0.00 H new ATOM 0 HB ILE A 53 1.366 7.851 -25.081 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.668 6.592 -24.988 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.715 5.541 -25.219 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.793 5.942 -24.135 1.00 0.00 H new ATOM 0 HG22 ILE A 53 3.187 7.533 -23.441 1.00 0.00 H new ATOM 0 HG23 ILE A 53 2.196 6.380 -22.516 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.884 4.552 -23.645 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.654 4.912 -22.825 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.751 5.979 -22.590 1.00 0.00 H new ATOM 836 N PRO A 54 -0.115 10.494 -24.640 1.00 0.00 N ATOM 837 CA PRO A 54 -0.933 11.156 -25.646 1.00 0.00 C ATOM 838 C PRO A 54 -0.581 10.558 -27.020 1.00 0.00 C ATOM 839 O PRO A 54 0.580 10.222 -27.267 1.00 0.00 O ATOM 840 CB PRO A 54 -0.567 12.630 -25.527 1.00 0.00 C ATOM 841 CG PRO A 54 0.903 12.605 -25.087 1.00 0.00 C ATOM 842 CD PRO A 54 1.059 11.300 -24.312 1.00 0.00 C ATOM 0 HA PRO A 54 -2.008 11.026 -25.517 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.692 13.152 -26.476 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -1.195 13.141 -24.797 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.573 12.637 -25.946 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.143 13.466 -24.463 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.977 10.785 -24.595 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.116 11.487 -23.240 1.00 0.00 H new ATOM 850 N THR A 55 -1.553 10.437 -27.922 1.00 0.00 N ATOM 851 CA THR A 55 -1.265 10.066 -29.304 1.00 0.00 C ATOM 852 C THR A 55 -1.017 11.358 -30.086 1.00 0.00 C ATOM 853 O THR A 55 -1.756 12.325 -29.917 1.00 0.00 O ATOM 854 CB THR A 55 -2.384 9.195 -29.879 1.00 0.00 C ATOM 855 OG1 THR A 55 -2.556 8.085 -29.011 1.00 0.00 O ATOM 856 CG2 THR A 55 -2.006 8.652 -31.257 1.00 0.00 C ATOM 0 H THR A 55 -2.541 10.590 -27.721 1.00 0.00 H new ATOM 0 HA THR A 55 -0.370 9.448 -29.374 1.00 0.00 H new ATOM 0 HB THR A 55 -3.290 9.795 -29.970 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.007 8.377 -28.191 1.00 0.00 H new ATOM 0 HG21 THR A 55 -2.820 8.037 -31.641 1.00 0.00 H new ATOM 0 HG22 THR A 55 -1.826 9.483 -31.939 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.102 8.048 -31.175 1.00 0.00 H new ATOM 864 N TRP A 56 -0.006 11.371 -30.948 1.00 0.00 N ATOM 865 CA TRP A 56 0.401 12.474 -31.794 1.00 0.00 C ATOM 866 C TRP A 56 0.629 11.964 -33.221 1.00 0.00 C ATOM 867 O TRP A 56 0.562 10.760 -33.461 1.00 0.00 O ATOM 868 CB TRP A 56 1.663 13.129 -31.215 1.00 0.00 C ATOM 869 CG TRP A 56 1.414 14.132 -30.133 1.00 0.00 C ATOM 870 CD1 TRP A 56 1.406 13.881 -28.807 1.00 0.00 C ATOM 871 CD2 TRP A 56 1.172 15.567 -30.268 1.00 0.00 C ATOM 872 NE1 TRP A 56 1.220 15.062 -28.108 1.00 0.00 N ATOM 873 CE2 TRP A 56 1.015 16.124 -28.964 1.00 0.00 C ATOM 874 CE3 TRP A 56 1.092 16.463 -31.357 1.00 0.00 C ATOM 875 CZ2 TRP A 56 0.741 17.482 -28.759 1.00 0.00 C ATOM 876 CZ3 TRP A 56 0.863 17.839 -31.154 1.00 0.00 C ATOM 877 CH2 TRP A 56 0.663 18.348 -29.860 1.00 0.00 C ATOM 0 H TRP A 56 0.588 10.552 -31.079 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.382 13.232 -31.828 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.313 12.347 -30.822 1.00 0.00 H new ATOM 0 HB3 TRP A 56 2.205 13.617 -32.025 1.00 0.00 H new ATOM 0 HD1 TRP A 56 1.527 12.906 -28.358 1.00 0.00 H new ATOM 0 HE1 TRP A 56 1.233 15.137 -27.091 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.208 16.087 -32.363 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 0.591 17.861 -27.759 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 0.841 18.508 -32.001 1.00 0.00 H new ATOM 0 HH2 TRP A 56 0.451 19.397 -29.714 1.00 0.00 H new ATOM 888 N ASP A 57 0.878 12.890 -34.157 1.00 0.00 N ATOM 889 CA ASP A 57 1.342 12.664 -35.533 1.00 0.00 C ATOM 890 C ASP A 57 0.767 11.400 -36.201 1.00 0.00 C ATOM 891 O ASP A 57 1.506 10.569 -36.736 1.00 0.00 O ATOM 892 CB ASP A 57 2.874 12.748 -35.594 1.00 0.00 C ATOM 893 CG ASP A 57 3.399 12.768 -37.044 1.00 0.00 C ATOM 894 OD1 ASP A 57 2.781 13.432 -37.913 1.00 0.00 O ATOM 895 OD2 ASP A 57 4.482 12.190 -37.304 1.00 0.00 O1- ATOM 0 H ASP A 57 0.752 13.883 -33.960 1.00 0.00 H new ATOM 0 HA ASP A 57 0.935 13.470 -36.143 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.208 13.647 -35.076 1.00 0.00 H new ATOM 0 HB3 ASP A 57 3.304 11.897 -35.065 1.00 0.00 H new ATOM 900 N PHE A 58 -0.568 11.266 -36.161 1.00 0.00 N ATOM 901 CA PHE A 58 -1.318 10.130 -36.691 1.00 0.00 C ATOM 902 C PHE A 58 -0.857 8.794 -36.096 1.00 0.00 C ATOM 903 O PHE A 58 -0.133 8.017 -36.731 1.00 0.00 O ATOM 904 CB PHE A 58 -1.308 10.128 -38.227 1.00 0.00 C ATOM 905 CG PHE A 58 -1.902 11.367 -38.855 1.00 0.00 C ATOM 906 CD1 PHE A 58 -3.242 11.687 -38.588 1.00 0.00 C ATOM 907 CD2 PHE A 58 -1.132 12.199 -39.689 1.00 0.00 C ATOM 908 CE1 PHE A 58 -3.831 12.817 -39.183 1.00 0.00 C ATOM 909 CE2 PHE A 58 -1.715 13.340 -40.272 1.00 0.00 C ATOM 910 CZ PHE A 58 -3.069 13.645 -40.024 1.00 0.00 C ATOM 0 H PHE A 58 -1.171 11.974 -35.742 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.355 10.250 -36.376 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -0.280 10.018 -38.572 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.858 9.256 -38.581 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -3.822 11.064 -37.924 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.096 11.963 -39.881 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -4.869 13.048 -38.993 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.125 13.982 -40.909 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.520 14.514 -40.480 1.00 0.00 H new ATOM 920 N GLY A 59 -1.337 8.486 -34.889 1.00 0.00 N ATOM 921 CA GLY A 59 -1.128 7.193 -34.277 1.00 0.00 C ATOM 922 C GLY A 59 0.278 6.949 -33.718 1.00 0.00 C ATOM 923 O GLY A 59 0.605 5.821 -33.350 1.00 0.00 O ATOM 0 H GLY A 59 -1.880 9.133 -34.317 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.848 7.072 -33.468 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -1.346 6.421 -35.015 1.00 0.00 H new ATOM 927 N GLU A 60 1.098 7.989 -33.652 1.00 0.00 N ATOM 928 CA GLU A 60 2.439 7.975 -33.104 1.00 0.00 C ATOM 929 C GLU A 60 2.414 8.335 -31.611 1.00 0.00 C ATOM 930 O GLU A 60 1.434 8.868 -31.078 1.00 0.00 O ATOM 931 CB GLU A 60 3.385 8.890 -33.905 1.00 0.00 C ATOM 932 CG GLU A 60 3.653 8.415 -35.341 1.00 0.00 C ATOM 933 CD GLU A 60 4.632 7.223 -35.403 1.00 0.00 C ATOM 934 OE1 GLU A 60 4.233 6.072 -35.101 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 5.812 7.429 -35.783 1.00 0.00 O ATOM 0 H GLU A 60 0.828 8.910 -33.998 1.00 0.00 H new ATOM 0 HA GLU A 60 2.835 6.963 -33.193 1.00 0.00 H new ATOM 0 HB2 GLU A 60 2.960 9.893 -33.939 1.00 0.00 H new ATOM 0 HB3 GLU A 60 4.335 8.965 -33.376 1.00 0.00 H new ATOM 0 HG2 GLU A 60 2.710 8.129 -35.806 1.00 0.00 H new ATOM 0 HG3 GLU A 60 4.058 9.243 -35.923 1.00 0.00 H new ATOM 942 N ILE A 61 3.517 8.033 -30.934 1.00 0.00 N ATOM 943 CA ILE A 61 3.771 8.363 -29.540 1.00 0.00 C ATOM 944 C ILE A 61 4.450 9.748 -29.528 1.00 0.00 C ATOM 945 O ILE A 61 5.136 10.110 -30.489 1.00 0.00 O ATOM 946 CB ILE A 61 4.669 7.252 -28.947 1.00 0.00 C ATOM 947 CG1 ILE A 61 4.113 5.812 -29.083 1.00 0.00 C ATOM 948 CG2 ILE A 61 4.958 7.490 -27.462 1.00 0.00 C ATOM 949 CD1 ILE A 61 5.249 4.776 -29.124 1.00 0.00 C ATOM 0 H ILE A 61 4.292 7.528 -31.364 1.00 0.00 H new ATOM 0 HA ILE A 61 2.866 8.413 -28.934 1.00 0.00 H new ATOM 0 HB ILE A 61 5.575 7.319 -29.549 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.450 5.595 -28.245 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.515 5.735 -29.991 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.592 6.689 -27.082 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.468 8.445 -27.339 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.020 7.506 -26.907 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.826 3.776 -29.220 1.00 0.00 H new ATOM 0 HD12 ILE A 61 5.896 4.979 -29.977 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.831 4.837 -28.204 1.00 0.00 H new ATOM 961 N GLN A 62 4.296 10.521 -28.444 1.00 0.00 N ATOM 962 CA GLN A 62 5.056 11.745 -28.252 1.00 0.00 C ATOM 963 C GLN A 62 6.523 11.378 -28.017 1.00 0.00 C ATOM 964 O GLN A 62 6.831 10.392 -27.347 1.00 0.00 O ATOM 965 CB GLN A 62 4.468 12.600 -27.117 1.00 0.00 C ATOM 966 CG GLN A 62 5.039 14.031 -27.014 1.00 0.00 C ATOM 967 CD GLN A 62 5.255 14.727 -28.371 1.00 0.00 C ATOM 968 OE1 GLN A 62 6.376 14.803 -28.866 1.00 0.00 O ATOM 969 NE2 GLN A 62 4.219 15.175 -29.059 1.00 0.00 N ATOM 0 H GLN A 62 3.645 10.311 -27.687 1.00 0.00 H new ATOM 0 HA GLN A 62 4.993 12.365 -29.147 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.389 12.665 -27.253 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.640 12.088 -26.170 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.362 14.637 -26.412 1.00 0.00 H new ATOM 0 HG3 GLN A 62 5.990 13.993 -26.483 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.281 15.119 -28.662 1.00 0.00 H new ATOM 0 HE22 GLN A 62 4.358 15.576 -29.986 1.00 0.00 H new ATOM 978 N GLU A 63 7.434 12.198 -28.516 1.00 0.00 N ATOM 979 CA GLU A 63 8.856 11.873 -28.573 1.00 0.00 C ATOM 980 C GLU A 63 9.466 11.697 -27.178 1.00 0.00 C ATOM 981 O GLU A 63 10.382 10.895 -27.003 1.00 0.00 O ATOM 982 CB GLU A 63 9.634 12.893 -29.423 1.00 0.00 C ATOM 983 CG GLU A 63 9.931 14.223 -28.716 1.00 0.00 C ATOM 984 CD GLU A 63 10.672 15.196 -29.650 1.00 0.00 C ATOM 985 OE1 GLU A 63 11.926 15.149 -29.703 1.00 0.00 O ATOM 986 OE2 GLU A 63 10.021 16.026 -30.333 1.00 0.00 O1- ATOM 0 H GLU A 63 7.208 13.117 -28.897 1.00 0.00 H new ATOM 0 HA GLU A 63 8.944 10.907 -29.070 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.577 12.443 -29.733 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.066 13.098 -30.330 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.998 14.676 -28.381 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.533 14.039 -27.827 1.00 0.00 H new ATOM 993 N ASP A 64 8.932 12.393 -26.168 1.00 0.00 N ATOM 994 CA ASP A 64 9.412 12.285 -24.788 1.00 0.00 C ATOM 995 C ASP A 64 9.109 10.900 -24.203 1.00 0.00 C ATOM 996 O ASP A 64 9.805 10.443 -23.295 1.00 0.00 O ATOM 997 CB ASP A 64 8.796 13.393 -23.920 1.00 0.00 C ATOM 998 CG ASP A 64 9.482 14.748 -24.163 1.00 0.00 C ATOM 999 OD1 ASP A 64 10.722 14.845 -23.995 1.00 0.00 O ATOM 1000 OD2 ASP A 64 8.776 15.717 -24.526 1.00 0.00 O1- ATOM 0 H ASP A 64 8.157 13.045 -26.285 1.00 0.00 H new ATOM 0 HA ASP A 64 10.495 12.411 -24.793 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.732 13.479 -24.139 1.00 0.00 H new ATOM 0 HB3 ASP A 64 8.884 13.123 -22.868 1.00 0.00 H new ATOM 1005 N TRP A 65 8.102 10.210 -24.750 1.00 0.00 N ATOM 1006 CA TRP A 65 7.804 8.825 -24.450 1.00 0.00 C ATOM 1007 C TRP A 65 8.621 7.890 -25.330 1.00 0.00 C ATOM 1008 O TRP A 65 9.166 6.914 -24.820 1.00 0.00 O ATOM 1009 CB TRP A 65 6.302 8.560 -24.560 1.00 0.00 C ATOM 1010 CG TRP A 65 5.588 8.488 -23.258 1.00 0.00 C ATOM 1011 CD1 TRP A 65 4.684 9.376 -22.796 1.00 0.00 C ATOM 1012 CD2 TRP A 65 5.638 7.410 -22.281 1.00 0.00 C ATOM 1013 NE1 TRP A 65 4.131 8.887 -21.630 1.00 0.00 N ATOM 1014 CE2 TRP A 65 4.680 7.680 -21.265 1.00 0.00 C ATOM 1015 CE3 TRP A 65 6.364 6.207 -22.178 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 4.440 6.801 -20.204 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 6.163 5.335 -21.094 1.00 0.00 C ATOM 1018 CH2 TRP A 65 5.210 5.632 -20.111 1.00 0.00 C ATOM 0 H TRP A 65 7.461 10.620 -25.430 1.00 0.00 H new ATOM 0 HA TRP A 65 8.092 8.622 -23.419 1.00 0.00 H new ATOM 0 HB2 TRP A 65 5.851 9.348 -25.163 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.150 7.622 -25.095 1.00 0.00 H new ATOM 0 HD1 TRP A 65 4.434 10.317 -23.263 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.401 9.364 -21.101 1.00 0.00 H new ATOM 0 HE3 TRP A 65 7.084 5.952 -22.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 3.677 7.018 -19.471 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 6.747 4.430 -21.018 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.068 4.959 -19.279 1.00 0.00 H new ATOM 1029 N GLU A 66 8.764 8.192 -26.624 1.00 0.00 N ATOM 1030 CA GLU A 66 9.588 7.396 -27.540 1.00 0.00 C ATOM 1031 C GLU A 66 11.024 7.270 -27.019 1.00 0.00 C ATOM 1032 O GLU A 66 11.647 6.217 -27.160 1.00 0.00 O ATOM 1033 CB GLU A 66 9.622 8.003 -28.951 1.00 0.00 C ATOM 1034 CG GLU A 66 8.256 8.002 -29.638 1.00 0.00 C ATOM 1035 CD GLU A 66 8.365 8.418 -31.119 1.00 0.00 C ATOM 1036 OE1 GLU A 66 8.842 9.541 -31.413 1.00 0.00 O1- ATOM 1037 OE2 GLU A 66 7.983 7.607 -31.997 1.00 0.00 O ATOM 0 H GLU A 66 8.313 8.993 -27.066 1.00 0.00 H new ATOM 0 HA GLU A 66 9.130 6.409 -27.593 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.991 9.027 -28.891 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.330 7.445 -29.563 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.815 7.008 -29.570 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.585 8.684 -29.116 1.00 0.00 H new ATOM 1044 N ALA A 67 11.523 8.325 -26.365 1.00 0.00 N ATOM 1045 CA ALA A 67 12.857 8.390 -25.794 1.00 0.00 C ATOM 1046 C ALA A 67 13.069 7.323 -24.717 1.00 0.00 C ATOM 1047 O ALA A 67 14.197 6.855 -24.545 1.00 0.00 O ATOM 1048 CB ALA A 67 13.094 9.790 -25.217 1.00 0.00 C ATOM 0 H ALA A 67 10.986 9.180 -26.218 1.00 0.00 H new ATOM 0 HA ALA A 67 13.579 8.192 -26.587 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.095 9.842 -24.788 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.001 10.531 -26.011 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.355 9.994 -24.442 1.00 0.00 H new ATOM 1054 N VAL A 68 12.009 6.928 -24.000 1.00 0.00 N ATOM 1055 CA VAL A 68 12.089 5.921 -22.948 1.00 0.00 C ATOM 1056 C VAL A 68 11.464 4.586 -23.345 1.00 0.00 C ATOM 1057 O VAL A 68 11.727 3.594 -22.670 1.00 0.00 O ATOM 1058 CB VAL A 68 11.554 6.481 -21.618 1.00 0.00 C ATOM 1059 CG1 VAL A 68 12.221 7.808 -21.221 1.00 0.00 C ATOM 1060 CG2 VAL A 68 10.029 6.626 -21.564 1.00 0.00 C ATOM 0 H VAL A 68 11.071 7.303 -24.138 1.00 0.00 H new ATOM 0 HA VAL A 68 13.143 5.688 -22.796 1.00 0.00 H new ATOM 0 HB VAL A 68 11.827 5.720 -20.887 1.00 0.00 H new ATOM 0 HG11 VAL A 68 11.805 8.156 -20.276 1.00 0.00 H new ATOM 0 HG12 VAL A 68 13.295 7.657 -21.111 1.00 0.00 H new ATOM 0 HG13 VAL A 68 12.037 8.554 -21.995 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.736 7.027 -20.594 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.700 7.304 -22.351 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.565 5.650 -21.709 1.00 0.00 H new ATOM 1070 N TRP A 69 10.699 4.526 -24.440 1.00 0.00 N ATOM 1071 CA TRP A 69 10.017 3.317 -24.928 1.00 0.00 C ATOM 1072 C TRP A 69 10.987 2.143 -25.090 1.00 0.00 C ATOM 1073 O TRP A 69 10.613 0.985 -24.920 1.00 0.00 O ATOM 1074 CB TRP A 69 9.316 3.627 -26.258 1.00 0.00 C ATOM 1075 CG TRP A 69 7.996 2.943 -26.448 1.00 0.00 C ATOM 1076 CD1 TRP A 69 7.769 1.748 -27.042 1.00 0.00 C ATOM 1077 CD2 TRP A 69 6.680 3.449 -26.094 1.00 0.00 C ATOM 1078 NE1 TRP A 69 6.414 1.457 -26.980 1.00 0.00 N ATOM 1079 CE2 TRP A 69 5.702 2.524 -26.534 1.00 0.00 C ATOM 1080 CE3 TRP A 69 6.203 4.621 -25.491 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 4.332 2.756 -26.461 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 4.824 4.872 -25.393 1.00 0.00 C ATOM 1083 CH2 TRP A 69 3.882 3.960 -25.913 1.00 0.00 C ATOM 0 H TRP A 69 10.531 5.340 -25.031 1.00 0.00 H new ATOM 0 HA TRP A 69 9.276 3.019 -24.186 1.00 0.00 H new ATOM 0 HB2 TRP A 69 9.165 4.704 -26.330 1.00 0.00 H new ATOM 0 HB3 TRP A 69 9.978 3.342 -27.076 1.00 0.00 H new ATOM 0 HD1 TRP A 69 8.523 1.120 -27.493 1.00 0.00 H new ATOM 0 HE1 TRP A 69 6.005 0.558 -27.236 1.00 0.00 H new ATOM 0 HE3 TRP A 69 6.905 5.341 -25.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 3.629 2.019 -26.821 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.480 5.776 -24.913 1.00 0.00 H new ATOM 0 HH2 TRP A 69 2.827 4.189 -25.888 1.00 0.00 H new ATOM 1094 N ASP A 70 12.246 2.470 -25.378 1.00 0.00 N ATOM 1095 CA ASP A 70 13.342 1.522 -25.549 1.00 0.00 C ATOM 1096 C ASP A 70 13.737 0.880 -24.218 1.00 0.00 C ATOM 1097 O ASP A 70 13.892 -0.336 -24.124 1.00 0.00 O ATOM 1098 CB ASP A 70 14.539 2.229 -26.181 1.00 0.00 C ATOM 1099 CG ASP A 70 15.741 1.278 -26.298 1.00 0.00 C ATOM 1100 OD1 ASP A 70 15.742 0.414 -27.207 1.00 0.00 O1- ATOM 1101 OD2 ASP A 70 16.692 1.407 -25.492 1.00 0.00 O ATOM 0 H ASP A 70 12.540 3.439 -25.503 1.00 0.00 H new ATOM 0 HA ASP A 70 13.007 0.723 -26.210 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.267 2.600 -27.169 1.00 0.00 H new ATOM 0 HB3 ASP A 70 14.813 3.096 -25.579 1.00 0.00 H new ATOM 1106 N GLN A 71 13.819 1.696 -23.163 1.00 0.00 N ATOM 1107 CA GLN A 71 14.117 1.252 -21.811 1.00 0.00 C ATOM 1108 C GLN A 71 12.996 0.425 -21.229 1.00 0.00 C ATOM 1109 O GLN A 71 13.294 -0.477 -20.465 1.00 0.00 O ATOM 1110 CB GLN A 71 14.416 2.446 -20.889 1.00 0.00 C ATOM 1111 CG GLN A 71 15.871 2.908 -20.993 1.00 0.00 C ATOM 1112 CD GLN A 71 16.049 4.262 -20.307 1.00 0.00 C ATOM 1113 OE1 GLN A 71 16.276 4.341 -19.102 1.00 0.00 O ATOM 1114 NE2 GLN A 71 15.882 5.347 -21.045 1.00 0.00 N ATOM 0 H GLN A 71 13.676 2.703 -23.233 1.00 0.00 H new ATOM 0 HA GLN A 71 15.005 0.623 -21.876 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.755 3.274 -21.144 1.00 0.00 H new ATOM 0 HB3 GLN A 71 14.197 2.170 -19.858 1.00 0.00 H new ATOM 0 HG2 GLN A 71 16.528 2.170 -20.532 1.00 0.00 H new ATOM 0 HG3 GLN A 71 16.162 2.983 -22.041 1.00 0.00 H new ATOM 0 HE21 GLN A 71 15.694 5.260 -22.044 1.00 0.00 H new ATOM 0 HE22 GLN A 71 15.941 6.270 -20.615 1.00 0.00 H new ATOM 1123 N LEU A 72 11.734 0.665 -21.591 1.00 0.00 N ATOM 1124 CA LEU A 72 10.596 -0.086 -21.041 1.00 0.00 C ATOM 1125 C LEU A 72 10.764 -1.587 -21.274 1.00 0.00 C ATOM 1126 O LEU A 72 10.325 -2.394 -20.462 1.00 0.00 O ATOM 1127 CB LEU A 72 9.270 0.356 -21.683 1.00 0.00 C ATOM 1128 CG LEU A 72 8.979 1.862 -21.647 1.00 0.00 C ATOM 1129 CD1 LEU A 72 7.637 2.133 -22.325 1.00 0.00 C ATOM 1130 CD2 LEU A 72 9.032 2.464 -20.242 1.00 0.00 C ATOM 0 H LEU A 72 11.470 1.380 -22.269 1.00 0.00 H new ATOM 0 HA LEU A 72 10.571 0.122 -19.971 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.265 0.029 -22.723 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.454 -0.164 -21.181 1.00 0.00 H new ATOM 0 HG LEU A 72 9.776 2.362 -22.197 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.427 3.202 -22.301 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.677 1.794 -23.360 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.848 1.596 -21.798 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.816 3.531 -20.295 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.292 1.975 -19.609 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.026 2.315 -19.820 1.00 0.00 H new ATOM 1142 N ASP A 73 11.427 -1.954 -22.372 1.00 0.00 N ATOM 1143 CA ASP A 73 11.720 -3.342 -22.714 1.00 0.00 C ATOM 1144 C ASP A 73 12.754 -3.946 -21.768 1.00 0.00 C ATOM 1145 O ASP A 73 12.703 -5.142 -21.486 1.00 0.00 O ATOM 1146 CB ASP A 73 12.226 -3.444 -24.155 1.00 0.00 C ATOM 1147 CG ASP A 73 12.468 -4.913 -24.549 1.00 0.00 C ATOM 1148 OD1 ASP A 73 11.473 -5.662 -24.694 1.00 0.00 O ATOM 1149 OD2 ASP A 73 13.643 -5.308 -24.752 1.00 0.00 O1- ATOM 0 H ASP A 73 11.779 -1.285 -23.056 1.00 0.00 H new ATOM 0 HA ASP A 73 10.792 -3.904 -22.614 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.499 -2.996 -24.833 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.151 -2.878 -24.261 1.00 0.00 H new ATOM 1154 N ASP A 74 13.641 -3.122 -21.210 1.00 0.00 N ATOM 1155 CA ASP A 74 14.703 -3.570 -20.323 1.00 0.00 C ATOM 1156 C ASP A 74 14.189 -3.736 -18.890 1.00 0.00 C ATOM 1157 O ASP A 74 14.734 -4.534 -18.123 1.00 0.00 O ATOM 1158 CB ASP A 74 15.870 -2.574 -20.365 1.00 0.00 C ATOM 1159 CG ASP A 74 16.957 -2.912 -19.334 1.00 0.00 C ATOM 1160 OD1 ASP A 74 17.714 -3.890 -19.547 1.00 0.00 O1- ATOM 1161 OD2 ASP A 74 17.093 -2.158 -18.340 1.00 0.00 O ATOM 0 H ASP A 74 13.638 -2.114 -21.366 1.00 0.00 H new ATOM 0 HA ASP A 74 15.053 -4.544 -20.665 1.00 0.00 H new ATOM 0 HB2 ASP A 74 16.307 -2.571 -21.364 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.494 -1.568 -20.178 1.00 0.00 H new ATOM 1166 N LEU A 75 13.118 -3.013 -18.533 1.00 0.00 N ATOM 1167 CA LEU A 75 12.703 -2.892 -17.143 1.00 0.00 C ATOM 1168 C LEU A 75 12.075 -4.161 -16.609 1.00 0.00 C ATOM 1169 O LEU A 75 11.498 -4.977 -17.326 1.00 0.00 O ATOM 1170 CB LEU A 75 11.739 -1.721 -16.893 1.00 0.00 C ATOM 1171 CG LEU A 75 12.197 -0.413 -17.508 1.00 0.00 C ATOM 1172 CD1 LEU A 75 11.277 0.745 -17.174 1.00 0.00 C ATOM 1173 CD2 LEU A 75 13.651 0.006 -17.272 1.00 0.00 C ATOM 0 H LEU A 75 12.529 -2.506 -19.193 1.00 0.00 H new ATOM 0 HA LEU A 75 13.630 -2.696 -16.605 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.758 -1.977 -17.294 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.618 -1.584 -15.818 1.00 0.00 H new ATOM 0 HG LEU A 75 12.142 -0.651 -18.570 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.654 1.655 -17.640 1.00 0.00 H new ATOM 0 HD12 LEU A 75 10.275 0.533 -17.548 1.00 0.00 H new ATOM 0 HD13 LEU A 75 11.240 0.880 -16.093 1.00 0.00 H new ATOM 0 HD21 LEU A 75 13.840 0.958 -17.768 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.830 0.112 -16.202 1.00 0.00 H new ATOM 0 HD23 LEU A 75 14.319 -0.753 -17.678 1.00 0.00 H new ATOM 1185 N ASN A 76 12.109 -4.231 -15.294 1.00 0.00 N ATOM 1186 CA ASN A 76 11.492 -5.253 -14.471 1.00 0.00 C ATOM 1187 C ASN A 76 10.091 -4.789 -14.091 1.00 0.00 C ATOM 1188 O ASN A 76 9.952 -4.033 -13.129 1.00 0.00 O ATOM 1189 CB ASN A 76 12.362 -5.530 -13.232 1.00 0.00 C ATOM 1190 CG ASN A 76 11.696 -6.529 -12.289 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.795 -7.738 -12.476 1.00 0.00 O ATOM 1192 ND2 ASN A 76 10.987 -6.052 -11.273 1.00 0.00 N ATOM 0 H ASN A 76 12.599 -3.532 -14.736 1.00 0.00 H new ATOM 0 HA ASN A 76 11.411 -6.190 -15.021 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.331 -5.916 -13.547 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.548 -4.596 -12.701 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.515 -6.693 -10.635 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.914 -5.045 -11.130 1.00 0.00 H new ATOM 1199 N LEU A 77 9.051 -5.211 -14.829 1.00 0.00 N ATOM 1200 CA LEU A 77 7.652 -4.891 -14.511 1.00 0.00 C ATOM 1201 C LEU A 77 6.795 -6.110 -14.219 1.00 0.00 C ATOM 1202 O LEU A 77 5.580 -6.007 -14.094 1.00 0.00 O ATOM 1203 CB LEU A 77 6.966 -4.019 -15.585 1.00 0.00 C ATOM 1204 CG LEU A 77 7.790 -2.896 -16.222 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.981 -2.238 -17.343 1.00 0.00 C ATOM 1206 CD2 LEU A 77 8.201 -1.813 -15.228 1.00 0.00 C ATOM 0 H LEU A 77 9.159 -5.785 -15.665 1.00 0.00 H new ATOM 0 HA LEU A 77 7.725 -4.309 -13.592 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.623 -4.678 -16.383 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.079 -3.572 -15.137 1.00 0.00 H new ATOM 0 HG LEU A 77 8.700 -3.359 -16.604 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.569 -1.439 -17.795 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.737 -2.982 -18.101 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.061 -1.823 -16.932 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.782 -1.048 -15.743 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.310 -1.361 -14.793 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.806 -2.256 -14.437 1.00 0.00 H new ATOM 1218 N GLU A 78 7.426 -7.262 -14.122 1.00 0.00 N ATOM 1219 CA GLU A 78 6.719 -8.530 -14.044 1.00 0.00 C ATOM 1220 C GLU A 78 5.908 -8.567 -12.745 1.00 0.00 C ATOM 1221 O GLU A 78 6.451 -8.424 -11.647 1.00 0.00 O ATOM 1222 CB GLU A 78 7.681 -9.724 -14.157 1.00 0.00 C ATOM 1223 CG GLU A 78 8.201 -9.917 -15.587 1.00 0.00 C ATOM 1224 CD GLU A 78 9.178 -11.101 -15.679 1.00 0.00 C ATOM 1225 OE1 GLU A 78 8.717 -12.266 -15.770 1.00 0.00 O1- ATOM 1226 OE2 GLU A 78 10.412 -10.877 -15.673 1.00 0.00 O ATOM 0 H GLU A 78 8.442 -7.349 -14.095 1.00 0.00 H new ATOM 0 HA GLU A 78 6.036 -8.614 -14.889 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.524 -9.574 -13.483 1.00 0.00 H new ATOM 0 HB3 GLU A 78 7.171 -10.631 -13.832 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.361 -10.085 -16.261 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.699 -9.006 -15.920 1.00 0.00 H new ATOM 1233 N GLY A 79 4.593 -8.733 -12.894 1.00 0.00 N ATOM 1234 CA GLY A 79 3.625 -8.804 -11.807 1.00 0.00 C ATOM 1235 C GLY A 79 3.230 -7.455 -11.225 1.00 0.00 C ATOM 1236 O GLY A 79 2.500 -7.402 -10.234 1.00 0.00 O ATOM 0 H GLY A 79 4.160 -8.825 -13.813 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.728 -9.306 -12.169 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.037 -9.423 -11.010 1.00 0.00 H new ATOM 1240 N LYS A 80 3.660 -6.359 -11.851 1.00 0.00 N ATOM 1241 CA LYS A 80 3.252 -5.016 -11.464 1.00 0.00 C ATOM 1242 C LYS A 80 1.860 -4.766 -11.949 1.00 0.00 C ATOM 1243 O LYS A 80 1.482 -5.238 -13.019 1.00 0.00 O ATOM 1244 CB LYS A 80 4.176 -3.913 -12.004 1.00 0.00 C ATOM 1245 CG LYS A 80 5.494 -3.991 -11.262 1.00 0.00 C ATOM 1246 CD LYS A 80 6.316 -2.715 -11.478 1.00 0.00 C ATOM 1247 CE LYS A 80 7.756 -2.885 -10.978 1.00 0.00 C ATOM 1248 NZ LYS A 80 7.857 -3.137 -9.511 1.00 0.00 N1+ ATOM 0 H LYS A 80 4.303 -6.382 -12.643 1.00 0.00 H new ATOM 0 HA LYS A 80 3.309 -4.973 -10.376 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.335 -4.041 -13.075 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.719 -2.933 -11.865 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.309 -4.134 -10.197 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.060 -4.856 -11.607 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.325 -2.461 -12.538 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.844 -1.883 -10.955 1.00 0.00 H new ATOM 0 HE2 LYS A 80 8.221 -3.713 -11.513 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.324 -1.988 -11.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.839 -2.990 -9.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.231 -2.481 -9.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.572 -4.116 -9.307 1.00 0.00 H new ATOM 1262 N ILE A 81 1.128 -3.969 -11.188 1.00 0.00 N ATOM 1263 CA ILE A 81 -0.132 -3.449 -11.690 1.00 0.00 C ATOM 1264 C ILE A 81 0.174 -2.178 -12.461 1.00 0.00 C ATOM 1265 O ILE A 81 0.982 -1.366 -12.014 1.00 0.00 O ATOM 1266 CB ILE A 81 -1.182 -3.254 -10.597 1.00 0.00 C ATOM 1267 CG1 ILE A 81 -1.431 -4.573 -9.840 1.00 0.00 C ATOM 1268 CG2 ILE A 81 -2.499 -2.849 -11.284 1.00 0.00 C ATOM 1269 CD1 ILE A 81 -1.436 -4.431 -8.333 1.00 0.00 C ATOM 0 H ILE A 81 1.376 -3.674 -10.244 1.00 0.00 H new ATOM 0 HA ILE A 81 -0.592 -4.180 -12.355 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.836 -2.497 -9.893 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.388 -4.987 -10.158 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -0.663 -5.292 -10.124 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -3.272 -2.701 -10.530 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.350 -1.922 -11.838 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -2.808 -3.637 -11.971 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.618 -5.404 -7.876 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -0.471 -4.049 -8.000 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.223 -3.738 -8.035 1.00 0.00 H new ATOM 1281 N VAL A 82 -0.485 -2.011 -13.600 1.00 0.00 N ATOM 1282 CA VAL A 82 -0.359 -0.865 -14.460 1.00 0.00 C ATOM 1283 C VAL A 82 -1.757 -0.377 -14.828 1.00 0.00 C ATOM 1284 O VAL A 82 -2.582 -1.161 -15.282 1.00 0.00 O ATOM 1285 CB VAL A 82 0.488 -1.237 -15.694 1.00 0.00 C ATOM 1286 CG1 VAL A 82 0.607 -0.065 -16.674 1.00 0.00 C ATOM 1287 CG2 VAL A 82 1.900 -1.682 -15.268 1.00 0.00 C ATOM 0 H VAL A 82 -1.145 -2.703 -13.955 1.00 0.00 H new ATOM 0 HA VAL A 82 0.158 -0.048 -13.956 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.022 -2.059 -16.195 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.211 -0.366 -17.530 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.386 0.226 -17.015 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.081 0.780 -16.175 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.482 -1.940 -16.152 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.392 -0.869 -14.734 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.826 -2.552 -14.616 1.00 0.00 H new ATOM 1297 N ALA A 83 -2.037 0.911 -14.670 1.00 0.00 N ATOM 1298 CA ALA A 83 -3.216 1.544 -15.216 1.00 0.00 C ATOM 1299 C ALA A 83 -2.774 2.446 -16.362 1.00 0.00 C ATOM 1300 O ALA A 83 -2.005 3.376 -16.122 1.00 0.00 O ATOM 1301 CB ALA A 83 -3.958 2.293 -14.110 1.00 0.00 C ATOM 0 H ALA A 83 -1.436 1.550 -14.149 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.920 0.813 -15.613 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.846 2.769 -14.526 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.254 1.591 -13.330 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.304 3.054 -13.684 1.00 0.00 H new ATOM 1307 N LEU A 84 -3.216 2.188 -17.594 1.00 0.00 N ATOM 1308 CA LEU A 84 -2.947 3.080 -18.723 1.00 0.00 C ATOM 1309 C LEU A 84 -4.039 4.119 -18.897 1.00 0.00 C ATOM 1310 O LEU A 84 -5.225 3.813 -18.791 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.724 2.304 -20.030 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.439 1.460 -20.054 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -1.136 1.028 -21.486 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -0.234 2.248 -19.530 1.00 0.00 C ATOM 0 H LEU A 84 -3.765 1.363 -17.836 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.021 3.605 -18.486 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.578 1.649 -20.200 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.695 3.012 -20.859 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.604 0.596 -19.411 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.225 0.430 -21.501 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -1.966 0.435 -21.870 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.001 1.910 -22.111 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.655 1.618 -19.563 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.077 3.129 -20.152 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.421 2.558 -18.502 1.00 0.00 H new ATOM 1326 N TYR A 85 -3.631 5.335 -19.243 1.00 0.00 N ATOM 1327 CA TYR A 85 -4.509 6.411 -19.671 1.00 0.00 C ATOM 1328 C TYR A 85 -3.871 7.127 -20.855 1.00 0.00 C ATOM 1329 O TYR A 85 -2.675 6.974 -21.098 1.00 0.00 O ATOM 1330 CB TYR A 85 -4.817 7.357 -18.505 1.00 0.00 C ATOM 1331 CG TYR A 85 -3.724 8.303 -18.054 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -2.685 7.846 -17.223 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -3.782 9.661 -18.424 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -1.703 8.739 -16.758 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -2.810 10.561 -17.958 1.00 0.00 C ATOM 1336 CZ TYR A 85 -1.773 10.105 -17.120 1.00 0.00 C ATOM 1337 OH TYR A 85 -0.822 10.982 -16.705 1.00 0.00 O ATOM 0 H TYR A 85 -2.647 5.605 -19.232 1.00 0.00 H new ATOM 0 HA TYR A 85 -5.468 6.007 -19.995 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.685 7.956 -18.780 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -5.108 6.749 -17.648 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -2.641 6.804 -16.941 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -4.576 10.011 -19.067 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -0.900 8.384 -16.128 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.857 11.602 -18.242 1.00 0.00 H new ATOM 0 HH TYR A 85 -1.029 11.876 -17.048 1.00 0.00 H new ATOM 1347 N GLY A 86 -4.639 7.887 -21.625 1.00 0.00 N ATOM 1348 CA GLY A 86 -4.065 8.657 -22.712 1.00 0.00 C ATOM 1349 C GLY A 86 -4.953 9.803 -23.137 1.00 0.00 C ATOM 1350 O GLY A 86 -6.075 9.948 -22.646 1.00 0.00 O ATOM 0 H GLY A 86 -5.649 7.984 -21.517 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.095 9.047 -22.405 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.889 8.001 -23.565 1.00 0.00 H new ATOM 1354 N LEU A 87 -4.435 10.617 -24.058 1.00 0.00 N ATOM 1355 CA LEU A 87 -5.100 11.808 -24.572 1.00 0.00 C ATOM 1356 C LEU A 87 -5.193 11.701 -26.088 1.00 0.00 C ATOM 1357 O LEU A 87 -4.271 11.165 -26.712 1.00 0.00 O ATOM 1358 CB LEU A 87 -4.325 13.097 -24.241 1.00 0.00 C ATOM 1359 CG LEU A 87 -3.713 13.223 -22.837 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -3.002 14.566 -22.747 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -4.739 13.165 -21.713 1.00 0.00 C ATOM 0 H LEU A 87 -3.518 10.459 -24.476 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.083 11.863 -24.104 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.520 13.200 -24.968 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.999 13.941 -24.390 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.040 12.375 -22.707 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.559 14.678 -21.757 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.218 14.614 -23.503 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.719 15.369 -22.916 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.232 13.260 -20.753 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.453 13.981 -21.829 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.267 12.212 -21.751 1.00 0.00 H new ATOM 1373 N GLY A 88 -6.239 12.268 -26.677 1.00 0.00 N ATOM 1374 CA GLY A 88 -6.424 12.298 -28.112 1.00 0.00 C ATOM 1375 C GLY A 88 -7.367 13.420 -28.551 1.00 0.00 C ATOM 1376 O GLY A 88 -7.818 14.221 -27.737 1.00 0.00 O ATOM 0 H GLY A 88 -6.990 12.725 -26.159 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.457 12.427 -28.598 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.823 11.340 -28.445 1.00 0.00 H new ATOM 1380 N ASP A 89 -7.689 13.457 -29.841 1.00 0.00 N ATOM 1381 CA ASP A 89 -8.661 14.339 -30.459 1.00 0.00 C ATOM 1382 C ASP A 89 -9.508 13.455 -31.363 1.00 0.00 C ATOM 1383 O ASP A 89 -8.993 12.892 -32.333 1.00 0.00 O ATOM 1384 CB ASP A 89 -7.979 15.480 -31.221 1.00 0.00 C ATOM 1385 CG ASP A 89 -8.900 16.215 -32.220 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -10.126 15.950 -32.283 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -8.382 17.082 -32.964 1.00 0.00 O ATOM 0 H ASP A 89 -7.250 12.834 -30.518 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.285 14.835 -29.716 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -7.593 16.202 -30.502 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -7.122 15.079 -31.762 1.00 0.00 H new ATOM 1392 N GLN A 90 -10.789 13.278 -31.028 1.00 0.00 N ATOM 1393 CA GLN A 90 -11.640 12.324 -31.722 1.00 0.00 C ATOM 1394 C GLN A 90 -12.214 12.924 -33.005 1.00 0.00 C ATOM 1395 O GLN A 90 -12.496 12.201 -33.960 1.00 0.00 O ATOM 1396 CB GLN A 90 -12.729 11.771 -30.778 1.00 0.00 C ATOM 1397 CG GLN A 90 -13.982 12.656 -30.623 1.00 0.00 C ATOM 1398 CD GLN A 90 -14.436 12.853 -29.181 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -15.544 12.501 -28.787 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -13.619 13.538 -28.402 1.00 0.00 N ATOM 0 H GLN A 90 -11.255 13.787 -30.277 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.030 11.475 -32.029 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.039 10.792 -31.143 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.289 11.619 -29.793 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -13.780 13.632 -31.065 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.799 12.212 -31.191 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -12.702 13.821 -28.748 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -13.905 13.784 -27.454 1.00 0.00 H new ATOM 1409 N LEU A 91 -12.402 14.244 -33.014 1.00 0.00 N ATOM 1410 CA LEU A 91 -12.980 14.955 -34.138 1.00 0.00 C ATOM 1411 C LEU A 91 -11.992 15.007 -35.299 1.00 0.00 C ATOM 1412 O LEU A 91 -12.356 14.747 -36.447 1.00 0.00 O ATOM 1413 CB LEU A 91 -13.392 16.372 -33.719 1.00 0.00 C ATOM 1414 CG LEU A 91 -14.481 16.409 -32.633 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -14.757 17.861 -32.231 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -15.799 15.752 -33.062 1.00 0.00 C ATOM 0 H LEU A 91 -12.153 14.848 -32.231 1.00 0.00 H new ATOM 0 HA LEU A 91 -13.871 14.420 -34.467 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -12.512 16.903 -33.356 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.750 16.910 -34.597 1.00 0.00 H new ATOM 0 HG LEU A 91 -14.095 15.833 -31.792 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -15.529 17.885 -31.462 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -13.843 18.311 -31.843 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -15.096 18.422 -33.102 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.520 15.815 -32.247 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -16.195 16.268 -33.937 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -15.621 14.705 -33.308 1.00 0.00 H new ATOM 1428 N GLY A 92 -10.743 15.347 -34.989 1.00 0.00 N ATOM 1429 CA GLY A 92 -9.688 15.507 -35.971 1.00 0.00 C ATOM 1430 C GLY A 92 -8.997 14.184 -36.290 1.00 0.00 C ATOM 1431 O GLY A 92 -8.620 13.966 -37.444 1.00 0.00 O ATOM 0 H GLY A 92 -10.437 15.520 -34.032 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.105 15.928 -36.886 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -8.952 16.220 -35.599 1.00 0.00 H new ATOM 1435 N TYR A 93 -8.857 13.295 -35.294 1.00 0.00 N ATOM 1436 CA TYR A 93 -8.001 12.117 -35.389 1.00 0.00 C ATOM 1437 C TYR A 93 -8.697 10.820 -34.973 1.00 0.00 C ATOM 1438 O TYR A 93 -8.009 9.904 -34.533 1.00 0.00 O ATOM 1439 CB TYR A 93 -6.679 12.338 -34.620 1.00 0.00 C ATOM 1440 CG TYR A 93 -5.898 13.570 -35.033 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -6.295 14.832 -34.566 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -4.804 13.464 -35.907 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -5.642 15.995 -34.996 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -4.133 14.623 -36.339 1.00 0.00 C ATOM 1445 CZ TYR A 93 -4.555 15.898 -35.894 1.00 0.00 C ATOM 1446 OH TYR A 93 -3.927 17.018 -36.353 1.00 0.00 O ATOM 0 H TYR A 93 -9.339 13.380 -34.399 1.00 0.00 H new ATOM 0 HA TYR A 93 -7.765 11.987 -36.445 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -6.902 12.407 -33.555 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -6.046 11.462 -34.756 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -7.114 14.908 -33.866 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -4.477 12.493 -36.248 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -5.968 16.962 -34.642 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -3.293 14.539 -37.013 1.00 0.00 H new ATOM 0 HH TYR A 93 -3.202 16.761 -36.960 1.00 0.00 H new ATOM 1456 N GLY A 94 -10.020 10.684 -35.125 1.00 0.00 N ATOM 1457 CA GLY A 94 -10.765 9.506 -34.672 1.00 0.00 C ATOM 1458 C GLY A 94 -10.212 8.207 -35.256 1.00 0.00 C ATOM 1459 O GLY A 94 -10.149 7.206 -34.549 1.00 0.00 O ATOM 0 H GLY A 94 -10.605 11.392 -35.568 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.732 9.455 -33.584 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -11.812 9.611 -34.954 1.00 0.00 H new ATOM 1463 N GLU A 95 -9.713 8.237 -36.498 1.00 0.00 N ATOM 1464 CA GLU A 95 -9.207 7.040 -37.186 1.00 0.00 C ATOM 1465 C GLU A 95 -8.051 6.370 -36.422 1.00 0.00 C ATOM 1466 O GLU A 95 -7.830 5.166 -36.585 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.722 7.392 -38.601 1.00 0.00 C ATOM 1468 CG GLU A 95 -9.835 7.757 -39.588 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.682 6.532 -39.987 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -10.281 5.787 -40.915 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -11.766 6.318 -39.392 1.00 0.00 O ATOM 0 H GLU A 95 -9.648 9.089 -37.054 1.00 0.00 H new ATOM 0 HA GLU A 95 -10.040 6.339 -37.236 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.026 8.228 -38.534 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.165 6.545 -39.000 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.481 8.514 -39.142 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.395 8.200 -40.482 1.00 0.00 H new ATOM 1478 N TRP A 96 -7.332 7.134 -35.590 1.00 0.00 N ATOM 1479 CA TRP A 96 -6.219 6.676 -34.769 1.00 0.00 C ATOM 1480 C TRP A 96 -6.591 6.754 -33.291 1.00 0.00 C ATOM 1481 O TRP A 96 -6.420 5.790 -32.544 1.00 0.00 O ATOM 1482 CB TRP A 96 -4.954 7.494 -35.082 1.00 0.00 C ATOM 1483 CG TRP A 96 -4.623 7.606 -36.541 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -3.825 6.776 -37.251 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -5.156 8.559 -37.511 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -3.838 7.141 -38.582 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -4.676 8.209 -38.805 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -6.033 9.659 -37.430 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -5.073 8.891 -39.962 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -6.421 10.373 -38.582 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -5.949 9.983 -39.848 1.00 0.00 C ATOM 0 H TRP A 96 -7.523 8.129 -35.470 1.00 0.00 H new ATOM 0 HA TRP A 96 -6.003 5.634 -35.003 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -5.077 8.497 -34.673 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -4.108 7.041 -34.566 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -3.262 5.952 -36.838 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -3.294 6.677 -39.309 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.416 9.961 -36.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -4.710 8.581 -40.931 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -7.083 11.222 -38.492 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -6.259 10.522 -40.731 1.00 0.00 H new ATOM 1502 N PHE A 97 -7.149 7.897 -32.899 1.00 0.00 N ATOM 1503 CA PHE A 97 -7.465 8.326 -31.565 1.00 0.00 C ATOM 1504 C PHE A 97 -6.294 8.001 -30.632 1.00 0.00 C ATOM 1505 O PHE A 97 -5.155 8.295 -30.981 1.00 0.00 O ATOM 1506 CB PHE A 97 -8.887 7.856 -31.182 1.00 0.00 C ATOM 1507 CG PHE A 97 -9.574 8.657 -30.088 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.354 10.047 -29.962 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -10.472 8.021 -29.209 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -9.955 10.765 -28.915 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.126 8.757 -28.204 1.00 0.00 C ATOM 1512 CZ PHE A 97 -10.847 10.124 -28.041 1.00 0.00 C ATOM 0 H PHE A 97 -7.411 8.605 -33.585 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.551 9.408 -31.469 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -9.512 7.885 -32.075 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -8.832 6.815 -30.865 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -8.722 10.559 -30.673 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -10.660 6.962 -29.307 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -9.730 11.813 -28.782 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -11.842 8.271 -27.558 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.318 10.681 -27.245 1.00 0.00 H new ATOM 1522 N LEU A 98 -6.580 7.383 -29.488 1.00 0.00 N ATOM 1523 CA LEU A 98 -5.698 6.838 -28.447 1.00 0.00 C ATOM 1524 C LEU A 98 -4.751 5.724 -28.952 1.00 0.00 C ATOM 1525 O LEU A 98 -4.519 4.732 -28.270 1.00 0.00 O ATOM 1526 CB LEU A 98 -6.556 6.333 -27.270 1.00 0.00 C ATOM 1527 CG LEU A 98 -7.117 7.348 -26.269 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -6.117 8.416 -25.850 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -8.373 8.051 -26.760 1.00 0.00 C ATOM 0 H LEU A 98 -7.556 7.232 -29.234 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.046 7.649 -28.122 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.399 5.784 -27.690 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -5.956 5.616 -26.710 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.360 6.730 -25.405 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.588 9.097 -25.141 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.254 7.943 -25.381 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.792 8.974 -26.728 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.716 8.755 -26.002 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.152 8.589 -27.682 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.153 7.313 -26.949 1.00 0.00 H new ATOM 1541 N ASP A 99 -4.194 5.837 -30.143 1.00 0.00 N ATOM 1542 CA ASP A 99 -3.420 4.777 -30.792 1.00 0.00 C ATOM 1543 C ASP A 99 -2.231 4.355 -29.928 1.00 0.00 C ATOM 1544 O ASP A 99 -2.011 3.166 -29.686 1.00 0.00 O ATOM 1545 CB ASP A 99 -2.914 5.247 -32.153 1.00 0.00 C ATOM 1546 CG ASP A 99 -2.603 4.064 -33.084 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -1.594 3.354 -32.871 1.00 0.00 O1- ATOM 1548 OD2 ASP A 99 -3.368 3.865 -34.058 1.00 0.00 O ATOM 0 H ASP A 99 -4.264 6.685 -30.705 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.079 3.919 -30.924 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -3.663 5.889 -32.618 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.016 5.850 -32.019 1.00 0.00 H new ATOM 1553 N ALA A 100 -1.538 5.344 -29.352 1.00 0.00 N ATOM 1554 CA ALA A 100 -0.408 5.137 -28.465 1.00 0.00 C ATOM 1555 C ALA A 100 -0.823 4.348 -27.229 1.00 0.00 C ATOM 1556 O ALA A 100 -0.019 3.582 -26.704 1.00 0.00 O ATOM 1557 CB ALA A 100 0.175 6.490 -28.047 1.00 0.00 C ATOM 0 H ALA A 100 -1.759 6.329 -29.498 1.00 0.00 H new ATOM 0 HA ALA A 100 0.349 4.563 -28.999 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.023 6.331 -27.381 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.506 7.033 -28.932 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.588 7.071 -27.529 1.00 0.00 H new ATOM 1563 N LEU A 101 -2.064 4.514 -26.769 1.00 0.00 N ATOM 1564 CA LEU A 101 -2.607 3.772 -25.652 1.00 0.00 C ATOM 1565 C LEU A 101 -2.661 2.297 -25.982 1.00 0.00 C ATOM 1566 O LEU A 101 -2.199 1.483 -25.190 1.00 0.00 O ATOM 1567 CB LEU A 101 -4.007 4.304 -25.309 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.503 3.948 -23.912 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -3.645 4.627 -22.868 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -5.954 4.423 -23.757 1.00 0.00 C ATOM 0 H LEU A 101 -2.722 5.180 -27.174 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.960 3.903 -24.784 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.003 5.389 -25.412 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.716 3.917 -26.040 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.445 2.868 -23.776 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.007 4.366 -21.874 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.612 4.297 -22.976 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.697 5.708 -23.001 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.315 4.171 -22.760 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.000 5.503 -23.898 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.579 3.933 -24.503 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.178 1.964 -27.165 1.00 0.00 N ATOM 1583 CA GLY A 102 -3.212 0.590 -27.646 1.00 0.00 C ATOM 1584 C GLY A 102 -1.793 0.040 -27.758 1.00 0.00 C ATOM 1585 O GLY A 102 -1.528 -1.068 -27.290 1.00 0.00 O ATOM 0 H GLY A 102 -3.583 2.640 -27.813 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -3.797 -0.028 -26.965 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.705 0.548 -28.617 1.00 0.00 H new ATOM 1589 N MET A 103 -0.859 0.839 -28.290 1.00 0.00 N ATOM 1590 CA MET A 103 0.523 0.406 -28.440 1.00 0.00 C ATOM 1591 C MET A 103 1.171 0.123 -27.101 1.00 0.00 C ATOM 1592 O MET A 103 1.771 -0.937 -26.923 1.00 0.00 O ATOM 1593 CB MET A 103 1.358 1.389 -29.268 1.00 0.00 C ATOM 1594 CG MET A 103 0.855 1.523 -30.709 1.00 0.00 C ATOM 1595 SD MET A 103 2.153 1.840 -31.935 1.00 0.00 S ATOM 1596 CE MET A 103 2.831 3.363 -31.238 1.00 0.00 C ATOM 0 H MET A 103 -1.042 1.786 -28.621 1.00 0.00 H new ATOM 0 HA MET A 103 0.494 -0.531 -28.997 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.341 2.368 -28.789 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.396 1.058 -29.279 1.00 0.00 H new ATOM 0 HG2 MET A 103 0.330 0.608 -30.983 1.00 0.00 H new ATOM 0 HG3 MET A 103 0.127 2.333 -30.752 1.00 0.00 H new ATOM 0 HE1 MET A 103 3.873 3.469 -31.540 1.00 0.00 H new ATOM 0 HE2 MET A 103 2.259 4.216 -31.602 1.00 0.00 H new ATOM 0 HE3 MET A 103 2.771 3.324 -30.150 1.00 0.00 H new ATOM 1606 N LEU A 104 1.043 1.026 -26.129 1.00 0.00 N ATOM 1607 CA LEU A 104 1.646 0.799 -24.847 1.00 0.00 C ATOM 1608 C LEU A 104 0.985 -0.365 -24.127 1.00 0.00 C ATOM 1609 O LEU A 104 1.652 -1.068 -23.377 1.00 0.00 O ATOM 1610 CB LEU A 104 1.604 2.053 -23.981 1.00 0.00 C ATOM 1611 CG LEU A 104 2.721 1.965 -22.939 1.00 0.00 C ATOM 1612 CD1 LEU A 104 4.169 1.921 -23.408 1.00 0.00 C ATOM 1613 CD2 LEU A 104 2.534 3.087 -21.936 1.00 0.00 C ATOM 0 H LEU A 104 0.532 1.904 -26.217 1.00 0.00 H new ATOM 0 HA LEU A 104 2.691 0.544 -25.023 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.731 2.943 -24.598 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.635 2.141 -23.490 1.00 0.00 H new ATOM 0 HG LEU A 104 2.594 0.969 -22.514 1.00 0.00 H new ATOM 0 HD11 LEU A 104 4.830 1.859 -22.543 1.00 0.00 H new ATOM 0 HD12 LEU A 104 4.320 1.048 -24.043 1.00 0.00 H new ATOM 0 HD13 LEU A 104 4.396 2.824 -23.974 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.323 3.039 -21.185 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.581 4.047 -22.451 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.564 2.983 -21.450 1.00 0.00 H new ATOM 1625 N HIS A 105 -0.303 -0.597 -24.355 1.00 0.00 N ATOM 1626 CA HIS A 105 -0.986 -1.720 -23.737 1.00 0.00 C ATOM 1627 C HIS A 105 -0.334 -3.024 -24.173 1.00 0.00 C ATOM 1628 O HIS A 105 0.010 -3.858 -23.346 1.00 0.00 O ATOM 1629 CB HIS A 105 -2.484 -1.693 -24.046 1.00 0.00 C ATOM 1630 CG HIS A 105 -3.265 -2.147 -22.852 1.00 0.00 C ATOM 1631 ND1 HIS A 105 -3.745 -1.297 -21.862 1.00 0.00 N ATOM 1632 CD2 HIS A 105 -3.462 -3.436 -22.469 1.00 0.00 C ATOM 1633 CE1 HIS A 105 -4.248 -2.092 -20.913 1.00 0.00 C ATOM 1634 NE2 HIS A 105 -4.110 -3.386 -21.257 1.00 0.00 N ATOM 0 H HIS A 105 -0.890 -0.024 -24.961 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.891 -1.642 -22.654 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -2.787 -0.684 -24.326 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.699 -2.338 -24.898 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.168 -4.324 -23.009 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -4.702 -1.744 -19.997 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -4.430 -4.188 -20.714 1.00 0.00 H new ATOM 1642 N ASP A 106 -0.076 -3.159 -25.468 1.00 0.00 N ATOM 1643 CA ASP A 106 0.576 -4.321 -26.063 1.00 0.00 C ATOM 1644 C ASP A 106 2.023 -4.457 -25.594 1.00 0.00 C ATOM 1645 O ASP A 106 2.470 -5.553 -25.251 1.00 0.00 O ATOM 1646 CB ASP A 106 0.543 -4.214 -27.586 1.00 0.00 C ATOM 1647 CG ASP A 106 1.287 -5.400 -28.224 1.00 0.00 C ATOM 1648 OD1 ASP A 106 0.722 -6.519 -28.254 1.00 0.00 O ATOM 1649 OD2 ASP A 106 2.423 -5.206 -28.715 1.00 0.00 O1- ATOM 0 H ASP A 106 -0.321 -2.444 -26.153 1.00 0.00 H new ATOM 0 HA ASP A 106 0.030 -5.207 -25.741 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -0.490 -4.196 -27.933 1.00 0.00 H new ATOM 0 HB3 ASP A 106 1.002 -3.277 -27.901 1.00 0.00 H new ATOM 1654 N LYS A 107 2.733 -3.326 -25.512 1.00 0.00 N ATOM 1655 CA LYS A 107 4.087 -3.239 -24.993 1.00 0.00 C ATOM 1656 C LYS A 107 4.089 -3.821 -23.597 1.00 0.00 C ATOM 1657 O LYS A 107 4.763 -4.811 -23.331 1.00 0.00 O ATOM 1658 CB LYS A 107 4.572 -1.781 -25.052 1.00 0.00 C ATOM 1659 CG LYS A 107 5.946 -1.615 -24.400 1.00 0.00 C ATOM 1660 CD LYS A 107 7.105 -2.269 -25.164 1.00 0.00 C ATOM 1661 CE LYS A 107 8.162 -1.233 -25.571 1.00 0.00 C ATOM 1662 NZ LYS A 107 9.133 -1.772 -26.576 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.364 -2.425 -25.816 1.00 0.00 H new ATOM 0 HA LYS A 107 4.790 -3.814 -25.595 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.621 -1.455 -26.091 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.850 -1.137 -24.549 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.155 -0.551 -24.293 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.909 -2.036 -23.395 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.566 -3.036 -24.542 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.721 -2.768 -26.054 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.666 -0.355 -25.984 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.705 -0.905 -24.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 9.826 -1.036 -26.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.628 -2.594 -26.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 8.620 -2.061 -27.434 1.00 0.00 H new ATOM 1676 N LEU A 108 3.338 -3.206 -22.695 1.00 0.00 N ATOM 1677 CA LEU A 108 3.408 -3.607 -21.296 1.00 0.00 C ATOM 1678 C LEU A 108 2.766 -4.974 -21.072 1.00 0.00 C ATOM 1679 O LEU A 108 3.170 -5.671 -20.148 1.00 0.00 O ATOM 1680 CB LEU A 108 2.883 -2.499 -20.378 1.00 0.00 C ATOM 1681 CG LEU A 108 3.605 -1.158 -20.600 1.00 0.00 C ATOM 1682 CD1 LEU A 108 3.020 -0.138 -19.631 1.00 0.00 C ATOM 1683 CD2 LEU A 108 5.135 -1.230 -20.463 1.00 0.00 C ATOM 0 H LEU A 108 2.688 -2.446 -22.898 1.00 0.00 H new ATOM 0 HA LEU A 108 4.454 -3.740 -21.020 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.815 -2.366 -20.549 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.003 -2.805 -19.339 1.00 0.00 H new ATOM 0 HG LEU A 108 3.436 -0.862 -21.635 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.517 0.822 -19.770 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.953 -0.025 -19.822 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.171 -0.480 -18.607 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.563 -0.242 -20.635 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.395 -1.568 -19.460 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.533 -1.930 -21.197 1.00 0.00 H new ATOM 1695 N SER A 109 1.887 -5.443 -21.958 1.00 0.00 N ATOM 1696 CA SER A 109 1.401 -6.818 -21.913 1.00 0.00 C ATOM 1697 C SER A 109 2.563 -7.814 -22.101 1.00 0.00 C ATOM 1698 O SER A 109 2.533 -8.896 -21.511 1.00 0.00 O ATOM 1699 CB SER A 109 0.287 -7.012 -22.959 1.00 0.00 C ATOM 1700 OG SER A 109 -0.423 -8.224 -22.750 1.00 0.00 O ATOM 0 H SER A 109 1.497 -4.886 -22.718 1.00 0.00 H new ATOM 0 HA SER A 109 0.972 -7.019 -20.931 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.406 -6.172 -22.913 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.722 -7.013 -23.958 1.00 0.00 H new ATOM 0 HG SER A 109 -1.123 -8.314 -23.430 1.00 0.00 H new ATOM 1706 N THR A 110 3.633 -7.457 -22.829 1.00 0.00 N ATOM 1707 CA THR A 110 4.763 -8.361 -23.033 1.00 0.00 C ATOM 1708 C THR A 110 5.630 -8.409 -21.759 1.00 0.00 C ATOM 1709 O THR A 110 6.347 -9.379 -21.513 1.00 0.00 O ATOM 1710 CB THR A 110 5.502 -7.941 -24.333 1.00 0.00 C ATOM 1711 OG1 THR A 110 5.767 -9.068 -25.154 1.00 0.00 O ATOM 1712 CG2 THR A 110 6.824 -7.196 -24.104 1.00 0.00 C ATOM 0 H THR A 110 3.734 -6.549 -23.283 1.00 0.00 H new ATOM 0 HA THR A 110 4.445 -9.392 -23.188 1.00 0.00 H new ATOM 0 HB THR A 110 4.817 -7.248 -24.821 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.231 -8.778 -25.967 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.270 -6.942 -25.066 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.634 -6.283 -23.540 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.508 -7.833 -23.544 1.00 0.00 H new ATOM 1720 N LYS A 111 5.539 -7.372 -20.910 1.00 0.00 N ATOM 1721 CA LYS A 111 6.289 -7.222 -19.669 1.00 0.00 C ATOM 1722 C LYS A 111 5.650 -7.979 -18.502 1.00 0.00 C ATOM 1723 O LYS A 111 6.160 -7.894 -17.388 1.00 0.00 O ATOM 1724 CB LYS A 111 6.456 -5.719 -19.366 1.00 0.00 C ATOM 1725 CG LYS A 111 7.145 -4.914 -20.477 1.00 0.00 C ATOM 1726 CD LYS A 111 8.577 -5.392 -20.757 1.00 0.00 C ATOM 1727 CE LYS A 111 9.498 -5.441 -19.519 1.00 0.00 C ATOM 1728 NZ LYS A 111 10.763 -6.203 -19.752 1.00 0.00 N1+ ATOM 0 H LYS A 111 4.912 -6.587 -21.084 1.00 0.00 H new ATOM 0 HA LYS A 111 7.273 -7.673 -19.797 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.472 -5.288 -19.180 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.031 -5.609 -18.446 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.557 -4.988 -21.392 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.167 -3.861 -20.196 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.533 -6.387 -21.199 1.00 0.00 H new ATOM 0 HD3 LYS A 111 9.026 -4.733 -21.500 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.746 -4.423 -19.219 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.956 -5.895 -18.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 11.359 -6.155 -18.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.536 -7.196 -19.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 11.275 -5.788 -20.556 1.00 0.00 H new ATOM 1742 N GLY A 112 4.547 -8.691 -18.734 1.00 0.00 N ATOM 1743 CA GLY A 112 3.935 -9.565 -17.735 1.00 0.00 C ATOM 1744 C GLY A 112 3.292 -8.771 -16.605 1.00 0.00 C ATOM 1745 O GLY A 112 3.342 -9.194 -15.450 1.00 0.00 O ATOM 0 H GLY A 112 4.051 -8.677 -19.625 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.182 -10.192 -18.213 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.692 -10.233 -17.324 1.00 0.00 H new ATOM 1749 N VAL A 113 2.744 -7.593 -16.913 1.00 0.00 N ATOM 1750 CA VAL A 113 2.037 -6.757 -15.953 1.00 0.00 C ATOM 1751 C VAL A 113 0.579 -7.226 -15.848 1.00 0.00 C ATOM 1752 O VAL A 113 0.112 -8.039 -16.653 1.00 0.00 O ATOM 1753 CB VAL A 113 2.211 -5.257 -16.290 1.00 0.00 C ATOM 1754 CG1 VAL A 113 3.645 -4.948 -16.739 1.00 0.00 C ATOM 1755 CG2 VAL A 113 1.232 -4.722 -17.344 1.00 0.00 C ATOM 0 H VAL A 113 2.782 -7.192 -17.850 1.00 0.00 H new ATOM 0 HA VAL A 113 2.470 -6.868 -14.959 1.00 0.00 H new ATOM 0 HB VAL A 113 1.985 -4.743 -15.356 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.734 -3.886 -16.968 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.340 -5.206 -15.940 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.882 -5.532 -17.628 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.427 -3.664 -17.517 1.00 0.00 H new ATOM 0 HG22 VAL A 113 1.364 -5.272 -18.276 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.209 -4.849 -16.989 1.00 0.00 H new ATOM 1765 N LYS A 114 -0.153 -6.684 -14.875 1.00 0.00 N ATOM 1766 CA LYS A 114 -1.604 -6.844 -14.768 1.00 0.00 C ATOM 1767 C LYS A 114 -2.216 -5.457 -14.903 1.00 0.00 C ATOM 1768 O LYS A 114 -1.604 -4.501 -14.432 1.00 0.00 O ATOM 1769 CB LYS A 114 -1.980 -7.630 -13.515 1.00 0.00 C ATOM 1770 CG LYS A 114 -1.739 -6.871 -12.212 1.00 0.00 C ATOM 1771 CD LYS A 114 -1.929 -7.832 -11.037 1.00 0.00 C ATOM 1772 CE LYS A 114 -0.600 -8.479 -10.617 1.00 0.00 C ATOM 1773 NZ LYS A 114 -0.794 -9.591 -9.642 1.00 0.00 N1+ ATOM 0 H LYS A 114 0.249 -6.115 -14.130 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.020 -7.457 -15.568 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.033 -7.906 -13.574 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.408 -8.558 -13.495 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -0.732 -6.454 -12.199 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.432 -6.033 -12.130 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.356 -7.294 -10.191 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.642 -8.609 -11.313 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -0.088 -8.859 -11.501 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.047 -7.721 -10.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.130 -9.996 -9.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.258 -9.225 -8.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.389 -10.328 -10.070 1.00 0.00 H new ATOM 1787 N PHE A 115 -3.367 -5.308 -15.553 1.00 0.00 N ATOM 1788 CA PHE A 115 -3.905 -4.008 -15.899 1.00 0.00 C ATOM 1789 C PHE A 115 -5.151 -3.675 -15.089 1.00 0.00 C ATOM 1790 O PHE A 115 -5.930 -4.570 -14.754 1.00 0.00 O ATOM 1791 CB PHE A 115 -4.155 -3.900 -17.404 1.00 0.00 C ATOM 1792 CG PHE A 115 -2.896 -3.851 -18.251 1.00 0.00 C ATOM 1793 CD1 PHE A 115 -2.181 -2.645 -18.381 1.00 0.00 C ATOM 1794 CD2 PHE A 115 -2.495 -4.986 -18.978 1.00 0.00 C ATOM 1795 CE1 PHE A 115 -1.107 -2.558 -19.285 1.00 0.00 C ATOM 1796 CE2 PHE A 115 -1.426 -4.895 -19.885 1.00 0.00 C ATOM 1797 CZ PHE A 115 -0.752 -3.674 -20.060 1.00 0.00 C ATOM 0 H PHE A 115 -3.949 -6.090 -15.852 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.155 -3.261 -15.637 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.758 -4.751 -17.721 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -4.743 -3.003 -17.598 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.457 -1.787 -17.787 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.008 -5.926 -18.839 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.556 -1.634 -19.383 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.122 -5.765 -20.449 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.039 -3.594 -20.791 1.00 0.00 H new ATOM 1807 N VAL A 116 -5.350 -2.386 -14.805 1.00 0.00 N ATOM 1808 CA VAL A 116 -6.580 -1.841 -14.246 1.00 0.00 C ATOM 1809 C VAL A 116 -7.027 -0.667 -15.115 1.00 0.00 C ATOM 1810 O VAL A 116 -6.312 -0.282 -16.048 1.00 0.00 O ATOM 1811 CB VAL A 116 -6.404 -1.465 -12.763 1.00 0.00 C ATOM 1812 CG1 VAL A 116 -5.909 -2.657 -11.937 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -5.496 -0.251 -12.529 1.00 0.00 C ATOM 0 H VAL A 116 -4.636 -1.675 -14.964 1.00 0.00 H new ATOM 0 HA VAL A 116 -7.367 -2.595 -14.258 1.00 0.00 H new ATOM 0 HB VAL A 116 -7.400 -1.178 -12.425 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -5.796 -2.356 -10.896 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -6.631 -3.471 -12.003 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -4.947 -2.993 -12.324 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.424 -0.051 -11.460 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.503 -0.457 -12.928 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -5.916 0.620 -13.033 1.00 0.00 H new ATOM 1823 N GLY A 117 -8.162 -0.044 -14.797 1.00 0.00 N ATOM 1824 CA GLY A 117 -8.559 1.170 -15.462 1.00 0.00 C ATOM 1825 C GLY A 117 -9.152 0.961 -16.855 1.00 0.00 C ATOM 1826 O GLY A 117 -8.961 1.824 -17.710 1.00 0.00 O ATOM 0 H GLY A 117 -8.813 -0.369 -14.082 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.292 1.687 -14.842 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.692 1.825 -15.544 1.00 0.00 H new ATOM 1830 N TYR A 118 -9.880 -0.126 -17.104 1.00 0.00 N ATOM 1831 CA TYR A 118 -10.650 -0.262 -18.336 1.00 0.00 C ATOM 1832 C TYR A 118 -11.847 0.690 -18.252 1.00 0.00 C ATOM 1833 O TYR A 118 -12.293 1.029 -17.155 1.00 0.00 O ATOM 1834 CB TYR A 118 -11.098 -1.717 -18.531 1.00 0.00 C ATOM 1835 CG TYR A 118 -9.946 -2.690 -18.702 1.00 0.00 C ATOM 1836 CD1 TYR A 118 -9.244 -2.726 -19.921 1.00 0.00 C ATOM 1837 CD2 TYR A 118 -9.571 -3.554 -17.653 1.00 0.00 C ATOM 1838 CE1 TYR A 118 -8.191 -3.637 -20.107 1.00 0.00 C ATOM 1839 CE2 TYR A 118 -8.516 -4.467 -17.832 1.00 0.00 C ATOM 1840 CZ TYR A 118 -7.831 -4.525 -19.066 1.00 0.00 C ATOM 1841 OH TYR A 118 -6.849 -5.455 -19.251 1.00 0.00 O ATOM 0 H TYR A 118 -9.952 -0.922 -16.471 1.00 0.00 H new ATOM 0 HA TYR A 118 -10.039 -0.001 -19.200 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -11.696 -2.022 -17.672 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -11.745 -1.775 -19.407 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -9.516 -2.050 -20.718 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -10.095 -3.515 -16.710 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -7.656 -3.660 -21.045 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -8.229 -5.125 -17.025 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.734 -5.978 -18.430 1.00 0.00 H new ATOM 1851 N TRP A 119 -12.391 1.105 -19.391 1.00 0.00 N ATOM 1852 CA TRP A 119 -13.582 1.959 -19.460 1.00 0.00 C ATOM 1853 C TRP A 119 -14.486 1.465 -20.569 1.00 0.00 C ATOM 1854 O TRP A 119 -13.947 1.131 -21.617 1.00 0.00 O ATOM 1855 CB TRP A 119 -13.208 3.394 -19.803 1.00 0.00 C ATOM 1856 CG TRP A 119 -13.084 4.386 -18.699 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -12.507 5.576 -18.934 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -13.619 4.459 -17.323 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -12.563 6.346 -17.809 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -13.275 5.742 -16.798 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -14.378 3.629 -16.456 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -13.640 6.172 -15.513 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -14.761 4.051 -15.169 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -14.394 5.318 -14.694 1.00 0.00 C ATOM 0 H TRP A 119 -12.016 0.857 -20.307 1.00 0.00 H new ATOM 0 HA TRP A 119 -14.073 1.922 -18.488 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -12.256 3.369 -20.333 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -13.953 3.771 -20.503 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -12.065 5.878 -19.872 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -12.127 7.264 -17.727 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -14.670 2.646 -16.794 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -13.344 7.148 -15.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.343 3.393 -14.541 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.690 5.634 -13.705 1.00 0.00 H new ATOM 1875 N PRO A 120 -15.818 1.477 -20.431 1.00 0.00 N ATOM 1876 CA PRO A 120 -16.679 1.231 -21.571 1.00 0.00 C ATOM 1877 C PRO A 120 -16.574 2.404 -22.560 1.00 0.00 C ATOM 1878 O PRO A 120 -16.471 3.567 -22.160 1.00 0.00 O ATOM 1879 CB PRO A 120 -18.078 1.035 -20.986 1.00 0.00 C ATOM 1880 CG PRO A 120 -18.053 1.909 -19.729 1.00 0.00 C ATOM 1881 CD PRO A 120 -16.603 1.812 -19.249 1.00 0.00 C ATOM 0 HA PRO A 120 -16.402 0.349 -22.148 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.854 1.352 -21.682 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.272 -0.010 -20.747 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.333 2.939 -19.951 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -18.750 1.545 -18.974 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.271 2.754 -18.813 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -16.496 1.049 -18.478 1.00 0.00 H new ATOM 1889 N THR A 121 -16.618 2.102 -23.857 1.00 0.00 N ATOM 1890 CA THR A 121 -16.521 3.048 -24.956 1.00 0.00 C ATOM 1891 C THR A 121 -17.795 3.881 -25.171 1.00 0.00 C ATOM 1892 O THR A 121 -17.838 4.730 -26.064 1.00 0.00 O ATOM 1893 CB THR A 121 -16.066 2.298 -26.222 1.00 0.00 C ATOM 1894 OG1 THR A 121 -17.003 1.286 -26.550 1.00 0.00 O ATOM 1895 CG2 THR A 121 -14.690 1.632 -26.052 1.00 0.00 C ATOM 0 H THR A 121 -16.728 1.141 -24.181 1.00 0.00 H new ATOM 0 HA THR A 121 -15.770 3.794 -24.699 1.00 0.00 H new ATOM 0 HB THR A 121 -15.996 3.044 -27.014 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.581 0.629 -27.143 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.418 1.118 -26.974 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.943 2.393 -25.827 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.733 0.913 -25.234 1.00 0.00 H new ATOM 1946 N GLU A 125 -17.374 8.831 -29.485 1.00 0.00 N ATOM 1947 CA GLU A 125 -17.323 8.558 -30.898 1.00 0.00 C ATOM 1948 C GLU A 125 -15.832 8.623 -31.253 1.00 0.00 C ATOM 1949 O GLU A 125 -15.137 9.512 -30.760 1.00 0.00 O ATOM 1950 CB GLU A 125 -18.205 9.592 -31.603 1.00 0.00 C ATOM 1951 CG GLU A 125 -17.759 11.055 -31.446 1.00 0.00 C ATOM 1952 CD GLU A 125 -18.796 12.017 -32.052 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -18.735 12.283 -33.278 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -19.670 12.527 -31.308 1.00 0.00 O ATOM 0 HA GLU A 125 -17.709 7.587 -31.208 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -18.238 9.352 -32.666 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -19.222 9.497 -31.223 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.619 11.285 -30.390 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.795 11.199 -31.934 1.00 0.00 H new ATOM 1961 N PHE A 126 -15.306 7.648 -32.002 1.00 0.00 N ATOM 1962 CA PHE A 126 -13.862 7.522 -32.227 1.00 0.00 C ATOM 1963 C PHE A 126 -13.612 6.610 -33.424 1.00 0.00 C ATOM 1964 O PHE A 126 -12.947 7.023 -34.360 1.00 0.00 O ATOM 1965 CB PHE A 126 -13.134 6.997 -30.968 1.00 0.00 C ATOM 1966 CG PHE A 126 -13.579 5.643 -30.436 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -14.819 5.517 -29.780 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -12.789 4.491 -30.639 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -15.294 4.257 -29.385 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -13.265 3.230 -30.238 1.00 0.00 C ATOM 1971 CZ PHE A 126 -14.520 3.110 -29.620 1.00 0.00 C ATOM 0 H PHE A 126 -15.863 6.930 -32.465 1.00 0.00 H new ATOM 0 HA PHE A 126 -13.456 8.511 -32.440 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -12.068 6.942 -31.189 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -13.257 7.732 -30.173 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -15.410 6.398 -29.579 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.818 4.578 -31.103 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -16.255 4.170 -28.900 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -12.662 2.350 -30.406 1.00 0.00 H new ATOM 0 HZ PHE A 126 -14.889 2.138 -29.326 1.00 0.00 H new ATOM 1981 N THR A 127 -14.179 5.395 -33.401 1.00 0.00 N ATOM 1982 CA THR A 127 -14.151 4.364 -34.444 1.00 0.00 C ATOM 1983 C THR A 127 -12.738 3.833 -34.801 1.00 0.00 C ATOM 1984 O THR A 127 -12.587 3.020 -35.719 1.00 0.00 O ATOM 1985 CB THR A 127 -15.110 4.752 -35.598 1.00 0.00 C ATOM 1986 OG1 THR A 127 -15.505 3.652 -36.404 1.00 0.00 O ATOM 1987 CG2 THR A 127 -14.599 5.880 -36.494 1.00 0.00 C ATOM 0 H THR A 127 -14.711 5.085 -32.587 1.00 0.00 H new ATOM 0 HA THR A 127 -14.565 3.438 -34.044 1.00 0.00 H new ATOM 0 HB THR A 127 -15.986 5.125 -35.067 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.748 3.041 -36.517 1.00 0.00 H new ATOM 0 HG21 THR A 127 -15.332 6.086 -37.274 1.00 0.00 H new ATOM 0 HG22 THR A 127 -14.444 6.778 -35.896 1.00 0.00 H new ATOM 0 HG23 THR A 127 -13.656 5.582 -36.952 1.00 0.00 H new ATOM 1995 N SER A 128 -11.703 4.215 -34.042 1.00 0.00 N ATOM 1996 CA SER A 128 -10.390 3.566 -34.128 1.00 0.00 C ATOM 1997 C SER A 128 -10.535 2.135 -33.590 1.00 0.00 C ATOM 1998 O SER A 128 -11.164 1.947 -32.544 1.00 0.00 O ATOM 1999 CB SER A 128 -9.309 4.324 -33.344 1.00 0.00 C ATOM 2000 OG SER A 128 -8.127 3.545 -33.232 1.00 0.00 O ATOM 0 H SER A 128 -11.751 4.972 -33.360 1.00 0.00 H new ATOM 0 HA SER A 128 -10.067 3.561 -35.169 1.00 0.00 H new ATOM 0 HB2 SER A 128 -9.083 5.265 -33.845 1.00 0.00 H new ATOM 0 HB3 SER A 128 -9.681 4.573 -32.350 1.00 0.00 H new ATOM 0 HG SER A 128 -7.377 4.123 -32.979 1.00 0.00 H new ATOM 2006 N PRO A 129 -9.921 1.124 -34.233 1.00 0.00 N ATOM 2007 CA PRO A 129 -9.909 -0.247 -33.739 1.00 0.00 C ATOM 2008 C PRO A 129 -8.784 -0.503 -32.717 1.00 0.00 C ATOM 2009 O PRO A 129 -8.762 -1.569 -32.097 1.00 0.00 O ATOM 2010 CB PRO A 129 -9.729 -1.093 -35.006 1.00 0.00 C ATOM 2011 CG PRO A 129 -8.817 -0.221 -35.871 1.00 0.00 C ATOM 2012 CD PRO A 129 -9.297 1.195 -35.551 1.00 0.00 C ATOM 0 HA PRO A 129 -10.821 -0.490 -33.194 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -9.275 -2.059 -34.786 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -10.681 -1.293 -35.497 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -7.766 -0.359 -35.617 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -8.922 -0.454 -36.931 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -8.464 1.898 -35.550 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -10.008 1.544 -36.300 1.00 0.00 H new ATOM 2020 N LYS A 130 -7.830 0.428 -32.545 1.00 0.00 N ATOM 2021 CA LYS A 130 -6.604 0.167 -31.786 1.00 0.00 C ATOM 2022 C LYS A 130 -6.780 0.215 -30.259 1.00 0.00 C ATOM 2023 O LYS A 130 -6.329 -0.719 -29.598 1.00 0.00 O ATOM 2024 CB LYS A 130 -5.458 1.070 -32.300 1.00 0.00 C ATOM 2025 CG LYS A 130 -4.050 0.518 -32.020 1.00 0.00 C ATOM 2026 CD LYS A 130 -3.706 -0.693 -32.906 1.00 0.00 C ATOM 2027 CE LYS A 130 -2.201 -0.982 -32.823 1.00 0.00 C ATOM 2028 NZ LYS A 130 -1.792 -2.113 -33.704 1.00 0.00 N1+ ATOM 0 H LYS A 130 -7.889 1.372 -32.926 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.329 -0.871 -31.973 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.575 1.210 -33.375 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.550 2.053 -31.838 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.315 1.306 -32.185 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.978 0.229 -30.971 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -4.272 -1.566 -32.582 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.992 -0.493 -33.939 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -1.646 -0.087 -33.103 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.934 -1.213 -31.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -0.768 -2.270 -33.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.301 -2.975 -33.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -2.021 -1.884 -34.692 1.00 0.00 H new ATOM 2042 N PRO A 131 -7.393 1.252 -29.648 1.00 0.00 N ATOM 2043 CA PRO A 131 -7.375 1.428 -28.191 1.00 0.00 C ATOM 2044 C PRO A 131 -8.531 0.704 -27.497 1.00 0.00 C ATOM 2045 O PRO A 131 -9.113 1.238 -26.558 1.00 0.00 O ATOM 2046 CB PRO A 131 -7.427 2.945 -28.003 1.00 0.00 C ATOM 2047 CG PRO A 131 -8.345 3.401 -29.139 1.00 0.00 C ATOM 2048 CD PRO A 131 -7.962 2.448 -30.273 1.00 0.00 C ATOM 0 HA PRO A 131 -6.490 0.988 -27.731 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -7.827 3.217 -27.026 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -6.437 3.395 -28.078 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -9.398 3.312 -28.871 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -8.172 4.443 -29.408 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -8.835 2.192 -30.874 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -7.240 2.915 -30.943 1.00 0.00 H new ATOM 2056 N VAL A 132 -8.886 -0.500 -27.928 1.00 0.00 N ATOM 2057 CA VAL A 132 -10.120 -1.174 -27.563 1.00 0.00 C ATOM 2058 C VAL A 132 -9.854 -2.673 -27.384 1.00 0.00 C ATOM 2059 O VAL A 132 -8.983 -3.225 -28.060 1.00 0.00 O ATOM 2060 CB VAL A 132 -11.233 -0.904 -28.605 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -12.524 -0.452 -27.919 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -10.924 0.147 -29.692 1.00 0.00 C ATOM 0 H VAL A 132 -8.303 -1.049 -28.560 1.00 0.00 H new ATOM 0 HA VAL A 132 -10.478 -0.775 -26.614 1.00 0.00 H new ATOM 0 HB VAL A 132 -11.324 -1.868 -29.106 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.291 -0.268 -28.672 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.865 -1.230 -27.236 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -12.337 0.465 -27.360 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -11.781 0.244 -30.359 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -10.720 1.109 -29.221 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -10.052 -0.168 -30.265 1.00 0.00 H new ATOM 2072 N ILE A 133 -10.598 -3.322 -26.482 1.00 0.00 N ATOM 2073 CA ILE A 133 -10.550 -4.746 -26.188 1.00 0.00 C ATOM 2074 C ILE A 133 -11.947 -5.335 -26.261 1.00 0.00 C ATOM 2075 O ILE A 133 -12.912 -4.641 -26.587 1.00 0.00 O ATOM 2076 CB ILE A 133 -9.861 -5.079 -24.843 1.00 0.00 C ATOM 2077 CG1 ILE A 133 -10.620 -4.568 -23.599 1.00 0.00 C ATOM 2078 CG2 ILE A 133 -8.431 -4.582 -24.935 1.00 0.00 C ATOM 2079 CD1 ILE A 133 -10.295 -3.126 -23.262 1.00 0.00 C ATOM 0 H ILE A 133 -11.286 -2.834 -25.909 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.924 -5.209 -26.951 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.869 -6.158 -24.690 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -11.692 -4.663 -23.769 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -10.375 -5.200 -22.745 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.910 -4.799 -24.003 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -7.924 -5.083 -25.759 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.430 -3.506 -25.109 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -10.858 -2.823 -22.379 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -9.228 -3.031 -23.062 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -10.565 -2.486 -24.102 1.00 0.00 H new ATOM 2091 N ALA A 134 -12.047 -6.593 -25.848 1.00 0.00 N ATOM 2092 CA ALA A 134 -13.256 -7.375 -25.854 1.00 0.00 C ATOM 2093 C ALA A 134 -13.761 -7.428 -27.298 1.00 0.00 C ATOM 2094 O ALA A 134 -13.051 -7.930 -28.174 1.00 0.00 O ATOM 2095 CB ALA A 134 -14.194 -6.832 -24.762 1.00 0.00 C ATOM 0 H ALA A 134 -11.246 -7.110 -25.485 1.00 0.00 H new ATOM 0 HA ALA A 134 -13.135 -8.422 -25.575 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -15.116 -7.413 -24.752 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -13.705 -6.910 -23.791 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -14.426 -5.787 -24.968 1.00 0.00 H new ATOM 2101 N ASP A 135 -14.936 -6.861 -27.560 1.00 0.00 N ATOM 2102 CA ASP A 135 -15.531 -6.739 -28.888 1.00 0.00 C ATOM 2103 C ASP A 135 -15.449 -5.307 -29.431 1.00 0.00 C ATOM 2104 O ASP A 135 -16.062 -4.968 -30.444 1.00 0.00 O ATOM 2105 CB ASP A 135 -16.969 -7.248 -28.840 1.00 0.00 C ATOM 2106 CG ASP A 135 -17.584 -7.444 -30.240 1.00 0.00 C ATOM 2107 OD1 ASP A 135 -16.981 -8.159 -31.077 1.00 0.00 O ATOM 2108 OD2 ASP A 135 -18.708 -6.938 -30.484 1.00 0.00 O ATOM 0 H ASP A 135 -15.521 -6.460 -26.827 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.960 -7.352 -29.585 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -16.996 -8.195 -28.301 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -17.580 -6.543 -28.276 1.00 0.00 H new ATOM 2113 N GLY A 136 -14.717 -4.436 -28.726 1.00 0.00 N ATOM 2114 CA GLY A 136 -14.638 -3.006 -28.997 1.00 0.00 C ATOM 2115 C GLY A 136 -15.568 -2.189 -28.102 1.00 0.00 C ATOM 2116 O GLY A 136 -15.921 -1.063 -28.444 1.00 0.00 O ATOM 0 H GLY A 136 -14.148 -4.721 -27.929 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -13.612 -2.668 -28.853 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.891 -2.823 -30.041 1.00 0.00 H new ATOM 2120 N GLN A 137 -15.974 -2.758 -26.957 1.00 0.00 N ATOM 2121 CA GLN A 137 -16.972 -2.195 -26.057 1.00 0.00 C ATOM 2122 C GLN A 137 -16.305 -1.515 -24.866 1.00 0.00 C ATOM 2123 O GLN A 137 -16.946 -0.734 -24.169 1.00 0.00 O ATOM 2124 CB GLN A 137 -17.946 -3.282 -25.564 1.00 0.00 C ATOM 2125 CG GLN A 137 -18.164 -4.407 -26.573 1.00 0.00 C ATOM 2126 CD GLN A 137 -19.094 -5.487 -26.020 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -20.273 -5.565 -26.358 1.00 0.00 O ATOM 2128 NE2 GLN A 137 -18.568 -6.340 -25.152 1.00 0.00 N ATOM 0 H GLN A 137 -15.601 -3.649 -26.629 1.00 0.00 H new ATOM 0 HA GLN A 137 -17.538 -1.449 -26.615 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -17.565 -3.706 -24.635 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -18.906 -2.821 -25.333 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -18.587 -3.997 -27.490 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -17.204 -4.852 -26.835 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -17.587 -6.257 -24.886 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -19.144 -7.080 -24.751 1.00 0.00 H new ATOM 2137 N LEU A 138 -15.030 -1.842 -24.611 1.00 0.00 N ATOM 2138 CA LEU A 138 -14.217 -1.152 -23.604 1.00 0.00 C ATOM 2139 C LEU A 138 -12.877 -0.734 -24.184 1.00 0.00 C ATOM 2140 O LEU A 138 -12.306 -1.459 -24.994 1.00 0.00 O ATOM 2141 CB LEU A 138 -14.047 -1.887 -22.250 1.00 0.00 C ATOM 2142 CG LEU A 138 -14.178 -3.420 -22.191 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -13.475 -3.959 -20.940 1.00 0.00 C ATOM 2144 CD2 LEU A 138 -15.652 -3.834 -22.118 1.00 0.00 C ATOM 0 H LEU A 138 -14.536 -2.591 -25.097 1.00 0.00 H new ATOM 0 HA LEU A 138 -14.796 -0.266 -23.346 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -13.062 -1.629 -21.861 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -14.781 -1.471 -21.560 1.00 0.00 H new ATOM 0 HG LEU A 138 -13.721 -3.828 -23.093 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -13.573 -5.044 -20.907 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -12.419 -3.691 -20.972 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -13.933 -3.526 -20.050 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -15.723 -4.921 -22.077 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -16.106 -3.407 -21.224 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -16.177 -3.469 -23.001 1.00 0.00 H new ATOM 2156 N PHE A 139 -12.381 0.426 -23.753 1.00 0.00 N ATOM 2157 CA PHE A 139 -11.073 0.939 -24.090 1.00 0.00 C ATOM 2158 C PHE A 139 -10.031 0.222 -23.257 1.00 0.00 C ATOM 2159 O PHE A 139 -10.304 -0.198 -22.132 1.00 0.00 O ATOM 2160 CB PHE A 139 -10.955 2.434 -23.775 1.00 0.00 C ATOM 2161 CG PHE A 139 -11.878 3.333 -24.548 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -11.773 3.423 -25.948 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -12.843 4.085 -23.860 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -12.602 4.313 -26.653 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -13.683 4.954 -24.569 1.00 0.00 C ATOM 2166 CZ PHE A 139 -13.547 5.093 -25.962 1.00 0.00 C ATOM 0 H PHE A 139 -12.905 1.049 -23.138 1.00 0.00 H new ATOM 0 HA PHE A 139 -10.922 0.780 -25.158 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -11.142 2.579 -22.711 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -9.928 2.747 -23.964 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -11.059 2.811 -26.479 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -12.938 3.994 -22.788 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.513 4.398 -27.726 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -14.438 5.520 -24.043 1.00 0.00 H new ATOM 0 HZ PHE A 139 -14.166 5.796 -26.499 1.00 0.00 H new ATOM 2176 N VAL A 140 -8.801 0.208 -23.755 1.00 0.00 N ATOM 2177 CA VAL A 140 -7.654 -0.323 -23.041 1.00 0.00 C ATOM 2178 C VAL A 140 -7.326 0.499 -21.774 1.00 0.00 C ATOM 2179 O VAL A 140 -6.616 0.003 -20.901 1.00 0.00 O ATOM 2180 CB VAL A 140 -6.458 -0.420 -24.010 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -6.630 -1.478 -25.100 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -6.095 0.917 -24.649 1.00 0.00 C ATOM 0 H VAL A 140 -8.572 0.571 -24.680 1.00 0.00 H new ATOM 0 HA VAL A 140 -7.891 -1.324 -22.681 1.00 0.00 H new ATOM 0 HB VAL A 140 -5.633 -0.734 -23.371 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.749 -1.486 -25.741 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.753 -2.458 -24.639 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -7.511 -1.245 -25.697 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.246 0.781 -25.320 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -6.948 1.294 -25.214 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.831 1.633 -23.870 1.00 0.00 H new ATOM 2192 N GLY A 141 -7.818 1.742 -21.649 1.00 0.00 N ATOM 2193 CA GLY A 141 -7.438 2.636 -20.557 1.00 0.00 C ATOM 2194 C GLY A 141 -8.370 3.839 -20.483 1.00 0.00 C ATOM 2195 O GLY A 141 -9.289 3.951 -21.298 1.00 0.00 O ATOM 0 H GLY A 141 -8.487 2.149 -22.302 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.465 2.093 -19.612 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.412 2.975 -20.701 1.00 0.00 H new ATOM 2199 N LEU A 142 -8.128 4.761 -19.543 1.00 0.00 N ATOM 2200 CA LEU A 142 -8.821 6.043 -19.484 1.00 0.00 C ATOM 2201 C LEU A 142 -8.520 6.799 -20.763 1.00 0.00 C ATOM 2202 O LEU A 142 -7.360 6.971 -21.136 1.00 0.00 O ATOM 2203 CB LEU A 142 -8.397 6.833 -18.235 1.00 0.00 C ATOM 2204 CG LEU A 142 -8.705 8.340 -18.152 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.213 8.596 -18.075 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -8.070 8.926 -16.889 1.00 0.00 C ATOM 0 H LEU A 142 -7.441 4.633 -18.800 1.00 0.00 H new ATOM 0 HA LEU A 142 -9.897 5.892 -19.403 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -8.863 6.356 -17.373 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.320 6.713 -18.122 1.00 0.00 H new ATOM 0 HG LEU A 142 -8.301 8.808 -19.050 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.397 9.669 -18.017 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -10.697 8.192 -18.964 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -10.620 8.110 -17.188 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.289 9.992 -16.833 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -8.477 8.425 -16.011 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.990 8.779 -16.923 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.582 7.259 -21.414 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.502 7.993 -22.664 1.00 0.00 C ATOM 2220 C ALA A 143 -9.895 9.425 -22.350 1.00 0.00 C ATOM 2221 O ALA A 143 -10.964 9.643 -21.775 1.00 0.00 O ATOM 2222 CB ALA A 143 -10.422 7.330 -23.698 1.00 0.00 C ATOM 0 H ALA A 143 -10.537 7.129 -21.080 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.501 7.987 -23.096 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.366 7.877 -24.639 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -10.106 6.299 -23.858 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -11.449 7.342 -23.332 1.00 0.00 H new ATOM 2228 N LEU A 144 -9.045 10.390 -22.696 1.00 0.00 N ATOM 2229 CA LEU A 144 -9.306 11.813 -22.520 1.00 0.00 C ATOM 2230 C LEU A 144 -9.208 12.466 -23.893 1.00 0.00 C ATOM 2231 O LEU A 144 -8.423 12.029 -24.734 1.00 0.00 O ATOM 2232 CB LEU A 144 -8.290 12.438 -21.544 1.00 0.00 C ATOM 2233 CG LEU A 144 -8.203 11.771 -20.158 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -7.153 12.441 -19.269 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -9.531 11.825 -19.402 1.00 0.00 C ATOM 0 H LEU A 144 -8.136 10.197 -23.116 1.00 0.00 H new ATOM 0 HA LEU A 144 -10.297 11.969 -22.093 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.303 12.406 -22.005 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.544 13.489 -21.407 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.930 10.735 -20.359 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.123 11.941 -18.301 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -6.175 12.370 -19.744 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.412 13.490 -19.128 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.417 11.342 -18.432 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -9.825 12.864 -19.258 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.298 11.307 -19.977 1.00 0.00 H new ATOM 2247 N ASP A 145 -9.957 13.542 -24.099 1.00 0.00 N ATOM 2248 CA ASP A 145 -9.859 14.380 -25.283 1.00 0.00 C ATOM 2249 C ASP A 145 -9.859 15.813 -24.802 1.00 0.00 C ATOM 2250 O ASP A 145 -10.636 16.189 -23.925 1.00 0.00 O ATOM 2251 CB ASP A 145 -10.932 14.015 -26.314 1.00 0.00 C ATOM 2252 CG ASP A 145 -11.205 15.088 -27.370 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -11.541 16.227 -26.993 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -11.272 14.757 -28.579 1.00 0.00 O ATOM 0 H ASP A 145 -10.662 13.861 -23.434 1.00 0.00 H new ATOM 0 HA ASP A 145 -8.934 14.219 -25.837 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -10.632 13.097 -26.819 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -11.862 13.799 -25.788 1.00 0.00 H new ATOM 2259 N GLU A 146 -8.916 16.577 -25.333 1.00 0.00 N ATOM 2260 CA GLU A 146 -8.609 17.919 -24.861 1.00 0.00 C ATOM 2261 C GLU A 146 -9.008 18.965 -25.906 1.00 0.00 C ATOM 2262 O GLU A 146 -8.664 20.141 -25.756 1.00 0.00 O ATOM 2263 CB GLU A 146 -7.120 18.006 -24.464 1.00 0.00 C ATOM 2264 CG GLU A 146 -6.786 17.184 -23.212 1.00 0.00 C ATOM 2265 CD GLU A 146 -7.463 17.761 -21.950 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -7.102 18.876 -21.504 1.00 0.00 O1- ATOM 2267 OE2 GLU A 146 -8.352 17.085 -21.384 1.00 0.00 O ATOM 0 H GLU A 146 -8.334 16.278 -26.115 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.196 18.137 -23.969 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.507 17.658 -25.295 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -6.856 19.049 -24.289 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -7.108 16.153 -23.358 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -5.706 17.164 -23.068 1.00 0.00 H new ATOM 2274 N THR A 147 -9.749 18.560 -26.949 1.00 0.00 N ATOM 2275 CA THR A 147 -10.243 19.481 -27.964 1.00 0.00 C ATOM 2276 C THR A 147 -11.759 19.710 -27.865 1.00 0.00 C ATOM 2277 O THR A 147 -12.216 20.818 -28.150 1.00 0.00 O ATOM 2278 CB THR A 147 -9.691 19.110 -29.358 1.00 0.00 C ATOM 2279 OG1 THR A 147 -9.329 20.277 -30.084 1.00 0.00 O ATOM 2280 CG2 THR A 147 -10.668 18.306 -30.219 1.00 0.00 C ATOM 0 H THR A 147 -10.017 17.588 -27.105 1.00 0.00 H new ATOM 0 HA THR A 147 -9.844 20.476 -27.769 1.00 0.00 H new ATOM 0 HB THR A 147 -8.823 18.482 -29.158 1.00 0.00 H new ATOM 0 HG1 THR A 147 -8.980 20.020 -30.963 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.207 18.084 -31.182 1.00 0.00 H new ATOM 0 HG22 THR A 147 -10.917 17.373 -29.713 1.00 0.00 H new ATOM 0 HG23 THR A 147 -11.577 18.887 -30.377 1.00 0.00 H new ATOM 2288 N ASN A 148 -12.539 18.719 -27.417 1.00 0.00 N ATOM 2289 CA ASN A 148 -13.974 18.861 -27.206 1.00 0.00 C ATOM 2290 C ASN A 148 -14.456 18.242 -25.892 1.00 0.00 C ATOM 2291 O ASN A 148 -15.438 18.726 -25.331 1.00 0.00 O ATOM 2292 CB ASN A 148 -14.729 18.241 -28.383 1.00 0.00 C ATOM 2293 CG ASN A 148 -14.373 16.777 -28.582 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -14.944 15.922 -27.920 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -13.386 16.471 -29.414 1.00 0.00 N ATOM 0 H ASN A 148 -12.183 17.790 -27.190 1.00 0.00 H new ATOM 0 HA ASN A 148 -14.181 19.929 -27.140 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -15.802 18.333 -28.214 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -14.501 18.796 -29.293 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -13.085 15.501 -29.514 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -12.928 17.205 -29.954 1.00 0.00 H new ATOM 2302 N GLN A 149 -13.773 17.222 -25.364 1.00 0.00 N ATOM 2303 CA GLN A 149 -14.055 16.670 -24.039 1.00 0.00 C ATOM 2304 C GLN A 149 -13.257 17.375 -22.947 1.00 0.00 C ATOM 2305 O GLN A 149 -13.251 16.875 -21.830 1.00 0.00 O ATOM 2306 CB GLN A 149 -13.837 15.148 -23.942 1.00 0.00 C ATOM 2307 CG GLN A 149 -14.466 14.295 -25.040 1.00 0.00 C ATOM 2308 CD GLN A 149 -15.989 14.252 -24.975 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -16.557 13.587 -24.113 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -16.671 14.969 -25.849 1.00 0.00 N ATOM 0 H GLN A 149 -13.006 16.755 -25.847 1.00 0.00 H new ATOM 0 HA GLN A 149 -15.118 16.854 -23.882 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -12.764 14.958 -23.936 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -14.227 14.809 -22.982 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -14.162 14.684 -26.012 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -14.078 13.279 -24.968 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -16.178 15.514 -26.557 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -17.690 14.978 -25.817 1.00 0.00 H new ATOM 2319 N TYR A 150 -12.615 18.514 -23.222 1.00 0.00 N ATOM 2320 CA TYR A 150 -11.658 19.149 -22.299 1.00 0.00 C ATOM 2321 C TYR A 150 -12.260 19.478 -20.924 1.00 0.00 C ATOM 2322 O TYR A 150 -11.537 19.679 -19.945 1.00 0.00 O ATOM 2323 CB TYR A 150 -11.083 20.425 -22.938 1.00 0.00 C ATOM 2324 CG TYR A 150 -12.109 21.431 -23.443 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -12.910 22.162 -22.543 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -12.269 21.633 -24.828 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -13.887 23.055 -23.015 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -13.242 22.526 -25.310 1.00 0.00 C ATOM 2329 CZ TYR A 150 -14.064 23.237 -24.407 1.00 0.00 C ATOM 2330 OH TYR A 150 -15.009 24.097 -24.889 1.00 0.00 O ATOM 0 H TYR A 150 -12.742 19.027 -24.094 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.865 18.422 -22.124 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -10.446 20.920 -22.206 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -10.444 20.135 -23.772 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -12.772 22.035 -21.480 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.640 21.098 -25.524 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -14.502 23.602 -22.316 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -13.362 22.669 -26.374 1.00 0.00 H new ATOM 0 HH TYR A 150 -14.986 24.093 -25.869 1.00 0.00 H new ATOM 2340 N ASP A 151 -13.589 19.589 -20.855 1.00 0.00 N ATOM 2341 CA ASP A 151 -14.315 19.898 -19.620 1.00 0.00 C ATOM 2342 C ASP A 151 -14.651 18.630 -18.811 1.00 0.00 C ATOM 2343 O ASP A 151 -14.921 18.690 -17.611 1.00 0.00 O ATOM 2344 CB ASP A 151 -15.598 20.647 -19.993 1.00 0.00 C ATOM 2345 CG ASP A 151 -16.376 21.094 -18.742 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -15.846 21.924 -17.963 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -17.543 20.670 -18.568 1.00 0.00 O ATOM 0 H ASP A 151 -14.198 19.466 -21.664 1.00 0.00 H new ATOM 0 HA ASP A 151 -13.680 20.515 -18.984 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -15.349 21.519 -20.598 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -16.230 20.004 -20.605 1.00 0.00 H new ATOM 2352 N LEU A 152 -14.623 17.466 -19.469 1.00 0.00 N ATOM 2353 CA LEU A 152 -15.142 16.172 -18.992 1.00 0.00 C ATOM 2354 C LEU A 152 -14.040 15.191 -18.773 1.00 0.00 C ATOM 2355 O LEU A 152 -14.147 14.244 -18.008 1.00 0.00 O ATOM 2356 CB LEU A 152 -16.044 15.552 -20.063 1.00 0.00 C ATOM 2357 CG LEU A 152 -17.049 16.566 -20.591 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -17.895 15.887 -21.653 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -17.840 17.118 -19.409 1.00 0.00 C ATOM 0 H LEU A 152 -14.215 17.394 -20.401 1.00 0.00 H new ATOM 0 HA LEU A 152 -15.675 16.368 -18.062 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -15.433 15.179 -20.885 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -16.573 14.695 -19.645 1.00 0.00 H new ATOM 0 HG LEU A 152 -16.576 17.422 -21.072 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -18.624 16.596 -22.046 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -17.253 15.540 -22.463 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -18.417 15.037 -21.214 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -18.567 17.848 -19.766 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.361 16.303 -18.907 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -17.158 17.599 -18.708 1.00 0.00 H new ATOM 2371 N SER A 153 -12.968 15.439 -19.483 1.00 0.00 N ATOM 2372 CA SER A 153 -11.711 14.785 -19.225 1.00 0.00 C ATOM 2373 C SER A 153 -11.384 14.937 -17.733 1.00 0.00 C ATOM 2374 O SER A 153 -10.960 13.976 -17.096 1.00 0.00 O ATOM 2375 CB SER A 153 -10.620 15.349 -20.145 1.00 0.00 C ATOM 2376 OG SER A 153 -10.541 16.749 -20.103 1.00 0.00 O ATOM 0 H SER A 153 -12.943 16.102 -20.258 1.00 0.00 H new ATOM 0 HA SER A 153 -11.770 13.720 -19.449 1.00 0.00 H new ATOM 0 HB2 SER A 153 -9.657 14.927 -19.859 1.00 0.00 H new ATOM 0 HB3 SER A 153 -10.816 15.032 -21.169 1.00 0.00 H new ATOM 0 HG SER A 153 -9.607 17.027 -20.202 1.00 0.00 H new ATOM 2382 N ASP A 154 -11.733 16.081 -17.136 1.00 0.00 N ATOM 2383 CA ASP A 154 -11.566 16.324 -15.713 1.00 0.00 C ATOM 2384 C ASP A 154 -12.443 15.375 -14.910 1.00 0.00 C ATOM 2385 O ASP A 154 -11.970 14.709 -13.985 1.00 0.00 O ATOM 2386 CB ASP A 154 -11.893 17.779 -15.368 1.00 0.00 C ATOM 2387 CG ASP A 154 -11.753 18.016 -13.857 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -10.598 18.111 -13.379 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -12.789 18.120 -13.159 1.00 0.00 O ATOM 0 H ASP A 154 -12.143 16.868 -17.639 1.00 0.00 H new ATOM 0 HA ASP A 154 -10.524 16.140 -15.453 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -11.224 18.447 -15.911 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.908 18.016 -15.687 1.00 0.00 H new ATOM 2394 N GLU A 155 -13.708 15.250 -15.307 1.00 0.00 N ATOM 2395 CA GLU A 155 -14.676 14.436 -14.590 1.00 0.00 C ATOM 2396 C GLU A 155 -14.372 12.939 -14.727 1.00 0.00 C ATOM 2397 O GLU A 155 -14.647 12.159 -13.818 1.00 0.00 O ATOM 2398 CB GLU A 155 -16.108 14.816 -15.003 1.00 0.00 C ATOM 2399 CG GLU A 155 -16.747 14.031 -16.161 1.00 0.00 C ATOM 2400 CD GLU A 155 -18.285 14.094 -16.090 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -18.870 15.184 -16.306 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -18.925 13.051 -15.812 1.00 0.00 O ATOM 0 H GLU A 155 -14.086 15.711 -16.134 1.00 0.00 H new ATOM 0 HA GLU A 155 -14.592 14.648 -13.524 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -16.750 14.707 -14.129 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -16.111 15.872 -15.271 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -16.407 14.439 -17.113 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -16.420 12.992 -16.124 1.00 0.00 H new ATOM 2409 N ARG A 156 -13.765 12.543 -15.849 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.453 11.149 -16.153 1.00 0.00 C ATOM 2411 C ARG A 156 -12.216 10.722 -15.406 1.00 0.00 C ATOM 2412 O ARG A 156 -12.053 9.539 -15.126 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.223 10.968 -17.656 1.00 0.00 C ATOM 2414 CG ARG A 156 -14.525 10.859 -18.454 1.00 0.00 C ATOM 2415 CD ARG A 156 -14.158 10.572 -19.912 1.00 0.00 C ATOM 2416 NE ARG A 156 -15.320 10.055 -20.666 1.00 0.00 N ATOM 2417 CZ ARG A 156 -15.977 10.627 -21.688 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -15.648 11.844 -22.110 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -16.956 9.962 -22.288 1.00 0.00 N ATOM 0 H ARG A 156 -13.474 13.192 -16.580 1.00 0.00 H new ATOM 0 HA ARG A 156 -14.297 10.533 -15.844 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -12.642 11.810 -18.033 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.627 10.071 -17.821 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -15.152 10.062 -18.054 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -15.097 11.784 -18.379 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -13.792 11.484 -20.384 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.346 9.846 -19.949 1.00 0.00 H new ATOM 0 HE ARG A 156 -15.669 9.143 -20.371 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -14.889 12.353 -21.657 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.154 12.268 -22.887 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -17.204 9.024 -21.972 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -17.461 10.388 -23.065 1.00 0.00 H new ATOM 2433 N ILE A 157 -11.320 11.658 -15.109 1.00 0.00 N ATOM 2434 CA ILE A 157 -10.090 11.304 -14.430 1.00 0.00 C ATOM 2435 C ILE A 157 -10.465 10.821 -13.033 1.00 0.00 C ATOM 2436 O ILE A 157 -10.089 9.730 -12.630 1.00 0.00 O ATOM 2437 CB ILE A 157 -9.089 12.479 -14.424 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -8.393 12.697 -15.777 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -8.015 12.163 -13.375 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -7.815 14.113 -15.913 1.00 0.00 C ATOM 0 H ILE A 157 -11.424 12.649 -15.325 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.571 10.502 -14.955 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.646 13.390 -14.203 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.592 11.967 -15.893 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -9.105 12.519 -16.583 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -7.288 12.974 -13.343 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -8.483 12.056 -12.396 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -7.510 11.234 -13.640 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -7.334 14.218 -16.885 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -8.619 14.844 -15.825 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -7.082 14.284 -15.125 1.00 0.00 H new ATOM 2452 N GLN A 158 -11.204 11.637 -12.294 1.00 0.00 N ATOM 2453 CA GLN A 158 -11.587 11.353 -10.917 1.00 0.00 C ATOM 2454 C GLN A 158 -12.334 10.041 -10.788 1.00 0.00 C ATOM 2455 O GLN A 158 -12.009 9.235 -9.918 1.00 0.00 O ATOM 2456 CB GLN A 158 -12.371 12.511 -10.277 1.00 0.00 C ATOM 2457 CG GLN A 158 -13.432 13.175 -11.153 1.00 0.00 C ATOM 2458 CD GLN A 158 -13.661 14.629 -10.756 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -14.379 14.946 -9.813 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -13.018 15.529 -11.484 1.00 0.00 N ATOM 0 H GLN A 158 -11.560 12.528 -12.639 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.656 11.250 -10.359 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -12.856 12.138 -9.375 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -11.659 13.275 -9.964 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -13.124 13.127 -12.197 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -14.369 12.624 -11.071 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.429 15.230 -12.261 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -13.112 16.521 -11.267 1.00 0.00 H new ATOM 2469 N SER A 159 -13.281 9.796 -11.679 1.00 0.00 N ATOM 2470 CA SER A 159 -14.016 8.536 -11.652 1.00 0.00 C ATOM 2471 C SER A 159 -13.102 7.363 -12.005 1.00 0.00 C ATOM 2472 O SER A 159 -13.213 6.292 -11.407 1.00 0.00 O ATOM 2473 CB SER A 159 -15.237 8.596 -12.558 1.00 0.00 C ATOM 2474 OG SER A 159 -14.891 9.073 -13.845 1.00 0.00 O ATOM 0 H SER A 159 -13.558 10.440 -12.420 1.00 0.00 H new ATOM 0 HA SER A 159 -14.376 8.373 -10.636 1.00 0.00 H new ATOM 0 HB2 SER A 159 -15.682 7.604 -12.641 1.00 0.00 H new ATOM 0 HB3 SER A 159 -15.991 9.247 -12.116 1.00 0.00 H new ATOM 0 HG SER A 159 -14.896 10.053 -13.843 1.00 0.00 H new ATOM 2480 N TRP A 160 -12.143 7.558 -12.920 1.00 0.00 N ATOM 2481 CA TRP A 160 -11.208 6.502 -13.277 1.00 0.00 C ATOM 2482 C TRP A 160 -10.351 6.156 -12.076 1.00 0.00 C ATOM 2483 O TRP A 160 -10.182 4.996 -11.714 1.00 0.00 O ATOM 2484 CB TRP A 160 -10.324 6.980 -14.419 1.00 0.00 C ATOM 2485 CG TRP A 160 -9.458 5.908 -14.960 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -9.914 4.846 -15.655 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -8.005 5.815 -14.970 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -8.843 4.104 -16.093 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -7.644 4.649 -15.701 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.957 6.641 -14.520 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -6.317 4.307 -15.961 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -5.615 6.329 -14.808 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.296 5.164 -15.527 1.00 0.00 C ATOM 0 H TRP A 160 -12.001 8.436 -13.420 1.00 0.00 H new ATOM 0 HA TRP A 160 -11.759 5.615 -13.591 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -10.952 7.372 -15.219 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.701 7.803 -14.070 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -10.953 4.616 -15.838 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -8.928 3.250 -16.644 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.186 7.526 -13.946 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -6.080 3.395 -16.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.827 6.988 -14.475 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.265 4.929 -15.745 1.00 0.00 H new ATOM 2504 N CYS A 161 -9.872 7.194 -11.411 1.00 0.00 N ATOM 2505 CA CYS A 161 -9.091 7.079 -10.207 1.00 0.00 C ATOM 2506 C CYS A 161 -9.872 6.317 -9.147 1.00 0.00 C ATOM 2507 O CYS A 161 -9.278 5.525 -8.422 1.00 0.00 O ATOM 2508 CB CYS A 161 -8.731 8.480 -9.730 1.00 0.00 C ATOM 2509 SG CYS A 161 -7.575 9.205 -10.915 1.00 0.00 S ATOM 0 H CYS A 161 -10.023 8.159 -11.706 1.00 0.00 H new ATOM 0 HA CYS A 161 -8.175 6.521 -10.401 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -9.627 9.095 -9.649 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.282 8.439 -8.738 1.00 0.00 H new ATOM 0 HG CYS A 161 -8.227 9.611 -11.964 1.00 0.00 H new ATOM 2515 N GLU A 162 -11.192 6.503 -9.102 1.00 0.00 N ATOM 2516 CA GLU A 162 -12.038 5.902 -8.085 1.00 0.00 C ATOM 2517 C GLU A 162 -12.082 4.382 -8.262 1.00 0.00 C ATOM 2518 O GLU A 162 -12.086 3.651 -7.270 1.00 0.00 O ATOM 2519 CB GLU A 162 -13.410 6.604 -8.068 1.00 0.00 C ATOM 2520 CG GLU A 162 -14.647 5.699 -8.102 1.00 0.00 C ATOM 2521 CD GLU A 162 -15.939 6.532 -8.018 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -16.419 7.029 -9.065 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -16.487 6.689 -6.899 1.00 0.00 O ATOM 0 H GLU A 162 -11.700 7.077 -9.774 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.621 6.055 -7.089 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.465 7.222 -7.172 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.458 7.278 -8.923 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -14.647 5.111 -9.020 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -14.610 4.994 -7.272 1.00 0.00 H new ATOM 2530 N GLN A 163 -12.040 3.893 -9.506 1.00 0.00 N ATOM 2531 CA GLN A 163 -11.935 2.466 -9.754 1.00 0.00 C ATOM 2532 C GLN A 163 -10.505 1.977 -9.581 1.00 0.00 C ATOM 2533 O GLN A 163 -10.314 0.993 -8.874 1.00 0.00 O ATOM 2534 CB GLN A 163 -12.564 2.025 -11.078 1.00 0.00 C ATOM 2535 CG GLN A 163 -11.984 2.683 -12.331 1.00 0.00 C ATOM 2536 CD GLN A 163 -12.457 2.004 -13.616 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -13.413 1.227 -13.642 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -11.787 2.291 -14.717 1.00 0.00 N ATOM 0 H GLN A 163 -12.077 4.468 -10.348 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.537 1.975 -8.989 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.453 0.945 -11.171 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -13.633 2.234 -11.040 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -12.270 3.734 -12.352 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -10.895 2.650 -12.285 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -10.998 2.936 -14.680 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -12.059 1.868 -15.604 1.00 0.00 H new ATOM 2547 N ILE A 164 -9.482 2.644 -10.124 1.00 0.00 N ATOM 2548 CA ILE A 164 -8.156 2.044 -10.143 1.00 0.00 C ATOM 2549 C ILE A 164 -7.637 1.881 -8.719 1.00 0.00 C ATOM 2550 O ILE A 164 -7.062 0.844 -8.398 1.00 0.00 O ATOM 2551 CB ILE A 164 -7.168 2.782 -11.074 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -6.569 4.103 -10.544 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -7.726 2.889 -12.498 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.706 4.868 -11.569 1.00 0.00 C ATOM 0 H ILE A 164 -9.547 3.572 -10.543 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.243 1.050 -10.581 1.00 0.00 H new ATOM 0 HB ILE A 164 -6.287 2.141 -11.098 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.382 4.751 -10.216 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -5.961 3.886 -9.666 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -7.010 3.413 -13.131 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -7.900 1.890 -12.897 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -8.666 3.441 -12.480 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.326 5.782 -11.114 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.869 4.242 -11.880 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -6.312 5.121 -12.439 1.00 0.00 H new ATOM 2566 N LEU A 165 -7.897 2.850 -7.835 1.00 0.00 N ATOM 2567 CA LEU A 165 -7.449 2.795 -6.444 1.00 0.00 C ATOM 2568 C LEU A 165 -8.113 1.655 -5.673 1.00 0.00 C ATOM 2569 O LEU A 165 -7.644 1.298 -4.598 1.00 0.00 O ATOM 2570 CB LEU A 165 -7.631 4.172 -5.768 1.00 0.00 C ATOM 2571 CG LEU A 165 -9.072 4.611 -5.403 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -9.596 4.017 -4.087 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -9.108 6.138 -5.237 1.00 0.00 C ATOM 0 H LEU A 165 -8.424 3.693 -8.066 1.00 0.00 H new ATOM 0 HA LEU A 165 -6.383 2.568 -6.433 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.037 4.178 -4.854 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.207 4.928 -6.429 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.702 4.250 -6.216 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.610 4.374 -3.905 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.601 2.929 -4.155 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -8.950 4.326 -3.265 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.120 6.452 -4.980 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.423 6.434 -4.442 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.807 6.613 -6.171 1.00 0.00 H new ATOM 2585 N ASN A 166 -9.180 1.070 -6.222 1.00 0.00 N ATOM 2586 CA ASN A 166 -9.836 -0.111 -5.700 1.00 0.00 C ATOM 2587 C ASN A 166 -9.267 -1.315 -6.420 1.00 0.00 C ATOM 2588 O ASN A 166 -8.855 -2.259 -5.768 1.00 0.00 O ATOM 2589 CB ASN A 166 -11.362 -0.020 -5.860 1.00 0.00 C ATOM 2590 CG ASN A 166 -12.009 0.758 -4.719 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -12.156 0.242 -3.616 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -12.388 2.010 -4.934 1.00 0.00 N ATOM 0 H ASN A 166 -9.619 1.425 -7.071 1.00 0.00 H new ATOM 0 HA ASN A 166 -9.649 -0.201 -4.630 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -11.599 0.462 -6.808 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -11.783 -1.025 -5.899 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -12.806 2.553 -4.179 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -12.262 2.430 -5.855 1.00 0.00 H new ATOM 2599 N GLU A 167 -9.139 -1.270 -7.745 1.00 0.00 N ATOM 2600 CA GLU A 167 -8.727 -2.417 -8.544 1.00 0.00 C ATOM 2601 C GLU A 167 -7.333 -2.884 -8.119 1.00 0.00 C ATOM 2602 O GLU A 167 -7.066 -4.081 -8.084 1.00 0.00 O ATOM 2603 CB GLU A 167 -8.722 -2.062 -10.041 1.00 0.00 C ATOM 2604 CG GLU A 167 -10.100 -1.865 -10.682 1.00 0.00 C ATOM 2605 CD GLU A 167 -9.959 -1.413 -12.149 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -9.791 -0.196 -12.398 1.00 0.00 O ATOM 2607 OE2 GLU A 167 -9.969 -2.275 -13.059 1.00 0.00 O1- ATOM 0 H GLU A 167 -9.320 -0.430 -8.295 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.441 -3.223 -8.378 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.144 -1.148 -10.177 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.200 -2.852 -10.581 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.665 -2.796 -10.636 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.665 -1.122 -10.120 1.00 0.00 H new ATOM 2614 N MET A 168 -6.456 -1.941 -7.759 1.00 0.00 N ATOM 2615 CA MET A 168 -5.077 -2.208 -7.361 1.00 0.00 C ATOM 2616 C MET A 168 -5.026 -2.731 -5.932 1.00 0.00 C ATOM 2617 O MET A 168 -4.349 -3.714 -5.652 1.00 0.00 O ATOM 2618 CB MET A 168 -4.231 -0.931 -7.558 1.00 0.00 C ATOM 2619 CG MET A 168 -4.181 -0.678 -9.063 1.00 0.00 C ATOM 2620 SD MET A 168 -3.292 0.735 -9.762 1.00 0.00 S ATOM 2621 CE MET A 168 -4.182 2.091 -8.996 1.00 0.00 C ATOM 0 H MET A 168 -6.694 -0.949 -7.737 1.00 0.00 H new ATOM 0 HA MET A 168 -4.651 -2.988 -7.992 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.677 -0.085 -7.036 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.228 -1.063 -7.152 1.00 0.00 H new ATOM 0 HG2 MET A 168 -3.759 -1.573 -9.520 1.00 0.00 H new ATOM 0 HG3 MET A 168 -5.213 -0.602 -9.405 1.00 0.00 H new ATOM 0 HE1 MET A 168 -3.865 3.033 -9.443 1.00 0.00 H new ATOM 0 HE2 MET A 168 -5.253 1.958 -9.152 1.00 0.00 H new ATOM 0 HE3 MET A 168 -3.970 2.107 -7.927 1.00 0.00 H new ATOM 2631 N ALA A 169 -5.787 -2.099 -5.047 1.00 0.00 N ATOM 2632 CA ALA A 169 -5.806 -2.411 -3.626 1.00 0.00 C ATOM 2633 C ALA A 169 -6.429 -3.780 -3.374 1.00 0.00 C ATOM 2634 O ALA A 169 -5.921 -4.567 -2.581 1.00 0.00 O ATOM 2635 CB ALA A 169 -6.623 -1.333 -2.903 1.00 0.00 C ATOM 0 H ALA A 169 -6.420 -1.341 -5.303 1.00 0.00 H new ATOM 0 HA ALA A 169 -4.783 -2.433 -3.251 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -6.648 -1.551 -1.835 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -6.162 -0.358 -3.064 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -7.640 -1.323 -3.295 1.00 0.00 H new ATOM 2641 N GLU A 170 -7.521 -4.061 -4.080 1.00 0.00 N ATOM 2642 CA GLU A 170 -8.276 -5.296 -3.985 1.00 0.00 C ATOM 2643 C GLU A 170 -7.462 -6.451 -4.588 1.00 0.00 C ATOM 2644 O GLU A 170 -7.541 -7.578 -4.097 1.00 0.00 O ATOM 2645 CB GLU A 170 -9.629 -5.108 -4.691 1.00 0.00 C ATOM 2646 CG GLU A 170 -10.532 -4.074 -3.985 1.00 0.00 C ATOM 2647 CD GLU A 170 -11.194 -4.657 -2.723 1.00 0.00 C ATOM 2648 OE1 GLU A 170 -12.279 -5.279 -2.835 1.00 0.00 O ATOM 2649 OE2 GLU A 170 -10.647 -4.487 -1.606 1.00 0.00 O ATOM 0 H GLU A 170 -7.914 -3.408 -4.757 1.00 0.00 H new ATOM 0 HA GLU A 170 -8.470 -5.548 -2.942 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -9.456 -4.791 -5.719 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -10.147 -6.066 -4.735 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -9.940 -3.200 -3.714 1.00 0.00 H new ATOM 0 HG3 GLU A 170 -11.304 -3.734 -4.676 1.00 0.00 H new ATOM 2656 N HIS A 171 -6.622 -6.173 -5.598 1.00 0.00 N ATOM 2657 CA HIS A 171 -5.638 -7.123 -6.106 1.00 0.00 C ATOM 2658 C HIS A 171 -4.647 -7.508 -5.005 1.00 0.00 C ATOM 2659 O HIS A 171 -4.262 -8.672 -4.871 1.00 0.00 O ATOM 2660 CB HIS A 171 -4.864 -6.505 -7.283 1.00 0.00 C ATOM 2661 CG HIS A 171 -5.025 -7.308 -8.540 1.00 0.00 C ATOM 2662 ND1 HIS A 171 -4.459 -8.567 -8.754 1.00 0.00 N ATOM 2663 CD2 HIS A 171 -5.810 -6.977 -9.604 1.00 0.00 C ATOM 2664 CE1 HIS A 171 -4.933 -8.969 -9.944 1.00 0.00 C ATOM 2665 NE2 HIS A 171 -5.733 -8.032 -10.484 1.00 0.00 N ATOM 0 H HIS A 171 -6.612 -5.276 -6.083 1.00 0.00 H new ATOM 0 HA HIS A 171 -6.168 -8.014 -6.442 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -5.215 -5.487 -7.454 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -3.806 -6.438 -7.027 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -6.379 -6.068 -9.731 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -4.703 -9.918 -10.406 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -6.201 -8.093 -11.388 1.00 0.00 H new ATOM 2673 N TYR A 172 -4.227 -6.503 -4.235 1.00 0.00 N ATOM 2674 CA TYR A 172 -3.192 -6.583 -3.221 1.00 0.00 C ATOM 2675 C TYR A 172 -3.693 -7.069 -1.861 1.00 0.00 C ATOM 2676 O TYR A 172 -2.893 -7.206 -0.931 1.00 0.00 O ATOM 2677 CB TYR A 172 -2.474 -5.225 -3.158 1.00 0.00 C ATOM 2678 CG TYR A 172 -1.049 -5.301 -3.634 1.00 0.00 C ATOM 2679 CD1 TYR A 172 -0.813 -5.455 -5.008 1.00 0.00 C ATOM 2680 CD2 TYR A 172 0.018 -5.244 -2.723 1.00 0.00 C ATOM 2681 CE1 TYR A 172 0.505 -5.598 -5.482 1.00 0.00 C ATOM 2682 CE2 TYR A 172 1.340 -5.367 -3.190 1.00 0.00 C ATOM 2683 CZ TYR A 172 1.587 -5.567 -4.569 1.00 0.00 C ATOM 2684 OH TYR A 172 2.869 -5.737 -5.001 1.00 0.00 O ATOM 0 H TYR A 172 -4.624 -5.567 -4.311 1.00 0.00 H new ATOM 0 HA TYR A 172 -2.478 -7.355 -3.509 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -3.018 -4.502 -3.766 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -2.491 -4.856 -2.132 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -1.641 -5.464 -5.701 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -0.175 -5.106 -1.669 1.00 0.00 H new ATOM 0 HE1 TYR A 172 0.690 -5.731 -6.538 1.00 0.00 H new ATOM 0 HE2 TYR A 172 2.166 -5.309 -2.496 1.00 0.00 H new ATOM 0 HH TYR A 172 3.481 -5.685 -4.237 1.00 0.00 H new ATOM 2694 N ALA A 173 -4.993 -7.337 -1.739 1.00 0.00 N ATOM 2695 CA ALA A 173 -5.586 -7.818 -0.511 1.00 0.00 C ATOM 2696 C ALA A 173 -5.198 -9.278 -0.270 1.00 0.00 C ATOM 2697 O ALA A 173 -4.896 -9.630 0.893 1.00 0.00 O ATOM 2698 CB ALA A 173 -7.107 -7.635 -0.545 1.00 0.00 C ATOM 2699 OXT ALA A 173 -5.221 -10.083 -1.231 1.00 0.00 O1- ATOM 0 H ALA A 173 -5.661 -7.222 -2.501 1.00 0.00 H new ATOM 0 HA ALA A 173 -5.202 -7.231 0.323 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.539 -8.002 0.386 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -7.344 -6.578 -0.663 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.522 -8.195 -1.383 1.00 0.00 H new