USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1316 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 114 LYS NZ :NH3+ 156:sc= 1.15 (180deg=0) USER MOD Set 1.2: A 171 HIS : no HD1:sc= 0.813 K(o=2,f=-3.7) USER MOD Set 2.1: A 90 GLN : amide:sc= 1.27 K(o=1.5,f=0.64) USER MOD Set 2.2: A 124 TYR OH : rot -35:sc= 0.233 USER MOD Set 3.1: A 9 SER OG : rot -123:sc= 0.927 USER MOD Set 3.2: A 62 GLN :FLIP amide:sc= 0.171 F(o=0.42,f=1.1) USER MOD Set 4.1: A 33 HIS : no HD1:sc= -1.95! C(o=-2!,f=-5!) USER MOD Set 4.2: A 46 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 1 MET CE :methyl -175:sc=-0.00983 (180deg=-0.0525) USER MOD Set 5.2: A 3 MET CE :methyl -163:sc= -1.92 (180deg=-2.99) USER MOD Single : A 1 MET N :NH3+ -156:sc= 0.224 (180deg=0.0679) USER MOD Single : A 2 ASN : amide:sc= 0.283 K(o=0.28,f=-5.9!) USER MOD Single : A 7 TYR OH : rot 150:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00657 USER MOD Single : A 12 CYS SG : rot 109:sc= 0.233 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 170:sc= 0 USER MOD Single : A 16 MET CE :methyl 134:sc= -0.0848 (180deg=-1.12) USER MOD Single : A 20 LYS NZ :NH3+ -174:sc= 1.27 (180deg=1.24) USER MOD Single : A 31 THR OG1 : rot 76:sc= 0.00814 USER MOD Single : A 34 ASN : amide:sc= 0.163 K(o=0.16,f=-6.3!) 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+ -179:sc= 2.44 (180deg=2.44) USER MOD Single : A 43 MET CE :methyl -167:sc= -1.01 (180deg=-1.66) USER MOD Single : A 45 GLN : amide:sc= 0.377 X(o=0.38,f=0) USER MOD Single : A 55 THR OG1 : rot 100:sc= 0.0691 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -160:sc= 2.07 (180deg=1.49) 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 180:sc= -0.852 (180deg=-0.852) USER MOD Single : A 105 HIS : no HD1:sc= -1.37 K(o=-1.4,f=-1.9) 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= 0.0597 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 1.34 (180deg=1.34) USER MOD Single : A 118 TYR OH : rot 37:sc= 0.0678 USER MOD Single : A 121 THR OG1 : rot 159:sc= 1.24 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot -148:sc= 0.505 USER MOD Single : A 130 LYS NZ :NH3+ -176:sc= 1.22 (180deg=1.13) USER MOD Single : A 137 GLN : amide:sc= 0.932 K(o=0.93,f=0) USER MOD Single : A 147 THR OG1 : rot -170:sc= 0 USER MOD Single : A 148 ASN : amide:sc= 0.261 K(o=0.26,f=-2.9!) USER MOD Single : A 149 GLN : amide:sc= 0.926 K(o=0.93,f=-8.8!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot -148:sc= 1.23 USER MOD Single : A 158 GLN : amide:sc= -0.411 X(o=-0.41,f=-0.45) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 79:sc= -1.46 USER MOD Single : A 163 GLN : amide:sc= -0.0622 X(o=-0.062,f=0) USER MOD Single : A 166 ASN : amide:sc= 0.872 K(o=0.87,f=0) USER MOD Single : A 168 MET CE :methyl -163:sc= -0.535 (180deg=-1.79) USER MOD Single : A 172 TYR OH : rot 35:sc= 0.964 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.739 1.517 0.876 1.00 0.00 N ATOM 2 CA MET A 1 2.727 0.740 -0.405 1.00 0.00 C ATOM 3 C MET A 1 1.282 0.445 -0.866 1.00 0.00 C ATOM 4 O MET A 1 0.326 0.755 -0.153 1.00 0.00 O ATOM 5 CB MET A 1 3.633 -0.525 -0.337 1.00 0.00 C ATOM 6 CG MET A 1 2.999 -1.795 0.254 1.00 0.00 C ATOM 7 SD MET A 1 2.430 -1.668 1.973 1.00 0.00 S ATOM 8 CE MET A 1 1.505 -3.218 2.080 1.00 0.00 C ATOM 0 H1 MET A 1 3.634 2.041 0.956 1.00 0.00 H new ATOM 0 H2 MET A 1 1.943 2.187 0.883 1.00 0.00 H new ATOM 0 H3 MET A 1 2.648 0.863 1.680 1.00 0.00 H new ATOM 0 HA MET A 1 3.172 1.365 -1.179 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.976 -0.753 -1.346 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.517 -0.280 0.252 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.151 -2.079 -0.369 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.726 -2.604 0.191 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.003 -3.276 3.046 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.763 -3.255 1.282 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.191 -4.059 1.976 1.00 0.00 H new ATOM 20 N ASN A 2 1.107 -0.145 -2.057 1.00 0.00 N ATOM 21 CA ASN A 2 -0.197 -0.407 -2.688 1.00 0.00 C ATOM 22 C ASN A 2 -0.404 -1.898 -2.948 1.00 0.00 C ATOM 23 O ASN A 2 0.553 -2.670 -2.932 1.00 0.00 O ATOM 24 CB ASN A 2 -0.295 0.361 -4.019 1.00 0.00 C ATOM 25 CG ASN A 2 0.589 -0.213 -5.127 1.00 0.00 C ATOM 26 OD1 ASN A 2 1.678 -0.734 -4.904 1.00 0.00 O ATOM 27 ND2 ASN A 2 0.124 -0.153 -6.358 1.00 0.00 N ATOM 0 H ASN A 2 1.892 -0.463 -2.626 1.00 0.00 H new ATOM 0 HA ASN A 2 -0.974 -0.068 -2.002 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -1.332 0.357 -4.355 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -0.019 1.402 -3.849 1.00 0.00 H new ATOM 0 HD21 ASN A 2 0.669 -0.540 -7.128 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -0.781 0.280 -6.541 1.00 0.00 H new ATOM 34 N MET A 3 -1.643 -2.299 -3.245 1.00 0.00 N ATOM 35 CA MET A 3 -1.977 -3.674 -3.608 1.00 0.00 C ATOM 36 C MET A 3 -2.807 -3.702 -4.881 1.00 0.00 C ATOM 37 O MET A 3 -3.776 -2.952 -4.991 1.00 0.00 O ATOM 38 CB MET A 3 -2.741 -4.384 -2.476 1.00 0.00 C ATOM 39 CG MET A 3 -2.302 -4.011 -1.063 1.00 0.00 C ATOM 40 SD MET A 3 -3.109 -5.027 0.186 1.00 0.00 S ATOM 41 CE MET A 3 -2.622 -4.040 1.613 1.00 0.00 C ATOM 0 H MET A 3 -2.447 -1.672 -3.240 1.00 0.00 H new ATOM 0 HA MET A 3 -1.040 -4.205 -3.777 1.00 0.00 H new ATOM 0 HB2 MET A 3 -3.803 -4.161 -2.580 1.00 0.00 H new ATOM 0 HB3 MET A 3 -2.628 -5.461 -2.602 1.00 0.00 H new ATOM 0 HG2 MET A 3 -1.221 -4.123 -0.978 1.00 0.00 H new ATOM 0 HG3 MET A 3 -2.529 -2.961 -0.878 1.00 0.00 H new ATOM 0 HE1 MET A 3 -2.749 -4.628 2.522 1.00 0.00 H new ATOM 0 HE2 MET A 3 -1.577 -3.747 1.513 1.00 0.00 H new ATOM 0 HE3 MET A 3 -3.245 -3.148 1.668 1.00 0.00 H new ATOM 51 N GLY A 4 -2.458 -4.584 -5.816 1.00 0.00 N ATOM 52 CA GLY A 4 -3.293 -4.918 -6.964 1.00 0.00 C ATOM 53 C GLY A 4 -3.981 -6.237 -6.638 1.00 0.00 C ATOM 54 O GLY A 4 -3.371 -7.088 -5.996 1.00 0.00 O ATOM 0 H GLY A 4 -1.574 -5.093 -5.795 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.027 -4.134 -7.149 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.690 -5.009 -7.867 1.00 0.00 H new ATOM 58 N LEU A 5 -5.240 -6.423 -7.026 1.00 0.00 N ATOM 59 CA LEU A 5 -6.057 -7.576 -6.649 1.00 0.00 C ATOM 60 C LEU A 5 -6.610 -8.135 -7.948 1.00 0.00 C ATOM 61 O LEU A 5 -7.550 -7.552 -8.487 1.00 0.00 O ATOM 62 CB LEU A 5 -7.146 -7.060 -5.689 1.00 0.00 C ATOM 63 CG LEU A 5 -8.057 -8.112 -5.032 1.00 0.00 C ATOM 64 CD1 LEU A 5 -9.073 -7.333 -4.207 1.00 0.00 C ATOM 65 CD2 LEU A 5 -8.812 -9.028 -5.997 1.00 0.00 C ATOM 0 H LEU A 5 -5.733 -5.761 -7.625 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.518 -8.371 -6.133 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -6.657 -6.493 -4.896 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -7.777 -6.361 -6.238 1.00 0.00 H new ATOM 0 HG LEU A 5 -7.419 -8.781 -4.453 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -9.751 -8.029 -3.714 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.553 -6.739 -3.456 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -9.643 -6.673 -4.861 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -9.423 -9.730 -5.429 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.454 -8.427 -6.642 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.098 -9.580 -6.608 1.00 0.00 H new ATOM 77 N PHE A 6 -6.025 -9.215 -8.468 1.00 0.00 N ATOM 78 CA PHE A 6 -6.402 -9.738 -9.772 1.00 0.00 C ATOM 79 C PHE A 6 -7.292 -10.966 -9.649 1.00 0.00 C ATOM 80 O PHE A 6 -7.129 -11.794 -8.751 1.00 0.00 O ATOM 81 CB PHE A 6 -5.189 -9.908 -10.705 1.00 0.00 C ATOM 82 CG PHE A 6 -4.651 -11.310 -10.887 1.00 0.00 C ATOM 83 CD1 PHE A 6 -5.335 -12.209 -11.726 1.00 0.00 C ATOM 84 CD2 PHE A 6 -3.419 -11.685 -10.328 1.00 0.00 C ATOM 85 CE1 PHE A 6 -4.806 -13.478 -11.992 1.00 0.00 C ATOM 86 CE2 PHE A 6 -2.878 -12.951 -10.611 1.00 0.00 C ATOM 87 CZ PHE A 6 -3.579 -13.853 -11.431 1.00 0.00 C ATOM 0 H PHE A 6 -5.287 -9.742 -8.001 1.00 0.00 H new ATOM 0 HA PHE A 6 -7.021 -8.991 -10.269 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -5.460 -9.520 -11.687 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -4.381 -9.282 -10.327 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -6.276 -11.918 -12.169 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -2.888 -11.002 -9.682 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -5.343 -14.166 -12.628 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -1.921 -13.232 -10.197 1.00 0.00 H new ATOM 0 HZ PHE A 6 -3.172 -14.834 -11.628 1.00 0.00 H new ATOM 97 N TYR A 7 -8.233 -11.061 -10.585 1.00 0.00 N ATOM 98 CA TYR A 7 -9.160 -12.164 -10.787 1.00 0.00 C ATOM 99 C TYR A 7 -9.669 -12.047 -12.233 1.00 0.00 C ATOM 100 O TYR A 7 -9.301 -11.111 -12.945 1.00 0.00 O ATOM 101 CB TYR A 7 -10.316 -12.057 -9.777 1.00 0.00 C ATOM 102 CG TYR A 7 -11.153 -10.793 -9.898 1.00 0.00 C ATOM 103 CD1 TYR A 7 -10.719 -9.599 -9.296 1.00 0.00 C ATOM 104 CD2 TYR A 7 -12.362 -10.812 -10.619 1.00 0.00 C ATOM 105 CE1 TYR A 7 -11.487 -8.428 -9.399 1.00 0.00 C ATOM 106 CE2 TYR A 7 -13.148 -9.651 -10.705 1.00 0.00 C ATOM 107 CZ TYR A 7 -12.717 -8.452 -10.099 1.00 0.00 C ATOM 108 OH TYR A 7 -13.494 -7.337 -10.203 1.00 0.00 O ATOM 0 H TYR A 7 -8.375 -10.317 -11.268 1.00 0.00 H new ATOM 0 HA TYR A 7 -8.683 -13.132 -10.631 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -10.969 -12.921 -9.900 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -9.905 -12.109 -8.769 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -9.787 -9.582 -8.750 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -12.685 -11.720 -11.106 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -11.140 -7.511 -8.945 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -14.087 -9.676 -11.238 1.00 0.00 H new ATOM 0 HH TYR A 7 -13.997 -7.366 -11.044 1.00 0.00 H new ATOM 118 N GLY A 8 -10.539 -12.954 -12.679 1.00 0.00 N ATOM 119 CA GLY A 8 -11.139 -12.864 -14.011 1.00 0.00 C ATOM 120 C GLY A 8 -11.969 -14.100 -14.272 1.00 0.00 C ATOM 121 O GLY A 8 -11.496 -15.014 -14.937 1.00 0.00 O ATOM 0 H GLY A 8 -10.845 -13.761 -12.136 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -11.762 -11.972 -14.082 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -10.360 -12.769 -14.767 1.00 0.00 H new ATOM 125 N SER A 9 -13.145 -14.199 -13.653 1.00 0.00 N ATOM 126 CA SER A 9 -14.001 -15.378 -13.731 1.00 0.00 C ATOM 127 C SER A 9 -15.465 -14.952 -13.596 1.00 0.00 C ATOM 128 O SER A 9 -15.792 -14.196 -12.681 1.00 0.00 O ATOM 129 CB SER A 9 -13.601 -16.338 -12.605 1.00 0.00 C ATOM 130 OG SER A 9 -12.346 -16.924 -12.915 1.00 0.00 O ATOM 0 H SER A 9 -13.533 -13.452 -13.077 1.00 0.00 H new ATOM 0 HA SER A 9 -13.882 -15.882 -14.690 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.541 -15.802 -11.658 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.358 -17.113 -12.486 1.00 0.00 H new ATOM 0 HG SER A 9 -12.435 -17.900 -12.928 1.00 0.00 H new ATOM 136 N SER A 10 -16.331 -15.455 -14.480 1.00 0.00 N ATOM 137 CA SER A 10 -17.777 -15.233 -14.418 1.00 0.00 C ATOM 138 C SER A 10 -18.468 -16.365 -13.649 1.00 0.00 C ATOM 139 O SER A 10 -19.399 -16.113 -12.882 1.00 0.00 O ATOM 140 CB SER A 10 -18.338 -15.100 -15.841 1.00 0.00 C ATOM 141 OG SER A 10 -17.595 -14.148 -16.595 1.00 0.00 O ATOM 0 H SER A 10 -16.043 -16.035 -15.268 1.00 0.00 H new ATOM 0 HA SER A 10 -17.975 -14.307 -13.879 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.307 -16.069 -16.340 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.384 -14.798 -15.797 1.00 0.00 H new ATOM 0 HG SER A 10 -17.970 -14.082 -17.498 1.00 0.00 H new ATOM 147 N THR A 11 -17.998 -17.608 -13.805 1.00 0.00 N ATOM 148 CA THR A 11 -18.490 -18.751 -13.042 1.00 0.00 C ATOM 149 C THR A 11 -18.078 -18.533 -11.582 1.00 0.00 C ATOM 150 O THR A 11 -16.891 -18.322 -11.320 1.00 0.00 O ATOM 151 CB THR A 11 -17.913 -20.055 -13.637 1.00 0.00 C ATOM 152 OG1 THR A 11 -17.937 -19.994 -15.059 1.00 0.00 O ATOM 153 CG2 THR A 11 -18.709 -21.279 -13.175 1.00 0.00 C ATOM 0 H THR A 11 -17.261 -17.846 -14.469 1.00 0.00 H new ATOM 0 HA THR A 11 -19.575 -18.841 -13.092 1.00 0.00 H new ATOM 0 HB THR A 11 -16.886 -20.154 -13.285 1.00 0.00 H new ATOM 0 HG1 THR A 11 -17.568 -20.823 -15.428 1.00 0.00 H new ATOM 0 HG21 THR A 11 -18.277 -22.180 -13.611 1.00 0.00 H new ATOM 0 HG22 THR A 11 -18.671 -21.348 -12.088 1.00 0.00 H new ATOM 0 HG23 THR A 11 -19.746 -21.181 -13.497 1.00 0.00 H new ATOM 161 N CYS A 12 -19.048 -18.547 -10.655 1.00 0.00 N ATOM 162 CA CYS A 12 -18.861 -18.165 -9.251 1.00 0.00 C ATOM 163 C CYS A 12 -18.090 -16.836 -9.164 1.00 0.00 C ATOM 164 O CYS A 12 -17.002 -16.778 -8.586 1.00 0.00 O ATOM 165 CB CYS A 12 -18.203 -19.316 -8.471 1.00 0.00 C ATOM 166 SG CYS A 12 -19.148 -20.859 -8.651 1.00 0.00 S ATOM 0 H CYS A 12 -20.004 -18.831 -10.868 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.827 -17.990 -8.777 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -17.185 -19.466 -8.830 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -18.133 -19.050 -7.416 1.00 0.00 H new ATOM 0 HG CYS A 12 -18.481 -21.692 -9.393 1.00 0.00 H new ATOM 172 N TYR A 13 -18.642 -15.794 -9.806 1.00 0.00 N ATOM 173 CA TYR A 13 -17.979 -14.518 -10.063 1.00 0.00 C ATOM 174 C TYR A 13 -17.247 -13.958 -8.842 1.00 0.00 C ATOM 175 O TYR A 13 -17.810 -13.806 -7.756 1.00 0.00 O ATOM 176 CB TYR A 13 -18.948 -13.489 -10.680 1.00 0.00 C ATOM 177 CG TYR A 13 -20.309 -13.361 -10.012 1.00 0.00 C ATOM 178 CD1 TYR A 13 -20.504 -12.467 -8.942 1.00 0.00 C ATOM 179 CD2 TYR A 13 -21.396 -14.126 -10.487 1.00 0.00 C ATOM 180 CE1 TYR A 13 -21.769 -12.341 -8.339 1.00 0.00 C ATOM 181 CE2 TYR A 13 -22.661 -14.010 -9.887 1.00 0.00 C ATOM 182 CZ TYR A 13 -22.858 -13.116 -8.810 1.00 0.00 C ATOM 183 OH TYR A 13 -24.094 -13.012 -8.238 1.00 0.00 O ATOM 0 H TYR A 13 -19.594 -15.824 -10.170 1.00 0.00 H new ATOM 0 HA TYR A 13 -17.203 -14.723 -10.801 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -18.465 -12.512 -10.664 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -19.104 -13.750 -11.727 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -19.677 -11.874 -8.581 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -21.255 -14.804 -11.316 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -21.910 -11.654 -7.518 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -23.486 -14.606 -10.250 1.00 0.00 H new ATOM 0 HH TYR A 13 -24.717 -13.618 -8.692 1.00 0.00 H new ATOM 193 N THR A 14 -15.973 -13.616 -9.052 1.00 0.00 N ATOM 194 CA THR A 14 -15.030 -13.264 -7.990 1.00 0.00 C ATOM 195 C THR A 14 -15.199 -11.808 -7.521 1.00 0.00 C ATOM 196 O THR A 14 -14.597 -11.406 -6.528 1.00 0.00 O ATOM 197 CB THR A 14 -13.618 -13.588 -8.512 1.00 0.00 C ATOM 198 OG1 THR A 14 -13.642 -14.798 -9.247 1.00 0.00 O ATOM 199 CG2 THR A 14 -12.547 -13.726 -7.437 1.00 0.00 C ATOM 0 H THR A 14 -15.561 -13.576 -9.984 1.00 0.00 H new ATOM 0 HA THR A 14 -15.222 -13.850 -7.091 1.00 0.00 H new ATOM 0 HB THR A 14 -13.348 -12.729 -9.126 1.00 0.00 H new ATOM 0 HG1 THR A 14 -12.786 -14.917 -9.710 1.00 0.00 H new ATOM 0 HG21 THR A 14 -11.589 -13.954 -7.905 1.00 0.00 H new ATOM 0 HG22 THR A 14 -12.466 -12.791 -6.882 1.00 0.00 H new ATOM 0 HG23 THR A 14 -12.818 -14.531 -6.754 1.00 0.00 H new ATOM 207 N GLU A 15 -16.046 -11.017 -8.189 1.00 0.00 N ATOM 208 CA GLU A 15 -16.224 -9.587 -7.929 1.00 0.00 C ATOM 209 C GLU A 15 -16.595 -9.323 -6.466 1.00 0.00 C ATOM 210 O GLU A 15 -16.117 -8.352 -5.888 1.00 0.00 O ATOM 211 CB GLU A 15 -17.320 -9.024 -8.851 1.00 0.00 C ATOM 212 CG GLU A 15 -16.923 -9.022 -10.334 1.00 0.00 C ATOM 213 CD GLU A 15 -18.053 -8.450 -11.211 1.00 0.00 C ATOM 214 OE1 GLU A 15 -18.108 -7.211 -11.411 1.00 0.00 O ATOM 215 OE2 GLU A 15 -18.890 -9.239 -11.710 1.00 0.00 O ATOM 0 H GLU A 15 -16.640 -11.363 -8.943 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.276 -9.088 -8.132 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.229 -9.613 -8.726 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -17.556 -8.005 -8.544 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -16.018 -8.430 -10.470 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.690 -10.038 -10.653 1.00 0.00 H new ATOM 222 N MET A 16 -17.397 -10.198 -5.840 1.00 0.00 N ATOM 223 CA MET A 16 -17.839 -9.997 -4.454 1.00 0.00 C ATOM 224 C MET A 16 -16.656 -10.125 -3.496 1.00 0.00 C ATOM 225 O MET A 16 -16.484 -9.292 -2.611 1.00 0.00 O ATOM 226 CB MET A 16 -18.958 -10.987 -4.079 1.00 0.00 C ATOM 227 CG MET A 16 -20.211 -10.923 -4.967 1.00 0.00 C ATOM 228 SD MET A 16 -21.088 -9.330 -5.030 1.00 0.00 S ATOM 229 CE MET A 16 -20.225 -8.511 -6.402 1.00 0.00 C ATOM 0 H MET A 16 -17.752 -11.051 -6.273 1.00 0.00 H new ATOM 0 HA MET A 16 -18.246 -8.990 -4.369 1.00 0.00 H new ATOM 0 HB2 MET A 16 -18.555 -11.999 -4.119 1.00 0.00 H new ATOM 0 HB3 MET A 16 -19.254 -10.802 -3.046 1.00 0.00 H new ATOM 0 HG2 MET A 16 -19.922 -11.193 -5.983 1.00 0.00 H new ATOM 0 HG3 MET A 16 -20.912 -11.684 -4.622 1.00 0.00 H new ATOM 0 HE1 MET A 16 -20.955 -8.060 -7.074 1.00 0.00 H new ATOM 0 HE2 MET A 16 -19.567 -7.736 -6.008 1.00 0.00 H new ATOM 0 HE3 MET A 16 -19.633 -9.245 -6.949 1.00 0.00 H new ATOM 239 N ALA A 17 -15.801 -11.129 -3.714 1.00 0.00 N ATOM 240 CA ALA A 17 -14.589 -11.310 -2.916 1.00 0.00 C ATOM 241 C ALA A 17 -13.662 -10.116 -3.140 1.00 0.00 C ATOM 242 O ALA A 17 -13.158 -9.542 -2.178 1.00 0.00 O ATOM 243 CB ALA A 17 -13.899 -12.630 -3.286 1.00 0.00 C ATOM 0 H ALA A 17 -15.929 -11.832 -4.442 1.00 0.00 H new ATOM 0 HA ALA A 17 -14.847 -11.361 -1.858 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.998 -12.751 -2.684 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -14.578 -13.461 -3.095 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -13.630 -12.616 -4.342 1.00 0.00 H new ATOM 249 N ALA A 18 -13.480 -9.706 -4.398 1.00 0.00 N ATOM 250 CA ALA A 18 -12.548 -8.648 -4.758 1.00 0.00 C ATOM 251 C ALA A 18 -12.958 -7.309 -4.150 1.00 0.00 C ATOM 252 O ALA A 18 -12.135 -6.646 -3.518 1.00 0.00 O ATOM 253 CB ALA A 18 -12.442 -8.578 -6.282 1.00 0.00 C ATOM 0 H ALA A 18 -13.979 -10.103 -5.194 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.565 -8.877 -4.347 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.746 -7.788 -6.562 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.082 -9.532 -6.666 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.423 -8.364 -6.706 1.00 0.00 H new ATOM 259 N GLU A 19 -14.232 -6.933 -4.271 1.00 0.00 N ATOM 260 CA GLU A 19 -14.742 -5.710 -3.667 1.00 0.00 C ATOM 261 C GLU A 19 -14.579 -5.770 -2.160 1.00 0.00 C ATOM 262 O GLU A 19 -14.152 -4.781 -1.569 1.00 0.00 O ATOM 263 CB GLU A 19 -16.225 -5.485 -4.009 1.00 0.00 C ATOM 264 CG GLU A 19 -16.395 -4.827 -5.379 1.00 0.00 C ATOM 265 CD GLU A 19 -17.687 -3.992 -5.436 1.00 0.00 C ATOM 266 OE1 GLU A 19 -17.665 -2.841 -4.928 1.00 0.00 O ATOM 267 OE2 GLU A 19 -18.710 -4.467 -5.986 1.00 0.00 O ATOM 0 H GLU A 19 -14.932 -7.466 -4.787 1.00 0.00 H new ATOM 0 HA GLU A 19 -14.167 -4.877 -4.072 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -16.751 -6.440 -3.996 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -16.684 -4.858 -3.244 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -15.536 -4.189 -5.589 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -16.419 -5.593 -6.154 1.00 0.00 H new ATOM 274 N LYS A 20 -14.882 -6.909 -1.534 1.00 0.00 N ATOM 275 CA LYS A 20 -14.866 -6.983 -0.080 1.00 0.00 C ATOM 276 C LYS A 20 -13.438 -6.931 0.448 1.00 0.00 C ATOM 277 O LYS A 20 -13.203 -6.200 1.397 1.00 0.00 O ATOM 278 CB LYS A 20 -15.652 -8.211 0.410 1.00 0.00 C ATOM 279 CG LYS A 20 -17.166 -7.991 0.217 1.00 0.00 C ATOM 280 CD LYS A 20 -18.011 -9.246 0.495 1.00 0.00 C ATOM 281 CE LYS A 20 -18.036 -9.687 1.971 1.00 0.00 C ATOM 282 NZ LYS A 20 -18.778 -8.745 2.858 1.00 0.00 N ATOM 0 H LYS A 20 -15.137 -7.777 -2.005 1.00 0.00 H new ATOM 0 HA LYS A 20 -15.375 -6.110 0.328 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.334 -9.097 -0.139 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -15.436 -8.393 1.463 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -17.495 -7.188 0.877 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -17.349 -7.659 -0.805 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -19.034 -9.059 0.168 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.628 -10.068 -0.110 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -18.492 -10.675 2.040 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -17.012 -9.783 2.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -18.671 -9.044 3.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -18.395 -7.785 2.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -19.786 -8.748 2.602 1.00 0.00 H new ATOM 296 N ILE A 21 -12.468 -7.601 -0.181 1.00 0.00 N ATOM 297 CA ILE A 21 -11.053 -7.485 0.174 1.00 0.00 C ATOM 298 C ILE A 21 -10.658 -6.005 0.153 1.00 0.00 C ATOM 299 O ILE A 21 -10.131 -5.480 1.133 1.00 0.00 O ATOM 300 CB ILE A 21 -10.211 -8.304 -0.837 1.00 0.00 C ATOM 301 CG1 ILE A 21 -10.337 -9.835 -0.709 1.00 0.00 C ATOM 302 CG2 ILE A 21 -8.724 -7.924 -0.729 1.00 0.00 C ATOM 303 CD1 ILE A 21 -9.940 -10.571 -1.998 1.00 0.00 C ATOM 0 H ILE A 21 -12.645 -8.242 -0.955 1.00 0.00 H new ATOM 0 HA ILE A 21 -10.871 -7.879 1.174 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.624 -8.041 -1.811 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.707 -10.180 0.111 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -11.365 -10.091 -0.451 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.146 -8.508 -1.445 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.603 -6.862 -0.945 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -8.368 -8.132 0.280 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.048 -11.646 -1.851 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -10.587 -10.250 -2.814 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.903 -10.341 -2.244 1.00 0.00 H new ATOM 315 N ARG A 22 -10.914 -5.333 -0.974 1.00 0.00 N ATOM 316 CA ARG A 22 -10.537 -3.938 -1.181 1.00 0.00 C ATOM 317 C ARG A 22 -11.222 -3.062 -0.139 1.00 0.00 C ATOM 318 O ARG A 22 -10.582 -2.172 0.404 1.00 0.00 O ATOM 319 CB ARG A 22 -10.874 -3.587 -2.653 1.00 0.00 C ATOM 320 CG ARG A 22 -10.801 -2.094 -3.034 1.00 0.00 C ATOM 321 CD ARG A 22 -11.991 -1.587 -3.866 1.00 0.00 C ATOM 322 NE ARG A 22 -13.302 -1.818 -3.214 1.00 0.00 N ATOM 323 CZ ARG A 22 -14.501 -1.755 -3.823 1.00 0.00 C ATOM 324 NH1 ARG A 22 -14.616 -1.304 -5.067 1.00 0.00 N ATOM 325 NH2 ARG A 22 -15.588 -2.182 -3.196 1.00 0.00 N ATOM 0 H ARG A 22 -11.393 -5.749 -1.773 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.471 -3.760 -1.038 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.193 -4.139 -3.301 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.880 -3.946 -2.869 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -10.735 -1.502 -2.121 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.882 -1.920 -3.594 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -11.868 -0.520 -4.051 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.984 -2.082 -4.837 1.00 0.00 H new ATOM 0 HE ARG A 22 -13.295 -2.044 -2.219 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.787 -0.998 -5.577 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -15.533 -1.264 -5.512 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -15.517 -2.559 -2.251 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.496 -2.134 -3.659 1.00 0.00 H new ATOM 339 N ASP A 23 -12.486 -3.323 0.166 1.00 0.00 N ATOM 340 CA ASP A 23 -13.248 -2.537 1.130 1.00 0.00 C ATOM 341 C ASP A 23 -12.690 -2.708 2.541 1.00 0.00 C ATOM 342 O ASP A 23 -12.547 -1.731 3.280 1.00 0.00 O ATOM 343 CB ASP A 23 -14.722 -2.941 1.103 1.00 0.00 C ATOM 344 CG ASP A 23 -15.514 -2.147 2.157 1.00 0.00 C ATOM 345 OD1 ASP A 23 -15.801 -0.951 1.915 1.00 0.00 O ATOM 346 OD2 ASP A 23 -15.873 -2.723 3.211 1.00 0.00 O ATOM 0 H ASP A 23 -13.015 -4.089 -0.250 1.00 0.00 H new ATOM 0 HA ASP A 23 -13.160 -1.488 0.848 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -15.138 -2.758 0.112 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.817 -4.010 1.296 1.00 0.00 H new ATOM 351 N ILE A 24 -12.324 -3.942 2.893 1.00 0.00 N ATOM 352 CA ILE A 24 -11.861 -4.311 4.214 1.00 0.00 C ATOM 353 C ILE A 24 -10.497 -3.681 4.475 1.00 0.00 C ATOM 354 O ILE A 24 -10.315 -2.974 5.468 1.00 0.00 O ATOM 355 CB ILE A 24 -11.868 -5.853 4.356 1.00 0.00 C ATOM 356 CG1 ILE A 24 -13.305 -6.388 4.530 1.00 0.00 C ATOM 357 CG2 ILE A 24 -11.001 -6.289 5.551 1.00 0.00 C ATOM 358 CD1 ILE A 24 -13.444 -7.889 4.214 1.00 0.00 C ATOM 0 H ILE A 24 -12.345 -4.727 2.242 1.00 0.00 H new ATOM 0 HA ILE A 24 -12.533 -3.925 4.980 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.451 -6.273 3.441 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -13.629 -6.209 5.555 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.975 -5.825 3.881 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.018 -7.376 5.635 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.975 -5.953 5.398 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -11.395 -5.848 6.467 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -14.480 -8.197 4.357 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.151 -8.072 3.180 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -12.800 -8.462 4.881 1.00 0.00 H new ATOM 370 N ILE A 25 -9.536 -3.959 3.595 1.00 0.00 N ATOM 371 CA ILE A 25 -8.168 -3.501 3.773 1.00 0.00 C ATOM 372 C ILE A 25 -8.139 -1.972 3.628 1.00 0.00 C ATOM 373 O ILE A 25 -7.506 -1.283 4.430 1.00 0.00 O ATOM 374 CB ILE A 25 -7.270 -4.214 2.744 1.00 0.00 C ATOM 375 CG1 ILE A 25 -7.247 -5.739 2.994 1.00 0.00 C ATOM 376 CG2 ILE A 25 -5.848 -3.634 2.745 1.00 0.00 C ATOM 377 CD1 ILE A 25 -6.432 -6.515 1.960 1.00 0.00 C ATOM 0 H ILE A 25 -9.687 -4.504 2.746 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.788 -3.745 4.765 1.00 0.00 H new ATOM 0 HB ILE A 25 -7.696 -4.040 1.756 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.837 -5.930 3.986 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.270 -6.114 2.994 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.240 -4.159 2.008 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -5.887 -2.574 2.494 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.406 -3.757 3.734 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.460 -7.578 2.198 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -6.855 -6.354 0.968 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -5.399 -6.167 1.975 1.00 0.00 H new ATOM 389 N GLY A 26 -8.841 -1.465 2.614 1.00 0.00 N ATOM 390 CA GLY A 26 -9.064 -0.045 2.378 1.00 0.00 C ATOM 391 C GLY A 26 -8.939 0.303 0.893 1.00 0.00 C ATOM 392 O GLY A 26 -7.890 0.052 0.294 1.00 0.00 O ATOM 0 H GLY A 26 -9.284 -2.056 1.911 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.055 0.233 2.736 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.343 0.538 2.951 1.00 0.00 H new ATOM 396 N PRO A 27 -9.955 0.937 0.282 1.00 0.00 N ATOM 397 CA PRO A 27 -9.977 1.234 -1.151 1.00 0.00 C ATOM 398 C PRO A 27 -9.005 2.347 -1.575 1.00 0.00 C ATOM 399 O PRO A 27 -8.845 2.577 -2.774 1.00 0.00 O ATOM 400 CB PRO A 27 -11.442 1.580 -1.460 1.00 0.00 C ATOM 401 CG PRO A 27 -11.956 2.155 -0.143 1.00 0.00 C ATOM 402 CD PRO A 27 -11.228 1.305 0.891 1.00 0.00 C ATOM 0 HA PRO A 27 -9.626 0.378 -1.727 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -11.521 2.303 -2.272 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -12.008 0.699 -1.761 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.716 3.213 -0.041 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -13.039 2.064 -0.055 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -11.072 1.862 1.815 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -11.809 0.419 1.147 1.00 0.00 H new ATOM 410 N GLU A 28 -8.334 3.025 -0.632 1.00 0.00 N ATOM 411 CA GLU A 28 -7.332 4.034 -0.959 1.00 0.00 C ATOM 412 C GLU A 28 -5.985 3.385 -1.321 1.00 0.00 C ATOM 413 O GLU A 28 -5.146 4.029 -1.952 1.00 0.00 O ATOM 414 CB GLU A 28 -7.225 5.088 0.157 1.00 0.00 C ATOM 415 CG GLU A 28 -6.667 4.564 1.488 1.00 0.00 C ATOM 416 CD GLU A 28 -6.568 5.692 2.531 1.00 0.00 C ATOM 417 OE1 GLU A 28 -5.518 6.379 2.597 1.00 0.00 O1- ATOM 418 OE2 GLU A 28 -7.532 5.895 3.310 1.00 0.00 O ATOM 0 H GLU A 28 -8.473 2.887 0.369 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.655 4.570 -1.852 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.590 5.902 -0.192 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.214 5.510 0.335 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.309 3.769 1.867 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -5.682 4.127 1.326 1.00 0.00 H new ATOM 425 N LEU A 29 -5.782 2.114 -0.934 1.00 0.00 N ATOM 426 CA LEU A 29 -4.522 1.397 -1.081 1.00 0.00 C ATOM 427 C LEU A 29 -4.658 0.030 -1.765 1.00 0.00 C ATOM 428 O LEU A 29 -3.636 -0.557 -2.119 1.00 0.00 O ATOM 429 CB LEU A 29 -3.831 1.301 0.289 1.00 0.00 C ATOM 430 CG LEU A 29 -4.532 0.411 1.341 1.00 0.00 C ATOM 431 CD1 LEU A 29 -3.480 -0.309 2.194 1.00 0.00 C ATOM 432 CD2 LEU A 29 -5.434 1.213 2.286 1.00 0.00 C ATOM 0 H LEU A 29 -6.513 1.551 -0.500 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.894 1.972 -1.762 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.820 0.923 0.138 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -3.737 2.307 0.698 1.00 0.00 H new ATOM 0 HG LEU A 29 -5.151 -0.296 0.788 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -3.978 -0.935 2.934 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.856 -0.932 1.553 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.857 0.427 2.702 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -5.901 0.538 3.004 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.836 1.953 2.819 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.207 1.719 1.708 1.00 0.00 H new ATOM 444 N VAL A 30 -5.875 -0.479 -1.976 1.00 0.00 N ATOM 445 CA VAL A 30 -6.127 -1.671 -2.788 1.00 0.00 C ATOM 446 C VAL A 30 -6.765 -1.228 -4.111 1.00 0.00 C ATOM 447 O VAL A 30 -7.489 -0.232 -4.155 1.00 0.00 O ATOM 448 CB VAL A 30 -6.967 -2.701 -2.006 1.00 0.00 C ATOM 449 CG1 VAL A 30 -7.129 -4.032 -2.769 1.00 0.00 C ATOM 450 CG2 VAL A 30 -6.325 -3.019 -0.650 1.00 0.00 C ATOM 0 H VAL A 30 -6.722 -0.070 -1.583 1.00 0.00 H new ATOM 0 HA VAL A 30 -5.195 -2.185 -3.024 1.00 0.00 H new ATOM 0 HB VAL A 30 -7.947 -2.242 -1.872 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -7.728 -4.722 -2.174 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -7.626 -3.847 -3.721 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.147 -4.469 -2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.938 -3.748 -0.119 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -5.327 -3.429 -0.807 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.253 -2.106 -0.059 1.00 0.00 H new ATOM 460 N THR A 31 -6.518 -1.989 -5.178 1.00 0.00 N ATOM 461 CA THR A 31 -6.902 -1.669 -6.545 1.00 0.00 C ATOM 462 C THR A 31 -7.439 -2.958 -7.160 1.00 0.00 C ATOM 463 O THR A 31 -6.801 -4.002 -7.028 1.00 0.00 O ATOM 464 CB THR A 31 -5.669 -1.144 -7.318 1.00 0.00 C ATOM 465 OG1 THR A 31 -4.850 -0.301 -6.517 1.00 0.00 O ATOM 466 CG2 THR A 31 -6.078 -0.366 -8.574 1.00 0.00 C ATOM 0 H THR A 31 -6.025 -2.879 -5.106 1.00 0.00 H new ATOM 0 HA THR A 31 -7.663 -0.890 -6.584 1.00 0.00 H new ATOM 0 HB THR A 31 -5.101 -2.030 -7.602 1.00 0.00 H new ATOM 0 HG1 THR A 31 -4.330 -0.848 -5.892 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.185 -0.013 -9.090 1.00 0.00 H new ATOM 0 HG22 THR A 31 -6.647 -1.018 -9.237 1.00 0.00 H new ATOM 0 HG23 THR A 31 -6.693 0.487 -8.289 1.00 0.00 H new ATOM 474 N LEU A 32 -8.608 -2.920 -7.800 1.00 0.00 N ATOM 475 CA LEU A 32 -9.158 -4.094 -8.472 1.00 0.00 C ATOM 476 C LEU A 32 -8.472 -4.231 -9.833 1.00 0.00 C ATOM 477 O LEU A 32 -8.184 -3.226 -10.484 1.00 0.00 O ATOM 478 CB LEU A 32 -10.692 -4.000 -8.623 1.00 0.00 C ATOM 479 CG LEU A 32 -11.485 -3.721 -7.331 1.00 0.00 C ATOM 480 CD1 LEU A 32 -12.983 -3.928 -7.577 1.00 0.00 C ATOM 481 CD2 LEU A 32 -11.052 -4.596 -6.150 1.00 0.00 C ATOM 0 H LEU A 32 -9.192 -2.086 -7.866 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.965 -4.981 -7.869 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.918 -3.212 -9.341 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.052 -4.935 -9.052 1.00 0.00 H new ATOM 0 HG LEU A 32 -11.274 -2.685 -7.065 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -13.534 -3.728 -6.658 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -13.321 -3.247 -8.358 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -13.161 -4.957 -7.891 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -11.651 -4.347 -5.274 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.198 -5.646 -6.403 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.999 -4.418 -5.932 1.00 0.00 H new ATOM 493 N HIS A 33 -8.221 -5.469 -10.267 1.00 0.00 N ATOM 494 CA HIS A 33 -7.475 -5.783 -11.483 1.00 0.00 C ATOM 495 C HIS A 33 -8.209 -6.910 -12.217 1.00 0.00 C ATOM 496 O HIS A 33 -7.745 -8.048 -12.285 1.00 0.00 O ATOM 497 CB HIS A 33 -6.019 -6.106 -11.104 1.00 0.00 C ATOM 498 CG HIS A 33 -5.105 -6.165 -12.295 1.00 0.00 C ATOM 499 ND1 HIS A 33 -4.575 -7.323 -12.871 1.00 0.00 N ATOM 500 CD2 HIS A 33 -4.700 -5.078 -13.005 1.00 0.00 C ATOM 501 CE1 HIS A 33 -3.886 -6.906 -13.941 1.00 0.00 C ATOM 502 NE2 HIS A 33 -3.950 -5.567 -14.048 1.00 0.00 N ATOM 0 H HIS A 33 -8.540 -6.300 -9.768 1.00 0.00 H new ATOM 0 HA HIS A 33 -7.425 -4.941 -12.174 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -5.653 -5.350 -10.409 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -5.988 -7.062 -10.581 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -4.922 -4.043 -12.793 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -3.354 -7.554 -14.622 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -3.514 -5.007 -14.781 1.00 0.00 H new ATOM 510 N ASN A 34 -9.429 -6.627 -12.685 1.00 0.00 N ATOM 511 CA ASN A 34 -10.236 -7.634 -13.371 1.00 0.00 C ATOM 512 C ASN A 34 -9.630 -7.881 -14.754 1.00 0.00 C ATOM 513 O ASN A 34 -9.579 -6.973 -15.586 1.00 0.00 O ATOM 514 CB ASN A 34 -11.705 -7.194 -13.477 1.00 0.00 C ATOM 515 CG ASN A 34 -12.607 -8.279 -14.069 1.00 0.00 C ATOM 516 OD1 ASN A 34 -12.151 -9.288 -14.599 1.00 0.00 O ATOM 517 ND2 ASN A 34 -13.915 -8.089 -14.012 1.00 0.00 N ATOM 0 H ASN A 34 -9.875 -5.714 -12.601 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.228 -8.561 -12.798 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -12.071 -6.924 -12.486 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -11.768 -6.298 -14.095 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -14.549 -8.782 -14.409 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -14.290 -7.249 -13.571 1.00 0.00 H new ATOM 524 N LEU A 35 -9.205 -9.115 -15.017 1.00 0.00 N ATOM 525 CA LEU A 35 -8.544 -9.498 -16.261 1.00 0.00 C ATOM 526 C LEU A 35 -9.464 -9.400 -17.479 1.00 0.00 C ATOM 527 O LEU A 35 -8.969 -9.330 -18.606 1.00 0.00 O ATOM 528 CB LEU A 35 -7.994 -10.918 -16.126 1.00 0.00 C ATOM 529 CG LEU A 35 -6.789 -11.015 -15.179 1.00 0.00 C ATOM 530 CD1 LEU A 35 -6.508 -12.501 -14.947 1.00 0.00 C ATOM 531 CD2 LEU A 35 -5.563 -10.288 -15.751 1.00 0.00 C ATOM 0 H LEU A 35 -9.312 -9.889 -14.361 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.731 -8.792 -16.430 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -8.786 -11.574 -15.764 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -7.703 -11.283 -17.111 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.012 -10.523 -14.232 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.655 -12.610 -14.277 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.384 -12.971 -14.500 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.284 -12.982 -15.899 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -4.729 -10.377 -15.055 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -5.288 -10.735 -16.706 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.801 -9.235 -15.899 1.00 0.00 H new ATOM 543 N LYS A 36 -10.788 -9.361 -17.278 1.00 0.00 N ATOM 544 CA LYS A 36 -11.739 -9.028 -18.336 1.00 0.00 C ATOM 545 C LYS A 36 -11.406 -7.669 -18.974 1.00 0.00 C ATOM 546 O LYS A 36 -11.752 -7.457 -20.138 1.00 0.00 O ATOM 547 CB LYS A 36 -13.166 -9.042 -17.745 1.00 0.00 C ATOM 548 CG LYS A 36 -14.312 -8.740 -18.730 1.00 0.00 C ATOM 549 CD LYS A 36 -14.397 -9.734 -19.901 1.00 0.00 C ATOM 550 CE LYS A 36 -15.596 -9.467 -20.823 1.00 0.00 C ATOM 551 NZ LYS A 36 -15.453 -8.223 -21.628 1.00 0.00 N ATOM 0 H LYS A 36 -11.225 -9.560 -16.378 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.674 -9.771 -19.131 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.344 -10.022 -17.302 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -13.209 -8.314 -16.935 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -15.258 -8.749 -18.188 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -14.182 -7.733 -19.128 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.477 -9.681 -20.484 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -14.466 -10.748 -19.507 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -15.724 -10.315 -21.496 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -16.501 -9.399 -20.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -16.293 -8.100 -22.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -15.360 -7.406 -20.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -14.606 -8.293 -22.228 1.00 0.00 H new ATOM 565 N ASP A 37 -10.763 -6.753 -18.240 1.00 0.00 N ATOM 566 CA ASP A 37 -10.506 -5.383 -18.689 1.00 0.00 C ATOM 567 C ASP A 37 -9.019 -5.017 -18.717 1.00 0.00 C ATOM 568 O ASP A 37 -8.569 -4.386 -19.676 1.00 0.00 O ATOM 569 CB ASP A 37 -11.279 -4.389 -17.819 1.00 0.00 C ATOM 570 CG ASP A 37 -11.086 -2.955 -18.343 1.00 0.00 C ATOM 571 OD1 ASP A 37 -11.644 -2.628 -19.417 1.00 0.00 O ATOM 572 OD2 ASP A 37 -10.409 -2.144 -17.669 1.00 0.00 O ATOM 0 H ASP A 37 -10.403 -6.947 -17.306 1.00 0.00 H new ATOM 0 HA ASP A 37 -10.855 -5.326 -19.720 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -12.339 -4.643 -17.819 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -10.935 -4.455 -16.787 1.00 0.00 H new ATOM 577 N ASP A 38 -8.244 -5.422 -17.706 1.00 0.00 N ATOM 578 CA ASP A 38 -6.830 -5.064 -17.583 1.00 0.00 C ATOM 579 C ASP A 38 -5.941 -6.176 -18.138 1.00 0.00 C ATOM 580 O ASP A 38 -6.200 -7.364 -17.926 1.00 0.00 O ATOM 581 CB ASP A 38 -6.401 -4.758 -16.140 1.00 0.00 C ATOM 582 CG ASP A 38 -7.000 -3.458 -15.588 1.00 0.00 C ATOM 583 OD1 ASP A 38 -6.577 -2.365 -16.042 1.00 0.00 O ATOM 584 OD2 ASP A 38 -7.847 -3.522 -14.665 1.00 0.00 O1- ATOM 0 H ASP A 38 -8.584 -6.011 -16.946 1.00 0.00 H new ATOM 0 HA ASP A 38 -6.706 -4.150 -18.164 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -6.697 -5.587 -15.497 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -5.314 -4.695 -16.098 1.00 0.00 H new ATOM 589 N SER A 39 -4.851 -5.780 -18.798 1.00 0.00 N ATOM 590 CA SER A 39 -3.812 -6.685 -19.285 1.00 0.00 C ATOM 591 C SER A 39 -2.926 -7.150 -18.112 1.00 0.00 C ATOM 592 O SER A 39 -2.829 -6.446 -17.104 1.00 0.00 O ATOM 593 CB SER A 39 -3.027 -5.986 -20.415 1.00 0.00 C ATOM 594 OG SER A 39 -3.920 -5.448 -21.388 1.00 0.00 O ATOM 0 H SER A 39 -4.663 -4.801 -19.013 1.00 0.00 H new ATOM 0 HA SER A 39 -4.249 -7.589 -19.709 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.411 -5.189 -19.998 1.00 0.00 H new ATOM 0 HB3 SER A 39 -2.350 -6.697 -20.889 1.00 0.00 H new ATOM 0 HG SER A 39 -3.405 -5.007 -22.096 1.00 0.00 H new ATOM 600 N PRO A 40 -2.238 -8.306 -18.200 1.00 0.00 N ATOM 601 CA PRO A 40 -1.561 -8.902 -17.045 1.00 0.00 C ATOM 602 C PRO A 40 -0.245 -8.216 -16.697 1.00 0.00 C ATOM 603 O PRO A 40 0.158 -8.240 -15.546 1.00 0.00 O ATOM 604 CB PRO A 40 -1.351 -10.373 -17.420 1.00 0.00 C ATOM 605 CG PRO A 40 -1.194 -10.315 -18.940 1.00 0.00 C ATOM 606 CD PRO A 40 -2.175 -9.211 -19.346 1.00 0.00 C ATOM 0 HA PRO A 40 -2.164 -8.787 -16.144 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -0.468 -10.791 -16.938 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -2.199 -10.991 -17.124 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -0.172 -10.074 -19.231 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -1.442 -11.268 -19.408 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -1.832 -8.690 -20.240 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.158 -9.623 -19.575 1.00 0.00 H new ATOM 614 N LYS A 41 0.433 -7.556 -17.639 1.00 0.00 N ATOM 615 CA LYS A 41 1.750 -6.953 -17.365 1.00 0.00 C ATOM 616 C LYS A 41 1.637 -5.747 -16.417 1.00 0.00 C ATOM 617 O LYS A 41 2.606 -5.383 -15.761 1.00 0.00 O ATOM 618 CB LYS A 41 2.469 -6.650 -18.699 1.00 0.00 C ATOM 619 CG LYS A 41 2.815 -7.946 -19.471 1.00 0.00 C ATOM 620 CD LYS A 41 4.104 -8.642 -19.013 1.00 0.00 C ATOM 621 CE LYS A 41 5.371 -7.967 -19.564 1.00 0.00 C ATOM 622 NZ LYS A 41 6.601 -8.548 -18.970 1.00 0.00 N1+ ATOM 0 H LYS A 41 0.099 -7.423 -18.594 1.00 0.00 H new ATOM 0 HA LYS A 41 2.375 -7.665 -16.826 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.835 -6.016 -19.318 1.00 0.00 H new ATOM 0 HB3 LYS A 41 3.383 -6.090 -18.501 1.00 0.00 H new ATOM 0 HG2 LYS A 41 1.985 -8.645 -19.370 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.904 -7.708 -20.531 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.143 -8.645 -17.924 1.00 0.00 H new ATOM 0 HD3 LYS A 41 4.083 -9.684 -19.334 1.00 0.00 H new ATOM 0 HE2 LYS A 41 5.402 -8.079 -20.648 1.00 0.00 H new ATOM 0 HE3 LYS A 41 5.335 -6.898 -19.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 7.435 -8.058 -19.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 6.575 -8.434 -17.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 6.656 -9.559 -19.206 1.00 0.00 H new ATOM 636 N LEU A 42 0.423 -5.220 -16.230 1.00 0.00 N ATOM 637 CA LEU A 42 0.074 -4.225 -15.214 1.00 0.00 C ATOM 638 C LEU A 42 0.304 -4.786 -13.810 1.00 0.00 C ATOM 639 O LEU A 42 0.589 -4.009 -12.905 1.00 0.00 O ATOM 640 CB LEU A 42 -1.415 -3.830 -15.361 1.00 0.00 C ATOM 641 CG LEU A 42 -1.874 -2.899 -16.505 1.00 0.00 C ATOM 642 CD1 LEU A 42 -1.500 -1.442 -16.227 1.00 0.00 C ATOM 643 CD2 LEU A 42 -1.327 -3.283 -17.884 1.00 0.00 C ATOM 0 H LEU A 42 -0.375 -5.487 -16.806 1.00 0.00 H new ATOM 0 HA LEU A 42 0.708 -3.350 -15.357 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.985 -4.755 -15.452 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.716 -3.360 -14.425 1.00 0.00 H new ATOM 0 HG LEU A 42 -2.957 -3.019 -16.532 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -1.838 -0.816 -17.052 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.977 -1.114 -15.303 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -0.418 -1.357 -16.127 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -1.696 -2.580 -18.631 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.238 -3.253 -17.865 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.657 -4.290 -18.139 1.00 0.00 H new ATOM 655 N MET A 43 0.232 -6.109 -13.615 1.00 0.00 N ATOM 656 CA MET A 43 0.493 -6.747 -12.320 1.00 0.00 C ATOM 657 C MET A 43 1.903 -6.441 -11.820 1.00 0.00 C ATOM 658 O MET A 43 2.141 -6.481 -10.616 1.00 0.00 O ATOM 659 CB MET A 43 0.378 -8.272 -12.423 1.00 0.00 C ATOM 660 CG MET A 43 -1.033 -8.790 -12.689 1.00 0.00 C ATOM 661 SD MET A 43 -1.071 -10.592 -12.602 1.00 0.00 S ATOM 662 CE MET A 43 -2.610 -10.887 -13.496 1.00 0.00 C ATOM 0 H MET A 43 -0.010 -6.769 -14.354 1.00 0.00 H new ATOM 0 HA MET A 43 -0.250 -6.348 -11.630 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.034 -8.619 -13.221 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.743 -8.714 -11.496 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.725 -8.370 -11.959 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.369 -8.460 -13.672 1.00 0.00 H new ATOM 0 HE1 MET A 43 -2.923 -11.921 -13.350 1.00 0.00 H new ATOM 0 HE2 MET A 43 -3.383 -10.217 -13.120 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.455 -10.702 -14.559 1.00 0.00 H new ATOM 672 N GLU A 44 2.847 -6.141 -12.721 1.00 0.00 N ATOM 673 CA GLU A 44 4.236 -5.907 -12.349 1.00 0.00 C ATOM 674 C GLU A 44 4.341 -4.665 -11.456 1.00 0.00 C ATOM 675 O GLU A 44 5.178 -4.637 -10.552 1.00 0.00 O ATOM 676 CB GLU A 44 5.122 -5.776 -13.603 1.00 0.00 C ATOM 677 CG GLU A 44 5.156 -7.072 -14.439 1.00 0.00 C ATOM 678 CD GLU A 44 6.065 -7.006 -15.682 1.00 0.00 C ATOM 679 OE1 GLU A 44 6.456 -5.908 -16.142 1.00 0.00 O1- ATOM 680 OE2 GLU A 44 6.389 -8.094 -16.217 1.00 0.00 O ATOM 0 H GLU A 44 2.665 -6.055 -13.721 1.00 0.00 H new ATOM 0 HA GLU A 44 4.598 -6.764 -11.781 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.753 -4.958 -14.221 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.136 -5.515 -13.302 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.491 -7.891 -13.803 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.141 -7.310 -14.758 1.00 0.00 H new ATOM 687 N GLN A 45 3.456 -3.678 -11.666 1.00 0.00 N ATOM 688 CA GLN A 45 3.543 -2.360 -11.035 1.00 0.00 C ATOM 689 C GLN A 45 3.322 -2.398 -9.517 1.00 0.00 C ATOM 690 O GLN A 45 3.943 -1.637 -8.774 1.00 0.00 O ATOM 691 CB GLN A 45 2.447 -1.443 -11.602 1.00 0.00 C ATOM 692 CG GLN A 45 2.388 -1.291 -13.132 1.00 0.00 C ATOM 693 CD GLN A 45 1.099 -0.566 -13.520 1.00 0.00 C ATOM 694 OE1 GLN A 45 1.123 0.535 -14.064 1.00 0.00 O ATOM 695 NE2 GLN A 45 -0.051 -1.163 -13.228 1.00 0.00 N ATOM 0 H GLN A 45 2.652 -3.778 -12.286 1.00 0.00 H new ATOM 0 HA GLN A 45 4.550 -1.999 -11.243 1.00 0.00 H new ATOM 0 HB2 GLN A 45 1.482 -1.817 -11.261 1.00 0.00 H new ATOM 0 HB3 GLN A 45 2.576 -0.452 -11.168 1.00 0.00 H new ATOM 0 HG2 GLN A 45 3.254 -0.732 -13.487 1.00 0.00 H new ATOM 0 HG3 GLN A 45 2.425 -2.271 -13.608 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.051 -2.077 -12.776 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.935 -0.707 -13.456 1.00 0.00 H new ATOM 704 N TYR A 46 2.382 -3.239 -9.077 1.00 0.00 N ATOM 705 CA TYR A 46 1.864 -3.209 -7.712 1.00 0.00 C ATOM 706 C TYR A 46 2.880 -3.832 -6.769 1.00 0.00 C ATOM 707 O TYR A 46 3.446 -4.878 -7.091 1.00 0.00 O ATOM 708 CB TYR A 46 0.496 -3.907 -7.625 1.00 0.00 C ATOM 709 CG TYR A 46 -0.564 -3.384 -8.583 1.00 0.00 C ATOM 710 CD1 TYR A 46 -0.673 -3.923 -9.879 1.00 0.00 C ATOM 711 CD2 TYR A 46 -1.468 -2.381 -8.176 1.00 0.00 C ATOM 712 CE1 TYR A 46 -1.663 -3.463 -10.765 1.00 0.00 C ATOM 713 CE2 TYR A 46 -2.430 -1.885 -9.074 1.00 0.00 C ATOM 714 CZ TYR A 46 -2.535 -2.425 -10.376 1.00 0.00 C ATOM 715 OH TYR A 46 -3.464 -1.968 -11.264 1.00 0.00 O ATOM 0 H TYR A 46 1.960 -3.961 -9.661 1.00 0.00 H new ATOM 0 HA TYR A 46 1.707 -2.173 -7.410 1.00 0.00 H new ATOM 0 HB2 TYR A 46 0.637 -4.971 -7.812 1.00 0.00 H new ATOM 0 HB3 TYR A 46 0.121 -3.809 -6.606 1.00 0.00 H new ATOM 0 HD1 TYR A 46 0.010 -4.697 -10.196 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -1.421 -1.992 -7.170 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -1.756 -3.906 -11.746 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -3.091 -1.088 -8.767 1.00 0.00 H new ATOM 0 HH TYR A 46 -3.990 -1.253 -10.848 1.00 0.00 H new ATOM 725 N ASP A 47 3.123 -3.221 -5.609 1.00 0.00 N ATOM 726 CA ASP A 47 4.113 -3.744 -4.670 1.00 0.00 C ATOM 727 C ASP A 47 3.603 -5.020 -4.009 1.00 0.00 C ATOM 728 O ASP A 47 4.353 -5.983 -3.839 1.00 0.00 O ATOM 729 CB ASP A 47 4.450 -2.714 -3.599 1.00 0.00 C ATOM 730 CG ASP A 47 5.639 -3.235 -2.785 1.00 0.00 C ATOM 731 OD1 ASP A 47 6.771 -3.267 -3.322 1.00 0.00 O1- ATOM 732 OD2 ASP A 47 5.455 -3.566 -1.593 1.00 0.00 O ATOM 0 H ASP A 47 2.652 -2.371 -5.300 1.00 0.00 H new ATOM 0 HA ASP A 47 5.018 -3.969 -5.235 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.695 -1.756 -4.058 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.590 -2.546 -2.950 1.00 0.00 H new ATOM 737 N VAL A 48 2.301 -5.051 -3.711 1.00 0.00 N ATOM 738 CA VAL A 48 1.607 -6.257 -3.297 1.00 0.00 C ATOM 739 C VAL A 48 0.728 -6.698 -4.453 1.00 0.00 C ATOM 740 O VAL A 48 0.122 -5.865 -5.129 1.00 0.00 O ATOM 741 CB VAL A 48 0.764 -6.038 -2.033 1.00 0.00 C ATOM 742 CG1 VAL A 48 0.274 -7.397 -1.509 1.00 0.00 C ATOM 743 CG2 VAL A 48 1.499 -5.246 -0.944 1.00 0.00 C ATOM 0 H VAL A 48 1.700 -4.228 -3.753 1.00 0.00 H new ATOM 0 HA VAL A 48 2.338 -7.025 -3.046 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.092 -5.422 -2.307 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.325 -7.246 -0.611 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.333 -7.884 -2.272 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.132 -8.026 -1.271 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.847 -5.127 -0.078 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.400 -5.784 -0.649 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.773 -4.264 -1.330 1.00 0.00 H new ATOM 753 N LEU A 49 0.579 -8.006 -4.635 1.00 0.00 N ATOM 754 CA LEU A 49 -0.311 -8.567 -5.632 1.00 0.00 C ATOM 755 C LEU A 49 -1.141 -9.673 -4.995 1.00 0.00 C ATOM 756 O LEU A 49 -0.600 -10.645 -4.480 1.00 0.00 O ATOM 757 CB LEU A 49 0.586 -9.070 -6.755 1.00 0.00 C ATOM 758 CG LEU A 49 -0.163 -9.519 -8.020 1.00 0.00 C ATOM 759 CD1 LEU A 49 -0.823 -8.344 -8.751 1.00 0.00 C ATOM 760 CD2 LEU A 49 0.818 -10.212 -8.967 1.00 0.00 C ATOM 0 H LEU A 49 1.078 -8.707 -4.088 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.022 -7.843 -6.031 1.00 0.00 H new ATOM 0 HB2 LEU A 49 1.286 -8.279 -7.025 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.178 -9.906 -6.383 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.953 -10.204 -7.711 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.340 -8.711 -9.638 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.540 -7.859 -8.088 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.059 -7.625 -9.048 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.291 -10.532 -9.866 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.612 -9.517 -9.240 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.250 -11.081 -8.471 1.00 0.00 H new ATOM 772 N ILE A 50 -2.456 -9.529 -5.006 1.00 0.00 N ATOM 773 CA ILE A 50 -3.403 -10.474 -4.455 1.00 0.00 C ATOM 774 C ILE A 50 -3.935 -11.300 -5.640 1.00 0.00 C ATOM 775 O ILE A 50 -4.344 -10.723 -6.647 1.00 0.00 O ATOM 776 CB ILE A 50 -4.464 -9.671 -3.666 1.00 0.00 C ATOM 777 CG1 ILE A 50 -3.925 -9.066 -2.353 1.00 0.00 C ATOM 778 CG2 ILE A 50 -5.700 -10.532 -3.412 1.00 0.00 C ATOM 779 CD1 ILE A 50 -4.785 -7.887 -1.876 1.00 0.00 C ATOM 0 H ILE A 50 -2.909 -8.713 -5.418 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.983 -11.182 -3.741 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.742 -8.822 -4.290 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -3.901 -9.835 -1.581 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.898 -8.731 -2.501 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -6.438 -9.954 -2.856 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.127 -10.845 -4.365 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.418 -11.412 -2.834 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.373 -7.488 -0.949 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -4.787 -7.107 -2.637 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.806 -8.228 -1.703 1.00 0.00 H new ATOM 791 N LEU A 51 -3.907 -12.631 -5.527 1.00 0.00 N ATOM 792 CA LEU A 51 -4.277 -13.584 -6.579 1.00 0.00 C ATOM 793 C LEU A 51 -5.573 -14.252 -6.164 1.00 0.00 C ATOM 794 O LEU A 51 -5.643 -14.757 -5.042 1.00 0.00 O ATOM 795 CB LEU A 51 -3.195 -14.677 -6.712 1.00 0.00 C ATOM 796 CG LEU A 51 -1.865 -14.280 -7.365 1.00 0.00 C ATOM 797 CD1 LEU A 51 -1.494 -12.796 -7.363 1.00 0.00 C ATOM 798 CD2 LEU A 51 -0.728 -14.996 -6.652 1.00 0.00 C ATOM 0 H LEU A 51 -3.614 -13.093 -4.666 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.380 -13.060 -7.529 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.979 -15.060 -5.715 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.618 -15.502 -7.285 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.008 -14.560 -8.409 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -0.531 -12.661 -7.856 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.257 -12.229 -7.896 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.429 -12.439 -6.335 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.221 -14.719 -7.111 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.720 -14.709 -5.600 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.869 -16.074 -6.733 1.00 0.00 H new ATOM 810 N GLY A 52 -6.542 -14.329 -7.075 1.00 0.00 N ATOM 811 CA GLY A 52 -7.820 -14.977 -6.820 1.00 0.00 C ATOM 812 C GLY A 52 -8.234 -15.793 -8.031 1.00 0.00 C ATOM 813 O GLY A 52 -8.062 -15.339 -9.163 1.00 0.00 O ATOM 0 H GLY A 52 -6.458 -13.940 -8.014 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -7.743 -15.622 -5.945 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -8.580 -14.228 -6.598 1.00 0.00 H new ATOM 817 N ILE A 53 -8.773 -16.996 -7.811 1.00 0.00 N ATOM 818 CA ILE A 53 -9.352 -17.815 -8.875 1.00 0.00 C ATOM 819 C ILE A 53 -10.387 -18.800 -8.315 1.00 0.00 C ATOM 820 O ILE A 53 -10.109 -19.479 -7.325 1.00 0.00 O ATOM 821 CB ILE A 53 -8.245 -18.562 -9.665 1.00 0.00 C ATOM 822 CG1 ILE A 53 -8.858 -19.563 -10.672 1.00 0.00 C ATOM 823 CG2 ILE A 53 -7.188 -19.262 -8.779 1.00 0.00 C ATOM 824 CD1 ILE A 53 -8.006 -19.840 -11.902 1.00 0.00 C ATOM 0 H ILE A 53 -8.819 -17.428 -6.888 1.00 0.00 H new ATOM 0 HA ILE A 53 -9.867 -17.148 -9.566 1.00 0.00 H new ATOM 0 HB ILE A 53 -7.708 -17.784 -10.207 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -9.044 -20.506 -10.157 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -9.826 -19.182 -10.997 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -6.453 -19.759 -9.413 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -6.688 -18.521 -8.155 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -7.677 -20.000 -8.144 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -8.519 -20.553 -12.547 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -7.841 -18.911 -12.447 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -7.046 -20.255 -11.594 1.00 0.00 H new ATOM 836 N PRO A 54 -11.568 -18.914 -8.942 1.00 0.00 N ATOM 837 CA PRO A 54 -12.469 -20.034 -8.710 1.00 0.00 C ATOM 838 C PRO A 54 -11.925 -21.272 -9.421 1.00 0.00 C ATOM 839 O PRO A 54 -11.653 -21.218 -10.623 1.00 0.00 O ATOM 840 CB PRO A 54 -13.832 -19.628 -9.285 1.00 0.00 C ATOM 841 CG PRO A 54 -13.764 -18.112 -9.189 1.00 0.00 C ATOM 842 CD PRO A 54 -12.310 -17.829 -9.565 1.00 0.00 C ATOM 0 HA PRO A 54 -12.561 -20.271 -7.650 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -13.961 -19.968 -10.312 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.660 -20.039 -8.707 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -14.463 -17.629 -9.872 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -14.002 -17.757 -8.186 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -12.172 -17.820 -10.646 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.984 -16.857 -9.194 1.00 0.00 H new ATOM 850 N THR A 55 -11.782 -22.378 -8.700 1.00 0.00 N ATOM 851 CA THR A 55 -11.540 -23.682 -9.307 1.00 0.00 C ATOM 852 C THR A 55 -12.924 -24.344 -9.356 1.00 0.00 C ATOM 853 O THR A 55 -13.481 -24.679 -8.307 1.00 0.00 O ATOM 854 CB THR A 55 -10.502 -24.501 -8.521 1.00 0.00 C ATOM 855 OG1 THR A 55 -9.326 -23.754 -8.250 1.00 0.00 O ATOM 856 CG2 THR A 55 -10.042 -25.692 -9.355 1.00 0.00 C ATOM 0 H THR A 55 -11.830 -22.397 -7.681 1.00 0.00 H new ATOM 0 HA THR A 55 -11.103 -23.604 -10.303 1.00 0.00 H new ATOM 0 HB THR A 55 -10.990 -24.798 -7.593 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.357 -23.418 -7.330 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.307 -26.268 -8.793 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.898 -26.325 -9.588 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.592 -25.335 -10.281 1.00 0.00 H new ATOM 864 N TRP A 56 -13.523 -24.448 -10.549 1.00 0.00 N ATOM 865 CA TRP A 56 -14.879 -24.971 -10.696 1.00 0.00 C ATOM 866 C TRP A 56 -14.871 -26.485 -10.950 1.00 0.00 C ATOM 867 O TRP A 56 -13.822 -27.082 -11.194 1.00 0.00 O ATOM 868 CB TRP A 56 -15.656 -24.172 -11.755 1.00 0.00 C ATOM 869 CG TRP A 56 -17.147 -24.262 -11.617 1.00 0.00 C ATOM 870 CD1 TRP A 56 -17.855 -23.815 -10.555 1.00 0.00 C ATOM 871 CD2 TRP A 56 -18.133 -24.846 -12.525 1.00 0.00 C ATOM 872 NE1 TRP A 56 -19.193 -24.096 -10.729 1.00 0.00 N ATOM 873 CE2 TRP A 56 -19.425 -24.737 -11.924 1.00 0.00 C ATOM 874 CE3 TRP A 56 -18.075 -25.459 -13.794 1.00 0.00 C ATOM 875 CZ2 TRP A 56 -20.587 -25.221 -12.545 1.00 0.00 C ATOM 876 CZ3 TRP A 56 -19.232 -25.952 -14.427 1.00 0.00 C ATOM 877 CH2 TRP A 56 -20.486 -25.837 -13.802 1.00 0.00 C ATOM 0 H TRP A 56 -13.084 -24.174 -11.428 1.00 0.00 H new ATOM 0 HA TRP A 56 -15.413 -24.836 -9.756 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -15.359 -23.125 -11.695 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -15.371 -24.528 -12.745 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -17.434 -23.312 -9.697 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -19.921 -23.858 -10.055 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -17.121 -25.552 -14.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -21.547 -25.121 -12.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -19.156 -26.421 -15.397 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -21.370 -26.222 -14.288 1.00 0.00 H new ATOM 888 N ASP A 57 -16.056 -27.099 -10.880 1.00 0.00 N ATOM 889 CA ASP A 57 -16.254 -28.551 -10.924 1.00 0.00 C ATOM 890 C ASP A 57 -15.806 -29.179 -12.251 1.00 0.00 C ATOM 891 O ASP A 57 -15.357 -30.328 -12.269 1.00 0.00 O ATOM 892 CB ASP A 57 -17.742 -28.847 -10.703 1.00 0.00 C ATOM 893 CG ASP A 57 -18.034 -30.356 -10.777 1.00 0.00 C ATOM 894 OD1 ASP A 57 -17.689 -31.079 -9.812 1.00 0.00 O ATOM 895 OD2 ASP A 57 -18.656 -30.811 -11.768 1.00 0.00 O ATOM 0 H ASP A 57 -16.931 -26.583 -10.788 1.00 0.00 H new ATOM 0 HA ASP A 57 -15.637 -28.991 -10.141 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -18.050 -28.463 -9.730 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -18.334 -28.324 -11.454 1.00 0.00 H new ATOM 900 N PHE A 58 -15.894 -28.427 -13.355 1.00 0.00 N ATOM 901 CA PHE A 58 -15.512 -28.865 -14.693 1.00 0.00 C ATOM 902 C PHE A 58 -14.788 -27.725 -15.419 1.00 0.00 C ATOM 903 O PHE A 58 -14.995 -26.552 -15.105 1.00 0.00 O ATOM 904 CB PHE A 58 -16.765 -29.314 -15.463 1.00 0.00 C ATOM 905 CG PHE A 58 -16.478 -29.853 -16.852 1.00 0.00 C ATOM 906 CD1 PHE A 58 -15.909 -31.132 -17.006 1.00 0.00 C ATOM 907 CD2 PHE A 58 -16.753 -29.071 -17.991 1.00 0.00 C ATOM 908 CE1 PHE A 58 -15.611 -31.625 -18.291 1.00 0.00 C ATOM 909 CE2 PHE A 58 -16.454 -29.567 -19.274 1.00 0.00 C ATOM 910 CZ PHE A 58 -15.882 -30.842 -19.425 1.00 0.00 C ATOM 0 H PHE A 58 -16.244 -27.469 -13.336 1.00 0.00 H new ATOM 0 HA PHE A 58 -14.830 -29.713 -14.629 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -17.277 -30.083 -14.885 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.449 -28.470 -15.547 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -15.701 -31.737 -16.136 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -17.193 -28.091 -17.880 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -15.174 -32.606 -18.405 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -16.665 -28.965 -20.146 1.00 0.00 H new ATOM 0 HZ PHE A 58 -15.651 -31.219 -20.411 1.00 0.00 H new ATOM 920 N GLY A 59 -13.947 -28.067 -16.401 1.00 0.00 N ATOM 921 CA GLY A 59 -13.339 -27.103 -17.315 1.00 0.00 C ATOM 922 C GLY A 59 -12.216 -26.256 -16.702 1.00 0.00 C ATOM 923 O GLY A 59 -11.674 -25.406 -17.412 1.00 0.00 O ATOM 0 H GLY A 59 -13.669 -29.031 -16.583 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.941 -27.640 -18.176 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -14.117 -26.436 -17.687 1.00 0.00 H new ATOM 927 N GLU A 60 -11.851 -26.494 -15.433 1.00 0.00 N ATOM 928 CA GLU A 60 -10.835 -25.766 -14.665 1.00 0.00 C ATOM 929 C GLU A 60 -10.963 -24.234 -14.810 1.00 0.00 C ATOM 930 O GLU A 60 -12.062 -23.700 -14.982 1.00 0.00 O ATOM 931 CB GLU A 60 -9.430 -26.386 -14.885 1.00 0.00 C ATOM 932 CG GLU A 60 -8.705 -26.097 -16.210 1.00 0.00 C ATOM 933 CD GLU A 60 -7.444 -26.971 -16.343 1.00 0.00 C ATOM 934 OE1 GLU A 60 -6.425 -26.668 -15.681 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 -7.460 -27.952 -17.128 1.00 0.00 O ATOM 0 H GLU A 60 -12.281 -27.241 -14.887 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.018 -25.901 -13.599 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -8.786 -26.047 -14.073 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.525 -27.467 -14.787 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -9.376 -26.289 -17.047 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.430 -25.043 -16.257 1.00 0.00 H new ATOM 942 N ILE A 61 -9.838 -23.544 -14.627 1.00 0.00 N ATOM 943 CA ILE A 61 -9.578 -22.133 -14.883 1.00 0.00 C ATOM 944 C ILE A 61 -10.471 -21.568 -16.007 1.00 0.00 C ATOM 945 O ILE A 61 -10.527 -22.103 -17.120 1.00 0.00 O ATOM 946 CB ILE A 61 -8.087 -22.001 -15.271 1.00 0.00 C ATOM 947 CG1 ILE A 61 -7.142 -22.707 -14.266 1.00 0.00 C ATOM 948 CG2 ILE A 61 -7.691 -20.535 -15.523 1.00 0.00 C ATOM 949 CD1 ILE A 61 -5.663 -22.432 -14.513 1.00 0.00 C ATOM 0 H ILE A 61 -9.007 -24.007 -14.260 1.00 0.00 H new ATOM 0 HA ILE A 61 -9.809 -21.557 -13.987 1.00 0.00 H new ATOM 0 HB ILE A 61 -7.962 -22.530 -16.216 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.397 -22.387 -13.256 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -7.315 -23.782 -14.313 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -6.636 -20.484 -15.793 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -8.294 -20.130 -16.336 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -7.862 -19.951 -14.619 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.066 -22.960 -13.770 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.390 -22.778 -15.510 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.474 -21.361 -14.436 1.00 0.00 H new ATOM 961 N GLN A 62 -11.118 -20.438 -15.709 1.00 0.00 N ATOM 962 CA GLN A 62 -12.003 -19.722 -16.617 1.00 0.00 C ATOM 963 C GLN A 62 -11.179 -19.030 -17.708 1.00 0.00 C ATOM 964 O GLN A 62 -10.022 -18.669 -17.488 1.00 0.00 O ATOM 965 CB GLN A 62 -12.853 -18.700 -15.832 1.00 0.00 C ATOM 966 CG GLN A 62 -13.899 -19.308 -14.870 1.00 0.00 C ATOM 967 CD GLN A 62 -13.331 -20.196 -13.753 1.00 0.00 C ATOM 968 OE1 GLN A 62 -12.330 -19.725 -13.017 1.00 0.00 O flip ATOM 969 NE2 GLN A 62 -13.785 -21.318 -13.548 1.00 0.00 N flip ATOM 0 H GLN A 62 -11.034 -19.986 -14.798 1.00 0.00 H new ATOM 0 HA GLN A 62 -12.680 -20.430 -17.095 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -12.183 -18.061 -15.257 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -13.370 -18.059 -16.546 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -14.463 -18.495 -14.413 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -14.606 -19.897 -15.455 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -14.554 -21.669 -14.119 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -13.394 -21.899 -12.806 1.00 0.00 H new ATOM 978 N GLU A 63 -11.789 -18.797 -18.874 1.00 0.00 N ATOM 979 CA GLU A 63 -11.086 -18.338 -20.071 1.00 0.00 C ATOM 980 C GLU A 63 -10.375 -17.002 -19.830 1.00 0.00 C ATOM 981 O GLU A 63 -9.215 -16.858 -20.206 1.00 0.00 O ATOM 982 CB GLU A 63 -12.094 -18.252 -21.227 1.00 0.00 C ATOM 983 CG GLU A 63 -11.448 -17.758 -22.529 1.00 0.00 C ATOM 984 CD GLU A 63 -12.437 -17.822 -23.710 1.00 0.00 C ATOM 985 OE1 GLU A 63 -13.158 -16.823 -23.958 1.00 0.00 O ATOM 986 OE2 GLU A 63 -12.490 -18.865 -24.409 1.00 0.00 O ATOM 0 H GLU A 63 -12.792 -18.923 -19.013 1.00 0.00 H new ATOM 0 HA GLU A 63 -10.304 -19.051 -20.331 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.537 -19.234 -21.394 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.906 -17.580 -20.949 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -11.102 -16.733 -22.398 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.571 -18.365 -22.754 1.00 0.00 H new ATOM 993 N ASP A 64 -11.030 -16.053 -19.151 1.00 0.00 N ATOM 994 CA ASP A 64 -10.482 -14.708 -18.894 1.00 0.00 C ATOM 995 C ASP A 64 -9.186 -14.764 -18.087 1.00 0.00 C ATOM 996 O ASP A 64 -8.357 -13.854 -18.173 1.00 0.00 O ATOM 997 CB ASP A 64 -11.512 -13.842 -18.146 1.00 0.00 C ATOM 998 CG ASP A 64 -12.529 -13.234 -19.124 1.00 0.00 C ATOM 999 OD1 ASP A 64 -12.135 -12.371 -19.943 1.00 0.00 O ATOM 1000 OD2 ASP A 64 -13.720 -13.625 -19.077 1.00 0.00 O ATOM 0 H ASP A 64 -11.962 -16.194 -18.760 1.00 0.00 H new ATOM 0 HA ASP A 64 -10.260 -14.262 -19.864 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -12.032 -14.448 -17.404 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.000 -13.046 -17.606 1.00 0.00 H new ATOM 1005 N TRP A 65 -8.996 -15.836 -17.320 1.00 0.00 N ATOM 1006 CA TRP A 65 -7.847 -16.044 -16.465 1.00 0.00 C ATOM 1007 C TRP A 65 -6.808 -16.902 -17.193 1.00 0.00 C ATOM 1008 O TRP A 65 -5.620 -16.583 -17.184 1.00 0.00 O ATOM 1009 CB TRP A 65 -8.367 -16.689 -15.180 1.00 0.00 C ATOM 1010 CG TRP A 65 -7.564 -16.485 -13.939 1.00 0.00 C ATOM 1011 CD1 TRP A 65 -7.909 -15.680 -12.908 1.00 0.00 C ATOM 1012 CD2 TRP A 65 -6.380 -17.203 -13.497 1.00 0.00 C ATOM 1013 NE1 TRP A 65 -7.057 -15.890 -11.846 1.00 0.00 N ATOM 1014 CE2 TRP A 65 -6.136 -16.871 -12.137 1.00 0.00 C ATOM 1015 CE3 TRP A 65 -5.569 -18.197 -14.075 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 -5.194 -17.556 -11.364 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 -4.615 -18.886 -13.313 1.00 0.00 C ATOM 1018 CH2 TRP A 65 -4.447 -18.588 -11.954 1.00 0.00 C ATOM 0 H TRP A 65 -9.665 -16.605 -17.281 1.00 0.00 H new ATOM 0 HA TRP A 65 -7.340 -15.112 -16.214 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -9.373 -16.312 -14.997 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -8.455 -17.762 -15.353 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -8.730 -14.978 -12.916 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -7.103 -15.385 -10.961 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -5.683 -18.433 -15.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -5.043 -17.295 -10.327 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -4.007 -19.650 -13.775 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -3.743 -19.152 -11.361 1.00 0.00 H new ATOM 1029 N GLU A 66 -7.226 -17.960 -17.894 1.00 0.00 N ATOM 1030 CA GLU A 66 -6.349 -18.830 -18.645 1.00 0.00 C ATOM 1031 C GLU A 66 -5.669 -18.040 -19.769 1.00 0.00 C ATOM 1032 O GLU A 66 -4.497 -18.281 -20.063 1.00 0.00 O ATOM 1033 CB GLU A 66 -7.186 -20.019 -19.147 1.00 0.00 C ATOM 1034 CG GLU A 66 -6.598 -20.610 -20.421 1.00 0.00 C ATOM 1035 CD GLU A 66 -7.286 -21.923 -20.829 1.00 0.00 C ATOM 1036 OE1 GLU A 66 -8.322 -21.872 -21.535 1.00 0.00 O ATOM 1037 OE2 GLU A 66 -6.782 -23.012 -20.463 1.00 0.00 O1- ATOM 0 H GLU A 66 -8.208 -18.232 -17.949 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.541 -19.223 -18.028 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.231 -20.787 -18.375 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -8.209 -19.693 -19.333 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.692 -19.887 -21.231 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.533 -20.791 -20.277 1.00 0.00 H new ATOM 1044 N ALA A 67 -6.374 -17.060 -20.343 1.00 0.00 N ATOM 1045 CA ALA A 67 -5.883 -16.222 -21.429 1.00 0.00 C ATOM 1046 C ALA A 67 -4.570 -15.522 -21.064 1.00 0.00 C ATOM 1047 O ALA A 67 -3.798 -15.161 -21.952 1.00 0.00 O ATOM 1048 CB ALA A 67 -6.939 -15.162 -21.759 1.00 0.00 C ATOM 0 H ALA A 67 -7.324 -16.826 -20.055 1.00 0.00 H new ATOM 0 HA ALA A 67 -5.694 -16.864 -22.289 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -6.579 -14.530 -22.571 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.864 -15.652 -22.063 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -7.126 -14.548 -20.878 1.00 0.00 H new ATOM 1054 N VAL A 68 -4.322 -15.330 -19.766 1.00 0.00 N ATOM 1055 CA VAL A 68 -3.106 -14.715 -19.254 1.00 0.00 C ATOM 1056 C VAL A 68 -2.278 -15.654 -18.391 1.00 0.00 C ATOM 1057 O VAL A 68 -1.132 -15.312 -18.117 1.00 0.00 O ATOM 1058 CB VAL A 68 -3.437 -13.415 -18.512 1.00 0.00 C ATOM 1059 CG1 VAL A 68 -4.083 -12.397 -19.459 1.00 0.00 C ATOM 1060 CG2 VAL A 68 -4.342 -13.638 -17.300 1.00 0.00 C ATOM 0 H VAL A 68 -4.976 -15.604 -19.033 1.00 0.00 H new ATOM 0 HA VAL A 68 -2.482 -14.479 -20.116 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.489 -13.023 -18.145 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.309 -11.483 -18.911 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -3.395 -12.171 -20.274 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.004 -12.813 -19.867 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.542 -12.683 -16.815 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.282 -14.084 -17.625 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.848 -14.307 -16.595 1.00 0.00 H new ATOM 1070 N TRP A 69 -2.796 -16.819 -17.984 1.00 0.00 N ATOM 1071 CA TRP A 69 -2.089 -17.781 -17.132 1.00 0.00 C ATOM 1072 C TRP A 69 -0.721 -18.119 -17.729 1.00 0.00 C ATOM 1073 O TRP A 69 0.282 -18.155 -17.021 1.00 0.00 O ATOM 1074 CB TRP A 69 -2.972 -19.023 -16.960 1.00 0.00 C ATOM 1075 CG TRP A 69 -2.435 -20.144 -16.117 1.00 0.00 C ATOM 1076 CD1 TRP A 69 -1.764 -20.019 -14.948 1.00 0.00 C ATOM 1077 CD2 TRP A 69 -2.552 -21.584 -16.348 1.00 0.00 C ATOM 1078 NE1 TRP A 69 -1.486 -21.269 -14.430 1.00 0.00 N ATOM 1079 CE2 TRP A 69 -1.931 -22.269 -15.264 1.00 0.00 C ATOM 1080 CE3 TRP A 69 -3.137 -22.384 -17.355 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 -1.880 -23.664 -15.184 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 -3.093 -23.791 -17.288 1.00 0.00 C ATOM 1083 CH2 TRP A 69 -2.464 -24.433 -16.206 1.00 0.00 C ATOM 0 H TRP A 69 -3.734 -17.124 -18.242 1.00 0.00 H new ATOM 0 HA TRP A 69 -1.901 -17.352 -16.148 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -3.921 -18.704 -16.530 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -3.189 -19.421 -17.951 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -1.487 -19.082 -14.489 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -1.011 -21.430 -13.542 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -3.627 -21.908 -18.192 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 -1.397 -24.146 -14.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -3.545 -24.380 -18.072 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -2.430 -25.511 -16.160 1.00 0.00 H new ATOM 1094 N ASP A 70 -0.670 -18.228 -19.054 1.00 0.00 N ATOM 1095 CA ASP A 70 0.537 -18.482 -19.835 1.00 0.00 C ATOM 1096 C ASP A 70 1.571 -17.344 -19.746 1.00 0.00 C ATOM 1097 O ASP A 70 2.770 -17.593 -19.863 1.00 0.00 O ATOM 1098 CB ASP A 70 0.094 -18.716 -21.284 1.00 0.00 C ATOM 1099 CG ASP A 70 1.298 -18.990 -22.204 1.00 0.00 C ATOM 1100 OD1 ASP A 70 1.875 -20.101 -22.124 1.00 0.00 O ATOM 1101 OD2 ASP A 70 1.642 -18.112 -23.033 1.00 0.00 O1- ATOM 0 H ASP A 70 -1.503 -18.138 -19.636 1.00 0.00 H new ATOM 0 HA ASP A 70 1.048 -19.356 -19.430 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.595 -19.560 -21.323 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.450 -17.843 -21.645 1.00 0.00 H new ATOM 1106 N GLN A 71 1.129 -16.102 -19.497 1.00 0.00 N ATOM 1107 CA GLN A 71 1.972 -14.918 -19.360 1.00 0.00 C ATOM 1108 C GLN A 71 2.368 -14.645 -17.915 1.00 0.00 C ATOM 1109 O GLN A 71 3.334 -13.930 -17.675 1.00 0.00 O ATOM 1110 CB GLN A 71 1.280 -13.675 -19.935 1.00 0.00 C ATOM 1111 CG GLN A 71 1.044 -13.824 -21.447 1.00 0.00 C ATOM 1112 CD GLN A 71 0.843 -12.467 -22.120 1.00 0.00 C ATOM 1113 OE1 GLN A 71 1.748 -11.910 -22.739 1.00 0.00 O ATOM 1114 NE2 GLN A 71 -0.341 -11.894 -21.980 1.00 0.00 N ATOM 0 H GLN A 71 0.137 -15.893 -19.382 1.00 0.00 H new ATOM 0 HA GLN A 71 2.879 -15.128 -19.927 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.328 -13.518 -19.429 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.892 -12.793 -19.744 1.00 0.00 H new ATOM 0 HG2 GLN A 71 1.894 -14.333 -21.900 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.168 -14.450 -21.619 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.080 -12.370 -21.463 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.515 -10.976 -22.389 1.00 0.00 H new ATOM 1123 N LEU A 72 1.645 -15.198 -16.938 1.00 0.00 N ATOM 1124 CA LEU A 72 1.932 -14.963 -15.518 1.00 0.00 C ATOM 1125 C LEU A 72 3.350 -15.419 -15.158 1.00 0.00 C ATOM 1126 O LEU A 72 3.939 -14.884 -14.223 1.00 0.00 O ATOM 1127 CB LEU A 72 0.894 -15.633 -14.600 1.00 0.00 C ATOM 1128 CG LEU A 72 -0.557 -15.175 -14.815 1.00 0.00 C ATOM 1129 CD1 LEU A 72 -1.453 -15.819 -13.754 1.00 0.00 C ATOM 1130 CD2 LEU A 72 -0.755 -13.659 -14.776 1.00 0.00 C ATOM 0 H LEU A 72 0.851 -15.816 -17.105 1.00 0.00 H new ATOM 0 HA LEU A 72 1.865 -13.887 -15.354 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.944 -16.712 -14.747 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.170 -15.440 -13.563 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.826 -15.495 -15.822 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.483 -15.496 -13.903 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.396 -16.904 -13.840 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.118 -15.516 -12.762 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.807 -13.425 -14.937 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.442 -13.276 -13.805 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.156 -13.194 -15.559 1.00 0.00 H new ATOM 1142 N ASP A 73 3.911 -16.383 -15.902 1.00 0.00 N ATOM 1143 CA ASP A 73 5.284 -16.843 -15.690 1.00 0.00 C ATOM 1144 C ASP A 73 6.309 -15.852 -16.266 1.00 0.00 C ATOM 1145 O ASP A 73 7.428 -15.768 -15.761 1.00 0.00 O ATOM 1146 CB ASP A 73 5.489 -18.263 -16.238 1.00 0.00 C ATOM 1147 CG ASP A 73 6.980 -18.640 -16.354 1.00 0.00 C ATOM 1148 OD1 ASP A 73 7.588 -19.022 -15.327 1.00 0.00 O1- ATOM 1149 OD2 ASP A 73 7.525 -18.611 -17.485 1.00 0.00 O ATOM 0 H ASP A 73 3.427 -16.861 -16.662 1.00 0.00 H new ATOM 0 HA ASP A 73 5.454 -16.885 -14.614 1.00 0.00 H new ATOM 0 HB2 ASP A 73 4.986 -18.977 -15.586 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.020 -18.342 -17.219 1.00 0.00 H new ATOM 1154 N ASP A 74 5.941 -15.044 -17.267 1.00 0.00 N ATOM 1155 CA ASP A 74 6.840 -14.051 -17.864 1.00 0.00 C ATOM 1156 C ASP A 74 7.069 -12.855 -16.931 1.00 0.00 C ATOM 1157 O ASP A 74 8.143 -12.252 -16.952 1.00 0.00 O ATOM 1158 CB ASP A 74 6.280 -13.556 -19.206 1.00 0.00 C ATOM 1159 CG ASP A 74 7.152 -12.430 -19.793 1.00 0.00 C ATOM 1160 OD1 ASP A 74 8.201 -12.734 -20.414 1.00 0.00 O1- ATOM 1161 OD2 ASP A 74 6.769 -11.240 -19.665 1.00 0.00 O ATOM 0 H ASP A 74 5.011 -15.061 -17.686 1.00 0.00 H new ATOM 0 HA ASP A 74 7.799 -14.543 -18.028 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.231 -14.386 -19.911 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.261 -13.195 -19.067 1.00 0.00 H new ATOM 1166 N LEU A 75 6.068 -12.535 -16.098 1.00 0.00 N ATOM 1167 CA LEU A 75 5.997 -11.313 -15.306 1.00 0.00 C ATOM 1168 C LEU A 75 7.246 -11.101 -14.456 1.00 0.00 C ATOM 1169 O LEU A 75 7.745 -12.030 -13.821 1.00 0.00 O ATOM 1170 CB LEU A 75 4.760 -11.322 -14.383 1.00 0.00 C ATOM 1171 CG LEU A 75 3.391 -11.449 -15.070 1.00 0.00 C ATOM 1172 CD1 LEU A 75 2.286 -11.371 -14.016 1.00 0.00 C ATOM 1173 CD2 LEU A 75 3.157 -10.383 -16.138 1.00 0.00 C ATOM 0 H LEU A 75 5.262 -13.144 -15.957 1.00 0.00 H new ATOM 0 HA LEU A 75 5.920 -10.492 -16.019 1.00 0.00 H new ATOM 0 HB2 LEU A 75 4.866 -12.147 -13.679 1.00 0.00 H new ATOM 0 HB3 LEU A 75 4.764 -10.402 -13.799 1.00 0.00 H new ATOM 0 HG LEU A 75 3.374 -12.414 -15.577 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.314 -11.461 -14.501 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.410 -12.182 -13.298 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.345 -10.415 -13.497 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.174 -10.526 -16.586 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.207 -9.394 -15.682 1.00 0.00 H new ATOM 0 HD23 LEU A 75 3.923 -10.466 -16.909 1.00 0.00 H new ATOM 1185 N ASN A 76 7.705 -9.857 -14.372 1.00 0.00 N ATOM 1186 CA ASN A 76 8.748 -9.437 -13.440 1.00 0.00 C ATOM 1187 C ASN A 76 8.128 -9.299 -12.047 1.00 0.00 C ATOM 1188 O ASN A 76 7.341 -8.381 -11.825 1.00 0.00 O ATOM 1189 CB ASN A 76 9.368 -8.108 -13.912 1.00 0.00 C ATOM 1190 CG ASN A 76 10.471 -7.656 -12.960 1.00 0.00 C ATOM 1191 OD1 ASN A 76 10.265 -6.813 -12.091 1.00 0.00 O ATOM 1192 ND2 ASN A 76 11.658 -8.233 -13.078 1.00 0.00 N ATOM 0 H ASN A 76 7.358 -9.099 -14.959 1.00 0.00 H new ATOM 0 HA ASN A 76 9.546 -10.178 -13.401 1.00 0.00 H new ATOM 0 HB2 ASN A 76 9.775 -8.228 -14.916 1.00 0.00 H new ATOM 0 HB3 ASN A 76 8.595 -7.342 -13.970 1.00 0.00 H new ATOM 0 HD21 ASN A 76 12.414 -7.978 -12.443 1.00 0.00 H new ATOM 0 HD22 ASN A 76 11.815 -8.932 -13.804 1.00 0.00 H new ATOM 1199 N LEU A 77 8.429 -10.225 -11.125 1.00 0.00 N ATOM 1200 CA LEU A 77 7.789 -10.287 -9.799 1.00 0.00 C ATOM 1201 C LEU A 77 8.781 -10.331 -8.632 1.00 0.00 C ATOM 1202 O LEU A 77 8.339 -10.458 -7.491 1.00 0.00 O ATOM 1203 CB LEU A 77 6.878 -11.529 -9.696 1.00 0.00 C ATOM 1204 CG LEU A 77 5.781 -11.728 -10.751 1.00 0.00 C ATOM 1205 CD1 LEU A 77 5.002 -12.989 -10.398 1.00 0.00 C ATOM 1206 CD2 LEU A 77 4.776 -10.568 -10.776 1.00 0.00 C ATOM 0 H LEU A 77 9.125 -10.955 -11.277 1.00 0.00 H new ATOM 0 HA LEU A 77 7.215 -9.364 -9.716 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.518 -12.411 -9.715 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.396 -11.505 -8.719 1.00 0.00 H new ATOM 0 HG LEU A 77 6.268 -11.790 -11.724 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.216 -13.150 -11.136 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.677 -13.845 -10.395 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.555 -12.876 -9.410 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.021 -10.757 -11.539 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.294 -10.483 -9.802 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.298 -9.639 -11.005 1.00 0.00 H new ATOM 1218 N GLU A 78 10.089 -10.281 -8.887 1.00 0.00 N ATOM 1219 CA GLU A 78 11.113 -10.559 -7.885 1.00 0.00 C ATOM 1220 C GLU A 78 10.894 -9.732 -6.615 1.00 0.00 C ATOM 1221 O GLU A 78 10.712 -8.512 -6.658 1.00 0.00 O ATOM 1222 CB GLU A 78 12.505 -10.298 -8.485 1.00 0.00 C ATOM 1223 CG GLU A 78 13.516 -11.406 -8.175 1.00 0.00 C ATOM 1224 CD GLU A 78 13.946 -11.423 -6.698 1.00 0.00 C ATOM 1225 OE1 GLU A 78 14.733 -10.537 -6.285 1.00 0.00 O ATOM 1226 OE2 GLU A 78 13.507 -12.327 -5.950 1.00 0.00 O1- ATOM 0 H GLU A 78 10.469 -10.044 -9.804 1.00 0.00 H new ATOM 0 HA GLU A 78 11.043 -11.608 -7.597 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.413 -10.192 -9.566 1.00 0.00 H new ATOM 0 HB3 GLU A 78 12.886 -9.351 -8.103 1.00 0.00 H new ATOM 0 HG2 GLU A 78 13.081 -12.371 -8.433 1.00 0.00 H new ATOM 0 HG3 GLU A 78 14.397 -11.275 -8.804 1.00 0.00 H new ATOM 1233 N GLY A 79 10.900 -10.432 -5.486 1.00 0.00 N ATOM 1234 CA GLY A 79 10.766 -9.887 -4.141 1.00 0.00 C ATOM 1235 C GLY A 79 9.378 -9.346 -3.770 1.00 0.00 C ATOM 1236 O GLY A 79 9.220 -8.899 -2.631 1.00 0.00 O ATOM 0 H GLY A 79 11.004 -11.447 -5.485 1.00 0.00 H new ATOM 0 HA2 GLY A 79 11.034 -10.665 -3.427 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.492 -9.082 -4.022 1.00 0.00 H new ATOM 1240 N LYS A 80 8.373 -9.347 -4.663 1.00 0.00 N ATOM 1241 CA LYS A 80 7.103 -8.682 -4.378 1.00 0.00 C ATOM 1242 C LYS A 80 6.277 -9.505 -3.392 1.00 0.00 C ATOM 1243 O LYS A 80 6.385 -10.735 -3.351 1.00 0.00 O ATOM 1244 CB LYS A 80 6.380 -8.224 -5.664 1.00 0.00 C ATOM 1245 CG LYS A 80 5.316 -9.155 -6.266 1.00 0.00 C ATOM 1246 CD LYS A 80 4.301 -8.431 -7.178 1.00 0.00 C ATOM 1247 CE LYS A 80 4.828 -7.747 -8.467 1.00 0.00 C ATOM 1248 NZ LYS A 80 5.434 -6.395 -8.263 1.00 0.00 N1+ ATOM 0 H LYS A 80 8.420 -9.797 -5.577 1.00 0.00 H new ATOM 0 HA LYS A 80 7.292 -7.740 -3.863 1.00 0.00 H new ATOM 0 HB2 LYS A 80 5.905 -7.265 -5.456 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.138 -8.046 -6.427 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.813 -9.937 -6.840 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.777 -9.647 -5.457 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.543 -9.156 -7.473 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.799 -7.671 -6.579 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.573 -8.397 -8.926 1.00 0.00 H new ATOM 0 HE3 LYS A 80 4.004 -7.656 -9.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.446 -5.880 -9.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.871 -5.863 -7.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.407 -6.500 -7.912 1.00 0.00 H new ATOM 1262 N ILE A 81 5.434 -8.828 -2.616 1.00 0.00 N ATOM 1263 CA ILE A 81 4.563 -9.479 -1.645 1.00 0.00 C ATOM 1264 C ILE A 81 3.357 -10.002 -2.420 1.00 0.00 C ATOM 1265 O ILE A 81 2.821 -9.312 -3.287 1.00 0.00 O ATOM 1266 CB ILE A 81 4.162 -8.552 -0.469 1.00 0.00 C ATOM 1267 CG1 ILE A 81 5.354 -7.732 0.082 1.00 0.00 C ATOM 1268 CG2 ILE A 81 3.525 -9.407 0.647 1.00 0.00 C ATOM 1269 CD1 ILE A 81 5.061 -6.936 1.364 1.00 0.00 C ATOM 0 H ILE A 81 5.337 -7.813 -2.644 1.00 0.00 H new ATOM 0 HA ILE A 81 5.091 -10.300 -1.159 1.00 0.00 H new ATOM 0 HB ILE A 81 3.442 -7.824 -0.844 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.183 -8.412 0.277 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.685 -7.038 -0.690 1.00 0.00 H new ATOM 0 HG21 ILE A 81 3.239 -8.764 1.480 1.00 0.00 H new ATOM 0 HG22 ILE A 81 2.641 -9.912 0.258 1.00 0.00 H new ATOM 0 HG23 ILE A 81 4.245 -10.149 0.992 1.00 0.00 H new ATOM 0 HD11 ILE A 81 5.957 -6.396 1.670 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.256 -6.226 1.175 1.00 0.00 H new ATOM 0 HD13 ILE A 81 4.762 -7.621 2.157 1.00 0.00 H new ATOM 1281 N VAL A 82 2.919 -11.215 -2.116 1.00 0.00 N ATOM 1282 CA VAL A 82 1.859 -11.897 -2.843 1.00 0.00 C ATOM 1283 C VAL A 82 0.869 -12.533 -1.863 1.00 0.00 C ATOM 1284 O VAL A 82 1.288 -13.175 -0.905 1.00 0.00 O ATOM 1285 CB VAL A 82 2.502 -12.905 -3.819 1.00 0.00 C ATOM 1286 CG1 VAL A 82 1.473 -13.799 -4.502 1.00 0.00 C ATOM 1287 CG2 VAL A 82 3.266 -12.176 -4.939 1.00 0.00 C ATOM 0 H VAL A 82 3.297 -11.763 -1.343 1.00 0.00 H new ATOM 0 HA VAL A 82 1.275 -11.194 -3.437 1.00 0.00 H new ATOM 0 HB VAL A 82 3.171 -13.512 -3.209 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.981 -14.488 -5.177 1.00 0.00 H new ATOM 0 HG12 VAL A 82 0.926 -14.366 -3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 82 0.775 -13.183 -5.070 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.710 -12.909 -5.613 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.577 -11.541 -5.496 1.00 0.00 H new ATOM 0 HG23 VAL A 82 4.053 -11.561 -4.502 1.00 0.00 H new ATOM 1297 N ALA A 83 -0.437 -12.406 -2.117 1.00 0.00 N ATOM 1298 CA ALA A 83 -1.484 -13.146 -1.402 1.00 0.00 C ATOM 1299 C ALA A 83 -2.096 -14.145 -2.373 1.00 0.00 C ATOM 1300 O ALA A 83 -2.178 -13.842 -3.562 1.00 0.00 O ATOM 1301 CB ALA A 83 -2.570 -12.199 -0.854 1.00 0.00 C ATOM 0 H ALA A 83 -0.802 -11.779 -2.834 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.046 -13.660 -0.546 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -3.329 -12.780 -0.331 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.117 -11.487 -0.163 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.032 -11.659 -1.680 1.00 0.00 H new ATOM 1307 N LEU A 84 -2.600 -15.280 -1.884 1.00 0.00 N ATOM 1308 CA LEU A 84 -3.312 -16.254 -2.711 1.00 0.00 C ATOM 1309 C LEU A 84 -4.609 -16.620 -2.029 1.00 0.00 C ATOM 1310 O LEU A 84 -4.602 -16.879 -0.830 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.451 -17.520 -2.916 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.823 -17.579 -4.311 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -0.702 -18.616 -4.382 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -2.868 -17.912 -5.388 1.00 0.00 C ATOM 0 H LEU A 84 -2.525 -15.549 -0.903 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.517 -15.816 -3.688 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.662 -17.545 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.068 -18.405 -2.761 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.410 -16.588 -4.501 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.281 -18.629 -5.387 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.078 -18.358 -3.665 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.102 -19.601 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.386 -17.945 -6.365 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.317 -18.881 -5.172 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.643 -17.146 -5.392 1.00 0.00 H new ATOM 1326 N TYR A 85 -5.703 -16.698 -2.773 1.00 0.00 N ATOM 1327 CA TYR A 85 -6.951 -17.263 -2.302 1.00 0.00 C ATOM 1328 C TYR A 85 -7.644 -17.920 -3.488 1.00 0.00 C ATOM 1329 O TYR A 85 -7.266 -17.705 -4.643 1.00 0.00 O ATOM 1330 CB TYR A 85 -7.822 -16.192 -1.628 1.00 0.00 C ATOM 1331 CG TYR A 85 -8.404 -15.143 -2.546 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -7.688 -13.960 -2.802 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -9.674 -15.342 -3.125 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -8.242 -12.992 -3.654 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -10.229 -14.370 -3.975 1.00 0.00 C ATOM 1336 CZ TYR A 85 -9.509 -13.186 -4.242 1.00 0.00 C ATOM 1337 OH TYR A 85 -10.024 -12.224 -5.057 1.00 0.00 O ATOM 0 H TYR A 85 -5.745 -16.364 -3.736 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.766 -18.017 -1.537 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -8.642 -16.690 -1.111 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -7.224 -15.690 -0.867 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.722 -13.798 -2.348 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -10.224 -16.247 -2.914 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -7.691 -12.087 -3.862 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.200 -14.528 -4.421 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.903 -12.508 -5.384 1.00 0.00 H new ATOM 1347 N GLY A 86 -8.664 -18.722 -3.215 1.00 0.00 N ATOM 1348 CA GLY A 86 -9.506 -19.279 -4.252 1.00 0.00 C ATOM 1349 C GLY A 86 -10.800 -19.777 -3.649 1.00 0.00 C ATOM 1350 O GLY A 86 -10.891 -20.001 -2.442 1.00 0.00 O ATOM 0 H GLY A 86 -8.926 -19.001 -2.270 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -9.714 -18.523 -5.009 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -8.989 -20.097 -4.753 1.00 0.00 H new ATOM 1354 N LEU A 87 -11.802 -19.922 -4.505 1.00 0.00 N ATOM 1355 CA LEU A 87 -13.094 -20.498 -4.196 1.00 0.00 C ATOM 1356 C LEU A 87 -13.212 -21.817 -4.945 1.00 0.00 C ATOM 1357 O LEU A 87 -12.654 -21.961 -6.030 1.00 0.00 O ATOM 1358 CB LEU A 87 -14.161 -19.456 -4.562 1.00 0.00 C ATOM 1359 CG LEU A 87 -15.615 -19.955 -4.585 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -16.546 -18.791 -4.244 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -15.981 -20.467 -5.981 1.00 0.00 C ATOM 0 H LEU A 87 -11.728 -19.626 -5.478 1.00 0.00 H new ATOM 0 HA LEU A 87 -13.228 -20.732 -3.140 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -14.093 -18.631 -3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.922 -19.051 -5.545 1.00 0.00 H new ATOM 0 HG LEU A 87 -15.720 -20.763 -3.861 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -17.580 -19.136 -4.258 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.304 -18.410 -3.252 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -16.419 -17.996 -4.979 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -17.013 -20.817 -5.981 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -15.871 -19.660 -6.705 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -15.319 -21.290 -6.252 1.00 0.00 H new ATOM 1373 N GLY A 88 -13.981 -22.748 -4.404 1.00 0.00 N ATOM 1374 CA GLY A 88 -14.360 -23.963 -5.100 1.00 0.00 C ATOM 1375 C GLY A 88 -15.402 -24.719 -4.291 1.00 0.00 C ATOM 1376 O GLY A 88 -16.113 -24.123 -3.477 1.00 0.00 O ATOM 0 H GLY A 88 -14.362 -22.679 -3.460 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -14.758 -23.719 -6.085 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.483 -24.591 -5.257 1.00 0.00 H new ATOM 1380 N ASP A 89 -15.487 -26.030 -4.512 1.00 0.00 N ATOM 1381 CA ASP A 89 -16.317 -26.940 -3.729 1.00 0.00 C ATOM 1382 C ASP A 89 -15.534 -28.224 -3.475 1.00 0.00 C ATOM 1383 O ASP A 89 -14.946 -28.795 -4.397 1.00 0.00 O ATOM 1384 CB ASP A 89 -17.629 -27.255 -4.447 1.00 0.00 C ATOM 1385 CG ASP A 89 -18.337 -28.469 -3.821 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -18.373 -28.601 -2.573 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -18.797 -29.335 -4.599 1.00 0.00 O ATOM 0 H ASP A 89 -14.969 -26.497 -5.256 1.00 0.00 H new ATOM 0 HA ASP A 89 -16.569 -26.462 -2.783 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -18.286 -26.387 -4.403 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -17.430 -27.452 -5.501 1.00 0.00 H new ATOM 1392 N GLN A 90 -15.515 -28.671 -2.222 1.00 0.00 N ATOM 1393 CA GLN A 90 -14.833 -29.884 -1.796 1.00 0.00 C ATOM 1394 C GLN A 90 -15.646 -31.165 -2.064 1.00 0.00 C ATOM 1395 O GLN A 90 -15.080 -32.255 -1.986 1.00 0.00 O ATOM 1396 CB GLN A 90 -14.447 -29.736 -0.311 1.00 0.00 C ATOM 1397 CG GLN A 90 -15.660 -29.716 0.637 1.00 0.00 C ATOM 1398 CD GLN A 90 -15.384 -28.893 1.898 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -15.091 -29.425 2.967 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -15.473 -27.576 1.801 1.00 0.00 N ATOM 0 H GLN A 90 -15.986 -28.186 -1.458 1.00 0.00 H new ATOM 0 HA GLN A 90 -13.931 -30.003 -2.397 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.790 -30.559 -0.030 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.878 -28.815 -0.181 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -16.522 -29.302 0.115 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.918 -30.737 0.919 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -15.717 -27.146 0.909 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -15.298 -26.991 2.618 1.00 0.00 H new ATOM 1409 N LEU A 91 -16.949 -31.068 -2.361 1.00 0.00 N ATOM 1410 CA LEU A 91 -17.855 -32.216 -2.421 1.00 0.00 C ATOM 1411 C LEU A 91 -17.894 -32.857 -3.804 1.00 0.00 C ATOM 1412 O LEU A 91 -17.810 -34.081 -3.918 1.00 0.00 O ATOM 1413 CB LEU A 91 -19.279 -31.813 -1.987 1.00 0.00 C ATOM 1414 CG LEU A 91 -19.383 -31.331 -0.532 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -20.827 -30.894 -0.244 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -18.958 -32.389 0.496 1.00 0.00 C ATOM 0 H LEU A 91 -17.405 -30.180 -2.568 1.00 0.00 H new ATOM 0 HA LEU A 91 -17.463 -32.959 -1.726 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -19.637 -31.022 -2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -19.943 -32.667 -2.123 1.00 0.00 H new ATOM 0 HG LEU A 91 -18.691 -30.496 -0.427 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -20.905 -30.551 0.788 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -21.103 -30.083 -0.918 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -21.500 -31.738 -0.398 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -19.057 -31.980 1.501 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -19.595 -33.268 0.398 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -17.920 -32.671 0.320 1.00 0.00 H new ATOM 1428 N GLY A 92 -18.025 -32.038 -4.849 1.00 0.00 N ATOM 1429 CA GLY A 92 -18.299 -32.494 -6.207 1.00 0.00 C ATOM 1430 C GLY A 92 -17.174 -33.337 -6.807 1.00 0.00 C ATOM 1431 O GLY A 92 -17.451 -34.276 -7.559 1.00 0.00 O ATOM 0 H GLY A 92 -17.942 -31.024 -4.771 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -19.219 -33.078 -6.207 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -18.472 -31.627 -6.845 1.00 0.00 H new ATOM 1435 N TYR A 93 -15.916 -33.044 -6.451 1.00 0.00 N ATOM 1436 CA TYR A 93 -14.753 -33.812 -6.904 1.00 0.00 C ATOM 1437 C TYR A 93 -13.645 -33.799 -5.850 1.00 0.00 C ATOM 1438 O TYR A 93 -13.024 -34.827 -5.583 1.00 0.00 O ATOM 1439 CB TYR A 93 -14.276 -33.252 -8.259 1.00 0.00 C ATOM 1440 CG TYR A 93 -13.092 -33.936 -8.936 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -12.830 -35.316 -8.766 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -12.279 -33.186 -9.812 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -11.750 -35.923 -9.431 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -11.201 -33.789 -10.483 1.00 0.00 C ATOM 1445 CZ TYR A 93 -10.926 -35.162 -10.294 1.00 0.00 C ATOM 1446 OH TYR A 93 -9.882 -35.740 -10.957 1.00 0.00 O ATOM 0 H TYR A 93 -15.678 -32.264 -5.838 1.00 0.00 H new ATOM 0 HA TYR A 93 -15.033 -34.856 -7.043 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -15.119 -33.282 -8.949 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -14.019 -32.203 -8.116 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -13.464 -35.907 -8.121 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -12.487 -32.138 -9.969 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -11.549 -36.974 -9.283 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -10.582 -33.202 -11.144 1.00 0.00 H new ATOM 0 HH TYR A 93 -9.429 -35.066 -11.505 1.00 0.00 H new ATOM 1456 N GLY A 94 -13.420 -32.644 -5.217 1.00 0.00 N ATOM 1457 CA GLY A 94 -12.497 -32.490 -4.092 1.00 0.00 C ATOM 1458 C GLY A 94 -11.051 -32.345 -4.547 1.00 0.00 C ATOM 1459 O GLY A 94 -10.338 -31.492 -4.025 1.00 0.00 O ATOM 0 H GLY A 94 -13.884 -31.774 -5.478 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.782 -31.614 -3.509 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.583 -33.354 -3.433 1.00 0.00 H new ATOM 1463 N GLU A 95 -10.617 -33.086 -5.571 1.00 0.00 N ATOM 1464 CA GLU A 95 -9.277 -32.932 -6.141 1.00 0.00 C ATOM 1465 C GLU A 95 -9.135 -31.539 -6.757 1.00 0.00 C ATOM 1466 O GLU A 95 -8.097 -30.902 -6.611 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.993 -34.039 -7.168 1.00 0.00 C ATOM 1468 CG GLU A 95 -8.748 -35.394 -6.490 1.00 0.00 C ATOM 1469 CD GLU A 95 -8.365 -36.499 -7.495 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -7.240 -36.454 -8.053 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -9.155 -37.455 -7.690 1.00 0.00 O1- ATOM 0 H GLU A 95 -11.181 -33.805 -6.025 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.536 -33.031 -5.348 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.835 -34.123 -7.855 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.122 -33.768 -7.764 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.953 -35.288 -5.752 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.646 -35.694 -5.951 1.00 0.00 H new ATOM 1478 N TRP A 96 -10.198 -31.006 -7.366 1.00 0.00 N ATOM 1479 CA TRP A 96 -10.222 -29.643 -7.890 1.00 0.00 C ATOM 1480 C TRP A 96 -10.902 -28.676 -6.905 1.00 0.00 C ATOM 1481 O TRP A 96 -11.597 -27.756 -7.329 1.00 0.00 O ATOM 1482 CB TRP A 96 -10.823 -29.622 -9.308 1.00 0.00 C ATOM 1483 CG TRP A 96 -10.034 -30.258 -10.416 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -8.833 -30.879 -10.319 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -10.369 -30.284 -11.838 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -8.409 -31.282 -11.569 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -9.315 -30.935 -12.544 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -11.457 -29.815 -12.609 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -9.329 -31.110 -13.934 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -11.488 -29.994 -14.006 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -10.425 -30.633 -14.673 1.00 0.00 C ATOM 0 H TRP A 96 -11.071 -31.514 -7.509 1.00 0.00 H new ATOM 0 HA TRP A 96 -9.200 -29.278 -7.988 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -11.796 -30.112 -9.266 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -11.002 -28.582 -9.580 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -8.288 -31.035 -9.400 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -7.534 -31.775 -11.747 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -12.277 -29.311 -12.119 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -8.508 -31.605 -14.431 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -12.336 -29.637 -14.572 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -10.452 -30.756 -15.746 1.00 0.00 H new ATOM 1502 N PHE A 97 -10.707 -28.858 -5.589 1.00 0.00 N ATOM 1503 CA PHE A 97 -11.216 -27.899 -4.603 1.00 0.00 C ATOM 1504 C PHE A 97 -10.573 -26.530 -4.843 1.00 0.00 C ATOM 1505 O PHE A 97 -11.273 -25.533 -4.988 1.00 0.00 O ATOM 1506 CB PHE A 97 -10.940 -28.388 -3.167 1.00 0.00 C ATOM 1507 CG PHE A 97 -11.328 -27.412 -2.064 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -12.529 -26.679 -2.135 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -10.468 -27.221 -0.965 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -12.852 -25.745 -1.137 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -10.795 -26.288 0.036 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.983 -25.542 -0.055 1.00 0.00 C ATOM 0 H PHE A 97 -10.206 -29.652 -5.189 1.00 0.00 H new ATOM 0 HA PHE A 97 -12.296 -27.811 -4.720 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -11.478 -29.323 -3.009 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.877 -28.612 -3.075 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -13.206 -26.836 -2.962 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -9.555 -27.793 -0.890 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -13.771 -25.182 -1.203 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -10.132 -26.145 0.876 1.00 0.00 H new ATOM 0 HZ PHE A 97 -12.226 -24.815 0.706 1.00 0.00 H new ATOM 1522 N LEU A 98 -9.235 -26.489 -4.899 1.00 0.00 N ATOM 1523 CA LEU A 98 -8.451 -25.254 -5.018 1.00 0.00 C ATOM 1524 C LEU A 98 -7.252 -25.479 -5.941 1.00 0.00 C ATOM 1525 O LEU A 98 -6.214 -24.844 -5.787 1.00 0.00 O ATOM 1526 CB LEU A 98 -8.029 -24.775 -3.607 1.00 0.00 C ATOM 1527 CG LEU A 98 -9.169 -24.210 -2.737 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -8.654 -23.909 -1.324 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -9.805 -22.945 -3.312 1.00 0.00 C ATOM 0 H LEU A 98 -8.657 -27.329 -4.862 1.00 0.00 H new ATOM 0 HA LEU A 98 -9.056 -24.467 -5.468 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.571 -25.611 -3.079 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.262 -24.008 -3.716 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.941 -24.980 -2.714 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.467 -23.510 -0.718 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.279 -24.826 -0.870 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.849 -23.176 -1.379 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -10.599 -22.603 -2.648 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.048 -22.166 -3.403 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.222 -23.162 -4.295 1.00 0.00 H new ATOM 1541 N ASP A 99 -7.345 -26.403 -6.893 1.00 0.00 N ATOM 1542 CA ASP A 99 -6.194 -26.817 -7.702 1.00 0.00 C ATOM 1543 C ASP A 99 -5.593 -25.646 -8.483 1.00 0.00 C ATOM 1544 O ASP A 99 -4.371 -25.550 -8.593 1.00 0.00 O ATOM 1545 CB ASP A 99 -6.597 -27.957 -8.637 1.00 0.00 C ATOM 1546 CG ASP A 99 -5.399 -28.455 -9.463 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -4.402 -28.917 -8.864 1.00 0.00 O ATOM 1548 OD2 ASP A 99 -5.454 -28.416 -10.711 1.00 0.00 O1- ATOM 0 H ASP A 99 -8.213 -26.885 -7.127 1.00 0.00 H new ATOM 0 HA ASP A 99 -5.417 -27.174 -7.026 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -7.006 -28.781 -8.053 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.387 -27.618 -9.307 1.00 0.00 H new ATOM 1553 N ALA A 100 -6.410 -24.682 -8.934 1.00 0.00 N ATOM 1554 CA ALA A 100 -5.889 -23.514 -9.632 1.00 0.00 C ATOM 1555 C ALA A 100 -5.185 -22.532 -8.686 1.00 0.00 C ATOM 1556 O ALA A 100 -4.233 -21.873 -9.103 1.00 0.00 O ATOM 1557 CB ALA A 100 -6.993 -22.864 -10.469 1.00 0.00 C ATOM 0 H ALA A 100 -7.424 -24.694 -8.826 1.00 0.00 H new ATOM 0 HA ALA A 100 -5.111 -23.844 -10.320 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -6.592 -21.992 -10.986 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.365 -23.581 -11.201 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -7.810 -22.555 -9.817 1.00 0.00 H new ATOM 1563 N LEU A 101 -5.574 -22.486 -7.402 1.00 0.00 N ATOM 1564 CA LEU A 101 -4.827 -21.765 -6.365 1.00 0.00 C ATOM 1565 C LEU A 101 -3.431 -22.391 -6.285 1.00 0.00 C ATOM 1566 O LEU A 101 -2.422 -21.686 -6.328 1.00 0.00 O ATOM 1567 CB LEU A 101 -5.591 -21.868 -5.021 1.00 0.00 C ATOM 1568 CG LEU A 101 -5.190 -20.909 -3.890 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -6.131 -21.104 -2.695 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -3.779 -21.191 -3.379 1.00 0.00 C ATOM 0 H LEU A 101 -6.415 -22.948 -7.056 1.00 0.00 H new ATOM 0 HA LEU A 101 -4.727 -20.705 -6.599 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.651 -21.718 -5.227 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -5.480 -22.887 -4.650 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.243 -19.899 -4.297 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.846 -20.423 -1.893 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -7.156 -20.895 -3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -6.061 -22.132 -2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.535 -20.491 -2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.728 -22.210 -2.997 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -3.066 -21.073 -4.195 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.375 -23.728 -6.242 1.00 0.00 N ATOM 1583 CA GLY A 102 -2.125 -24.468 -6.142 1.00 0.00 C ATOM 1584 C GLY A 102 -1.234 -24.221 -7.351 1.00 0.00 C ATOM 1585 O GLY A 102 -0.039 -24.003 -7.187 1.00 0.00 O ATOM 0 H GLY A 102 -4.203 -24.323 -6.276 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -1.598 -24.174 -5.234 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -2.337 -25.534 -6.057 1.00 0.00 H new ATOM 1589 N MET A 103 -1.803 -24.197 -8.560 1.00 0.00 N ATOM 1590 CA MET A 103 -1.022 -23.957 -9.771 1.00 0.00 C ATOM 1591 C MET A 103 -0.402 -22.559 -9.777 1.00 0.00 C ATOM 1592 O MET A 103 0.750 -22.433 -10.190 1.00 0.00 O ATOM 1593 CB MET A 103 -1.869 -24.207 -11.030 1.00 0.00 C ATOM 1594 CG MET A 103 -2.121 -25.702 -11.250 1.00 0.00 C ATOM 1595 SD MET A 103 -2.991 -26.152 -12.773 1.00 0.00 S ATOM 1596 CE MET A 103 -4.640 -25.505 -12.392 1.00 0.00 C ATOM 0 H MET A 103 -2.800 -24.341 -8.723 1.00 0.00 H new ATOM 0 HA MET A 103 -0.197 -24.669 -9.779 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.822 -23.686 -10.938 1.00 0.00 H new ATOM 0 HB3 MET A 103 -1.361 -23.791 -11.900 1.00 0.00 H new ATOM 0 HG2 MET A 103 -1.160 -26.216 -11.240 1.00 0.00 H new ATOM 0 HG3 MET A 103 -2.694 -26.081 -10.404 1.00 0.00 H new ATOM 0 HE1 MET A 103 -5.309 -25.698 -13.230 1.00 0.00 H new ATOM 0 HE2 MET A 103 -5.026 -25.996 -11.499 1.00 0.00 H new ATOM 0 HE3 MET A 103 -4.578 -24.431 -12.217 1.00 0.00 H new ATOM 1606 N LEU A 104 -1.092 -21.510 -9.296 1.00 0.00 N ATOM 1607 CA LEU A 104 -0.471 -20.188 -9.289 1.00 0.00 C ATOM 1608 C LEU A 104 0.627 -20.123 -8.230 1.00 0.00 C ATOM 1609 O LEU A 104 1.670 -19.538 -8.493 1.00 0.00 O ATOM 1610 CB LEU A 104 -1.526 -19.062 -9.197 1.00 0.00 C ATOM 1611 CG LEU A 104 -1.007 -17.668 -9.600 1.00 0.00 C ATOM 1612 CD1 LEU A 104 0.011 -17.626 -10.753 1.00 0.00 C ATOM 1613 CD2 LEU A 104 -2.159 -16.775 -10.039 1.00 0.00 C ATOM 0 H LEU A 104 -2.040 -21.552 -8.923 1.00 0.00 H new ATOM 0 HA LEU A 104 0.025 -20.017 -10.244 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.371 -19.320 -9.835 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.901 -19.015 -8.175 1.00 0.00 H new ATOM 0 HG LEU A 104 -0.503 -17.329 -8.695 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.301 -16.593 -10.944 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.893 -18.206 -10.481 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.439 -18.049 -11.651 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -1.773 -15.795 -10.320 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.663 -17.225 -10.894 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.867 -16.664 -9.218 1.00 0.00 H new ATOM 1625 N HIS A 105 0.459 -20.790 -7.083 1.00 0.00 N ATOM 1626 CA HIS A 105 1.545 -20.974 -6.119 1.00 0.00 C ATOM 1627 C HIS A 105 2.759 -21.611 -6.802 1.00 0.00 C ATOM 1628 O HIS A 105 3.862 -21.065 -6.744 1.00 0.00 O ATOM 1629 CB HIS A 105 1.053 -21.804 -4.917 1.00 0.00 C ATOM 1630 CG HIS A 105 2.069 -22.792 -4.388 1.00 0.00 C ATOM 1631 ND1 HIS A 105 3.293 -22.457 -3.802 1.00 0.00 N ATOM 1632 CD2 HIS A 105 1.954 -24.152 -4.446 1.00 0.00 C ATOM 1633 CE1 HIS A 105 3.888 -23.628 -3.519 1.00 0.00 C ATOM 1634 NE2 HIS A 105 3.107 -24.660 -3.891 1.00 0.00 N ATOM 0 H HIS A 105 -0.425 -21.213 -6.800 1.00 0.00 H new ATOM 0 HA HIS A 105 1.860 -20.002 -5.738 1.00 0.00 H new ATOM 0 HB2 HIS A 105 0.770 -21.125 -4.113 1.00 0.00 H new ATOM 0 HB3 HIS A 105 0.153 -22.346 -5.208 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.125 -24.716 -4.847 1.00 0.00 H new ATOM 0 HE1 HIS A 105 4.859 -23.728 -3.057 1.00 0.00 H new ATOM 0 HE2 HIS A 105 3.331 -25.649 -3.780 1.00 0.00 H new ATOM 1642 N ASP A 106 2.548 -22.724 -7.504 1.00 0.00 N ATOM 1643 CA ASP A 106 3.634 -23.521 -8.066 1.00 0.00 C ATOM 1644 C ASP A 106 4.406 -22.743 -9.128 1.00 0.00 C ATOM 1645 O ASP A 106 5.639 -22.717 -9.114 1.00 0.00 O ATOM 1646 CB ASP A 106 3.092 -24.828 -8.646 1.00 0.00 C ATOM 1647 CG ASP A 106 4.228 -25.623 -9.307 1.00 0.00 C ATOM 1648 OD1 ASP A 106 5.041 -26.236 -8.576 1.00 0.00 O ATOM 1649 OD2 ASP A 106 4.297 -25.652 -10.559 1.00 0.00 O1- ATOM 0 H ASP A 106 1.619 -23.097 -7.698 1.00 0.00 H new ATOM 0 HA ASP A 106 4.327 -23.756 -7.259 1.00 0.00 H new ATOM 0 HB2 ASP A 106 2.633 -25.423 -7.856 1.00 0.00 H new ATOM 0 HB3 ASP A 106 2.313 -24.615 -9.378 1.00 0.00 H new ATOM 1654 N LYS A 107 3.678 -22.029 -9.993 1.00 0.00 N ATOM 1655 CA LYS A 107 4.249 -21.117 -10.979 1.00 0.00 C ATOM 1656 C LYS A 107 5.087 -20.032 -10.291 1.00 0.00 C ATOM 1657 O LYS A 107 6.126 -19.637 -10.818 1.00 0.00 O ATOM 1658 CB LYS A 107 3.110 -20.513 -11.815 1.00 0.00 C ATOM 1659 CG LYS A 107 3.675 -19.629 -12.938 1.00 0.00 C ATOM 1660 CD LYS A 107 2.596 -19.062 -13.869 1.00 0.00 C ATOM 1661 CE LYS A 107 1.833 -20.051 -14.771 1.00 0.00 C ATOM 1662 NZ LYS A 107 2.685 -20.971 -15.591 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.659 -22.072 -10.025 1.00 0.00 H new ATOM 0 HA LYS A 107 4.920 -21.662 -11.643 1.00 0.00 H new ATOM 0 HB2 LYS A 107 2.503 -21.311 -12.243 1.00 0.00 H new ATOM 0 HB3 LYS A 107 2.455 -19.923 -11.175 1.00 0.00 H new ATOM 0 HG2 LYS A 107 4.232 -18.804 -12.495 1.00 0.00 H new ATOM 0 HG3 LYS A 107 4.383 -20.212 -13.527 1.00 0.00 H new ATOM 0 HD2 LYS A 107 1.865 -18.537 -13.254 1.00 0.00 H new ATOM 0 HD3 LYS A 107 3.066 -18.317 -14.511 1.00 0.00 H new ATOM 0 HE2 LYS A 107 1.177 -20.655 -14.144 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.193 -19.481 -15.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.076 -21.593 -16.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 3.293 -20.411 -16.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 3.278 -21.549 -14.961 1.00 0.00 H new ATOM 1676 N LEU A 108 4.629 -19.520 -9.146 1.00 0.00 N ATOM 1677 CA LEU A 108 5.203 -18.338 -8.507 1.00 0.00 C ATOM 1678 C LEU A 108 6.365 -18.637 -7.578 1.00 0.00 C ATOM 1679 O LEU A 108 7.163 -17.732 -7.340 1.00 0.00 O ATOM 1680 CB LEU A 108 4.111 -17.588 -7.742 1.00 0.00 C ATOM 1681 CG LEU A 108 3.189 -16.798 -8.674 1.00 0.00 C ATOM 1682 CD1 LEU A 108 1.981 -16.317 -7.892 1.00 0.00 C ATOM 1683 CD2 LEU A 108 3.883 -15.582 -9.258 1.00 0.00 C ATOM 0 H LEU A 108 3.843 -19.919 -8.634 1.00 0.00 H new ATOM 0 HA LEU A 108 5.609 -17.724 -9.311 1.00 0.00 H new ATOM 0 HB2 LEU A 108 3.519 -18.300 -7.166 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.573 -16.906 -7.028 1.00 0.00 H new ATOM 0 HG LEU A 108 2.899 -17.462 -9.488 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.321 -15.754 -8.552 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.444 -17.175 -7.488 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.309 -15.676 -7.074 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.194 -15.050 -9.913 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.200 -14.921 -8.451 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.755 -15.900 -9.830 1.00 0.00 H new ATOM 1695 N SER A 109 6.492 -19.857 -7.063 1.00 0.00 N ATOM 1696 CA SER A 109 7.529 -20.188 -6.093 1.00 0.00 C ATOM 1697 C SER A 109 8.928 -19.876 -6.657 1.00 0.00 C ATOM 1698 O SER A 109 9.795 -19.365 -5.944 1.00 0.00 O ATOM 1699 CB SER A 109 7.375 -21.672 -5.725 1.00 0.00 C ATOM 1700 OG SER A 109 8.113 -21.997 -4.558 1.00 0.00 O ATOM 0 H SER A 109 5.883 -20.639 -7.305 1.00 0.00 H new ATOM 0 HA SER A 109 7.419 -19.580 -5.195 1.00 0.00 H new ATOM 0 HB2 SER A 109 6.321 -21.901 -5.566 1.00 0.00 H new ATOM 0 HB3 SER A 109 7.714 -22.291 -6.556 1.00 0.00 H new ATOM 0 HG SER A 109 7.993 -22.947 -4.349 1.00 0.00 H new ATOM 1706 N THR A 110 9.131 -20.093 -7.959 1.00 0.00 N ATOM 1707 CA THR A 110 10.402 -19.885 -8.645 1.00 0.00 C ATOM 1708 C THR A 110 10.576 -18.429 -9.120 1.00 0.00 C ATOM 1709 O THR A 110 11.669 -18.046 -9.542 1.00 0.00 O ATOM 1710 CB THR A 110 10.488 -20.922 -9.785 1.00 0.00 C ATOM 1711 OG1 THR A 110 9.280 -20.912 -10.535 1.00 0.00 O ATOM 1712 CG2 THR A 110 10.675 -22.336 -9.216 1.00 0.00 C ATOM 0 H THR A 110 8.393 -20.427 -8.579 1.00 0.00 H new ATOM 0 HA THR A 110 11.236 -20.040 -7.960 1.00 0.00 H new ATOM 0 HB THR A 110 11.337 -20.660 -10.416 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.339 -21.570 -11.259 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.733 -23.053 -10.035 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.595 -22.375 -8.633 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.829 -22.585 -8.575 1.00 0.00 H new ATOM 1720 N LYS A 111 9.533 -17.584 -9.019 1.00 0.00 N ATOM 1721 CA LYS A 111 9.586 -16.158 -9.340 1.00 0.00 C ATOM 1722 C LYS A 111 10.133 -15.333 -8.169 1.00 0.00 C ATOM 1723 O LYS A 111 10.373 -14.138 -8.333 1.00 0.00 O ATOM 1724 CB LYS A 111 8.200 -15.653 -9.802 1.00 0.00 C ATOM 1725 CG LYS A 111 7.634 -16.348 -11.058 1.00 0.00 C ATOM 1726 CD LYS A 111 8.455 -16.182 -12.345 1.00 0.00 C ATOM 1727 CE LYS A 111 8.462 -14.721 -12.821 1.00 0.00 C ATOM 1728 NZ LYS A 111 9.242 -14.537 -14.075 1.00 0.00 N1+ ATOM 0 H LYS A 111 8.612 -17.888 -8.704 1.00 0.00 H new ATOM 0 HA LYS A 111 10.283 -16.025 -10.168 1.00 0.00 H new ATOM 0 HB2 LYS A 111 7.492 -15.784 -8.984 1.00 0.00 H new ATOM 0 HB3 LYS A 111 8.267 -14.583 -9.997 1.00 0.00 H new ATOM 0 HG2 LYS A 111 7.537 -17.413 -10.847 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.629 -15.966 -11.239 1.00 0.00 H new ATOM 0 HD2 LYS A 111 9.478 -16.514 -12.171 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.042 -16.819 -13.127 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.436 -14.389 -12.982 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.882 -14.089 -12.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.217 -13.536 -14.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.228 -14.828 -13.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 8.827 -15.119 -14.831 1.00 0.00 H new ATOM 1742 N GLY A 112 10.322 -15.943 -6.994 1.00 0.00 N ATOM 1743 CA GLY A 112 10.966 -15.296 -5.858 1.00 0.00 C ATOM 1744 C GLY A 112 10.058 -14.276 -5.176 1.00 0.00 C ATOM 1745 O GLY A 112 10.544 -13.286 -4.630 1.00 0.00 O ATOM 0 H GLY A 112 10.030 -16.903 -6.809 1.00 0.00 H new ATOM 0 HA2 GLY A 112 11.265 -16.054 -5.134 1.00 0.00 H new ATOM 0 HA3 GLY A 112 11.876 -14.800 -6.194 1.00 0.00 H new ATOM 1749 N VAL A 113 8.736 -14.479 -5.228 1.00 0.00 N ATOM 1750 CA VAL A 113 7.788 -13.676 -4.475 1.00 0.00 C ATOM 1751 C VAL A 113 7.818 -14.081 -2.990 1.00 0.00 C ATOM 1752 O VAL A 113 8.493 -15.043 -2.605 1.00 0.00 O ATOM 1753 CB VAL A 113 6.394 -13.783 -5.116 1.00 0.00 C ATOM 1754 CG1 VAL A 113 6.441 -13.401 -6.600 1.00 0.00 C ATOM 1755 CG2 VAL A 113 5.733 -15.154 -4.924 1.00 0.00 C ATOM 0 H VAL A 113 8.302 -15.207 -5.796 1.00 0.00 H new ATOM 0 HA VAL A 113 8.067 -12.623 -4.510 1.00 0.00 H new ATOM 0 HB VAL A 113 5.765 -13.068 -4.586 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.443 -13.485 -7.029 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.794 -12.375 -6.700 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.120 -14.071 -7.127 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.753 -15.156 -5.402 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.358 -15.925 -5.374 1.00 0.00 H new ATOM 0 HG23 VAL A 113 5.617 -15.356 -3.859 1.00 0.00 H new ATOM 1765 N LYS A 114 7.048 -13.375 -2.160 1.00 0.00 N ATOM 1766 CA LYS A 114 6.862 -13.691 -0.744 1.00 0.00 C ATOM 1767 C LYS A 114 5.373 -13.907 -0.531 1.00 0.00 C ATOM 1768 O LYS A 114 4.611 -13.013 -0.881 1.00 0.00 O ATOM 1769 CB LYS A 114 7.430 -12.536 0.103 1.00 0.00 C ATOM 1770 CG LYS A 114 7.581 -12.902 1.591 1.00 0.00 C ATOM 1771 CD LYS A 114 6.398 -12.451 2.465 1.00 0.00 C ATOM 1772 CE LYS A 114 6.388 -13.147 3.840 1.00 0.00 C ATOM 1773 NZ LYS A 114 7.594 -12.861 4.670 1.00 0.00 N1+ ATOM 0 H LYS A 114 6.526 -12.551 -2.460 1.00 0.00 H new ATOM 0 HA LYS A 114 7.392 -14.593 -0.439 1.00 0.00 H new ATOM 0 HB2 LYS A 114 8.402 -12.244 -0.295 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.775 -11.669 0.012 1.00 0.00 H new ATOM 0 HG2 LYS A 114 7.695 -13.982 1.680 1.00 0.00 H new ATOM 0 HG3 LYS A 114 8.497 -12.452 1.975 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.445 -11.371 2.607 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.464 -12.664 1.946 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.499 -12.835 4.388 1.00 0.00 H new ATOM 0 HE3 LYS A 114 6.308 -14.224 3.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 7.364 -12.997 5.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 8.362 -13.508 4.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 7.898 -11.879 4.514 1.00 0.00 H new ATOM 1787 N PHE A 115 4.947 -15.036 0.030 1.00 0.00 N ATOM 1788 CA PHE A 115 3.522 -15.306 0.231 1.00 0.00 C ATOM 1789 C PHE A 115 3.093 -14.768 1.593 1.00 0.00 C ATOM 1790 O PHE A 115 3.864 -14.826 2.552 1.00 0.00 O ATOM 1791 CB PHE A 115 3.210 -16.801 0.064 1.00 0.00 C ATOM 1792 CG PHE A 115 3.465 -17.325 -1.338 1.00 0.00 C ATOM 1793 CD1 PHE A 115 2.606 -16.960 -2.395 1.00 0.00 C ATOM 1794 CD2 PHE A 115 4.558 -18.178 -1.593 1.00 0.00 C ATOM 1795 CE1 PHE A 115 2.842 -17.444 -3.695 1.00 0.00 C ATOM 1796 CE2 PHE A 115 4.782 -18.673 -2.890 1.00 0.00 C ATOM 1797 CZ PHE A 115 3.923 -18.308 -3.940 1.00 0.00 C ATOM 0 H PHE A 115 5.566 -15.779 0.354 1.00 0.00 H new ATOM 0 HA PHE A 115 2.943 -14.790 -0.535 1.00 0.00 H new ATOM 0 HB2 PHE A 115 3.814 -17.370 0.770 1.00 0.00 H new ATOM 0 HB3 PHE A 115 2.166 -16.976 0.324 1.00 0.00 H new ATOM 0 HD1 PHE A 115 1.766 -16.308 -2.207 1.00 0.00 H new ATOM 0 HD2 PHE A 115 5.226 -18.452 -0.790 1.00 0.00 H new ATOM 0 HE1 PHE A 115 2.191 -17.151 -4.506 1.00 0.00 H new ATOM 0 HE2 PHE A 115 5.615 -19.334 -3.079 1.00 0.00 H new ATOM 0 HZ PHE A 115 4.093 -18.691 -4.935 1.00 0.00 H new ATOM 1807 N VAL A 116 1.861 -14.265 1.690 1.00 0.00 N ATOM 1808 CA VAL A 116 1.226 -13.881 2.950 1.00 0.00 C ATOM 1809 C VAL A 116 -0.130 -14.582 3.061 1.00 0.00 C ATOM 1810 O VAL A 116 -0.732 -14.955 2.052 1.00 0.00 O ATOM 1811 CB VAL A 116 1.139 -12.340 3.090 1.00 0.00 C ATOM 1812 CG1 VAL A 116 2.543 -11.723 3.157 1.00 0.00 C ATOM 1813 CG2 VAL A 116 0.356 -11.637 1.973 1.00 0.00 C ATOM 0 H VAL A 116 1.265 -14.110 0.877 1.00 0.00 H new ATOM 0 HA VAL A 116 1.837 -14.210 3.791 1.00 0.00 H new ATOM 0 HB VAL A 116 0.588 -12.179 4.017 1.00 0.00 H new ATOM 0 HG11 VAL A 116 2.460 -10.641 3.255 1.00 0.00 H new ATOM 0 HG12 VAL A 116 3.077 -12.126 4.018 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.090 -11.964 2.246 1.00 0.00 H new ATOM 0 HG21 VAL A 116 0.348 -10.562 2.155 1.00 0.00 H new ATOM 0 HG22 VAL A 116 0.831 -11.839 1.013 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -0.668 -12.010 1.957 1.00 0.00 H new ATOM 1823 N GLY A 117 -0.637 -14.725 4.285 1.00 0.00 N ATOM 1824 CA GLY A 117 -1.972 -15.237 4.542 1.00 0.00 C ATOM 1825 C GLY A 117 -1.944 -16.729 4.830 1.00 0.00 C ATOM 1826 O GLY A 117 -1.856 -17.112 5.996 1.00 0.00 O ATOM 0 H GLY A 117 -0.122 -14.484 5.132 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -2.410 -14.709 5.389 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -2.611 -15.042 3.680 1.00 0.00 H new ATOM 1830 N TYR A 118 -2.037 -17.551 3.774 1.00 0.00 N ATOM 1831 CA TYR A 118 -2.265 -19.003 3.875 1.00 0.00 C ATOM 1832 C TYR A 118 -3.573 -19.292 4.648 1.00 0.00 C ATOM 1833 O TYR A 118 -4.352 -18.364 4.867 1.00 0.00 O ATOM 1834 CB TYR A 118 -0.988 -19.679 4.418 1.00 0.00 C ATOM 1835 CG TYR A 118 0.265 -19.653 3.545 1.00 0.00 C ATOM 1836 CD1 TYR A 118 0.239 -19.412 2.153 1.00 0.00 C ATOM 1837 CD2 TYR A 118 1.488 -19.984 4.153 1.00 0.00 C ATOM 1838 CE1 TYR A 118 1.394 -19.600 1.373 1.00 0.00 C ATOM 1839 CE2 TYR A 118 2.663 -20.113 3.391 1.00 0.00 C ATOM 1840 CZ TYR A 118 2.617 -19.953 1.989 1.00 0.00 C ATOM 1841 OH TYR A 118 3.746 -20.164 1.250 1.00 0.00 O ATOM 0 H TYR A 118 -1.955 -17.223 2.812 1.00 0.00 H new ATOM 0 HA TYR A 118 -2.435 -19.454 2.897 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -0.741 -19.210 5.370 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -1.226 -20.722 4.629 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -0.676 -19.081 1.684 1.00 0.00 H new ATOM 0 HD2 TYR A 118 1.526 -20.142 5.221 1.00 0.00 H new ATOM 0 HE1 TYR A 118 1.347 -19.475 0.301 1.00 0.00 H new ATOM 0 HE2 TYR A 118 3.601 -20.335 3.879 1.00 0.00 H new ATOM 0 HH TYR A 118 3.774 -19.526 0.507 1.00 0.00 H new ATOM 1851 N TRP A 119 -3.906 -20.549 4.969 1.00 0.00 N ATOM 1852 CA TRP A 119 -5.126 -20.884 5.723 1.00 0.00 C ATOM 1853 C TRP A 119 -4.922 -22.209 6.474 1.00 0.00 C ATOM 1854 O TRP A 119 -4.223 -23.072 5.940 1.00 0.00 O ATOM 1855 CB TRP A 119 -6.335 -20.968 4.764 1.00 0.00 C ATOM 1856 CG TRP A 119 -7.633 -20.439 5.285 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -7.977 -19.136 5.263 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -8.733 -21.120 5.966 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -9.206 -18.969 5.860 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -9.658 -20.138 6.423 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -9.019 -22.455 6.307 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -10.742 -20.443 7.259 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -10.094 -22.782 7.155 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -10.934 -21.775 7.661 1.00 0.00 C ATOM 0 H TRP A 119 -3.342 -21.360 4.716 1.00 0.00 H new ATOM 0 HA TRP A 119 -5.329 -20.101 6.454 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -6.086 -20.426 3.852 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -6.478 -22.012 4.485 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -7.378 -18.342 4.841 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.718 -18.087 5.882 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -8.400 -23.246 5.909 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -11.417 -19.667 7.588 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -10.275 -23.814 7.419 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -11.723 -22.024 8.355 1.00 0.00 H new ATOM 1875 N PRO A 120 -5.496 -22.420 7.673 1.00 0.00 N ATOM 1876 CA PRO A 120 -5.349 -23.674 8.418 1.00 0.00 C ATOM 1877 C PRO A 120 -6.052 -24.847 7.720 1.00 0.00 C ATOM 1878 O PRO A 120 -7.260 -24.810 7.494 1.00 0.00 O ATOM 1879 CB PRO A 120 -5.935 -23.396 9.809 1.00 0.00 C ATOM 1880 CG PRO A 120 -6.924 -22.255 9.568 1.00 0.00 C ATOM 1881 CD PRO A 120 -6.237 -21.450 8.470 1.00 0.00 C ATOM 0 HA PRO A 120 -4.304 -23.977 8.481 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -6.432 -24.276 10.217 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.160 -23.110 10.520 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -7.900 -22.624 9.251 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -7.085 -21.660 10.467 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -6.967 -20.918 7.860 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -5.569 -20.700 8.894 1.00 0.00 H new ATOM 1889 N THR A 121 -5.322 -25.927 7.435 1.00 0.00 N ATOM 1890 CA THR A 121 -5.904 -27.174 6.929 1.00 0.00 C ATOM 1891 C THR A 121 -6.570 -28.001 8.042 1.00 0.00 C ATOM 1892 O THR A 121 -7.280 -28.963 7.740 1.00 0.00 O ATOM 1893 CB THR A 121 -4.811 -28.002 6.235 1.00 0.00 C ATOM 1894 OG1 THR A 121 -3.604 -27.916 6.962 1.00 0.00 O ATOM 1895 CG2 THR A 121 -4.530 -27.522 4.812 1.00 0.00 C ATOM 0 H THR A 121 -4.309 -25.963 7.548 1.00 0.00 H new ATOM 0 HA THR A 121 -6.685 -26.913 6.215 1.00 0.00 H new ATOM 0 HB THR A 121 -5.179 -29.027 6.196 1.00 0.00 H new ATOM 0 HG1 THR A 121 -3.032 -28.680 6.738 1.00 0.00 H new ATOM 0 HG21 THR A 121 -3.750 -28.140 4.367 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.439 -27.599 4.216 1.00 0.00 H new ATOM 0 HG23 THR A 121 -4.200 -26.484 4.837 1.00 0.00 H new ATOM 1903 N GLU A 122 -6.338 -27.670 9.317 1.00 0.00 N ATOM 1904 CA GLU A 122 -6.762 -28.481 10.453 1.00 0.00 C ATOM 1905 C GLU A 122 -8.288 -28.638 10.443 1.00 0.00 C ATOM 1906 O GLU A 122 -9.031 -27.652 10.452 1.00 0.00 O ATOM 1907 CB GLU A 122 -6.281 -27.856 11.774 1.00 0.00 C ATOM 1908 CG GLU A 122 -4.751 -27.850 11.905 1.00 0.00 C ATOM 1909 CD GLU A 122 -4.311 -27.313 13.279 1.00 0.00 C ATOM 1910 OE1 GLU A 122 -4.120 -26.080 13.422 1.00 0.00 O1- ATOM 1911 OE2 GLU A 122 -4.143 -28.117 14.227 1.00 0.00 O ATOM 0 H GLU A 122 -5.844 -26.820 9.587 1.00 0.00 H new ATOM 0 HA GLU A 122 -6.312 -29.470 10.369 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -6.651 -26.833 11.843 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -6.711 -28.408 12.610 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -4.368 -28.861 11.767 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -4.318 -27.235 11.116 1.00 0.00 H new ATOM 1918 N GLY A 123 -8.749 -29.893 10.420 1.00 0.00 N ATOM 1919 CA GLY A 123 -10.162 -30.258 10.425 1.00 0.00 C ATOM 1920 C GLY A 123 -10.873 -30.026 9.085 1.00 0.00 C ATOM 1921 O GLY A 123 -12.070 -30.315 8.994 1.00 0.00 O ATOM 0 H GLY A 123 -8.129 -30.703 10.397 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.254 -31.310 10.696 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.672 -29.684 11.199 1.00 0.00 H new ATOM 1925 N TYR A 124 -10.182 -29.527 8.054 1.00 0.00 N ATOM 1926 CA TYR A 124 -10.761 -29.321 6.730 1.00 0.00 C ATOM 1927 C TYR A 124 -10.733 -30.635 5.936 1.00 0.00 C ATOM 1928 O TYR A 124 -9.879 -31.495 6.181 1.00 0.00 O ATOM 1929 CB TYR A 124 -10.048 -28.176 5.993 1.00 0.00 C ATOM 1930 CG TYR A 124 -10.998 -27.385 5.117 1.00 0.00 C ATOM 1931 CD1 TYR A 124 -11.288 -27.795 3.802 1.00 0.00 C ATOM 1932 CD2 TYR A 124 -11.654 -26.263 5.658 1.00 0.00 C ATOM 1933 CE1 TYR A 124 -12.249 -27.108 3.039 1.00 0.00 C ATOM 1934 CE2 TYR A 124 -12.604 -25.565 4.896 1.00 0.00 C ATOM 1935 CZ TYR A 124 -12.914 -25.988 3.586 1.00 0.00 C ATOM 1936 OH TYR A 124 -13.870 -25.336 2.864 1.00 0.00 O ATOM 0 H TYR A 124 -9.201 -29.255 8.119 1.00 0.00 H new ATOM 0 HA TYR A 124 -11.804 -29.022 6.836 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -9.586 -27.509 6.721 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -9.245 -28.584 5.380 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -10.770 -28.642 3.377 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -11.426 -25.938 6.662 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -12.478 -27.436 2.036 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -13.099 -24.701 5.314 1.00 0.00 H new ATOM 0 HH TYR A 124 -13.625 -25.343 1.915 1.00 0.00 H new ATOM 1946 N GLU A 125 -11.640 -30.786 4.966 1.00 0.00 N ATOM 1947 CA GLU A 125 -11.688 -31.939 4.072 1.00 0.00 C ATOM 1948 C GLU A 125 -11.175 -31.505 2.695 1.00 0.00 C ATOM 1949 O GLU A 125 -11.811 -30.712 1.997 1.00 0.00 O ATOM 1950 CB GLU A 125 -13.103 -32.537 4.016 1.00 0.00 C ATOM 1951 CG GLU A 125 -13.511 -33.173 5.354 1.00 0.00 C ATOM 1952 CD GLU A 125 -14.879 -33.873 5.255 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -14.936 -35.047 4.810 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -15.908 -33.268 5.651 1.00 0.00 O ATOM 0 H GLU A 125 -12.370 -30.099 4.780 1.00 0.00 H new ATOM 0 HA GLU A 125 -11.045 -32.735 4.447 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -13.817 -31.756 3.753 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -13.148 -33.289 3.228 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -12.754 -33.895 5.660 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -13.550 -32.404 6.126 1.00 0.00 H new ATOM 1961 N PHE A 126 -10.003 -32.016 2.324 1.00 0.00 N ATOM 1962 CA PHE A 126 -9.315 -31.788 1.056 1.00 0.00 C ATOM 1963 C PHE A 126 -8.542 -33.070 0.716 1.00 0.00 C ATOM 1964 O PHE A 126 -8.415 -33.956 1.569 1.00 0.00 O ATOM 1965 CB PHE A 126 -8.379 -30.564 1.169 1.00 0.00 C ATOM 1966 CG PHE A 126 -7.251 -30.725 2.176 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -7.499 -30.515 3.547 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -5.968 -31.138 1.759 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -6.486 -30.740 4.495 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -4.954 -31.358 2.709 1.00 0.00 C ATOM 1971 CZ PHE A 126 -5.212 -31.161 4.077 1.00 0.00 C ATOM 0 H PHE A 126 -9.477 -32.638 2.938 1.00 0.00 H new ATOM 0 HA PHE A 126 -10.023 -31.567 0.257 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -7.948 -30.360 0.189 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -8.973 -29.692 1.444 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -8.473 -30.179 3.871 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -5.764 -31.285 0.709 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -6.687 -30.589 5.545 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -3.975 -31.679 2.387 1.00 0.00 H new ATOM 0 HZ PHE A 126 -4.433 -31.333 4.805 1.00 0.00 H new ATOM 1981 N THR A 127 -8.039 -33.187 -0.518 1.00 0.00 N ATOM 1982 CA THR A 127 -7.332 -34.397 -0.954 1.00 0.00 C ATOM 1983 C THR A 127 -6.155 -34.089 -1.890 1.00 0.00 C ATOM 1984 O THR A 127 -5.172 -34.836 -1.901 1.00 0.00 O ATOM 1985 CB THR A 127 -8.379 -35.369 -1.547 1.00 0.00 C ATOM 1986 OG1 THR A 127 -7.850 -36.656 -1.820 1.00 0.00 O ATOM 1987 CG2 THR A 127 -9.054 -34.843 -2.821 1.00 0.00 C ATOM 0 H THR A 127 -8.108 -32.461 -1.231 1.00 0.00 H new ATOM 0 HA THR A 127 -6.853 -34.882 -0.103 1.00 0.00 H new ATOM 0 HB THR A 127 -9.130 -35.447 -0.761 1.00 0.00 H new ATOM 0 HG1 THR A 127 -8.555 -37.227 -2.191 1.00 0.00 H new ATOM 0 HG21 THR A 127 -9.775 -35.577 -3.180 1.00 0.00 H new ATOM 0 HG22 THR A 127 -9.567 -33.907 -2.601 1.00 0.00 H new ATOM 0 HG23 THR A 127 -8.299 -34.671 -3.588 1.00 0.00 H new ATOM 1995 N SER A 128 -6.208 -32.992 -2.648 1.00 0.00 N ATOM 1996 CA SER A 128 -5.167 -32.652 -3.608 1.00 0.00 C ATOM 1997 C SER A 128 -3.952 -32.063 -2.869 1.00 0.00 C ATOM 1998 O SER A 128 -4.131 -31.285 -1.929 1.00 0.00 O ATOM 1999 CB SER A 128 -5.772 -31.730 -4.677 1.00 0.00 C ATOM 2000 OG SER A 128 -6.653 -30.775 -4.102 1.00 0.00 O ATOM 0 H SER A 128 -6.973 -32.319 -2.611 1.00 0.00 H new ATOM 0 HA SER A 128 -4.792 -33.533 -4.129 1.00 0.00 H new ATOM 0 HB2 SER A 128 -4.973 -31.215 -5.210 1.00 0.00 H new ATOM 0 HB3 SER A 128 -6.311 -32.328 -5.412 1.00 0.00 H new ATOM 0 HG SER A 128 -7.366 -30.562 -4.740 1.00 0.00 H new ATOM 2006 N PRO A 129 -2.709 -32.383 -3.284 1.00 0.00 N ATOM 2007 CA PRO A 129 -1.505 -31.844 -2.650 1.00 0.00 C ATOM 2008 C PRO A 129 -1.193 -30.413 -3.117 1.00 0.00 C ATOM 2009 O PRO A 129 -0.605 -29.634 -2.371 1.00 0.00 O ATOM 2010 CB PRO A 129 -0.391 -32.834 -3.008 1.00 0.00 C ATOM 2011 CG PRO A 129 -0.833 -33.396 -4.357 1.00 0.00 C ATOM 2012 CD PRO A 129 -2.355 -33.429 -4.238 1.00 0.00 C ATOM 0 HA PRO A 129 -1.624 -31.751 -1.571 1.00 0.00 H new ATOM 0 HB2 PRO A 129 0.578 -32.340 -3.077 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -0.296 -33.619 -2.258 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -0.507 -32.764 -5.183 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -0.421 -34.390 -4.534 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -2.825 -33.250 -5.205 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -2.698 -34.404 -3.892 1.00 0.00 H new ATOM 2020 N LYS A 130 -1.592 -30.034 -4.340 1.00 0.00 N ATOM 2021 CA LYS A 130 -1.191 -28.755 -4.943 1.00 0.00 C ATOM 2022 C LYS A 130 -1.652 -27.517 -4.148 1.00 0.00 C ATOM 2023 O LYS A 130 -0.856 -26.587 -4.036 1.00 0.00 O ATOM 2024 CB LYS A 130 -1.634 -28.729 -6.417 1.00 0.00 C ATOM 2025 CG LYS A 130 -0.648 -27.945 -7.300 1.00 0.00 C ATOM 2026 CD LYS A 130 -1.129 -27.866 -8.759 1.00 0.00 C ATOM 2027 CE LYS A 130 -1.083 -29.237 -9.468 1.00 0.00 C ATOM 2028 NZ LYS A 130 -2.182 -29.410 -10.460 1.00 0.00 N1+ ATOM 0 H LYS A 130 -2.197 -30.600 -4.935 1.00 0.00 H new ATOM 0 HA LYS A 130 -0.104 -28.691 -4.903 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -1.720 -29.750 -6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -2.624 -28.279 -6.490 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -0.525 -26.938 -6.902 1.00 0.00 H new ATOM 0 HG3 LYS A 130 0.331 -28.423 -7.265 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.149 -27.482 -8.782 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -0.508 -27.156 -9.306 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -0.123 -29.348 -9.972 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.145 -30.029 -8.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -2.144 -30.371 -10.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -3.099 -29.265 -9.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -2.071 -28.715 -11.226 1.00 0.00 H new ATOM 2042 N PRO A 131 -2.886 -27.435 -3.601 1.00 0.00 N ATOM 2043 CA PRO A 131 -3.314 -26.263 -2.830 1.00 0.00 C ATOM 2044 C PRO A 131 -2.759 -26.208 -1.400 1.00 0.00 C ATOM 2045 O PRO A 131 -3.170 -25.329 -0.638 1.00 0.00 O ATOM 2046 CB PRO A 131 -4.845 -26.299 -2.848 1.00 0.00 C ATOM 2047 CG PRO A 131 -5.161 -27.787 -2.946 1.00 0.00 C ATOM 2048 CD PRO A 131 -4.035 -28.308 -3.835 1.00 0.00 C ATOM 0 HA PRO A 131 -2.915 -25.356 -3.284 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -5.268 -25.857 -1.946 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -5.250 -25.745 -3.695 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -5.160 -28.267 -1.967 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -6.142 -27.965 -3.387 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.793 -29.342 -3.589 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -4.329 -28.290 -4.884 1.00 0.00 H new ATOM 2056 N VAL A 132 -1.869 -27.109 -0.987 1.00 0.00 N ATOM 2057 CA VAL A 132 -1.352 -27.155 0.376 1.00 0.00 C ATOM 2058 C VAL A 132 0.174 -27.273 0.365 1.00 0.00 C ATOM 2059 O VAL A 132 0.799 -27.475 -0.678 1.00 0.00 O ATOM 2060 CB VAL A 132 -2.046 -28.277 1.179 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -3.550 -28.024 1.341 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -1.853 -29.663 0.554 1.00 0.00 C ATOM 0 H VAL A 132 -1.485 -27.832 -1.595 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.586 -26.221 0.886 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.564 -28.262 2.157 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.996 -28.838 1.912 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -3.706 -27.083 1.868 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -4.018 -27.971 0.358 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -2.363 -30.410 1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -2.269 -29.669 -0.453 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.789 -29.897 0.508 1.00 0.00 H new ATOM 2072 N ILE A 133 0.774 -27.107 1.542 1.00 0.00 N ATOM 2073 CA ILE A 133 2.200 -27.120 1.798 1.00 0.00 C ATOM 2074 C ILE A 133 2.456 -27.895 3.089 1.00 0.00 C ATOM 2075 O ILE A 133 1.511 -28.239 3.807 1.00 0.00 O ATOM 2076 CB ILE A 133 2.727 -25.667 1.859 1.00 0.00 C ATOM 2077 CG1 ILE A 133 1.901 -24.787 2.825 1.00 0.00 C ATOM 2078 CG2 ILE A 133 2.769 -25.078 0.442 1.00 0.00 C ATOM 2079 CD1 ILE A 133 2.525 -23.418 3.111 1.00 0.00 C ATOM 0 H ILE A 133 0.235 -26.950 2.394 1.00 0.00 H new ATOM 0 HA ILE A 133 2.740 -27.620 0.994 1.00 0.00 H new ATOM 0 HB ILE A 133 3.740 -25.683 2.262 1.00 0.00 H new ATOM 0 HG12 ILE A 133 0.906 -24.640 2.405 1.00 0.00 H new ATOM 0 HG13 ILE A 133 1.774 -25.321 3.767 1.00 0.00 H new ATOM 0 HG21 ILE A 133 3.140 -24.054 0.484 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.431 -25.678 -0.182 1.00 0.00 H new ATOM 0 HG23 ILE A 133 1.766 -25.083 0.016 1.00 0.00 H new ATOM 0 HD11 ILE A 133 1.885 -22.862 3.796 1.00 0.00 H new ATOM 0 HD12 ILE A 133 3.508 -23.553 3.562 1.00 0.00 H new ATOM 0 HD13 ILE A 133 2.627 -22.863 2.179 1.00 0.00 H new ATOM 2091 N ALA A 134 3.734 -28.148 3.389 1.00 0.00 N ATOM 2092 CA ALA A 134 4.199 -28.767 4.628 1.00 0.00 C ATOM 2093 C ALA A 134 3.523 -30.110 4.899 1.00 0.00 C ATOM 2094 O ALA A 134 3.112 -30.416 6.014 1.00 0.00 O ATOM 2095 CB ALA A 134 4.054 -27.771 5.766 1.00 0.00 C ATOM 0 H ALA A 134 4.497 -27.918 2.752 1.00 0.00 H new ATOM 0 HA ALA A 134 5.256 -29.014 4.531 1.00 0.00 H new ATOM 0 HB1 ALA A 134 4.399 -28.226 6.694 1.00 0.00 H new ATOM 0 HB2 ALA A 134 4.652 -26.885 5.552 1.00 0.00 H new ATOM 0 HB3 ALA A 134 3.007 -27.486 5.869 1.00 0.00 H new ATOM 2101 N ASP A 135 3.377 -30.881 3.832 1.00 0.00 N ATOM 2102 CA ASP A 135 2.694 -32.180 3.788 1.00 0.00 C ATOM 2103 C ASP A 135 1.247 -32.081 4.304 1.00 0.00 C ATOM 2104 O ASP A 135 0.759 -32.925 5.060 1.00 0.00 O ATOM 2105 CB ASP A 135 3.542 -33.276 4.453 1.00 0.00 C ATOM 2106 CG ASP A 135 2.958 -34.687 4.236 1.00 0.00 C ATOM 2107 OD1 ASP A 135 2.560 -35.020 3.093 1.00 0.00 O1- ATOM 2108 OD2 ASP A 135 2.964 -35.498 5.195 1.00 0.00 O ATOM 0 H ASP A 135 3.749 -30.610 2.922 1.00 0.00 H new ATOM 0 HA ASP A 135 2.594 -32.488 2.747 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.555 -33.240 4.053 1.00 0.00 H new ATOM 0 HB3 ASP A 135 3.614 -33.077 5.522 1.00 0.00 H new ATOM 2113 N GLY A 136 0.555 -31.010 3.898 1.00 0.00 N ATOM 2114 CA GLY A 136 -0.862 -30.796 4.182 1.00 0.00 C ATOM 2115 C GLY A 136 -1.121 -30.078 5.506 1.00 0.00 C ATOM 2116 O GLY A 136 -2.258 -30.088 5.976 1.00 0.00 O ATOM 0 H GLY A 136 0.975 -30.257 3.354 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -1.302 -30.215 3.372 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -1.370 -31.760 4.196 1.00 0.00 H new ATOM 2120 N GLN A 137 -0.109 -29.445 6.107 1.00 0.00 N ATOM 2121 CA GLN A 137 -0.237 -28.745 7.381 1.00 0.00 C ATOM 2122 C GLN A 137 -0.662 -27.280 7.207 1.00 0.00 C ATOM 2123 O GLN A 137 -0.946 -26.621 8.210 1.00 0.00 O ATOM 2124 CB GLN A 137 1.047 -28.881 8.215 1.00 0.00 C ATOM 2125 CG GLN A 137 1.289 -30.330 8.657 1.00 0.00 C ATOM 2126 CD GLN A 137 2.579 -30.470 9.465 1.00 0.00 C ATOM 2127 OE1 GLN A 137 2.574 -30.452 10.696 1.00 0.00 O ATOM 2128 NE2 GLN A 137 3.711 -30.606 8.792 1.00 0.00 N ATOM 0 H GLN A 137 0.832 -29.406 5.715 1.00 0.00 H new ATOM 0 HA GLN A 137 -1.043 -29.227 7.935 1.00 0.00 H new ATOM 0 HB2 GLN A 137 1.898 -28.532 7.631 1.00 0.00 H new ATOM 0 HB3 GLN A 137 0.979 -28.240 9.094 1.00 0.00 H new ATOM 0 HG2 GLN A 137 0.446 -30.673 9.257 1.00 0.00 H new ATOM 0 HG3 GLN A 137 1.338 -30.974 7.779 1.00 0.00 H new ATOM 0 HE21 GLN A 137 3.700 -30.619 7.772 1.00 0.00 H new ATOM 0 HE22 GLN A 137 4.595 -30.698 9.293 1.00 0.00 H new ATOM 2137 N LEU A 138 -0.718 -26.755 5.971 1.00 0.00 N ATOM 2138 CA LEU A 138 -1.267 -25.427 5.704 1.00 0.00 C ATOM 2139 C LEU A 138 -1.758 -25.337 4.259 1.00 0.00 C ATOM 2140 O LEU A 138 -1.154 -25.941 3.371 1.00 0.00 O ATOM 2141 CB LEU A 138 -0.176 -24.374 5.999 1.00 0.00 C ATOM 2142 CG LEU A 138 -0.636 -23.023 6.559 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -1.511 -23.130 7.816 1.00 0.00 C ATOM 2144 CD2 LEU A 138 0.602 -22.202 6.931 1.00 0.00 C ATOM 0 H LEU A 138 -0.385 -27.241 5.138 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.125 -25.237 6.349 1.00 0.00 H new ATOM 0 HB2 LEU A 138 0.531 -24.809 6.706 1.00 0.00 H new ATOM 0 HB3 LEU A 138 0.371 -24.187 5.075 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.239 -22.558 5.779 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -1.794 -22.131 8.148 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -2.409 -23.704 7.587 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.952 -23.631 8.607 1.00 0.00 H new ATOM 0 HD21 LEU A 138 0.292 -21.237 7.331 1.00 0.00 H new ATOM 0 HD22 LEU A 138 1.181 -22.738 7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 138 1.215 -22.046 6.044 1.00 0.00 H new ATOM 2156 N PHE A 139 -2.829 -24.583 4.006 1.00 0.00 N ATOM 2157 CA PHE A 139 -3.257 -24.235 2.657 1.00 0.00 C ATOM 2158 C PHE A 139 -2.337 -23.142 2.156 1.00 0.00 C ATOM 2159 O PHE A 139 -1.995 -22.233 2.908 1.00 0.00 O ATOM 2160 CB PHE A 139 -4.695 -23.709 2.596 1.00 0.00 C ATOM 2161 CG PHE A 139 -5.792 -24.735 2.758 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -6.086 -25.608 1.694 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -6.577 -24.765 3.925 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -7.155 -26.513 1.806 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -7.679 -25.627 4.013 1.00 0.00 C ATOM 2166 CZ PHE A 139 -7.960 -26.514 2.958 1.00 0.00 C ATOM 0 H PHE A 139 -3.425 -24.196 4.738 1.00 0.00 H new ATOM 0 HA PHE A 139 -3.216 -25.139 2.050 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.816 -22.954 3.373 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.835 -23.207 1.639 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -5.491 -25.582 0.793 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -6.330 -24.121 4.756 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -7.358 -27.209 1.006 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -8.311 -25.610 4.889 1.00 0.00 H new ATOM 0 HZ PHE A 139 -8.794 -27.196 3.033 1.00 0.00 H new ATOM 2176 N VAL A 140 -2.018 -23.160 0.869 1.00 0.00 N ATOM 2177 CA VAL A 140 -1.136 -22.174 0.257 1.00 0.00 C ATOM 2178 C VAL A 140 -1.880 -20.875 -0.104 1.00 0.00 C ATOM 2179 O VAL A 140 -1.372 -20.036 -0.845 1.00 0.00 O ATOM 2180 CB VAL A 140 -0.362 -22.873 -0.873 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -1.185 -23.084 -2.153 1.00 0.00 C ATOM 2182 CG2 VAL A 140 0.974 -22.189 -1.154 1.00 0.00 C ATOM 0 H VAL A 140 -2.365 -23.863 0.216 1.00 0.00 H new ATOM 0 HA VAL A 140 -0.388 -21.806 0.960 1.00 0.00 H new ATOM 0 HB VAL A 140 -0.147 -23.876 -0.503 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -0.570 -23.582 -2.903 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -2.055 -23.701 -1.929 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -1.514 -22.119 -2.537 1.00 0.00 H new ATOM 0 HG21 VAL A 140 1.489 -22.714 -1.959 1.00 0.00 H new ATOM 0 HG22 VAL A 140 0.798 -21.155 -1.449 1.00 0.00 H new ATOM 0 HG23 VAL A 140 1.590 -22.210 -0.255 1.00 0.00 H new ATOM 2192 N GLY A 141 -3.093 -20.683 0.418 1.00 0.00 N ATOM 2193 CA GLY A 141 -3.891 -19.486 0.233 1.00 0.00 C ATOM 2194 C GLY A 141 -5.232 -19.638 0.943 1.00 0.00 C ATOM 2195 O GLY A 141 -5.532 -20.720 1.439 1.00 0.00 O ATOM 0 H GLY A 141 -3.555 -21.383 0.998 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -3.358 -18.620 0.626 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -4.051 -19.307 -0.830 1.00 0.00 H new ATOM 2199 N LEU A 142 -6.026 -18.566 1.003 1.00 0.00 N ATOM 2200 CA LEU A 142 -7.339 -18.573 1.655 1.00 0.00 C ATOM 2201 C LEU A 142 -8.309 -19.487 0.914 1.00 0.00 C ATOM 2202 O LEU A 142 -8.382 -19.470 -0.314 1.00 0.00 O ATOM 2203 CB LEU A 142 -7.860 -17.135 1.841 1.00 0.00 C ATOM 2204 CG LEU A 142 -9.381 -16.863 1.786 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.081 -17.281 3.080 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -9.655 -15.367 1.593 1.00 0.00 C ATOM 0 H LEU A 142 -5.775 -17.664 0.599 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.242 -18.992 2.657 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -7.499 -16.779 2.806 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.390 -16.516 1.077 1.00 0.00 H new ATOM 0 HG LEU A 142 -9.766 -17.446 0.949 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -11.148 -17.073 3.000 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -9.931 -18.348 3.247 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -9.664 -16.721 3.917 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -10.731 -15.196 1.557 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -9.227 -14.808 2.425 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -9.203 -15.032 0.660 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.072 -20.239 1.702 1.00 0.00 N ATOM 2219 CA ALA A 143 -10.072 -21.191 1.261 1.00 0.00 C ATOM 2220 C ALA A 143 -11.465 -20.565 1.335 1.00 0.00 C ATOM 2221 O ALA A 143 -11.939 -20.275 2.437 1.00 0.00 O ATOM 2222 CB ALA A 143 -9.970 -22.400 2.202 1.00 0.00 C ATOM 0 H ALA A 143 -9.001 -20.194 2.719 1.00 0.00 H new ATOM 0 HA ALA A 143 -9.906 -21.490 0.226 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.706 -23.150 1.912 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.970 -22.828 2.137 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -10.162 -22.081 3.226 1.00 0.00 H new ATOM 2228 N LEU A 144 -12.122 -20.368 0.192 1.00 0.00 N ATOM 2229 CA LEU A 144 -13.547 -20.041 0.100 1.00 0.00 C ATOM 2230 C LEU A 144 -14.257 -21.323 -0.363 1.00 0.00 C ATOM 2231 O LEU A 144 -13.728 -22.044 -1.212 1.00 0.00 O ATOM 2232 CB LEU A 144 -13.812 -18.913 -0.923 1.00 0.00 C ATOM 2233 CG LEU A 144 -13.889 -17.451 -0.454 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -15.036 -17.213 0.535 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -12.585 -16.940 0.161 1.00 0.00 C ATOM 0 H LEU A 144 -11.668 -20.433 -0.719 1.00 0.00 H new ATOM 0 HA LEU A 144 -13.911 -19.690 1.066 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -13.028 -18.970 -1.678 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -14.753 -19.143 -1.422 1.00 0.00 H new ATOM 0 HG LEU A 144 -14.079 -16.884 -1.365 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -15.046 -16.165 0.835 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -15.984 -17.464 0.060 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -14.894 -17.841 1.415 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.711 -15.902 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.329 -17.548 1.028 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -11.785 -17.005 -0.576 1.00 0.00 H new ATOM 2247 N ASP A 145 -15.471 -21.576 0.122 1.00 0.00 N ATOM 2248 CA ASP A 145 -16.337 -22.649 -0.363 1.00 0.00 C ATOM 2249 C ASP A 145 -17.776 -22.130 -0.305 1.00 0.00 C ATOM 2250 O ASP A 145 -18.162 -21.564 0.719 1.00 0.00 O ATOM 2251 CB ASP A 145 -16.162 -23.927 0.468 1.00 0.00 C ATOM 2252 CG ASP A 145 -16.936 -25.113 -0.127 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -18.186 -25.053 -0.211 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -16.310 -26.153 -0.423 1.00 0.00 O ATOM 0 H ASP A 145 -15.888 -21.031 0.877 1.00 0.00 H new ATOM 0 HA ASP A 145 -16.075 -22.919 -1.386 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -15.103 -24.179 0.527 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -16.504 -23.746 1.487 1.00 0.00 H new ATOM 2259 N GLU A 146 -18.540 -22.274 -1.395 1.00 0.00 N ATOM 2260 CA GLU A 146 -19.900 -21.734 -1.529 1.00 0.00 C ATOM 2261 C GLU A 146 -20.929 -22.854 -1.796 1.00 0.00 C ATOM 2262 O GLU A 146 -22.007 -22.607 -2.341 1.00 0.00 O ATOM 2263 CB GLU A 146 -19.918 -20.617 -2.591 1.00 0.00 C ATOM 2264 CG GLU A 146 -19.399 -19.271 -2.064 1.00 0.00 C ATOM 2265 CD GLU A 146 -20.354 -18.638 -1.030 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -21.497 -18.268 -1.400 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -19.945 -18.453 0.140 1.00 0.00 O ATOM 0 H GLU A 146 -18.225 -22.778 -2.224 1.00 0.00 H new ATOM 0 HA GLU A 146 -20.203 -21.283 -0.584 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -19.311 -20.925 -3.442 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -20.937 -20.488 -2.956 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -18.419 -19.415 -1.609 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -19.265 -18.584 -2.899 1.00 0.00 H new ATOM 2274 N THR A 147 -20.600 -24.096 -1.436 1.00 0.00 N ATOM 2275 CA THR A 147 -21.504 -25.243 -1.476 1.00 0.00 C ATOM 2276 C THR A 147 -21.744 -25.757 -0.052 1.00 0.00 C ATOM 2277 O THR A 147 -22.864 -26.119 0.312 1.00 0.00 O ATOM 2278 CB THR A 147 -20.884 -26.317 -2.390 1.00 0.00 C ATOM 2279 OG1 THR A 147 -20.799 -25.823 -3.719 1.00 0.00 O ATOM 2280 CG2 THR A 147 -21.677 -27.631 -2.424 1.00 0.00 C ATOM 0 H THR A 147 -19.668 -24.337 -1.098 1.00 0.00 H new ATOM 0 HA THR A 147 -22.476 -24.965 -1.884 1.00 0.00 H new ATOM 0 HB THR A 147 -19.901 -26.533 -1.973 1.00 0.00 H new ATOM 0 HG1 THR A 147 -20.555 -26.554 -4.325 1.00 0.00 H new ATOM 0 HG21 THR A 147 -21.180 -28.339 -3.088 1.00 0.00 H new ATOM 0 HG22 THR A 147 -21.729 -28.051 -1.419 1.00 0.00 H new ATOM 0 HG23 THR A 147 -22.686 -27.438 -2.789 1.00 0.00 H new ATOM 2288 N ASN A 148 -20.689 -25.785 0.758 1.00 0.00 N ATOM 2289 CA ASN A 148 -20.664 -26.398 2.077 1.00 0.00 C ATOM 2290 C ASN A 148 -21.001 -25.361 3.148 1.00 0.00 C ATOM 2291 O ASN A 148 -21.561 -25.707 4.190 1.00 0.00 O ATOM 2292 CB ASN A 148 -19.273 -26.992 2.364 1.00 0.00 C ATOM 2293 CG ASN A 148 -18.906 -28.132 1.424 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -18.877 -29.284 1.841 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -18.640 -27.831 0.165 1.00 0.00 N ATOM 0 H ASN A 148 -19.796 -25.365 0.501 1.00 0.00 H new ATOM 0 HA ASN A 148 -21.407 -27.195 2.099 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -18.524 -26.205 2.281 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -19.243 -27.353 3.392 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -18.400 -28.570 -0.496 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -18.674 -26.860 -0.145 1.00 0.00 H new ATOM 2302 N GLN A 149 -20.622 -24.104 2.902 1.00 0.00 N ATOM 2303 CA GLN A 149 -20.742 -22.972 3.813 1.00 0.00 C ATOM 2304 C GLN A 149 -21.315 -21.782 3.030 1.00 0.00 C ATOM 2305 O GLN A 149 -21.200 -21.730 1.802 1.00 0.00 O ATOM 2306 CB GLN A 149 -19.361 -22.653 4.422 1.00 0.00 C ATOM 2307 CG GLN A 149 -18.866 -23.790 5.336 1.00 0.00 C ATOM 2308 CD GLN A 149 -17.401 -23.665 5.746 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -16.885 -22.583 6.017 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -16.691 -24.780 5.792 1.00 0.00 N ATOM 0 H GLN A 149 -20.201 -23.839 2.012 1.00 0.00 H new ATOM 0 HA GLN A 149 -21.416 -23.201 4.638 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -18.639 -22.489 3.622 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -19.420 -21.726 4.993 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -19.483 -23.815 6.234 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -19.009 -24.742 4.825 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -17.129 -25.673 5.565 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -15.706 -24.747 6.054 1.00 0.00 H new ATOM 2319 N TYR A 150 -21.944 -20.851 3.756 1.00 0.00 N ATOM 2320 CA TYR A 150 -22.565 -19.654 3.194 1.00 0.00 C ATOM 2321 C TYR A 150 -22.456 -18.493 4.188 1.00 0.00 C ATOM 2322 O TYR A 150 -22.035 -17.397 3.824 1.00 0.00 O ATOM 2323 CB TYR A 150 -24.049 -19.926 2.879 1.00 0.00 C ATOM 2324 CG TYR A 150 -24.305 -20.965 1.800 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -24.247 -20.592 0.443 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -24.598 -22.300 2.147 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -24.486 -21.543 -0.563 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -24.826 -23.261 1.145 1.00 0.00 C ATOM 2329 CZ TYR A 150 -24.771 -22.885 -0.218 1.00 0.00 C ATOM 2330 OH TYR A 150 -25.012 -23.822 -1.184 1.00 0.00 O ATOM 0 H TYR A 150 -22.035 -20.913 4.770 1.00 0.00 H new ATOM 0 HA TYR A 150 -22.046 -19.389 2.273 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -24.544 -20.248 3.795 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -24.517 -18.989 2.576 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -24.018 -19.571 0.175 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -24.648 -22.586 3.187 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -24.452 -21.249 -1.602 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -25.043 -24.284 1.416 1.00 0.00 H new ATOM 0 HH TYR A 150 -25.188 -24.689 -0.762 1.00 0.00 H new ATOM 2340 N ASP A 151 -22.821 -18.732 5.455 1.00 0.00 N ATOM 2341 CA ASP A 151 -22.943 -17.665 6.452 1.00 0.00 C ATOM 2342 C ASP A 151 -21.584 -17.068 6.814 1.00 0.00 C ATOM 2343 O ASP A 151 -21.436 -15.844 6.864 1.00 0.00 O ATOM 2344 CB ASP A 151 -23.629 -18.205 7.708 1.00 0.00 C ATOM 2345 CG ASP A 151 -23.720 -17.110 8.787 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -24.574 -16.199 8.656 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -22.958 -17.171 9.782 1.00 0.00 O ATOM 0 H ASP A 151 -23.038 -19.662 5.813 1.00 0.00 H new ATOM 0 HA ASP A 151 -23.547 -16.869 6.017 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -24.628 -18.562 7.459 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -23.073 -19.059 8.094 1.00 0.00 H new ATOM 2352 N LEU A 152 -20.577 -17.930 7.017 1.00 0.00 N ATOM 2353 CA LEU A 152 -19.248 -17.508 7.466 1.00 0.00 C ATOM 2354 C LEU A 152 -18.287 -17.190 6.319 1.00 0.00 C ATOM 2355 O LEU A 152 -17.105 -16.967 6.569 1.00 0.00 O ATOM 2356 CB LEU A 152 -18.665 -18.446 8.540 1.00 0.00 C ATOM 2357 CG LEU A 152 -18.043 -19.750 7.997 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -16.641 -19.959 8.586 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -18.925 -20.961 8.318 1.00 0.00 C ATOM 0 H LEU A 152 -20.663 -18.936 6.874 1.00 0.00 H new ATOM 0 HA LEU A 152 -19.386 -16.549 7.966 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -17.904 -17.904 9.100 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -19.456 -18.704 9.244 1.00 0.00 H new ATOM 0 HG LEU A 152 -17.968 -19.656 6.914 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -16.215 -20.883 8.194 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -16.002 -19.120 8.311 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -16.708 -20.023 9.672 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -18.460 -21.864 7.923 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -19.037 -21.053 9.398 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -19.906 -20.828 7.862 1.00 0.00 H new ATOM 2371 N SER A 153 -18.748 -17.140 5.070 1.00 0.00 N ATOM 2372 CA SER A 153 -17.895 -16.744 3.954 1.00 0.00 C ATOM 2373 C SER A 153 -17.446 -15.287 4.119 1.00 0.00 C ATOM 2374 O SER A 153 -16.306 -14.958 3.806 1.00 0.00 O ATOM 2375 CB SER A 153 -18.634 -16.977 2.629 1.00 0.00 C ATOM 2376 OG SER A 153 -19.072 -18.316 2.544 1.00 0.00 O ATOM 0 H SER A 153 -19.707 -17.369 4.807 1.00 0.00 H new ATOM 0 HA SER A 153 -16.994 -17.358 3.943 1.00 0.00 H new ATOM 0 HB2 SER A 153 -19.487 -16.302 2.557 1.00 0.00 H new ATOM 0 HB3 SER A 153 -17.975 -16.748 1.791 1.00 0.00 H new ATOM 0 HG SER A 153 -19.071 -18.602 1.607 1.00 0.00 H new ATOM 2382 N ASP A 154 -18.292 -14.434 4.704 1.00 0.00 N ATOM 2383 CA ASP A 154 -17.914 -13.068 5.065 1.00 0.00 C ATOM 2384 C ASP A 154 -16.769 -13.069 6.075 1.00 0.00 C ATOM 2385 O ASP A 154 -15.821 -12.302 5.926 1.00 0.00 O ATOM 2386 CB ASP A 154 -19.127 -12.336 5.645 1.00 0.00 C ATOM 2387 CG ASP A 154 -18.745 -10.934 6.142 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -18.594 -10.027 5.289 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -18.643 -10.727 7.376 1.00 0.00 O ATOM 0 H ASP A 154 -19.256 -14.672 4.939 1.00 0.00 H new ATOM 0 HA ASP A 154 -17.574 -12.552 4.167 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -19.904 -12.256 4.885 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -19.545 -12.915 6.468 1.00 0.00 H new ATOM 2394 N GLU A 155 -16.814 -13.985 7.044 1.00 0.00 N ATOM 2395 CA GLU A 155 -15.798 -14.131 8.078 1.00 0.00 C ATOM 2396 C GLU A 155 -14.468 -14.579 7.464 1.00 0.00 C ATOM 2397 O GLU A 155 -13.420 -13.986 7.730 1.00 0.00 O ATOM 2398 CB GLU A 155 -16.291 -15.126 9.148 1.00 0.00 C ATOM 2399 CG GLU A 155 -15.385 -15.209 10.377 1.00 0.00 C ATOM 2400 CD GLU A 155 -15.638 -14.078 11.399 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -15.572 -12.877 11.043 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -15.910 -14.393 12.586 1.00 0.00 O ATOM 0 H GLU A 155 -17.575 -14.658 7.130 1.00 0.00 H new ATOM 0 HA GLU A 155 -15.627 -13.167 8.557 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -17.293 -14.837 9.466 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -16.372 -16.116 8.700 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -15.535 -16.172 10.866 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -14.344 -15.173 10.056 1.00 0.00 H new ATOM 2409 N ARG A 156 -14.526 -15.599 6.599 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.380 -16.120 5.854 1.00 0.00 C ATOM 2411 C ARG A 156 -12.663 -14.991 5.125 1.00 0.00 C ATOM 2412 O ARG A 156 -11.439 -14.923 5.187 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.834 -17.187 4.839 1.00 0.00 C ATOM 2414 CG ARG A 156 -14.207 -18.512 5.504 1.00 0.00 C ATOM 2415 CD ARG A 156 -14.685 -19.540 4.462 1.00 0.00 C ATOM 2416 NE ARG A 156 -14.822 -20.865 5.084 1.00 0.00 N ATOM 2417 CZ ARG A 156 -13.809 -21.640 5.486 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -12.597 -21.505 4.955 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -14.032 -22.523 6.451 1.00 0.00 N ATOM 0 H ARG A 156 -15.394 -16.095 6.395 1.00 0.00 H new ATOM 0 HA ARG A 156 -12.693 -16.578 6.565 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.692 -16.811 4.282 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -13.035 -17.359 4.117 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.345 -18.908 6.041 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.993 -18.344 6.241 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -15.641 -19.226 4.042 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.975 -19.589 3.636 1.00 0.00 H new ATOM 0 HE ARG A 156 -15.767 -21.223 5.220 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -12.432 -20.804 4.233 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -11.833 -22.102 5.270 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -14.960 -22.599 6.868 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -13.276 -23.126 6.775 1.00 0.00 H new ATOM 2433 N ILE A 157 -13.405 -14.112 4.447 1.00 0.00 N ATOM 2434 CA ILE A 157 -12.800 -12.993 3.734 1.00 0.00 C ATOM 2435 C ILE A 157 -12.268 -11.999 4.781 1.00 0.00 C ATOM 2436 O ILE A 157 -11.085 -11.674 4.742 1.00 0.00 O ATOM 2437 CB ILE A 157 -13.802 -12.375 2.726 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -14.359 -13.391 1.695 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -13.104 -11.270 1.917 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -15.705 -12.958 1.100 1.00 0.00 C ATOM 0 H ILE A 157 -14.422 -14.156 4.379 1.00 0.00 H new ATOM 0 HA ILE A 157 -11.958 -13.319 3.123 1.00 0.00 H new ATOM 0 HB ILE A 157 -14.629 -12.001 3.329 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -13.635 -13.518 0.890 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -14.475 -14.362 2.176 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -13.810 -10.837 1.209 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -12.747 -10.494 2.594 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -12.260 -11.695 1.374 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -16.045 -13.708 0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -16.440 -12.858 1.898 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -15.587 -12.000 0.593 1.00 0.00 H new ATOM 2452 N GLN A 158 -13.100 -11.549 5.725 1.00 0.00 N ATOM 2453 CA GLN A 158 -12.788 -10.518 6.711 1.00 0.00 C ATOM 2454 C GLN A 158 -11.471 -10.783 7.422 1.00 0.00 C ATOM 2455 O GLN A 158 -10.531 -9.997 7.283 1.00 0.00 O ATOM 2456 CB GLN A 158 -13.967 -10.350 7.682 1.00 0.00 C ATOM 2457 CG GLN A 158 -13.689 -9.293 8.758 1.00 0.00 C ATOM 2458 CD GLN A 158 -13.653 -7.863 8.221 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -14.607 -7.383 7.615 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.555 -7.156 8.439 1.00 0.00 N ATOM 0 H GLN A 158 -14.049 -11.911 5.824 1.00 0.00 H new ATOM 0 HA GLN A 158 -12.647 -9.571 6.190 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -14.859 -10.069 7.122 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -14.179 -11.306 8.161 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -14.456 -9.363 9.529 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -12.735 -9.516 9.236 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -11.773 -7.572 8.944 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -12.491 -6.196 8.102 1.00 0.00 H new ATOM 2469 N SER A 159 -11.403 -11.866 8.181 1.00 0.00 N ATOM 2470 CA SER A 159 -10.282 -12.079 9.078 1.00 0.00 C ATOM 2471 C SER A 159 -8.997 -12.325 8.290 1.00 0.00 C ATOM 2472 O SER A 159 -7.927 -11.890 8.711 1.00 0.00 O ATOM 2473 CB SER A 159 -10.601 -13.226 10.045 1.00 0.00 C ATOM 2474 OG SER A 159 -11.827 -12.974 10.719 1.00 0.00 O ATOM 0 H SER A 159 -12.106 -12.605 8.193 1.00 0.00 H new ATOM 0 HA SER A 159 -10.118 -11.180 9.672 1.00 0.00 H new ATOM 0 HB2 SER A 159 -10.666 -14.166 9.497 1.00 0.00 H new ATOM 0 HB3 SER A 159 -9.795 -13.335 10.770 1.00 0.00 H new ATOM 0 HG SER A 159 -12.021 -13.713 11.332 1.00 0.00 H new ATOM 2480 N TRP A 160 -9.098 -12.942 7.109 1.00 0.00 N ATOM 2481 CA TRP A 160 -7.948 -13.157 6.246 1.00 0.00 C ATOM 2482 C TRP A 160 -7.443 -11.843 5.679 1.00 0.00 C ATOM 2483 O TRP A 160 -6.248 -11.593 5.710 1.00 0.00 O ATOM 2484 CB TRP A 160 -8.315 -14.124 5.132 1.00 0.00 C ATOM 2485 CG TRP A 160 -7.113 -14.612 4.405 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -6.289 -15.558 4.890 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -6.586 -14.249 3.098 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -5.319 -15.853 3.959 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -5.456 -15.075 2.827 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.990 -13.351 2.088 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -4.789 -15.039 1.598 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -6.345 -13.325 0.840 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.250 -14.170 0.592 1.00 0.00 C ATOM 0 H TRP A 160 -9.975 -13.302 6.732 1.00 0.00 H new ATOM 0 HA TRP A 160 -7.142 -13.592 6.837 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -8.856 -14.973 5.551 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -8.989 -13.632 4.431 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -6.375 -16.017 5.864 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.592 -16.557 4.089 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.809 -12.672 2.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -3.931 -15.671 1.423 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -6.692 -12.653 0.069 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.762 -14.152 -0.371 1.00 0.00 H new ATOM 2504 N CYS A 161 -8.337 -10.978 5.218 1.00 0.00 N ATOM 2505 CA CYS A 161 -7.973 -9.669 4.691 1.00 0.00 C ATOM 2506 C CYS A 161 -7.278 -8.833 5.761 1.00 0.00 C ATOM 2507 O CYS A 161 -6.251 -8.218 5.481 1.00 0.00 O ATOM 2508 CB CYS A 161 -9.242 -8.977 4.189 1.00 0.00 C ATOM 2509 SG CYS A 161 -9.802 -9.824 2.699 1.00 0.00 S ATOM 0 H CYS A 161 -9.339 -11.165 5.199 1.00 0.00 H new ATOM 0 HA CYS A 161 -7.272 -9.784 3.864 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -10.017 -9.005 4.955 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -9.042 -7.927 3.976 1.00 0.00 H new ATOM 0 HG CYS A 161 -10.420 -10.919 3.029 1.00 0.00 H new ATOM 2515 N GLU A 162 -7.781 -8.855 6.997 1.00 0.00 N ATOM 2516 CA GLU A 162 -7.127 -8.173 8.107 1.00 0.00 C ATOM 2517 C GLU A 162 -5.752 -8.790 8.364 1.00 0.00 C ATOM 2518 O GLU A 162 -4.765 -8.091 8.576 1.00 0.00 O ATOM 2519 CB GLU A 162 -7.998 -8.197 9.364 1.00 0.00 C ATOM 2520 CG GLU A 162 -9.225 -7.305 9.162 1.00 0.00 C ATOM 2521 CD GLU A 162 -9.991 -7.134 10.483 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -9.598 -6.280 11.314 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -11.009 -7.839 10.668 1.00 0.00 O ATOM 0 H GLU A 162 -8.642 -9.340 7.251 1.00 0.00 H new ATOM 0 HA GLU A 162 -6.987 -7.126 7.837 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.311 -9.218 9.581 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -7.423 -7.851 10.223 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -8.915 -6.330 8.786 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -9.880 -7.743 8.409 1.00 0.00 H new ATOM 2530 N GLN A 163 -5.660 -10.113 8.293 1.00 0.00 N ATOM 2531 CA GLN A 163 -4.432 -10.846 8.536 1.00 0.00 C ATOM 2532 C GLN A 163 -3.386 -10.507 7.486 1.00 0.00 C ATOM 2533 O GLN A 163 -2.261 -10.185 7.848 1.00 0.00 O ATOM 2534 CB GLN A 163 -4.711 -12.354 8.602 1.00 0.00 C ATOM 2535 CG GLN A 163 -3.428 -13.172 8.813 1.00 0.00 C ATOM 2536 CD GLN A 163 -3.672 -14.671 8.625 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -3.520 -15.465 9.551 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -4.048 -15.095 7.420 1.00 0.00 N ATOM 0 H GLN A 163 -6.452 -10.712 8.061 1.00 0.00 H new ATOM 0 HA GLN A 163 -4.028 -10.545 9.503 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -5.408 -12.558 9.415 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -5.196 -12.673 7.679 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -2.664 -12.837 8.111 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -3.042 -12.990 9.816 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -4.171 -14.426 6.660 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -4.213 -16.088 7.257 1.00 0.00 H new ATOM 2547 N ILE A 164 -3.723 -10.544 6.198 1.00 0.00 N ATOM 2548 CA ILE A 164 -2.730 -10.305 5.159 1.00 0.00 C ATOM 2549 C ILE A 164 -2.221 -8.879 5.259 1.00 0.00 C ATOM 2550 O ILE A 164 -1.023 -8.684 5.114 1.00 0.00 O ATOM 2551 CB ILE A 164 -3.223 -10.674 3.742 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -4.411 -9.850 3.205 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -3.571 -12.165 3.697 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -4.729 -10.105 1.721 1.00 0.00 C ATOM 0 H ILE A 164 -4.664 -10.735 5.854 1.00 0.00 H new ATOM 0 HA ILE A 164 -1.893 -10.981 5.333 1.00 0.00 H new ATOM 0 HB ILE A 164 -2.392 -10.429 3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -5.296 -10.077 3.800 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -4.197 -8.790 3.343 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -3.919 -12.427 2.698 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -2.685 -12.753 3.939 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -4.356 -12.377 4.422 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.576 -9.489 1.419 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -3.860 -9.850 1.114 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -4.976 -11.157 1.577 1.00 0.00 H new ATOM 2566 N LEU A 165 -3.085 -7.904 5.556 1.00 0.00 N ATOM 2567 CA LEU A 165 -2.673 -6.507 5.677 1.00 0.00 C ATOM 2568 C LEU A 165 -1.717 -6.338 6.859 1.00 0.00 C ATOM 2569 O LEU A 165 -0.782 -5.546 6.770 1.00 0.00 O ATOM 2570 CB LEU A 165 -3.918 -5.600 5.682 1.00 0.00 C ATOM 2571 CG LEU A 165 -4.410 -5.062 7.039 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -3.669 -3.783 7.438 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -5.910 -4.761 6.956 1.00 0.00 C ATOM 0 H LEU A 165 -4.080 -8.061 5.718 1.00 0.00 H new ATOM 0 HA LEU A 165 -2.092 -6.187 4.812 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -3.712 -4.745 5.038 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -4.738 -6.154 5.224 1.00 0.00 H new ATOM 0 HG LEU A 165 -4.214 -5.825 7.793 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -4.042 -3.432 8.400 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -2.602 -3.990 7.516 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -3.835 -3.015 6.682 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -6.258 -4.380 7.916 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -6.089 -4.014 6.183 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -6.451 -5.675 6.710 1.00 0.00 H new ATOM 2585 N ASN A 166 -1.893 -7.130 7.919 1.00 0.00 N ATOM 2586 CA ASN A 166 -0.945 -7.166 9.033 1.00 0.00 C ATOM 2587 C ASN A 166 0.351 -7.773 8.527 1.00 0.00 C ATOM 2588 O ASN A 166 1.375 -7.109 8.544 1.00 0.00 O ATOM 2589 CB ASN A 166 -1.427 -7.992 10.235 1.00 0.00 C ATOM 2590 CG ASN A 166 -2.333 -7.216 11.179 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -1.868 -6.490 12.055 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -3.640 -7.352 11.030 1.00 0.00 N ATOM 0 H ASN A 166 -2.689 -7.758 8.029 1.00 0.00 H new ATOM 0 HA ASN A 166 -0.824 -6.141 9.383 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -1.961 -8.870 9.872 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -0.560 -8.352 10.790 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -4.279 -6.850 11.647 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -4.009 -7.959 10.298 1.00 0.00 H new ATOM 2599 N GLU A 167 0.302 -9.019 8.054 1.00 0.00 N ATOM 2600 CA GLU A 167 1.420 -9.852 7.689 1.00 0.00 C ATOM 2601 C GLU A 167 2.343 -9.136 6.697 1.00 0.00 C ATOM 2602 O GLU A 167 3.563 -9.111 6.864 1.00 0.00 O ATOM 2603 CB GLU A 167 0.758 -11.105 7.113 1.00 0.00 C ATOM 2604 CG GLU A 167 1.747 -12.191 6.764 1.00 0.00 C ATOM 2605 CD GLU A 167 2.327 -12.907 7.999 1.00 0.00 C ATOM 2606 OE1 GLU A 167 1.626 -13.769 8.581 1.00 0.00 O1- ATOM 2607 OE2 GLU A 167 3.497 -12.640 8.362 1.00 0.00 O ATOM 0 H GLU A 167 -0.589 -9.495 7.910 1.00 0.00 H new ATOM 0 HA GLU A 167 2.077 -10.097 8.524 1.00 0.00 H new ATOM 0 HB2 GLU A 167 0.040 -11.494 7.835 1.00 0.00 H new ATOM 0 HB3 GLU A 167 0.196 -10.833 6.220 1.00 0.00 H new ATOM 0 HG2 GLU A 167 1.259 -12.925 6.123 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.564 -11.757 6.187 1.00 0.00 H new ATOM 2614 N MET A 168 1.752 -8.480 5.699 1.00 0.00 N ATOM 2615 CA MET A 168 2.505 -7.742 4.693 1.00 0.00 C ATOM 2616 C MET A 168 3.134 -6.475 5.261 1.00 0.00 C ATOM 2617 O MET A 168 4.208 -6.068 4.825 1.00 0.00 O ATOM 2618 CB MET A 168 1.633 -7.441 3.472 1.00 0.00 C ATOM 2619 CG MET A 168 0.503 -6.424 3.626 1.00 0.00 C ATOM 2620 SD MET A 168 -0.494 -6.348 2.114 1.00 0.00 S ATOM 2621 CE MET A 168 -1.662 -7.739 2.232 1.00 0.00 C ATOM 0 H MET A 168 0.741 -8.447 5.568 1.00 0.00 H new ATOM 0 HA MET A 168 3.328 -8.379 4.369 1.00 0.00 H new ATOM 0 HB2 MET A 168 2.288 -7.093 2.673 1.00 0.00 H new ATOM 0 HB3 MET A 168 1.193 -8.380 3.137 1.00 0.00 H new ATOM 0 HG2 MET A 168 -0.128 -6.698 4.471 1.00 0.00 H new ATOM 0 HG3 MET A 168 0.919 -5.440 3.844 1.00 0.00 H new ATOM 0 HE1 MET A 168 -2.084 -7.944 1.248 1.00 0.00 H new ATOM 0 HE2 MET A 168 -1.139 -8.624 2.594 1.00 0.00 H new ATOM 0 HE3 MET A 168 -2.464 -7.483 2.924 1.00 0.00 H new ATOM 2631 N ALA A 169 2.480 -5.861 6.242 1.00 0.00 N ATOM 2632 CA ALA A 169 2.997 -4.678 6.890 1.00 0.00 C ATOM 2633 C ALA A 169 4.137 -5.013 7.857 1.00 0.00 C ATOM 2634 O ALA A 169 5.099 -4.252 7.951 1.00 0.00 O ATOM 2635 CB ALA A 169 1.864 -3.935 7.591 1.00 0.00 C ATOM 0 H ALA A 169 1.579 -6.175 6.604 1.00 0.00 H new ATOM 0 HA ALA A 169 3.420 -4.024 6.127 1.00 0.00 H new ATOM 0 HB1 ALA A 169 2.260 -3.044 8.078 1.00 0.00 H new ATOM 0 HB2 ALA A 169 1.111 -3.644 6.858 1.00 0.00 H new ATOM 0 HB3 ALA A 169 1.410 -4.586 8.339 1.00 0.00 H new ATOM 2641 N GLU A 170 4.078 -6.158 8.539 1.00 0.00 N ATOM 2642 CA GLU A 170 5.142 -6.567 9.462 1.00 0.00 C ATOM 2643 C GLU A 170 6.423 -6.849 8.675 1.00 0.00 C ATOM 2644 O GLU A 170 7.535 -6.622 9.151 1.00 0.00 O ATOM 2645 CB GLU A 170 4.820 -7.844 10.261 1.00 0.00 C ATOM 2646 CG GLU A 170 3.367 -8.036 10.677 1.00 0.00 C ATOM 2647 CD GLU A 170 3.227 -8.933 11.920 1.00 0.00 C ATOM 2648 OE1 GLU A 170 3.400 -8.430 13.057 1.00 0.00 O ATOM 2649 OE2 GLU A 170 2.919 -10.142 11.773 1.00 0.00 O1- ATOM 0 H GLU A 170 3.305 -6.820 8.471 1.00 0.00 H new ATOM 0 HA GLU A 170 5.251 -5.741 10.165 1.00 0.00 H new ATOM 0 HB2 GLU A 170 5.121 -8.705 9.664 1.00 0.00 H new ATOM 0 HB3 GLU A 170 5.436 -7.849 11.160 1.00 0.00 H new ATOM 0 HG2 GLU A 170 2.919 -7.064 10.881 1.00 0.00 H new ATOM 0 HG3 GLU A 170 2.810 -8.476 9.850 1.00 0.00 H new ATOM 2656 N HIS A 171 6.247 -7.349 7.450 1.00 0.00 N ATOM 2657 CA HIS A 171 7.313 -7.648 6.517 1.00 0.00 C ATOM 2658 C HIS A 171 8.007 -6.361 6.039 1.00 0.00 C ATOM 2659 O HIS A 171 9.200 -6.386 5.727 1.00 0.00 O ATOM 2660 CB HIS A 171 6.667 -8.459 5.390 1.00 0.00 C ATOM 2661 CG HIS A 171 7.621 -8.836 4.288 1.00 0.00 C ATOM 2662 ND1 HIS A 171 8.409 -9.990 4.245 1.00 0.00 N ATOM 2663 CD2 HIS A 171 7.882 -8.073 3.191 1.00 0.00 C ATOM 2664 CE1 HIS A 171 9.150 -9.873 3.125 1.00 0.00 C ATOM 2665 NE2 HIS A 171 8.844 -8.741 2.468 1.00 0.00 N ATOM 0 H HIS A 171 5.322 -7.561 7.076 1.00 0.00 H new ATOM 0 HA HIS A 171 8.114 -8.230 6.973 1.00 0.00 H new ATOM 0 HB2 HIS A 171 6.235 -9.367 5.810 1.00 0.00 H new ATOM 0 HB3 HIS A 171 5.845 -7.882 4.965 1.00 0.00 H new ATOM 0 HD2 HIS A 171 7.424 -7.128 2.938 1.00 0.00 H new ATOM 0 HE1 HIS A 171 9.889 -10.591 2.800 1.00 0.00 H new ATOM 0 HE2 HIS A 171 9.254 -8.431 1.587 1.00 0.00 H new ATOM 2673 N TYR A 172 7.291 -5.230 6.038 1.00 0.00 N ATOM 2674 CA TYR A 172 7.856 -3.907 5.813 1.00 0.00 C ATOM 2675 C TYR A 172 8.586 -3.388 7.056 1.00 0.00 C ATOM 2676 O TYR A 172 9.716 -2.904 6.934 1.00 0.00 O ATOM 2677 CB TYR A 172 6.769 -2.917 5.367 1.00 0.00 C ATOM 2678 CG TYR A 172 6.787 -2.648 3.879 1.00 0.00 C ATOM 2679 CD1 TYR A 172 6.091 -3.501 3.003 1.00 0.00 C ATOM 2680 CD2 TYR A 172 7.517 -1.555 3.372 1.00 0.00 C ATOM 2681 CE1 TYR A 172 6.134 -3.269 1.618 1.00 0.00 C ATOM 2682 CE2 TYR A 172 7.559 -1.317 1.989 1.00 0.00 C ATOM 2683 CZ TYR A 172 6.869 -2.175 1.106 1.00 0.00 C ATOM 2684 OH TYR A 172 6.912 -1.936 -0.229 1.00 0.00 O ATOM 0 H TYR A 172 6.284 -5.216 6.197 1.00 0.00 H new ATOM 0 HA TYR A 172 8.590 -3.995 5.012 1.00 0.00 H new ATOM 0 HB2 TYR A 172 5.791 -3.309 5.648 1.00 0.00 H new ATOM 0 HB3 TYR A 172 6.901 -1.976 5.902 1.00 0.00 H new ATOM 0 HD1 TYR A 172 5.524 -4.333 3.395 1.00 0.00 H new ATOM 0 HD2 TYR A 172 8.045 -0.899 4.048 1.00 0.00 H new ATOM 0 HE1 TYR A 172 5.605 -3.927 0.944 1.00 0.00 H new ATOM 0 HE2 TYR A 172 8.119 -0.479 1.601 1.00 0.00 H new ATOM 0 HH TYR A 172 6.051 -2.173 -0.632 1.00 0.00 H new ATOM 2694 N ALA A 173 7.951 -3.516 8.227 1.00 0.00 N ATOM 2695 CA ALA A 173 8.359 -2.910 9.492 1.00 0.00 C ATOM 2696 C ALA A 173 8.756 -1.436 9.283 1.00 0.00 C ATOM 2697 O ALA A 173 7.931 -0.684 8.712 1.00 0.00 O ATOM 2698 CB ALA A 173 9.435 -3.768 10.175 1.00 0.00 C ATOM 2699 OXT ALA A 173 9.857 -1.014 9.707 1.00 0.00 O1- ATOM 0 H ALA A 173 7.100 -4.071 8.319 1.00 0.00 H new ATOM 0 HA ALA A 173 7.517 -2.889 10.183 1.00 0.00 H new ATOM 0 HB1 ALA A 173 9.728 -3.303 11.116 1.00 0.00 H new ATOM 0 HB2 ALA A 173 9.036 -4.763 10.371 1.00 0.00 H new ATOM 0 HB3 ALA A 173 10.305 -3.847 9.523 1.00 0.00 H new TER 2705 ALA A 173