USER MOD reduce.3.24.130724 H: found=0, std=0, add=1300, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1298 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 3 MET CE :methyl 177:sc= -0.544 (180deg=-0.548) USER MOD Set 1.2: A 168 MET CE :methyl -170:sc= -2.65 (180deg=-2.95) USER MOD Set 2.1: A 105 HIS : no HD1:sc= -1.75 K(o=-1.8,f=-4!) USER MOD Set 2.2: A 118 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 90 GLN : amide:sc= -3.35! K(o=-5.7!,f=-0.7) USER MOD Set 3.2: A 148 ASN : amide:sc= -2.32! C(o=-5.7!,f=-3.6!) USER MOD Set 4.1: A 10 SER OG : rot 140:sc= 0.728 USER MOD Set 4.2: A 62 GLN : amide:sc= -0.0413 K(o=0.69,f=-2.9!) USER MOD Set 5.1: A 33 HIS : no HE2:sc= 0.936 K(o=2.1,f=-3.9!) USER MOD Set 5.2: A 46 TYR OH : rot -131:sc= 1.19 USER MOD Set 6.1: A 12 CYS SG : rot 180:sc=-0.00962 USER MOD Set 6.2: A 16 MET CE :methyl -170:sc= -0.569 (180deg=-0.732) USER MOD Set 7.1: A 7 TYR OH : rot 30:sc= 0.172 USER MOD Set 7.2: A 34 ASN : amide:sc= -1.4 K(o=-1.2,f=-8.3!) USER MOD Single : A 1 MET CE :methyl -169:sc= -0.114 (180deg=-0.3) USER MOD Single : A 1 MET N :NH3+ -124:sc= 0.0286 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0.247 X(o=0.25,f=-0.11) USER MOD Single : A 9 SER OG : rot 130:sc= 0 USER MOD Single : A 11 THR OG1 : rot 170:sc= 2.22 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 158:sc= 0.0572 USER MOD Single : A 20 LYS NZ :NH3+ -178:sc= 1.3 (180deg=1.27) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -155:sc= 1.22 (180deg=0.925) USER MOD Single : A 43 MET CE :methyl 152:sc= -0.695 (180deg=-1.46) USER MOD Single : A 45 GLN : amide:sc= 0.483 X(o=0.48,f=0) USER MOD Single : A 55 THR OG1 : rot 72:sc= 0.379 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 76 ASN : amide:sc= -0.043 X(o=-0.043,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -155:sc= 1.64 (180deg=0.893) 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 163:sc= -0.24 (180deg=-0.694) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 167:sc= 2.42 (180deg=2.16) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 THR OG1 : rot -162:sc= 0.202 USER MOD Single : A 127 THR OG1 : rot -37:sc= 0.0806 USER MOD Single : A 128 SER OG : rot -134:sc= 1.28 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 GLN : amide:sc= 2 K(o=2,f=-3.9!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 166:sc= 1.22 USER MOD Single : A 158 GLN : amide:sc= 1.08 K(o=1.1,f=-0.065) USER MOD Single : A 159 SER OG : rot 80:sc= 1.06 USER MOD Single : A 161 CYS SG : rot 73:sc= -0.732 USER MOD Single : A 163 GLN : amide:sc= 1.36 K(o=1.4,f=-0.5) USER MOD Single : A 166 ASN : amide:sc= 0.891 K(o=0.89,f=0) USER MOD Single : A 171 HIS : no HD1:sc= -0.0638 X(o=-0.064,f=-0.12) USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.767 0.647 0.233 1.00 0.00 N ATOM 2 CA MET A 1 1.413 0.581 -1.117 1.00 0.00 C ATOM 3 C MET A 1 1.905 1.976 -1.552 1.00 0.00 C ATOM 4 O MET A 1 1.436 2.985 -1.033 1.00 0.00 O ATOM 5 CB MET A 1 0.497 -0.122 -2.174 1.00 0.00 C ATOM 6 CG MET A 1 -0.246 0.771 -3.192 1.00 0.00 C ATOM 7 SD MET A 1 -1.846 0.146 -3.795 1.00 0.00 S ATOM 8 CE MET A 1 -1.476 -1.582 -4.191 1.00 0.00 C ATOM 0 H1 MET A 1 1.238 -0.021 0.876 1.00 0.00 H new ATOM 0 H2 MET A 1 0.852 1.612 0.612 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.239 0.396 0.149 1.00 0.00 H new ATOM 0 HA MET A 1 2.297 -0.053 -1.046 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.112 -0.827 -2.733 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.248 -0.707 -1.635 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.410 1.747 -2.735 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.407 0.927 -4.051 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.309 -2.014 -4.746 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.571 -1.631 -4.797 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.325 -2.142 -3.268 1.00 0.00 H new ATOM 20 N ASN A 2 2.804 2.050 -2.536 1.00 0.00 N ATOM 21 CA ASN A 2 3.260 3.266 -3.208 1.00 0.00 C ATOM 22 C ASN A 2 3.232 3.018 -4.711 1.00 0.00 C ATOM 23 O ASN A 2 3.441 1.897 -5.170 1.00 0.00 O ATOM 24 CB ASN A 2 4.626 3.750 -2.702 1.00 0.00 C ATOM 25 CG ASN A 2 5.871 2.960 -3.127 1.00 0.00 C ATOM 26 OD1 ASN A 2 6.916 3.551 -3.366 1.00 0.00 O ATOM 27 ND2 ASN A 2 5.843 1.640 -3.196 1.00 0.00 N ATOM 0 H ASN A 2 3.258 1.215 -2.905 1.00 0.00 H new ATOM 0 HA ASN A 2 2.584 4.087 -2.970 1.00 0.00 H new ATOM 0 HB2 ASN A 2 4.757 4.782 -3.029 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.594 3.762 -1.613 1.00 0.00 H new ATOM 0 HD21 ASN A 2 6.687 1.124 -3.446 1.00 0.00 H new ATOM 0 HD22 ASN A 2 4.978 1.137 -2.999 1.00 0.00 H new ATOM 34 N MET A 3 2.927 4.061 -5.471 1.00 0.00 N ATOM 35 CA MET A 3 2.578 4.006 -6.880 1.00 0.00 C ATOM 36 C MET A 3 3.293 5.126 -7.618 1.00 0.00 C ATOM 37 O MET A 3 3.476 6.211 -7.075 1.00 0.00 O ATOM 38 CB MET A 3 1.050 4.111 -7.055 1.00 0.00 C ATOM 39 CG MET A 3 0.294 3.220 -6.051 1.00 0.00 C ATOM 40 SD MET A 3 -1.389 2.713 -6.487 1.00 0.00 S ATOM 41 CE MET A 3 -2.195 4.305 -6.752 1.00 0.00 C ATOM 0 H MET A 3 2.916 5.012 -5.102 1.00 0.00 H new ATOM 0 HA MET A 3 2.896 3.052 -7.300 1.00 0.00 H new ATOM 0 HB2 MET A 3 0.740 5.148 -6.925 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.780 3.823 -8.071 1.00 0.00 H new ATOM 0 HG2 MET A 3 0.886 2.319 -5.889 1.00 0.00 H new ATOM 0 HG3 MET A 3 0.250 3.748 -5.099 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.222 4.143 -7.078 1.00 0.00 H new ATOM 0 HE2 MET A 3 -2.195 4.872 -5.821 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.655 4.863 -7.517 1.00 0.00 H new ATOM 51 N GLY A 4 3.663 4.888 -8.870 1.00 0.00 N ATOM 52 CA GLY A 4 4.381 5.877 -9.664 1.00 0.00 C ATOM 53 C GLY A 4 3.506 6.359 -10.806 1.00 0.00 C ATOM 54 O GLY A 4 3.102 5.542 -11.633 1.00 0.00 O ATOM 0 H GLY A 4 3.476 4.013 -9.360 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.670 6.720 -9.036 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.300 5.442 -10.057 1.00 0.00 H new ATOM 58 N LEU A 5 3.193 7.656 -10.869 1.00 0.00 N ATOM 59 CA LEU A 5 2.546 8.251 -12.029 1.00 0.00 C ATOM 60 C LEU A 5 3.632 8.693 -13.011 1.00 0.00 C ATOM 61 O LEU A 5 4.324 9.668 -12.749 1.00 0.00 O ATOM 62 CB LEU A 5 1.649 9.419 -11.574 1.00 0.00 C ATOM 63 CG LEU A 5 0.728 10.056 -12.635 1.00 0.00 C ATOM 64 CD1 LEU A 5 1.417 10.526 -13.910 1.00 0.00 C ATOM 65 CD2 LEU A 5 -0.356 9.078 -13.063 1.00 0.00 C ATOM 0 H LEU A 5 3.383 8.317 -10.116 1.00 0.00 H new ATOM 0 HA LEU A 5 1.901 7.533 -12.536 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.025 9.066 -10.753 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.292 10.202 -11.171 1.00 0.00 H new ATOM 0 HG LEU A 5 0.331 10.936 -12.128 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.678 10.957 -14.585 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.165 11.279 -13.663 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.902 9.679 -14.395 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -0.994 9.547 -13.812 1.00 0.00 H new ATOM 0 HD22 LEU A 5 0.105 8.186 -13.487 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.957 8.799 -12.197 1.00 0.00 H new ATOM 77 N PHE A 6 3.731 8.035 -14.159 1.00 0.00 N ATOM 78 CA PHE A 6 4.608 8.413 -15.267 1.00 0.00 C ATOM 79 C PHE A 6 3.810 8.987 -16.428 1.00 0.00 C ATOM 80 O PHE A 6 2.710 8.526 -16.722 1.00 0.00 O ATOM 81 CB PHE A 6 5.409 7.199 -15.728 1.00 0.00 C ATOM 82 CG PHE A 6 6.338 6.664 -14.669 1.00 0.00 C ATOM 83 CD1 PHE A 6 5.849 5.837 -13.644 1.00 0.00 C ATOM 84 CD2 PHE A 6 7.687 7.042 -14.674 1.00 0.00 C ATOM 85 CE1 PHE A 6 6.697 5.435 -12.604 1.00 0.00 C ATOM 86 CE2 PHE A 6 8.539 6.618 -13.648 1.00 0.00 C ATOM 87 CZ PHE A 6 8.046 5.829 -12.592 1.00 0.00 C ATOM 0 H PHE A 6 3.186 7.195 -14.354 1.00 0.00 H new ATOM 0 HA PHE A 6 5.292 9.186 -14.916 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.720 6.410 -16.030 1.00 0.00 H new ATOM 0 HB3 PHE A 6 5.990 7.469 -16.610 1.00 0.00 H new ATOM 0 HD1 PHE A 6 4.819 5.511 -13.658 1.00 0.00 H new ATOM 0 HD2 PHE A 6 8.070 7.662 -15.471 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.311 4.818 -11.806 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.582 6.898 -13.667 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.696 5.530 -11.783 1.00 0.00 H new ATOM 97 N TYR A 7 4.372 9.968 -17.124 1.00 0.00 N ATOM 98 CA TYR A 7 3.753 10.584 -18.298 1.00 0.00 C ATOM 99 C TYR A 7 4.795 11.336 -19.127 1.00 0.00 C ATOM 100 O TYR A 7 5.948 11.472 -18.707 1.00 0.00 O ATOM 101 CB TYR A 7 2.652 11.562 -17.844 1.00 0.00 C ATOM 102 CG TYR A 7 3.184 12.820 -17.189 1.00 0.00 C ATOM 103 CD1 TYR A 7 3.569 12.791 -15.838 1.00 0.00 C ATOM 104 CD2 TYR A 7 3.356 14.001 -17.938 1.00 0.00 C ATOM 105 CE1 TYR A 7 4.079 13.941 -15.213 1.00 0.00 C ATOM 106 CE2 TYR A 7 3.891 15.144 -17.328 1.00 0.00 C ATOM 107 CZ TYR A 7 4.250 15.124 -15.963 1.00 0.00 C ATOM 108 OH TYR A 7 4.801 16.238 -15.402 1.00 0.00 O ATOM 0 H TYR A 7 5.282 10.365 -16.888 1.00 0.00 H new ATOM 0 HA TYR A 7 3.319 9.798 -18.916 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.048 11.841 -18.707 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.991 11.051 -17.144 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.472 11.875 -15.274 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.076 14.026 -18.981 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.339 13.920 -14.165 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.029 16.046 -17.906 1.00 0.00 H new ATOM 0 HH TYR A 7 5.433 15.973 -14.702 1.00 0.00 H new ATOM 118 N GLY A 8 4.356 11.868 -20.271 1.00 0.00 N ATOM 119 CA GLY A 8 5.089 12.820 -21.092 1.00 0.00 C ATOM 120 C GLY A 8 4.063 13.744 -21.740 1.00 0.00 C ATOM 121 O GLY A 8 2.952 13.307 -22.046 1.00 0.00 O ATOM 0 H GLY A 8 3.443 11.634 -20.661 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.791 13.391 -20.484 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.674 12.302 -21.852 1.00 0.00 H new ATOM 125 N SER A 9 4.391 15.022 -21.899 1.00 0.00 N ATOM 126 CA SER A 9 3.528 16.043 -22.476 1.00 0.00 C ATOM 127 C SER A 9 4.338 16.995 -23.362 1.00 0.00 C ATOM 128 O SER A 9 5.471 17.347 -23.024 1.00 0.00 O ATOM 129 CB SER A 9 2.801 16.800 -21.352 1.00 0.00 C ATOM 130 OG SER A 9 3.646 17.051 -20.241 1.00 0.00 O ATOM 0 H SER A 9 5.301 15.388 -21.618 1.00 0.00 H new ATOM 0 HA SER A 9 2.779 15.567 -23.109 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.422 17.746 -21.739 1.00 0.00 H new ATOM 0 HB3 SER A 9 1.937 16.221 -21.026 1.00 0.00 H new ATOM 0 HG SER A 9 3.590 17.998 -19.995 1.00 0.00 H new ATOM 136 N SER A 10 3.727 17.443 -24.461 1.00 0.00 N ATOM 137 CA SER A 10 4.271 18.453 -25.358 1.00 0.00 C ATOM 138 C SER A 10 3.760 19.841 -24.951 1.00 0.00 C ATOM 139 O SER A 10 4.514 20.819 -24.982 1.00 0.00 O ATOM 140 CB SER A 10 3.838 18.128 -26.793 1.00 0.00 C ATOM 141 OG SER A 10 3.847 16.727 -27.033 1.00 0.00 O ATOM 0 H SER A 10 2.813 17.100 -24.756 1.00 0.00 H new ATOM 0 HA SER A 10 5.359 18.454 -25.298 1.00 0.00 H new ATOM 0 HB2 SER A 10 2.838 18.523 -26.971 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.506 18.624 -27.497 1.00 0.00 H new ATOM 0 HG SER A 10 3.064 16.482 -27.568 1.00 0.00 H new ATOM 147 N THR A 11 2.485 19.919 -24.553 1.00 0.00 N ATOM 148 CA THR A 11 1.786 21.144 -24.225 1.00 0.00 C ATOM 149 C THR A 11 1.856 21.307 -22.701 1.00 0.00 C ATOM 150 O THR A 11 2.780 21.927 -22.169 1.00 0.00 O ATOM 151 CB THR A 11 0.365 21.079 -24.831 1.00 0.00 C ATOM 152 OG1 THR A 11 -0.303 19.929 -24.344 1.00 0.00 O ATOM 153 CG2 THR A 11 0.388 20.919 -26.348 1.00 0.00 C ATOM 0 H THR A 11 1.898 19.091 -24.450 1.00 0.00 H new ATOM 0 HA THR A 11 2.234 22.040 -24.655 1.00 0.00 H new ATOM 0 HB THR A 11 -0.128 22.011 -24.555 1.00 0.00 H new ATOM 0 HG1 THR A 11 -1.250 19.972 -24.591 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.634 20.878 -26.725 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.907 21.767 -26.795 1.00 0.00 H new ATOM 0 HG23 THR A 11 0.908 19.997 -26.609 1.00 0.00 H new ATOM 161 N CYS A 12 0.901 20.678 -22.011 1.00 0.00 N ATOM 162 CA CYS A 12 0.750 20.591 -20.566 1.00 0.00 C ATOM 163 C CYS A 12 -0.397 19.650 -20.153 1.00 0.00 C ATOM 164 O CYS A 12 -0.600 19.432 -18.962 1.00 0.00 O ATOM 165 CB CYS A 12 0.491 21.993 -19.974 1.00 0.00 C ATOM 166 SG CYS A 12 -0.825 22.877 -20.875 1.00 0.00 S ATOM 0 H CYS A 12 0.155 20.177 -22.494 1.00 0.00 H new ATOM 0 HA CYS A 12 1.680 20.180 -20.174 1.00 0.00 H new ATOM 0 HB2 CYS A 12 0.212 21.898 -18.924 1.00 0.00 H new ATOM 0 HB3 CYS A 12 1.410 22.577 -20.008 1.00 0.00 H new ATOM 0 HG CYS A 12 -1.007 24.047 -20.339 1.00 0.00 H new ATOM 172 N TYR A 13 -1.187 19.092 -21.079 1.00 0.00 N ATOM 173 CA TYR A 13 -2.423 18.391 -20.705 1.00 0.00 C ATOM 174 C TYR A 13 -2.125 17.122 -19.909 1.00 0.00 C ATOM 175 O TYR A 13 -2.749 16.875 -18.879 1.00 0.00 O ATOM 176 CB TYR A 13 -3.272 18.069 -21.939 1.00 0.00 C ATOM 177 CG TYR A 13 -3.451 19.183 -22.948 1.00 0.00 C ATOM 178 CD1 TYR A 13 -3.824 20.478 -22.540 1.00 0.00 C ATOM 179 CD2 TYR A 13 -3.233 18.910 -24.309 1.00 0.00 C ATOM 180 CE1 TYR A 13 -3.937 21.513 -23.484 1.00 0.00 C ATOM 181 CE2 TYR A 13 -3.337 19.947 -25.257 1.00 0.00 C ATOM 182 CZ TYR A 13 -3.688 21.255 -24.851 1.00 0.00 C ATOM 183 OH TYR A 13 -3.786 22.252 -25.781 1.00 0.00 O ATOM 0 H TYR A 13 -0.996 19.111 -22.081 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.996 19.061 -20.065 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.823 17.217 -22.449 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.259 17.754 -21.601 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -4.024 20.677 -21.497 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.986 17.908 -24.628 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -4.214 22.507 -23.164 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.147 19.742 -26.300 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.579 21.893 -26.669 1.00 0.00 H new ATOM 193 N THR A 14 -1.128 16.351 -20.346 1.00 0.00 N ATOM 194 CA THR A 14 -0.752 15.102 -19.680 1.00 0.00 C ATOM 195 C THR A 14 -0.149 15.431 -18.313 1.00 0.00 C ATOM 196 O THR A 14 -0.402 14.726 -17.341 1.00 0.00 O ATOM 197 CB THR A 14 0.193 14.258 -20.560 1.00 0.00 C ATOM 198 OG1 THR A 14 0.179 14.724 -21.897 1.00 0.00 O ATOM 199 CG2 THR A 14 -0.193 12.781 -20.589 1.00 0.00 C ATOM 0 H THR A 14 -0.562 16.572 -21.165 1.00 0.00 H new ATOM 0 HA THR A 14 -1.638 14.487 -19.524 1.00 0.00 H new ATOM 0 HB THR A 14 1.183 14.361 -20.116 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.003 14.445 -22.349 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.505 12.235 -21.223 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.158 12.376 -19.578 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.202 12.676 -20.987 1.00 0.00 H new ATOM 207 N GLU A 15 0.574 16.552 -18.221 1.00 0.00 N ATOM 208 CA GLU A 15 1.131 17.064 -16.981 1.00 0.00 C ATOM 209 C GLU A 15 0.011 17.383 -16.000 1.00 0.00 C ATOM 210 O GLU A 15 0.041 16.914 -14.867 1.00 0.00 O ATOM 211 CB GLU A 15 2.026 18.275 -17.296 1.00 0.00 C ATOM 212 CG GLU A 15 2.563 18.974 -16.045 1.00 0.00 C ATOM 213 CD GLU A 15 3.584 20.069 -16.418 1.00 0.00 C ATOM 214 OE1 GLU A 15 3.166 21.233 -16.637 1.00 0.00 O ATOM 215 OE2 GLU A 15 4.805 19.782 -16.474 1.00 0.00 O1- ATOM 0 H GLU A 15 0.789 17.136 -19.029 1.00 0.00 H new ATOM 0 HA GLU A 15 1.757 16.313 -16.498 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.866 17.947 -17.909 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.459 18.992 -17.889 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.737 19.417 -15.489 1.00 0.00 H new ATOM 0 HG3 GLU A 15 3.033 18.242 -15.389 1.00 0.00 H new ATOM 222 N MET A 16 -1.014 18.115 -16.432 1.00 0.00 N ATOM 223 CA MET A 16 -2.110 18.496 -15.549 1.00 0.00 C ATOM 224 C MET A 16 -2.906 17.272 -15.114 1.00 0.00 C ATOM 225 O MET A 16 -3.256 17.139 -13.942 1.00 0.00 O ATOM 226 CB MET A 16 -3.006 19.553 -16.212 1.00 0.00 C ATOM 227 CG MET A 16 -2.270 20.884 -16.423 1.00 0.00 C ATOM 228 SD MET A 16 -3.243 22.186 -17.229 1.00 0.00 S ATOM 229 CE MET A 16 -3.480 21.443 -18.866 1.00 0.00 C ATOM 0 H MET A 16 -1.107 18.455 -17.389 1.00 0.00 H new ATOM 0 HA MET A 16 -1.687 18.946 -14.651 1.00 0.00 H new ATOM 0 HB2 MET A 16 -3.358 19.178 -17.173 1.00 0.00 H new ATOM 0 HB3 MET A 16 -3.887 19.721 -15.593 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.933 21.252 -15.454 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.378 20.697 -17.021 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.905 22.184 -19.544 1.00 0.00 H new ATOM 0 HE2 MET A 16 -2.520 21.104 -19.254 1.00 0.00 H new ATOM 0 HE3 MET A 16 -4.159 20.594 -18.785 1.00 0.00 H new ATOM 239 N ALA A 17 -3.155 16.344 -16.037 1.00 0.00 N ATOM 240 CA ALA A 17 -3.824 15.093 -15.726 1.00 0.00 C ATOM 241 C ALA A 17 -3.026 14.296 -14.700 1.00 0.00 C ATOM 242 O ALA A 17 -3.621 13.785 -13.756 1.00 0.00 O ATOM 243 CB ALA A 17 -4.094 14.289 -17.000 1.00 0.00 C ATOM 0 H ALA A 17 -2.897 16.443 -17.019 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.792 15.317 -15.278 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.596 13.356 -16.742 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.729 14.870 -17.669 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.150 14.068 -17.498 1.00 0.00 H new ATOM 249 N ALA A 18 -1.700 14.251 -14.822 1.00 0.00 N ATOM 250 CA ALA A 18 -0.820 13.585 -13.879 1.00 0.00 C ATOM 251 C ALA A 18 -1.034 14.127 -12.475 1.00 0.00 C ATOM 252 O ALA A 18 -1.214 13.343 -11.541 1.00 0.00 O ATOM 253 CB ALA A 18 0.638 13.777 -14.314 1.00 0.00 C ATOM 0 H ALA A 18 -1.203 14.688 -15.598 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.051 12.520 -13.868 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.298 13.277 -13.605 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.781 13.350 -15.307 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.873 14.841 -14.340 1.00 0.00 H new ATOM 259 N GLU A 19 -1.062 15.454 -12.336 1.00 0.00 N ATOM 260 CA GLU A 19 -1.255 16.092 -11.035 1.00 0.00 C ATOM 261 C GLU A 19 -2.574 15.650 -10.441 1.00 0.00 C ATOM 262 O GLU A 19 -2.615 15.303 -9.261 1.00 0.00 O ATOM 263 CB GLU A 19 -1.244 17.631 -11.065 1.00 0.00 C ATOM 264 CG GLU A 19 -0.128 18.239 -11.899 1.00 0.00 C ATOM 265 CD GLU A 19 0.117 19.714 -11.536 1.00 0.00 C ATOM 266 OE1 GLU A 19 -0.534 20.606 -12.130 1.00 0.00 O1- ATOM 267 OE2 GLU A 19 0.955 19.991 -10.644 1.00 0.00 O ATOM 0 H GLU A 19 -0.953 16.108 -13.111 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.402 15.777 -10.434 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.201 17.981 -11.452 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.159 18.001 -10.043 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.790 17.670 -11.748 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.381 18.162 -12.956 1.00 0.00 H new ATOM 274 N LYS A 20 -3.616 15.636 -11.275 1.00 0.00 N ATOM 275 CA LYS A 20 -4.968 15.299 -10.893 1.00 0.00 C ATOM 276 C LYS A 20 -4.993 13.871 -10.415 1.00 0.00 C ATOM 277 O LYS A 20 -5.389 13.647 -9.283 1.00 0.00 O ATOM 278 CB LYS A 20 -5.934 15.583 -12.060 1.00 0.00 C ATOM 279 CG LYS A 20 -6.109 17.093 -12.286 1.00 0.00 C ATOM 280 CD LYS A 20 -6.817 17.329 -13.627 1.00 0.00 C ATOM 281 CE LYS A 20 -6.864 18.804 -14.044 1.00 0.00 C ATOM 282 NZ LYS A 20 -7.614 19.663 -13.079 1.00 0.00 N1+ ATOM 0 H LYS A 20 -3.528 15.868 -12.264 1.00 0.00 H new ATOM 0 HA LYS A 20 -5.311 15.922 -10.067 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.554 15.119 -12.970 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.903 15.130 -11.851 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.691 17.528 -11.474 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.138 17.587 -12.283 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.308 16.757 -14.403 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.835 16.945 -13.563 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.846 19.181 -14.141 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.328 18.883 -15.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.640 20.641 -13.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.585 19.305 -12.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.140 19.642 -12.154 1.00 0.00 H new ATOM 296 N ILE A 21 -4.527 12.914 -11.213 1.00 0.00 N ATOM 297 CA ILE A 21 -4.556 11.498 -10.849 1.00 0.00 C ATOM 298 C ILE A 21 -3.923 11.305 -9.475 1.00 0.00 C ATOM 299 O ILE A 21 -4.553 10.778 -8.563 1.00 0.00 O ATOM 300 CB ILE A 21 -3.822 10.680 -11.938 1.00 0.00 C ATOM 301 CG1 ILE A 21 -4.701 10.540 -13.190 1.00 0.00 C ATOM 302 CG2 ILE A 21 -3.469 9.280 -11.436 1.00 0.00 C ATOM 303 CD1 ILE A 21 -3.870 10.600 -14.474 1.00 0.00 C ATOM 0 H ILE A 21 -4.119 13.097 -12.130 1.00 0.00 H new ATOM 0 HA ILE A 21 -5.585 11.144 -10.790 1.00 0.00 H new ATOM 0 HB ILE A 21 -2.906 11.217 -12.182 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.243 9.595 -13.151 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.447 11.335 -13.202 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -2.954 8.730 -12.224 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -2.819 9.359 -10.565 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.382 8.751 -11.161 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.527 10.497 -15.338 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.349 11.556 -14.526 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.141 9.789 -14.474 1.00 0.00 H new ATOM 315 N ARG A 22 -2.678 11.754 -9.316 1.00 0.00 N ATOM 316 CA ARG A 22 -1.938 11.600 -8.068 1.00 0.00 C ATOM 317 C ARG A 22 -2.669 12.280 -6.918 1.00 0.00 C ATOM 318 O ARG A 22 -2.703 11.733 -5.827 1.00 0.00 O ATOM 319 CB ARG A 22 -0.516 12.138 -8.334 1.00 0.00 C ATOM 320 CG ARG A 22 0.375 12.380 -7.092 1.00 0.00 C ATOM 321 CD ARG A 22 0.992 13.781 -6.977 1.00 0.00 C ATOM 322 NE ARG A 22 0.006 14.832 -7.279 1.00 0.00 N ATOM 323 CZ ARG A 22 0.042 16.122 -6.904 1.00 0.00 C ATOM 324 NH1 ARG A 22 1.039 16.593 -6.163 1.00 0.00 N1+ ATOM 325 NH2 ARG A 22 -0.930 16.940 -7.292 1.00 0.00 N ATOM 0 H ARG A 22 -2.156 12.234 -10.049 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.862 10.559 -7.753 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.003 11.435 -8.990 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.603 13.078 -8.879 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.220 12.191 -6.199 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.182 11.647 -7.098 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.383 13.926 -5.970 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.836 13.865 -7.661 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.798 14.548 -7.838 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.794 15.973 -5.869 1.00 0.00 H new ATOM 0 HH12 ARG A 22 1.050 17.575 -5.888 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.694 16.587 -7.869 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -0.913 17.921 -7.013 1.00 0.00 H new ATOM 339 N ASP A 23 -3.259 13.440 -7.161 1.00 0.00 N ATOM 340 CA ASP A 23 -3.967 14.205 -6.135 1.00 0.00 C ATOM 341 C ASP A 23 -5.233 13.479 -5.678 1.00 0.00 C ATOM 342 O ASP A 23 -5.469 13.316 -4.481 1.00 0.00 O ATOM 343 CB ASP A 23 -4.339 15.605 -6.627 1.00 0.00 C ATOM 344 CG ASP A 23 -5.149 16.344 -5.547 1.00 0.00 C ATOM 345 OD1 ASP A 23 -4.540 16.803 -4.552 1.00 0.00 O1- ATOM 346 OD2 ASP A 23 -6.383 16.496 -5.702 1.00 0.00 O ATOM 0 H ASP A 23 -3.263 13.884 -8.080 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.283 14.301 -5.291 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.436 16.168 -6.865 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -4.922 15.534 -7.545 1.00 0.00 H new ATOM 351 N ILE A 24 -6.018 13.019 -6.653 1.00 0.00 N ATOM 352 CA ILE A 24 -7.305 12.373 -6.453 1.00 0.00 C ATOM 353 C ILE A 24 -7.076 11.062 -5.693 1.00 0.00 C ATOM 354 O ILE A 24 -7.766 10.774 -4.712 1.00 0.00 O ATOM 355 CB ILE A 24 -8.020 12.194 -7.822 1.00 0.00 C ATOM 356 CG1 ILE A 24 -8.460 13.543 -8.462 1.00 0.00 C ATOM 357 CG2 ILE A 24 -9.272 11.315 -7.629 1.00 0.00 C ATOM 358 CD1 ILE A 24 -8.509 13.537 -9.997 1.00 0.00 C ATOM 0 H ILE A 24 -5.761 13.091 -7.637 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.973 12.984 -5.846 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.301 11.728 -8.495 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.447 13.806 -8.081 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.774 14.325 -8.137 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.777 11.186 -8.586 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.976 10.340 -7.241 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.949 11.796 -6.923 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.825 14.517 -10.355 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.519 13.309 -10.392 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -9.218 12.781 -10.335 1.00 0.00 H new ATOM 370 N ILE A 25 -6.099 10.272 -6.145 1.00 0.00 N ATOM 371 CA ILE A 25 -5.811 8.953 -5.601 1.00 0.00 C ATOM 372 C ILE A 25 -5.143 9.078 -4.227 1.00 0.00 C ATOM 373 O ILE A 25 -5.571 8.435 -3.267 1.00 0.00 O ATOM 374 CB ILE A 25 -4.989 8.166 -6.633 1.00 0.00 C ATOM 375 CG1 ILE A 25 -5.855 7.929 -7.885 1.00 0.00 C ATOM 376 CG2 ILE A 25 -4.466 6.820 -6.108 1.00 0.00 C ATOM 377 CD1 ILE A 25 -5.100 7.231 -9.007 1.00 0.00 C ATOM 0 H ILE A 25 -5.480 10.539 -6.910 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.727 8.390 -5.424 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.110 8.767 -6.866 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.723 7.330 -7.611 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.230 8.886 -8.247 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.895 6.321 -6.891 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.824 6.991 -5.244 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.307 6.192 -5.816 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.763 7.092 -9.861 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.247 7.840 -9.305 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.748 6.260 -8.660 1.00 0.00 H new ATOM 389 N GLY A 26 -4.115 9.919 -4.139 1.00 0.00 N ATOM 390 CA GLY A 26 -3.482 10.313 -2.889 1.00 0.00 C ATOM 391 C GLY A 26 -1.990 10.543 -3.094 1.00 0.00 C ATOM 392 O GLY A 26 -1.257 9.580 -3.324 1.00 0.00 O ATOM 0 H GLY A 26 -3.691 10.355 -4.958 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.947 11.223 -2.510 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.636 9.539 -2.137 1.00 0.00 H new ATOM 396 N PRO A 27 -1.479 11.774 -2.932 1.00 0.00 N ATOM 397 CA PRO A 27 -0.059 12.088 -3.108 1.00 0.00 C ATOM 398 C PRO A 27 0.824 11.537 -1.966 1.00 0.00 C ATOM 399 O PRO A 27 2.032 11.767 -1.938 1.00 0.00 O ATOM 400 CB PRO A 27 -0.020 13.614 -3.246 1.00 0.00 C ATOM 401 CG PRO A 27 -1.195 14.076 -2.392 1.00 0.00 C ATOM 402 CD PRO A 27 -2.230 12.982 -2.615 1.00 0.00 C ATOM 0 HA PRO A 27 0.366 11.603 -3.987 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.924 14.026 -2.888 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.131 13.927 -4.284 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.920 14.164 -1.341 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.564 15.052 -2.707 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.843 12.838 -1.725 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.906 13.245 -3.428 1.00 0.00 H new ATOM 410 N GLU A 28 0.222 10.800 -1.028 1.00 0.00 N ATOM 411 CA GLU A 28 0.898 10.103 0.059 1.00 0.00 C ATOM 412 C GLU A 28 1.617 8.870 -0.503 1.00 0.00 C ATOM 413 O GLU A 28 2.683 8.481 -0.027 1.00 0.00 O ATOM 414 CB GLU A 28 -0.104 9.648 1.145 1.00 0.00 C ATOM 415 CG GLU A 28 -1.402 10.461 1.212 1.00 0.00 C ATOM 416 CD GLU A 28 -2.246 10.092 2.445 1.00 0.00 C ATOM 417 OE1 GLU A 28 -2.046 10.698 3.527 1.00 0.00 O ATOM 418 OE2 GLU A 28 -3.127 9.205 2.338 1.00 0.00 O1- ATOM 0 H GLU A 28 -0.790 10.670 -1.008 1.00 0.00 H new ATOM 0 HA GLU A 28 1.611 10.791 0.513 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.357 8.602 0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.389 9.698 2.116 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.164 11.524 1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -1.986 10.289 0.308 1.00 0.00 H new ATOM 425 N LEU A 29 0.982 8.246 -1.505 1.00 0.00 N ATOM 426 CA LEU A 29 1.363 6.985 -2.108 1.00 0.00 C ATOM 427 C LEU A 29 1.673 7.163 -3.586 1.00 0.00 C ATOM 428 O LEU A 29 2.462 6.377 -4.089 1.00 0.00 O ATOM 429 CB LEU A 29 0.295 5.907 -1.848 1.00 0.00 C ATOM 430 CG LEU A 29 -1.155 6.236 -2.269 1.00 0.00 C ATOM 431 CD1 LEU A 29 -1.793 4.989 -2.888 1.00 0.00 C ATOM 432 CD2 LEU A 29 -2.010 6.702 -1.091 1.00 0.00 C ATOM 0 H LEU A 29 0.143 8.639 -1.932 1.00 0.00 H new ATOM 0 HA LEU A 29 2.281 6.635 -1.636 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.599 4.998 -2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.295 5.682 -0.782 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.112 7.052 -2.991 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.817 5.214 -3.187 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.219 4.682 -3.762 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.799 4.182 -2.156 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.020 6.921 -1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.048 5.917 -0.336 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.573 7.601 -0.657 1.00 0.00 H new ATOM 444 N VAL A 30 1.101 8.145 -4.290 1.00 0.00 N ATOM 445 CA VAL A 30 1.421 8.378 -5.704 1.00 0.00 C ATOM 446 C VAL A 30 2.524 9.436 -5.813 1.00 0.00 C ATOM 447 O VAL A 30 2.459 10.446 -5.108 1.00 0.00 O ATOM 448 CB VAL A 30 0.162 8.747 -6.509 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.442 8.748 -8.027 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.012 7.802 -6.232 1.00 0.00 C ATOM 0 H VAL A 30 0.413 8.792 -3.904 1.00 0.00 H new ATOM 0 HA VAL A 30 1.799 7.456 -6.145 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.111 9.750 -6.181 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.468 9.013 -8.565 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.221 9.476 -8.253 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.771 7.756 -8.337 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.873 8.108 -6.826 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.730 6.784 -6.500 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.269 7.841 -5.173 1.00 0.00 H new ATOM 460 N THR A 31 3.459 9.264 -6.757 1.00 0.00 N ATOM 461 CA THR A 31 4.521 10.212 -7.048 1.00 0.00 C ATOM 462 C THR A 31 4.620 10.426 -8.562 1.00 0.00 C ATOM 463 O THR A 31 4.640 9.449 -9.305 1.00 0.00 O ATOM 464 CB THR A 31 5.834 9.712 -6.409 1.00 0.00 C ATOM 465 OG1 THR A 31 5.645 9.485 -5.019 1.00 0.00 O ATOM 466 CG2 THR A 31 6.978 10.716 -6.590 1.00 0.00 C ATOM 0 H THR A 31 3.491 8.435 -7.351 1.00 0.00 H new ATOM 0 HA THR A 31 4.306 11.188 -6.612 1.00 0.00 H new ATOM 0 HB THR A 31 6.103 8.784 -6.914 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.483 9.167 -4.623 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.883 10.324 -6.125 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.156 10.877 -7.653 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.709 11.662 -6.120 1.00 0.00 H new ATOM 474 N LEU A 32 4.637 11.682 -9.028 1.00 0.00 N ATOM 475 CA LEU A 32 4.820 12.019 -10.443 1.00 0.00 C ATOM 476 C LEU A 32 6.253 11.760 -10.911 1.00 0.00 C ATOM 477 O LEU A 32 7.198 11.979 -10.151 1.00 0.00 O ATOM 478 CB LEU A 32 4.512 13.501 -10.755 1.00 0.00 C ATOM 479 CG LEU A 32 3.128 14.041 -10.378 1.00 0.00 C ATOM 480 CD1 LEU A 32 2.835 15.335 -11.141 1.00 0.00 C ATOM 481 CD2 LEU A 32 2.018 13.025 -10.656 1.00 0.00 C ATOM 0 H LEU A 32 4.523 12.498 -8.427 1.00 0.00 H new ATOM 0 HA LEU A 32 4.115 11.375 -10.969 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.259 14.112 -10.248 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.650 13.653 -11.826 1.00 0.00 H new ATOM 0 HG LEU A 32 3.144 14.239 -9.306 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.849 15.706 -10.863 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.588 16.083 -10.892 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.860 15.139 -12.213 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.055 13.451 -10.373 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.008 12.778 -11.718 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.199 12.121 -10.075 1.00 0.00 H new ATOM 493 N HIS A 33 6.402 11.437 -12.201 1.00 0.00 N ATOM 494 CA HIS A 33 7.653 11.294 -12.911 1.00 0.00 C ATOM 495 C HIS A 33 7.416 11.772 -14.334 1.00 0.00 C ATOM 496 O HIS A 33 6.660 11.145 -15.078 1.00 0.00 O ATOM 497 CB HIS A 33 8.082 9.826 -12.893 1.00 0.00 C ATOM 498 CG HIS A 33 8.616 9.405 -11.550 1.00 0.00 C ATOM 499 ND1 HIS A 33 9.829 9.830 -10.999 1.00 0.00 N ATOM 500 CD2 HIS A 33 7.952 8.634 -10.640 1.00 0.00 C ATOM 501 CE1 HIS A 33 9.859 9.311 -9.762 1.00 0.00 C ATOM 502 NE2 HIS A 33 8.755 8.581 -9.524 1.00 0.00 N ATOM 0 H HIS A 33 5.597 11.260 -12.802 1.00 0.00 H new ATOM 0 HA HIS A 33 8.447 11.879 -12.447 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.231 9.198 -13.157 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.846 9.663 -13.653 1.00 0.00 H new ATOM 0 HD1 HIS A 33 10.540 10.411 -11.443 1.00 0.00 H new ATOM 0 HD2 HIS A 33 6.990 8.161 -10.770 1.00 0.00 H new ATOM 0 HE1 HIS A 33 10.661 9.459 -9.054 1.00 0.00 H new ATOM 510 N ASN A 34 8.026 12.890 -14.723 1.00 0.00 N ATOM 511 CA ASN A 34 7.959 13.363 -16.091 1.00 0.00 C ATOM 512 C ASN A 34 9.081 12.703 -16.877 1.00 0.00 C ATOM 513 O ASN A 34 10.254 13.026 -16.693 1.00 0.00 O ATOM 514 CB ASN A 34 8.070 14.878 -16.177 1.00 0.00 C ATOM 515 CG ASN A 34 7.652 15.291 -17.575 1.00 0.00 C ATOM 516 OD1 ASN A 34 8.116 14.763 -18.576 1.00 0.00 O ATOM 517 ND2 ASN A 34 6.753 16.236 -17.674 1.00 0.00 N ATOM 0 H ASN A 34 8.574 13.484 -14.100 1.00 0.00 H new ATOM 0 HA ASN A 34 6.989 13.097 -16.511 1.00 0.00 H new ATOM 0 HB2 ASN A 34 7.432 15.351 -15.431 1.00 0.00 H new ATOM 0 HB3 ASN A 34 9.091 15.199 -15.972 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.432 16.540 -18.593 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.373 16.669 -16.832 1.00 0.00 H new ATOM 524 N LEU A 35 8.716 11.811 -17.788 1.00 0.00 N ATOM 525 CA LEU A 35 9.671 11.002 -18.542 1.00 0.00 C ATOM 526 C LEU A 35 10.554 11.821 -19.495 1.00 0.00 C ATOM 527 O LEU A 35 11.524 11.277 -20.027 1.00 0.00 O ATOM 528 CB LEU A 35 8.940 9.882 -19.291 1.00 0.00 C ATOM 529 CG LEU A 35 8.441 8.780 -18.344 1.00 0.00 C ATOM 530 CD1 LEU A 35 7.485 7.875 -19.111 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.597 7.947 -17.767 1.00 0.00 C ATOM 0 H LEU A 35 7.742 11.625 -18.028 1.00 0.00 H new ATOM 0 HA LEU A 35 10.353 10.564 -17.813 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.094 10.303 -19.834 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.610 9.446 -20.032 1.00 0.00 H new ATOM 0 HG LEU A 35 7.934 9.253 -17.503 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.122 7.087 -18.451 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.641 8.462 -19.474 1.00 0.00 H new ATOM 0 HD13 LEU A 35 8.007 7.428 -19.957 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.197 7.180 -17.103 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.145 7.472 -18.581 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.270 8.597 -17.207 1.00 0.00 H new ATOM 543 N LYS A 36 10.274 13.121 -19.693 1.00 0.00 N ATOM 544 CA LYS A 36 11.205 14.007 -20.387 1.00 0.00 C ATOM 545 C LYS A 36 12.570 14.053 -19.684 1.00 0.00 C ATOM 546 O LYS A 36 13.586 14.296 -20.340 1.00 0.00 O ATOM 547 CB LYS A 36 10.609 15.392 -20.646 1.00 0.00 C ATOM 548 CG LYS A 36 10.764 16.256 -19.409 1.00 0.00 C ATOM 549 CD LYS A 36 9.876 17.493 -19.442 1.00 0.00 C ATOM 550 CE LYS A 36 9.895 17.880 -17.973 1.00 0.00 C ATOM 551 NZ LYS A 36 9.218 19.177 -17.693 1.00 0.00 N1+ ATOM 0 H LYS A 36 9.414 13.573 -19.382 1.00 0.00 H new ATOM 0 HA LYS A 36 11.384 13.582 -21.375 1.00 0.00 H new ATOM 0 HB2 LYS A 36 11.109 15.861 -21.494 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.555 15.301 -20.908 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.524 15.665 -18.525 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.805 16.564 -19.314 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.279 18.277 -20.083 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.870 17.273 -19.801 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.413 17.094 -17.392 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.929 17.938 -17.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.267 19.381 -16.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.692 19.937 -18.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.222 19.119 -17.987 1.00 0.00 H new ATOM 565 N ASP A 37 12.587 13.853 -18.362 1.00 0.00 N ATOM 566 CA ASP A 37 13.768 14.025 -17.518 1.00 0.00 C ATOM 567 C ASP A 37 13.971 12.845 -16.563 1.00 0.00 C ATOM 568 O ASP A 37 15.113 12.473 -16.286 1.00 0.00 O ATOM 569 CB ASP A 37 13.617 15.312 -16.703 1.00 0.00 C ATOM 570 CG ASP A 37 14.847 15.548 -15.806 1.00 0.00 C ATOM 571 OD1 ASP A 37 15.935 15.872 -16.343 1.00 0.00 O ATOM 572 OD2 ASP A 37 14.724 15.450 -14.563 1.00 0.00 O1- ATOM 0 H ASP A 37 11.761 13.561 -17.840 1.00 0.00 H new ATOM 0 HA ASP A 37 14.640 14.078 -18.170 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.486 16.159 -17.376 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.720 15.253 -16.087 1.00 0.00 H new ATOM 577 N ASP A 38 12.887 12.230 -16.079 1.00 0.00 N ATOM 578 CA ASP A 38 12.930 11.109 -15.158 1.00 0.00 C ATOM 579 C ASP A 38 13.145 9.828 -15.955 1.00 0.00 C ATOM 580 O ASP A 38 12.564 9.644 -17.030 1.00 0.00 O ATOM 581 CB ASP A 38 11.668 11.002 -14.290 1.00 0.00 C ATOM 582 CG ASP A 38 11.571 12.130 -13.245 1.00 0.00 C ATOM 583 OD1 ASP A 38 12.472 12.221 -12.374 1.00 0.00 O ATOM 584 OD2 ASP A 38 10.602 12.929 -13.296 1.00 0.00 O1- ATOM 0 H ASP A 38 11.938 12.510 -16.327 1.00 0.00 H new ATOM 0 HA ASP A 38 13.758 11.270 -14.468 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.787 11.029 -14.931 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.662 10.038 -13.781 1.00 0.00 H new ATOM 589 N SER A 39 13.947 8.918 -15.412 1.00 0.00 N ATOM 590 CA SER A 39 14.212 7.617 -16.002 1.00 0.00 C ATOM 591 C SER A 39 13.095 6.671 -15.570 1.00 0.00 C ATOM 592 O SER A 39 12.717 6.698 -14.405 1.00 0.00 O ATOM 593 CB SER A 39 15.590 7.100 -15.555 1.00 0.00 C ATOM 594 OG SER A 39 16.594 8.092 -15.748 1.00 0.00 O ATOM 0 H SER A 39 14.439 9.070 -14.532 1.00 0.00 H new ATOM 0 HA SER A 39 14.232 7.684 -17.090 1.00 0.00 H new ATOM 0 HB2 SER A 39 15.552 6.815 -14.503 1.00 0.00 H new ATOM 0 HB3 SER A 39 15.846 6.203 -16.119 1.00 0.00 H new ATOM 0 HG SER A 39 17.461 7.741 -15.455 1.00 0.00 H new ATOM 600 N PRO A 40 12.597 5.758 -16.418 1.00 0.00 N ATOM 601 CA PRO A 40 11.561 4.818 -16.008 1.00 0.00 C ATOM 602 C PRO A 40 12.120 3.720 -15.090 1.00 0.00 C ATOM 603 O PRO A 40 11.336 2.966 -14.538 1.00 0.00 O ATOM 604 CB PRO A 40 11.000 4.301 -17.336 1.00 0.00 C ATOM 605 CG PRO A 40 12.248 4.236 -18.207 1.00 0.00 C ATOM 606 CD PRO A 40 12.947 5.540 -17.817 1.00 0.00 C ATOM 0 HA PRO A 40 10.778 5.269 -15.399 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.528 3.324 -17.226 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.249 4.973 -17.750 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.858 3.360 -17.988 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.007 4.199 -19.269 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.027 5.462 -17.945 1.00 0.00 H new ATOM 0 HD3 PRO A 40 12.611 6.369 -18.441 1.00 0.00 H new ATOM 614 N LYS A 41 13.437 3.621 -14.858 1.00 0.00 N ATOM 615 CA LYS A 41 14.056 2.577 -14.022 1.00 0.00 C ATOM 616 C LYS A 41 13.452 2.545 -12.618 1.00 0.00 C ATOM 617 O LYS A 41 13.196 1.485 -12.066 1.00 0.00 O ATOM 618 CB LYS A 41 15.576 2.825 -13.934 1.00 0.00 C ATOM 619 CG LYS A 41 16.351 2.612 -15.250 1.00 0.00 C ATOM 620 CD LYS A 41 16.845 1.169 -15.450 1.00 0.00 C ATOM 621 CE LYS A 41 17.721 1.096 -16.716 1.00 0.00 C ATOM 622 NZ LYS A 41 18.359 -0.235 -16.904 1.00 0.00 N1+ ATOM 0 H LYS A 41 14.115 4.274 -15.252 1.00 0.00 H new ATOM 0 HA LYS A 41 13.862 1.610 -14.487 1.00 0.00 H new ATOM 0 HB2 LYS A 41 15.743 3.847 -13.594 1.00 0.00 H new ATOM 0 HB3 LYS A 41 15.993 2.164 -13.174 1.00 0.00 H new ATOM 0 HG2 LYS A 41 15.710 2.886 -16.088 1.00 0.00 H new ATOM 0 HG3 LYS A 41 17.207 3.286 -15.270 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.417 0.845 -14.580 1.00 0.00 H new ATOM 0 HD3 LYS A 41 15.996 0.492 -15.543 1.00 0.00 H new ATOM 0 HE2 LYS A 41 17.109 1.326 -17.588 1.00 0.00 H new ATOM 0 HE3 LYS A 41 18.496 1.860 -16.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 19.223 -0.129 -17.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.603 -0.637 -15.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.698 -0.871 -17.394 1.00 0.00 H new ATOM 636 N LEU A 42 13.130 3.716 -12.071 1.00 0.00 N ATOM 637 CA LEU A 42 12.488 3.847 -10.763 1.00 0.00 C ATOM 638 C LEU A 42 11.072 3.281 -10.726 1.00 0.00 C ATOM 639 O LEU A 42 10.581 2.927 -9.658 1.00 0.00 O ATOM 640 CB LEU A 42 12.557 5.283 -10.221 1.00 0.00 C ATOM 641 CG LEU A 42 12.673 6.470 -11.180 1.00 0.00 C ATOM 642 CD1 LEU A 42 11.317 6.711 -11.824 1.00 0.00 C ATOM 643 CD2 LEU A 42 13.133 7.730 -10.446 1.00 0.00 C ATOM 0 H LEU A 42 13.309 4.610 -12.528 1.00 0.00 H new ATOM 0 HA LEU A 42 13.071 3.225 -10.084 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.663 5.443 -9.618 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.410 5.331 -9.545 1.00 0.00 H new ATOM 0 HG LEU A 42 13.417 6.239 -11.942 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.385 7.555 -12.510 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.012 5.820 -12.373 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.581 6.931 -11.051 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.206 8.557 -11.153 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.413 7.981 -9.668 1.00 0.00 H new ATOM 0 HD23 LEU A 42 14.109 7.552 -9.994 1.00 0.00 H new ATOM 655 N MET A 43 10.433 3.108 -11.874 1.00 0.00 N ATOM 656 CA MET A 43 9.156 2.403 -12.000 1.00 0.00 C ATOM 657 C MET A 43 9.253 0.923 -11.574 1.00 0.00 C ATOM 658 O MET A 43 8.232 0.277 -11.367 1.00 0.00 O ATOM 659 CB MET A 43 8.500 2.676 -13.377 1.00 0.00 C ATOM 660 CG MET A 43 8.525 1.550 -14.417 1.00 0.00 C ATOM 661 SD MET A 43 7.459 1.798 -15.878 1.00 0.00 S ATOM 662 CE MET A 43 7.580 3.585 -16.177 1.00 0.00 C ATOM 0 H MET A 43 10.790 3.458 -12.763 1.00 0.00 H new ATOM 0 HA MET A 43 8.453 2.817 -11.277 1.00 0.00 H new ATOM 0 HB2 MET A 43 7.459 2.949 -13.204 1.00 0.00 H new ATOM 0 HB3 MET A 43 8.989 3.547 -13.814 1.00 0.00 H new ATOM 0 HG2 MET A 43 9.552 1.418 -14.758 1.00 0.00 H new ATOM 0 HG3 MET A 43 8.229 0.622 -13.928 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.425 3.788 -17.237 1.00 0.00 H new ATOM 0 HE2 MET A 43 6.820 4.104 -15.593 1.00 0.00 H new ATOM 0 HE3 MET A 43 8.568 3.937 -15.881 1.00 0.00 H new ATOM 672 N GLU A 44 10.457 0.382 -11.382 1.00 0.00 N ATOM 673 CA GLU A 44 10.649 -0.962 -10.841 1.00 0.00 C ATOM 674 C GLU A 44 10.304 -1.018 -9.345 1.00 0.00 C ATOM 675 O GLU A 44 9.845 -2.059 -8.876 1.00 0.00 O ATOM 676 CB GLU A 44 12.094 -1.422 -11.070 1.00 0.00 C ATOM 677 CG GLU A 44 12.428 -1.583 -12.560 1.00 0.00 C ATOM 678 CD GLU A 44 13.866 -2.080 -12.803 1.00 0.00 C ATOM 679 OE1 GLU A 44 14.772 -1.892 -11.955 1.00 0.00 O ATOM 680 OE2 GLU A 44 14.082 -2.686 -13.877 1.00 0.00 O1- ATOM 0 H GLU A 44 11.328 0.866 -11.598 1.00 0.00 H new ATOM 0 HA GLU A 44 9.972 -1.636 -11.366 1.00 0.00 H new ATOM 0 HB2 GLU A 44 12.777 -0.700 -10.623 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.255 -2.372 -10.560 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.726 -2.284 -13.011 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.290 -0.626 -13.063 1.00 0.00 H new ATOM 687 N GLN A 45 10.503 0.075 -8.595 1.00 0.00 N ATOM 688 CA GLN A 45 10.412 0.062 -7.130 1.00 0.00 C ATOM 689 C GLN A 45 8.952 -0.021 -6.687 1.00 0.00 C ATOM 690 O GLN A 45 8.595 -0.761 -5.772 1.00 0.00 O ATOM 691 CB GLN A 45 11.000 1.333 -6.490 1.00 0.00 C ATOM 692 CG GLN A 45 12.300 1.876 -7.097 1.00 0.00 C ATOM 693 CD GLN A 45 12.444 3.359 -6.761 1.00 0.00 C ATOM 694 OE1 GLN A 45 13.314 3.775 -5.998 1.00 0.00 O ATOM 695 NE2 GLN A 45 11.559 4.177 -7.317 1.00 0.00 N ATOM 0 H GLN A 45 10.731 0.989 -8.986 1.00 0.00 H new ATOM 0 HA GLN A 45 10.982 -0.808 -6.804 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.247 2.119 -6.542 1.00 0.00 H new ATOM 0 HB3 GLN A 45 11.177 1.131 -5.434 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.154 1.321 -6.709 1.00 0.00 H new ATOM 0 HG3 GLN A 45 12.294 1.737 -8.178 1.00 0.00 H new ATOM 0 HE21 GLN A 45 10.847 3.806 -7.947 1.00 0.00 H new ATOM 0 HE22 GLN A 45 11.591 5.176 -7.115 1.00 0.00 H new ATOM 704 N TYR A 46 8.133 0.818 -7.327 1.00 0.00 N ATOM 705 CA TYR A 46 6.759 1.084 -6.951 1.00 0.00 C ATOM 706 C TYR A 46 5.943 -0.186 -7.151 1.00 0.00 C ATOM 707 O TYR A 46 6.217 -1.001 -8.035 1.00 0.00 O ATOM 708 CB TYR A 46 6.200 2.259 -7.768 1.00 0.00 C ATOM 709 CG TYR A 46 6.888 3.591 -7.548 1.00 0.00 C ATOM 710 CD1 TYR A 46 6.571 4.396 -6.436 1.00 0.00 C ATOM 711 CD2 TYR A 46 7.856 4.032 -8.469 1.00 0.00 C ATOM 712 CE1 TYR A 46 7.247 5.612 -6.232 1.00 0.00 C ATOM 713 CE2 TYR A 46 8.529 5.250 -8.281 1.00 0.00 C ATOM 714 CZ TYR A 46 8.241 6.036 -7.143 1.00 0.00 C ATOM 715 OH TYR A 46 8.922 7.199 -6.943 1.00 0.00 O ATOM 0 H TYR A 46 8.428 1.345 -8.149 1.00 0.00 H new ATOM 0 HA TYR A 46 6.704 1.372 -5.901 1.00 0.00 H new ATOM 0 HB2 TYR A 46 6.265 2.007 -8.826 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.142 2.373 -7.532 1.00 0.00 H new ATOM 0 HD1 TYR A 46 5.808 4.079 -5.740 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.085 3.425 -9.333 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.006 6.224 -5.376 1.00 0.00 H new ATOM 0 HE2 TYR A 46 9.261 5.583 -9.001 1.00 0.00 H new ATOM 0 HH TYR A 46 8.916 7.728 -7.768 1.00 0.00 H new ATOM 725 N ASP A 47 4.917 -0.346 -6.329 1.00 0.00 N ATOM 726 CA ASP A 47 4.067 -1.542 -6.305 1.00 0.00 C ATOM 727 C ASP A 47 3.145 -1.563 -7.524 1.00 0.00 C ATOM 728 O ASP A 47 2.668 -2.615 -7.941 1.00 0.00 O ATOM 729 CB ASP A 47 3.194 -1.545 -5.036 1.00 0.00 C ATOM 730 CG ASP A 47 3.996 -1.483 -3.731 1.00 0.00 C ATOM 731 OD1 ASP A 47 4.687 -2.468 -3.381 1.00 0.00 O ATOM 732 OD2 ASP A 47 3.917 -0.426 -3.060 1.00 0.00 O1- ATOM 0 H ASP A 47 4.641 0.359 -5.646 1.00 0.00 H new ATOM 0 HA ASP A 47 4.715 -2.419 -6.316 1.00 0.00 H new ATOM 0 HB2 ASP A 47 2.513 -0.695 -5.073 1.00 0.00 H new ATOM 0 HB3 ASP A 47 2.580 -2.446 -5.031 1.00 0.00 H new ATOM 737 N VAL A 48 2.862 -0.383 -8.076 1.00 0.00 N ATOM 738 CA VAL A 48 1.844 -0.115 -9.074 1.00 0.00 C ATOM 739 C VAL A 48 2.342 1.087 -9.867 1.00 0.00 C ATOM 740 O VAL A 48 2.959 1.973 -9.275 1.00 0.00 O ATOM 741 CB VAL A 48 0.573 0.260 -8.298 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.485 0.877 -9.199 1.00 0.00 C ATOM 743 CG2 VAL A 48 -0.004 -0.930 -7.526 1.00 0.00 C ATOM 0 H VAL A 48 3.374 0.460 -7.817 1.00 0.00 H new ATOM 0 HA VAL A 48 1.645 -0.955 -9.740 1.00 0.00 H new ATOM 0 HB VAL A 48 0.873 1.014 -7.570 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.366 1.126 -8.608 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.088 1.782 -9.659 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.760 0.165 -9.977 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.902 -0.617 -6.993 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.256 -1.729 -8.224 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.735 -1.293 -6.811 1.00 0.00 H new ATOM 753 N LEU A 49 2.038 1.186 -11.158 1.00 0.00 N ATOM 754 CA LEU A 49 2.263 2.396 -11.919 1.00 0.00 C ATOM 755 C LEU A 49 0.995 2.844 -12.615 1.00 0.00 C ATOM 756 O LEU A 49 0.111 2.039 -12.891 1.00 0.00 O ATOM 757 CB LEU A 49 3.360 2.252 -12.982 1.00 0.00 C ATOM 758 CG LEU A 49 4.728 1.638 -12.685 1.00 0.00 C ATOM 759 CD1 LEU A 49 5.281 2.005 -11.313 1.00 0.00 C ATOM 760 CD2 LEU A 49 4.748 0.125 -12.873 1.00 0.00 C ATOM 0 H LEU A 49 1.629 0.425 -11.700 1.00 0.00 H new ATOM 0 HA LEU A 49 2.587 3.136 -11.188 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.929 1.669 -13.796 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.547 3.253 -13.372 1.00 0.00 H new ATOM 0 HG LEU A 49 5.390 2.084 -13.428 1.00 0.00 H new ATOM 0 HD11 LEU A 49 6.254 1.533 -11.175 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.390 3.087 -11.242 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.596 1.658 -10.540 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.744 -0.256 -12.648 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.023 -0.335 -12.201 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.491 -0.117 -13.904 1.00 0.00 H new ATOM 772 N ILE A 50 0.939 4.123 -12.968 1.00 0.00 N ATOM 773 CA ILE A 50 -0.077 4.677 -13.852 1.00 0.00 C ATOM 774 C ILE A 50 0.713 5.410 -14.927 1.00 0.00 C ATOM 775 O ILE A 50 1.534 6.254 -14.580 1.00 0.00 O ATOM 776 CB ILE A 50 -1.049 5.562 -13.061 1.00 0.00 C ATOM 777 CG1 ILE A 50 -1.806 4.728 -12.009 1.00 0.00 C ATOM 778 CG2 ILE A 50 -2.071 6.243 -13.976 1.00 0.00 C ATOM 779 CD1 ILE A 50 -1.353 5.145 -10.621 1.00 0.00 C ATOM 0 H ILE A 50 1.612 4.816 -12.641 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.721 3.928 -14.312 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.451 6.330 -12.570 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.881 4.877 -12.114 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.615 3.666 -12.163 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.741 6.860 -13.377 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.550 6.869 -14.700 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.650 5.484 -14.502 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.886 4.558 -9.873 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.281 4.974 -10.521 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.567 6.203 -10.471 1.00 0.00 H new ATOM 791 N LEU A 51 0.543 5.047 -16.197 1.00 0.00 N ATOM 792 CA LEU A 51 1.350 5.563 -17.307 1.00 0.00 C ATOM 793 C LEU A 51 0.433 6.275 -18.288 1.00 0.00 C ATOM 794 O LEU A 51 -0.630 5.745 -18.607 1.00 0.00 O ATOM 795 CB LEU A 51 2.121 4.424 -18.004 1.00 0.00 C ATOM 796 CG LEU A 51 3.485 4.079 -17.396 1.00 0.00 C ATOM 797 CD1 LEU A 51 3.391 3.720 -15.922 1.00 0.00 C ATOM 798 CD2 LEU A 51 4.052 2.859 -18.125 1.00 0.00 C ATOM 0 H LEU A 51 -0.168 4.377 -16.490 1.00 0.00 H new ATOM 0 HA LEU A 51 2.089 6.266 -16.922 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.500 3.528 -17.991 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.267 4.695 -19.050 1.00 0.00 H new ATOM 0 HG LEU A 51 4.118 4.960 -17.501 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.385 3.484 -15.541 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.980 4.564 -15.367 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.740 2.854 -15.799 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.023 2.602 -17.703 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.371 2.016 -18.008 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.166 3.089 -19.184 1.00 0.00 H new ATOM 810 N GLY A 52 0.849 7.447 -18.769 1.00 0.00 N ATOM 811 CA GLY A 52 0.018 8.292 -19.617 1.00 0.00 C ATOM 812 C GLY A 52 0.719 8.685 -20.899 1.00 0.00 C ATOM 813 O GLY A 52 1.754 9.342 -20.807 1.00 0.00 O ATOM 0 H GLY A 52 1.773 7.835 -18.579 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.906 7.765 -19.857 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.261 9.191 -19.068 1.00 0.00 H new ATOM 817 N ILE A 53 0.175 8.337 -22.071 1.00 0.00 N ATOM 818 CA ILE A 53 0.727 8.727 -23.378 1.00 0.00 C ATOM 819 C ILE A 53 -0.300 9.520 -24.198 1.00 0.00 C ATOM 820 O ILE A 53 -1.440 9.079 -24.333 1.00 0.00 O ATOM 821 CB ILE A 53 1.278 7.550 -24.223 1.00 0.00 C ATOM 822 CG1 ILE A 53 0.285 6.442 -24.596 1.00 0.00 C ATOM 823 CG2 ILE A 53 2.522 6.894 -23.611 1.00 0.00 C ATOM 824 CD1 ILE A 53 -0.253 5.646 -23.412 1.00 0.00 C ATOM 0 H ILE A 53 -0.670 7.770 -22.142 1.00 0.00 H new ATOM 0 HA ILE A 53 1.583 9.358 -23.140 1.00 0.00 H new ATOM 0 HB ILE A 53 1.531 8.066 -25.149 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.555 6.889 -25.128 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.771 5.755 -25.288 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.856 6.078 -24.252 1.00 0.00 H new ATOM 0 HG22 ILE A 53 3.317 7.634 -23.522 1.00 0.00 H new ATOM 0 HG23 ILE A 53 2.278 6.503 -22.623 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.947 4.885 -23.770 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.575 5.165 -22.890 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.772 6.317 -22.728 1.00 0.00 H new ATOM 836 N PRO A 54 0.067 10.670 -24.778 1.00 0.00 N ATOM 837 CA PRO A 54 -0.755 11.326 -25.790 1.00 0.00 C ATOM 838 C PRO A 54 -0.481 10.653 -27.147 1.00 0.00 C ATOM 839 O PRO A 54 0.641 10.200 -27.392 1.00 0.00 O ATOM 840 CB PRO A 54 -0.304 12.784 -25.750 1.00 0.00 C ATOM 841 CG PRO A 54 1.193 12.661 -25.417 1.00 0.00 C ATOM 842 CD PRO A 54 1.270 11.445 -24.502 1.00 0.00 C ATOM 0 HA PRO A 54 -1.830 11.255 -25.622 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.468 13.286 -26.704 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.842 13.355 -24.993 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.792 12.521 -26.317 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.566 13.557 -24.922 1.00 0.00 H new ATOM 0 HD2 PRO A 54 2.168 10.860 -24.702 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.312 11.744 -23.455 1.00 0.00 H new ATOM 850 N THR A 55 -1.470 10.609 -28.041 1.00 0.00 N ATOM 851 CA THR A 55 -1.240 10.199 -29.425 1.00 0.00 C ATOM 852 C THR A 55 -1.051 11.475 -30.249 1.00 0.00 C ATOM 853 O THR A 55 -1.897 12.366 -30.195 1.00 0.00 O ATOM 854 CB THR A 55 -2.390 9.334 -29.932 1.00 0.00 C ATOM 855 OG1 THR A 55 -2.611 8.251 -29.037 1.00 0.00 O ATOM 856 CG2 THR A 55 -2.049 8.737 -31.296 1.00 0.00 C ATOM 0 H THR A 55 -2.438 10.853 -27.830 1.00 0.00 H new ATOM 0 HA THR A 55 -0.348 9.579 -29.511 1.00 0.00 H new ATOM 0 HB THR A 55 -3.276 9.965 -30.006 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.017 8.587 -28.211 1.00 0.00 H new ATOM 0 HG21 THR A 55 -2.880 8.123 -31.643 1.00 0.00 H new ATOM 0 HG22 THR A 55 -1.869 9.541 -32.010 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.154 8.121 -31.210 1.00 0.00 H new ATOM 864 N TRP A 56 0.024 11.560 -31.025 1.00 0.00 N ATOM 865 CA TRP A 56 0.351 12.668 -31.898 1.00 0.00 C ATOM 866 C TRP A 56 0.469 12.174 -33.343 1.00 0.00 C ATOM 867 O TRP A 56 0.434 10.970 -33.582 1.00 0.00 O ATOM 868 CB TRP A 56 1.644 13.338 -31.404 1.00 0.00 C ATOM 869 CG TRP A 56 1.478 14.313 -30.278 1.00 0.00 C ATOM 870 CD1 TRP A 56 1.732 14.078 -28.972 1.00 0.00 C ATOM 871 CD2 TRP A 56 1.076 15.715 -30.355 1.00 0.00 C ATOM 872 NE1 TRP A 56 1.564 15.242 -28.241 1.00 0.00 N ATOM 873 CE2 TRP A 56 1.118 16.272 -29.043 1.00 0.00 C ATOM 874 CE3 TRP A 56 0.708 16.580 -31.411 1.00 0.00 C ATOM 875 CZ2 TRP A 56 0.789 17.611 -28.793 1.00 0.00 C ATOM 876 CZ3 TRP A 56 0.398 17.931 -31.168 1.00 0.00 C ATOM 877 CH2 TRP A 56 0.425 18.446 -29.860 1.00 0.00 C ATOM 0 H TRP A 56 0.722 10.817 -31.060 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.442 13.415 -31.876 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.338 12.559 -31.087 1.00 0.00 H new ATOM 0 HB3 TRP A 56 2.108 13.856 -32.244 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.023 13.123 -28.559 1.00 0.00 H new ATOM 0 HE1 TRP A 56 1.746 15.327 -27.241 1.00 0.00 H new ATOM 0 HE3 TRP A 56 0.664 16.198 -32.420 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 0.815 17.998 -27.785 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 0.137 18.577 -31.993 1.00 0.00 H new ATOM 0 HH2 TRP A 56 0.167 19.479 -29.678 1.00 0.00 H new ATOM 888 N ASP A 57 0.589 13.118 -34.281 1.00 0.00 N ATOM 889 CA ASP A 57 0.942 12.946 -35.698 1.00 0.00 C ATOM 890 C ASP A 57 0.504 11.613 -36.337 1.00 0.00 C ATOM 891 O ASP A 57 1.320 10.884 -36.904 1.00 0.00 O ATOM 892 CB ASP A 57 2.434 13.255 -35.898 1.00 0.00 C ATOM 893 CG ASP A 57 2.818 13.329 -37.392 1.00 0.00 C ATOM 894 OD1 ASP A 57 2.032 13.883 -38.201 1.00 0.00 O ATOM 895 OD2 ASP A 57 3.947 12.918 -37.752 1.00 0.00 O1- ATOM 0 H ASP A 57 0.430 14.100 -34.054 1.00 0.00 H new ATOM 0 HA ASP A 57 0.349 13.672 -36.254 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.675 14.202 -35.415 1.00 0.00 H new ATOM 0 HB3 ASP A 57 3.032 12.486 -35.408 1.00 0.00 H new ATOM 900 N PHE A 58 -0.798 11.303 -36.248 1.00 0.00 N ATOM 901 CA PHE A 58 -1.406 10.087 -36.789 1.00 0.00 C ATOM 902 C PHE A 58 -0.747 8.811 -36.238 1.00 0.00 C ATOM 903 O PHE A 58 -0.005 8.112 -36.940 1.00 0.00 O ATOM 904 CB PHE A 58 -1.452 10.131 -38.324 1.00 0.00 C ATOM 905 CG PHE A 58 -2.129 11.357 -38.906 1.00 0.00 C ATOM 906 CD1 PHE A 58 -3.463 11.637 -38.574 1.00 0.00 C ATOM 907 CD2 PHE A 58 -1.435 12.209 -39.788 1.00 0.00 C ATOM 908 CE1 PHE A 58 -4.119 12.743 -39.145 1.00 0.00 C ATOM 909 CE2 PHE A 58 -2.082 13.325 -40.346 1.00 0.00 C ATOM 910 CZ PHE A 58 -3.427 13.591 -40.029 1.00 0.00 C ATOM 0 H PHE A 58 -1.473 11.911 -35.784 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.439 10.049 -36.445 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -0.432 10.081 -38.705 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.971 9.242 -38.683 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -3.989 11.001 -37.877 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.404 12.004 -40.036 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.153 12.941 -38.905 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.547 13.979 -41.018 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.927 14.444 -40.463 1.00 0.00 H new ATOM 920 N GLY A 59 -1.064 8.466 -34.985 1.00 0.00 N ATOM 921 CA GLY A 59 -0.593 7.232 -34.376 1.00 0.00 C ATOM 922 C GLY A 59 0.911 7.210 -34.065 1.00 0.00 C ATOM 923 O GLY A 59 1.544 6.151 -34.115 1.00 0.00 O ATOM 0 H GLY A 59 -1.650 9.035 -34.374 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.145 7.064 -33.451 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -0.826 6.401 -35.042 1.00 0.00 H new ATOM 927 N GLU A 60 1.493 8.367 -33.757 1.00 0.00 N ATOM 928 CA GLU A 60 2.827 8.525 -33.220 1.00 0.00 C ATOM 929 C GLU A 60 2.748 8.745 -31.706 1.00 0.00 C ATOM 930 O GLU A 60 1.737 9.211 -31.164 1.00 0.00 O ATOM 931 CB GLU A 60 3.587 9.666 -33.919 1.00 0.00 C ATOM 932 CG GLU A 60 3.864 9.389 -35.401 1.00 0.00 C ATOM 933 CD GLU A 60 5.040 8.412 -35.608 1.00 0.00 C ATOM 934 OE1 GLU A 60 4.834 7.176 -35.554 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 6.181 8.878 -35.847 1.00 0.00 O ATOM 0 H GLU A 60 1.016 9.260 -33.885 1.00 0.00 H new ATOM 0 HA GLU A 60 3.391 7.612 -33.412 1.00 0.00 H new ATOM 0 HB2 GLU A 60 3.010 10.586 -33.830 1.00 0.00 H new ATOM 0 HB3 GLU A 60 4.533 9.832 -33.404 1.00 0.00 H new ATOM 0 HG2 GLU A 60 2.967 8.977 -35.864 1.00 0.00 H new ATOM 0 HG3 GLU A 60 4.082 10.329 -35.909 1.00 0.00 H new ATOM 942 N ILE A 61 3.842 8.418 -31.025 1.00 0.00 N ATOM 943 CA ILE A 61 4.051 8.656 -29.606 1.00 0.00 C ATOM 944 C ILE A 61 4.769 10.017 -29.491 1.00 0.00 C ATOM 945 O ILE A 61 5.521 10.396 -30.396 1.00 0.00 O ATOM 946 CB ILE A 61 4.890 7.490 -29.026 1.00 0.00 C ATOM 947 CG1 ILE A 61 4.316 6.077 -29.289 1.00 0.00 C ATOM 948 CG2 ILE A 61 5.103 7.641 -27.513 1.00 0.00 C ATOM 949 CD1 ILE A 61 5.442 5.032 -29.313 1.00 0.00 C ATOM 0 H ILE A 61 4.639 7.961 -31.468 1.00 0.00 H new ATOM 0 HA ILE A 61 3.121 8.693 -29.038 1.00 0.00 H new ATOM 0 HB ILE A 61 5.835 7.566 -29.565 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.593 5.822 -28.514 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.782 6.066 -30.239 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.696 6.804 -27.144 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.628 8.575 -27.311 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.137 7.652 -27.009 1.00 0.00 H new ATOM 0 HD11 ILE A 61 5.019 4.045 -29.499 1.00 0.00 H new ATOM 0 HD12 ILE A 61 6.150 5.278 -30.104 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.957 5.030 -28.353 1.00 0.00 H new ATOM 961 N GLN A 62 4.575 10.748 -28.385 1.00 0.00 N ATOM 962 CA GLN A 62 5.373 11.929 -28.102 1.00 0.00 C ATOM 963 C GLN A 62 6.815 11.496 -27.865 1.00 0.00 C ATOM 964 O GLN A 62 7.083 10.482 -27.222 1.00 0.00 O ATOM 965 CB GLN A 62 4.790 12.758 -26.943 1.00 0.00 C ATOM 966 CG GLN A 62 5.649 13.932 -26.434 1.00 0.00 C ATOM 967 CD GLN A 62 6.162 14.933 -27.482 1.00 0.00 C ATOM 968 OE1 GLN A 62 5.837 14.883 -28.667 1.00 0.00 O ATOM 969 NE2 GLN A 62 7.050 15.827 -27.075 1.00 0.00 N ATOM 0 H GLN A 62 3.871 10.535 -27.678 1.00 0.00 H new ATOM 0 HA GLN A 62 5.351 12.601 -28.960 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.825 13.154 -27.259 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.600 12.087 -26.106 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.065 14.484 -25.697 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.511 13.518 -25.912 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.319 15.868 -26.092 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.465 16.475 -27.745 1.00 0.00 H new ATOM 978 N GLU A 63 7.752 12.311 -28.328 1.00 0.00 N ATOM 979 CA GLU A 63 9.164 11.934 -28.382 1.00 0.00 C ATOM 980 C GLU A 63 9.756 11.700 -26.986 1.00 0.00 C ATOM 981 O GLU A 63 10.671 10.895 -26.826 1.00 0.00 O ATOM 982 CB GLU A 63 9.982 12.949 -29.200 1.00 0.00 C ATOM 983 CG GLU A 63 10.185 14.291 -28.485 1.00 0.00 C ATOM 984 CD GLU A 63 10.919 15.300 -29.385 1.00 0.00 C ATOM 985 OE1 GLU A 63 12.175 15.276 -29.433 1.00 0.00 O1- ATOM 986 OE2 GLU A 63 10.251 16.137 -30.042 1.00 0.00 O ATOM 0 H GLU A 63 7.560 13.250 -28.677 1.00 0.00 H new ATOM 0 HA GLU A 63 9.224 10.978 -28.901 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.956 12.518 -29.429 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.480 13.126 -30.151 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.218 14.699 -28.192 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.756 14.135 -27.570 1.00 0.00 H new ATOM 993 N ASP A 64 9.203 12.354 -25.962 1.00 0.00 N ATOM 994 CA ASP A 64 9.642 12.216 -24.574 1.00 0.00 C ATOM 995 C ASP A 64 9.343 10.807 -24.056 1.00 0.00 C ATOM 996 O ASP A 64 10.039 10.307 -23.172 1.00 0.00 O ATOM 997 CB ASP A 64 8.942 13.259 -23.687 1.00 0.00 C ATOM 998 CG ASP A 64 9.245 14.698 -24.130 1.00 0.00 C ATOM 999 OD1 ASP A 64 10.412 15.138 -24.010 1.00 0.00 O ATOM 1000 OD2 ASP A 64 8.314 15.372 -24.632 1.00 0.00 O1- ATOM 0 H ASP A 64 8.426 13.004 -26.077 1.00 0.00 H new ATOM 0 HA ASP A 64 10.718 12.383 -24.536 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.865 13.092 -23.714 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.259 13.125 -22.653 1.00 0.00 H new ATOM 1005 N TRP A 65 8.332 10.148 -24.633 1.00 0.00 N ATOM 1006 CA TRP A 65 8.024 8.756 -24.387 1.00 0.00 C ATOM 1007 C TRP A 65 8.869 7.851 -25.273 1.00 0.00 C ATOM 1008 O TRP A 65 9.411 6.868 -24.777 1.00 0.00 O ATOM 1009 CB TRP A 65 6.524 8.498 -24.546 1.00 0.00 C ATOM 1010 CG TRP A 65 5.783 8.426 -23.263 1.00 0.00 C ATOM 1011 CD1 TRP A 65 4.879 9.320 -22.808 1.00 0.00 C ATOM 1012 CD2 TRP A 65 5.827 7.352 -22.284 1.00 0.00 C ATOM 1013 NE1 TRP A 65 4.324 8.837 -21.642 1.00 0.00 N ATOM 1014 CE2 TRP A 65 4.863 7.624 -21.278 1.00 0.00 C ATOM 1015 CE3 TRP A 65 6.567 6.157 -22.176 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 4.629 6.750 -20.210 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 6.368 5.288 -21.090 1.00 0.00 C ATOM 1018 CH2 TRP A 65 5.407 5.585 -20.115 1.00 0.00 C ATOM 0 H TRP A 65 7.697 10.589 -25.298 1.00 0.00 H new ATOM 0 HA TRP A 65 8.280 8.516 -23.355 1.00 0.00 H new ATOM 0 HB2 TRP A 65 6.093 9.290 -25.158 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.382 7.563 -25.088 1.00 0.00 H new ATOM 0 HD1 TRP A 65 4.631 10.259 -23.280 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.600 9.321 -21.112 1.00 0.00 H new ATOM 0 HE3 TRP A 65 7.294 5.907 -22.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 3.867 6.967 -19.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 6.958 4.387 -21.007 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.263 4.912 -19.283 1.00 0.00 H new ATOM 1029 N GLU A 66 9.035 8.190 -26.555 1.00 0.00 N ATOM 1030 CA GLU A 66 9.866 7.413 -27.484 1.00 0.00 C ATOM 1031 C GLU A 66 11.290 7.251 -26.942 1.00 0.00 C ATOM 1032 O GLU A 66 11.903 6.194 -27.106 1.00 0.00 O ATOM 1033 CB GLU A 66 9.920 8.065 -28.873 1.00 0.00 C ATOM 1034 CG GLU A 66 8.551 8.126 -29.558 1.00 0.00 C ATOM 1035 CD GLU A 66 8.671 8.571 -31.028 1.00 0.00 C ATOM 1036 OE1 GLU A 66 9.175 9.688 -31.294 1.00 0.00 O1- ATOM 1037 OE2 GLU A 66 8.268 7.793 -31.928 1.00 0.00 O ATOM 0 H GLU A 66 8.599 9.009 -26.979 1.00 0.00 H new ATOM 0 HA GLU A 66 9.404 6.430 -27.579 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.319 9.075 -28.779 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.612 7.507 -29.504 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.076 7.146 -29.512 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.905 8.819 -29.019 1.00 0.00 H new ATOM 1044 N ALA A 67 11.793 8.276 -26.244 1.00 0.00 N ATOM 1045 CA ALA A 67 13.124 8.303 -25.662 1.00 0.00 C ATOM 1046 C ALA A 67 13.317 7.210 -24.604 1.00 0.00 C ATOM 1047 O ALA A 67 14.434 6.715 -24.441 1.00 0.00 O ATOM 1048 CB ALA A 67 13.382 9.685 -25.053 1.00 0.00 C ATOM 0 H ALA A 67 11.264 9.130 -26.068 1.00 0.00 H new ATOM 0 HA ALA A 67 13.843 8.106 -26.457 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.380 9.709 -24.615 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.309 10.445 -25.831 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.641 9.886 -24.279 1.00 0.00 H new ATOM 1054 N VAL A 68 12.250 6.821 -23.897 1.00 0.00 N ATOM 1055 CA VAL A 68 12.311 5.792 -22.861 1.00 0.00 C ATOM 1056 C VAL A 68 11.646 4.484 -23.277 1.00 0.00 C ATOM 1057 O VAL A 68 11.839 3.479 -22.600 1.00 0.00 O ATOM 1058 CB VAL A 68 11.788 6.341 -21.524 1.00 0.00 C ATOM 1059 CG1 VAL A 68 12.523 7.615 -21.078 1.00 0.00 C ATOM 1060 CG2 VAL A 68 10.272 6.566 -21.494 1.00 0.00 C ATOM 0 H VAL A 68 11.318 7.214 -24.030 1.00 0.00 H new ATOM 0 HA VAL A 68 13.360 5.531 -22.718 1.00 0.00 H new ATOM 0 HB VAL A 68 12.006 5.549 -20.807 1.00 0.00 H new ATOM 0 HG11 VAL A 68 12.113 7.958 -20.128 1.00 0.00 H new ATOM 0 HG12 VAL A 68 13.585 7.399 -20.958 1.00 0.00 H new ATOM 0 HG13 VAL A 68 12.394 8.392 -21.831 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.981 6.954 -20.518 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.995 7.283 -22.267 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.760 5.621 -21.676 1.00 0.00 H new ATOM 1070 N TRP A 69 10.908 4.466 -24.390 1.00 0.00 N ATOM 1071 CA TRP A 69 10.180 3.305 -24.909 1.00 0.00 C ATOM 1072 C TRP A 69 11.096 2.088 -25.068 1.00 0.00 C ATOM 1073 O TRP A 69 10.660 0.947 -24.932 1.00 0.00 O ATOM 1074 CB TRP A 69 9.545 3.697 -26.248 1.00 0.00 C ATOM 1075 CG TRP A 69 8.280 2.986 -26.600 1.00 0.00 C ATOM 1076 CD1 TRP A 69 8.162 1.862 -27.342 1.00 0.00 C ATOM 1077 CD2 TRP A 69 6.914 3.406 -26.309 1.00 0.00 C ATOM 1078 NE1 TRP A 69 6.824 1.547 -27.476 1.00 0.00 N ATOM 1079 CE2 TRP A 69 6.020 2.501 -26.937 1.00 0.00 C ATOM 1080 CE3 TRP A 69 6.333 4.483 -25.617 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 4.637 2.665 -26.952 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 4.937 4.663 -25.606 1.00 0.00 C ATOM 1083 CH2 TRP A 69 4.095 3.779 -26.312 1.00 0.00 C ATOM 0 H TRP A 69 10.797 5.292 -24.977 1.00 0.00 H new ATOM 0 HA TRP A 69 9.405 3.016 -24.199 1.00 0.00 H new ATOM 0 HB2 TRP A 69 9.346 4.769 -26.234 1.00 0.00 H new ATOM 0 HB3 TRP A 69 10.272 3.518 -27.040 1.00 0.00 H new ATOM 0 HD1 TRP A 69 8.983 1.300 -27.763 1.00 0.00 H new ATOM 0 HE1 TRP A 69 6.480 0.699 -27.926 1.00 0.00 H new ATOM 0 HE3 TRP A 69 6.965 5.180 -25.088 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 4.000 1.947 -27.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.507 5.485 -25.052 1.00 0.00 H new ATOM 0 HH2 TRP A 69 3.032 3.965 -26.357 1.00 0.00 H new ATOM 1094 N ASP A 70 12.378 2.350 -25.312 1.00 0.00 N ATOM 1095 CA ASP A 70 13.419 1.341 -25.466 1.00 0.00 C ATOM 1096 C ASP A 70 13.735 0.659 -24.133 1.00 0.00 C ATOM 1097 O ASP A 70 13.788 -0.568 -24.050 1.00 0.00 O ATOM 1098 CB ASP A 70 14.676 1.990 -26.049 1.00 0.00 C ATOM 1099 CG ASP A 70 15.826 0.970 -26.138 1.00 0.00 C ATOM 1100 OD1 ASP A 70 15.818 0.127 -27.068 1.00 0.00 O1- ATOM 1101 OD2 ASP A 70 16.747 1.023 -25.289 1.00 0.00 O ATOM 0 H ASP A 70 12.731 3.302 -25.411 1.00 0.00 H new ATOM 0 HA ASP A 70 13.059 0.572 -26.149 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.459 2.388 -27.040 1.00 0.00 H new ATOM 0 HB3 ASP A 70 14.978 2.832 -25.427 1.00 0.00 H new ATOM 1106 N GLN A 71 13.858 1.457 -23.070 1.00 0.00 N ATOM 1107 CA GLN A 71 14.139 0.992 -21.720 1.00 0.00 C ATOM 1108 C GLN A 71 12.985 0.218 -21.127 1.00 0.00 C ATOM 1109 O GLN A 71 13.241 -0.652 -20.310 1.00 0.00 O ATOM 1110 CB GLN A 71 14.497 2.171 -20.799 1.00 0.00 C ATOM 1111 CG GLN A 71 15.976 2.551 -20.898 1.00 0.00 C ATOM 1112 CD GLN A 71 16.244 3.867 -20.170 1.00 0.00 C ATOM 1113 OE1 GLN A 71 16.537 3.890 -18.978 1.00 0.00 O ATOM 1114 NE2 GLN A 71 16.086 4.988 -20.861 1.00 0.00 N ATOM 0 H GLN A 71 13.761 2.471 -23.132 1.00 0.00 H new ATOM 0 HA GLN A 71 14.991 0.317 -21.795 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.883 3.033 -21.060 1.00 0.00 H new ATOM 0 HB3 GLN A 71 14.258 1.910 -19.768 1.00 0.00 H new ATOM 0 HG2 GLN A 71 16.590 1.760 -20.468 1.00 0.00 H new ATOM 0 HG3 GLN A 71 16.264 2.644 -21.945 1.00 0.00 H new ATOM 0 HE21 GLN A 71 15.843 4.947 -21.851 1.00 0.00 H new ATOM 0 HE22 GLN A 71 16.208 5.891 -20.403 1.00 0.00 H new ATOM 1123 N LEU A 72 11.739 0.477 -21.527 1.00 0.00 N ATOM 1124 CA LEU A 72 10.576 -0.211 -20.948 1.00 0.00 C ATOM 1125 C LEU A 72 10.692 -1.726 -21.100 1.00 0.00 C ATOM 1126 O LEU A 72 10.197 -2.468 -20.260 1.00 0.00 O ATOM 1127 CB LEU A 72 9.272 0.238 -21.621 1.00 0.00 C ATOM 1128 CG LEU A 72 9.045 1.754 -21.697 1.00 0.00 C ATOM 1129 CD1 LEU A 72 7.705 2.042 -22.369 1.00 0.00 C ATOM 1130 CD2 LEU A 72 9.155 2.455 -20.340 1.00 0.00 C ATOM 0 H LEU A 72 11.506 1.158 -22.250 1.00 0.00 H new ATOM 0 HA LEU A 72 10.556 0.052 -19.890 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.251 -0.164 -22.634 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.436 -0.209 -21.083 1.00 0.00 H new ATOM 0 HG LEU A 72 9.849 2.171 -22.303 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.548 3.119 -22.421 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.707 1.627 -23.377 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.902 1.586 -21.790 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.984 3.524 -20.468 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.409 2.047 -19.658 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.151 2.294 -19.927 1.00 0.00 H new ATOM 1142 N ASP A 73 11.363 -2.180 -22.160 1.00 0.00 N ATOM 1143 CA ASP A 73 11.617 -3.598 -22.410 1.00 0.00 C ATOM 1144 C ASP A 73 12.599 -4.175 -21.393 1.00 0.00 C ATOM 1145 O ASP A 73 12.477 -5.341 -21.011 1.00 0.00 O ATOM 1146 CB ASP A 73 12.160 -3.802 -23.823 1.00 0.00 C ATOM 1147 CG ASP A 73 12.422 -5.295 -24.093 1.00 0.00 C ATOM 1148 OD1 ASP A 73 11.437 -6.065 -24.200 1.00 0.00 O1- ATOM 1149 OD2 ASP A 73 13.605 -5.692 -24.237 1.00 0.00 O ATOM 0 H ASP A 73 11.749 -1.566 -22.877 1.00 0.00 H new ATOM 0 HA ASP A 73 10.668 -4.125 -22.309 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.448 -3.415 -24.551 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.083 -3.237 -23.949 1.00 0.00 H new ATOM 1154 N ASP A 74 13.538 -3.355 -20.916 1.00 0.00 N ATOM 1155 CA ASP A 74 14.605 -3.788 -20.023 1.00 0.00 C ATOM 1156 C ASP A 74 14.099 -3.896 -18.585 1.00 0.00 C ATOM 1157 O ASP A 74 14.605 -4.703 -17.801 1.00 0.00 O ATOM 1158 CB ASP A 74 15.783 -2.808 -20.102 1.00 0.00 C ATOM 1159 CG ASP A 74 16.862 -3.128 -19.054 1.00 0.00 C ATOM 1160 OD1 ASP A 74 17.602 -4.125 -19.231 1.00 0.00 O ATOM 1161 OD2 ASP A 74 17.008 -2.341 -18.086 1.00 0.00 O1- ATOM 0 H ASP A 74 13.576 -2.361 -21.144 1.00 0.00 H new ATOM 0 HA ASP A 74 14.942 -4.775 -20.339 1.00 0.00 H new ATOM 0 HB2 ASP A 74 16.222 -2.846 -21.099 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.421 -1.791 -19.952 1.00 0.00 H new ATOM 1166 N LEU A 75 13.082 -3.096 -18.247 1.00 0.00 N ATOM 1167 CA LEU A 75 12.654 -2.929 -16.867 1.00 0.00 C ATOM 1168 C LEU A 75 11.987 -4.182 -16.339 1.00 0.00 C ATOM 1169 O LEU A 75 11.432 -4.999 -17.076 1.00 0.00 O ATOM 1170 CB LEU A 75 11.690 -1.751 -16.659 1.00 0.00 C ATOM 1171 CG LEU A 75 12.122 -0.476 -17.356 1.00 0.00 C ATOM 1172 CD1 LEU A 75 11.174 0.682 -17.095 1.00 0.00 C ATOM 1173 CD2 LEU A 75 13.566 -0.023 -17.134 1.00 0.00 C ATOM 0 H LEU A 75 12.541 -2.554 -18.920 1.00 0.00 H new ATOM 0 HA LEU A 75 13.571 -2.721 -16.316 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.702 -2.034 -17.020 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.595 -1.556 -15.591 1.00 0.00 H new ATOM 0 HG LEU A 75 12.075 -0.769 -18.405 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.531 1.569 -17.618 1.00 0.00 H new ATOM 0 HD12 LEU A 75 10.178 0.425 -17.455 1.00 0.00 H new ATOM 0 HD13 LEU A 75 11.132 0.884 -16.025 1.00 0.00 H new ATOM 0 HD21 LEU A 75 13.747 0.899 -17.686 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.733 0.152 -16.071 1.00 0.00 H new ATOM 0 HD23 LEU A 75 14.248 -0.797 -17.486 1.00 0.00 H new ATOM 1185 N ASN A 76 11.959 -4.239 -15.022 1.00 0.00 N ATOM 1186 CA ASN A 76 11.252 -5.231 -14.237 1.00 0.00 C ATOM 1187 C ASN A 76 9.855 -4.705 -13.935 1.00 0.00 C ATOM 1188 O ASN A 76 9.693 -3.939 -12.979 1.00 0.00 O ATOM 1189 CB ASN A 76 12.022 -5.585 -12.954 1.00 0.00 C ATOM 1190 CG ASN A 76 11.242 -6.604 -12.120 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.368 -7.809 -12.322 1.00 0.00 O ATOM 1192 ND2 ASN A 76 10.415 -6.160 -11.183 1.00 0.00 N ATOM 0 H ASN A 76 12.453 -3.561 -14.442 1.00 0.00 H new ATOM 0 HA ASN A 76 11.169 -6.157 -14.806 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.001 -5.991 -13.211 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.195 -4.683 -12.367 1.00 0.00 H new ATOM 0 HD21 ASN A 76 9.877 -6.821 -10.623 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.317 -5.157 -11.023 1.00 0.00 H new ATOM 1199 N LEU A 77 8.849 -5.086 -14.725 1.00 0.00 N ATOM 1200 CA LEU A 77 7.440 -4.806 -14.449 1.00 0.00 C ATOM 1201 C LEU A 77 6.614 -6.065 -14.216 1.00 0.00 C ATOM 1202 O LEU A 77 5.396 -6.028 -14.062 1.00 0.00 O ATOM 1203 CB LEU A 77 6.771 -3.952 -15.538 1.00 0.00 C ATOM 1204 CG LEU A 77 7.584 -2.835 -16.209 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.737 -2.189 -17.309 1.00 0.00 C ATOM 1206 CD2 LEU A 77 8.006 -1.749 -15.221 1.00 0.00 C ATOM 0 H LEU A 77 8.994 -5.607 -15.590 1.00 0.00 H new ATOM 0 HA LEU A 77 7.458 -4.231 -13.523 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.429 -4.627 -16.322 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.883 -3.496 -15.100 1.00 0.00 H new ATOM 0 HG LEU A 77 8.487 -3.289 -16.618 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.309 -1.395 -17.789 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.468 -2.942 -18.050 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.831 -1.770 -16.872 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.578 -0.983 -15.745 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.119 -1.298 -14.775 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.622 -2.190 -14.437 1.00 0.00 H new ATOM 1218 N GLU A 78 7.299 -7.181 -14.201 1.00 0.00 N ATOM 1219 CA GLU A 78 6.716 -8.499 -14.210 1.00 0.00 C ATOM 1220 C GLU A 78 6.038 -8.692 -12.849 1.00 0.00 C ATOM 1221 O GLU A 78 6.701 -8.693 -11.805 1.00 0.00 O ATOM 1222 CB GLU A 78 7.799 -9.546 -14.539 1.00 0.00 C ATOM 1223 CG GLU A 78 8.192 -9.646 -16.033 1.00 0.00 C ATOM 1224 CD GLU A 78 8.942 -8.444 -16.662 1.00 0.00 C ATOM 1225 OE1 GLU A 78 9.437 -7.548 -15.939 1.00 0.00 O ATOM 1226 OE2 GLU A 78 9.085 -8.414 -17.912 1.00 0.00 O1- ATOM 0 H GLU A 78 8.319 -7.196 -14.181 1.00 0.00 H new ATOM 0 HA GLU A 78 5.960 -8.624 -14.985 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.693 -9.314 -13.960 1.00 0.00 H new ATOM 0 HB3 GLU A 78 7.449 -10.523 -14.206 1.00 0.00 H new ATOM 0 HG2 GLU A 78 8.814 -10.532 -16.158 1.00 0.00 H new ATOM 0 HG3 GLU A 78 7.282 -9.812 -16.609 1.00 0.00 H new ATOM 1233 N GLY A 79 4.706 -8.799 -12.862 1.00 0.00 N ATOM 1234 CA GLY A 79 3.890 -8.981 -11.670 1.00 0.00 C ATOM 1235 C GLY A 79 3.616 -7.709 -10.867 1.00 0.00 C ATOM 1236 O GLY A 79 3.341 -7.814 -9.671 1.00 0.00 O ATOM 0 H GLY A 79 4.159 -8.760 -13.722 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.936 -9.417 -11.966 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.383 -9.703 -11.019 1.00 0.00 H new ATOM 1240 N LYS A 80 3.626 -6.525 -11.493 1.00 0.00 N ATOM 1241 CA LYS A 80 3.148 -5.273 -10.880 1.00 0.00 C ATOM 1242 C LYS A 80 2.048 -4.664 -11.745 1.00 0.00 C ATOM 1243 O LYS A 80 1.880 -5.081 -12.890 1.00 0.00 O ATOM 1244 CB LYS A 80 4.312 -4.334 -10.498 1.00 0.00 C ATOM 1245 CG LYS A 80 5.049 -3.700 -11.676 1.00 0.00 C ATOM 1246 CD LYS A 80 6.126 -2.668 -11.293 1.00 0.00 C ATOM 1247 CE LYS A 80 7.402 -3.195 -10.605 1.00 0.00 C ATOM 1248 NZ LYS A 80 7.295 -3.344 -9.120 1.00 0.00 N1+ ATOM 0 H LYS A 80 3.968 -6.405 -12.446 1.00 0.00 H new ATOM 0 HA LYS A 80 2.680 -5.480 -9.918 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.922 -3.538 -9.863 1.00 0.00 H new ATOM 0 HB3 LYS A 80 5.030 -4.896 -9.901 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.518 -4.492 -12.260 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.318 -3.216 -12.324 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.425 -2.141 -12.199 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.667 -1.932 -10.633 1.00 0.00 H new ATOM 0 HE2 LYS A 80 7.658 -4.163 -11.036 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.226 -2.518 -10.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.243 -3.283 -8.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 6.695 -2.586 -8.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.873 -4.267 -8.893 1.00 0.00 H new ATOM 1262 N ILE A 81 1.229 -3.767 -11.191 1.00 0.00 N ATOM 1263 CA ILE A 81 0.016 -3.312 -11.866 1.00 0.00 C ATOM 1264 C ILE A 81 0.300 -2.041 -12.641 1.00 0.00 C ATOM 1265 O ILE A 81 1.149 -1.249 -12.241 1.00 0.00 O ATOM 1266 CB ILE A 81 -1.133 -3.164 -10.853 1.00 0.00 C ATOM 1267 CG1 ILE A 81 -1.346 -4.464 -10.046 1.00 0.00 C ATOM 1268 CG2 ILE A 81 -2.472 -2.913 -11.565 1.00 0.00 C ATOM 1269 CD1 ILE A 81 -1.706 -4.214 -8.599 1.00 0.00 C ATOM 0 H ILE A 81 1.386 -3.343 -10.277 1.00 0.00 H new ATOM 0 HA ILE A 81 -0.308 -4.057 -12.593 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.851 -2.331 -10.209 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.137 -5.050 -10.515 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -0.437 -5.064 -10.089 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -3.265 -2.813 -10.824 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.406 -1.997 -12.152 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -2.696 -3.751 -12.225 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.842 -5.167 -8.088 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -0.905 -3.654 -8.116 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.631 -3.640 -8.548 1.00 0.00 H new ATOM 1281 N VAL A 82 -0.436 -1.844 -13.731 1.00 0.00 N ATOM 1282 CA VAL A 82 -0.347 -0.702 -14.606 1.00 0.00 C ATOM 1283 C VAL A 82 -1.755 -0.219 -14.943 1.00 0.00 C ATOM 1284 O VAL A 82 -2.582 -1.000 -15.402 1.00 0.00 O ATOM 1285 CB VAL A 82 0.449 -1.077 -15.873 1.00 0.00 C ATOM 1286 CG1 VAL A 82 0.544 0.104 -16.847 1.00 0.00 C ATOM 1287 CG2 VAL A 82 1.868 -1.546 -15.519 1.00 0.00 C ATOM 0 H VAL A 82 -1.142 -2.515 -14.034 1.00 0.00 H new ATOM 0 HA VAL A 82 0.184 0.113 -14.113 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.092 -1.892 -16.353 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.111 -0.196 -17.728 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.458 0.409 -17.147 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.047 0.939 -16.359 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.405 -1.803 -16.432 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.397 -0.746 -15.001 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.811 -2.422 -14.873 1.00 0.00 H new ATOM 1297 N ALA A 83 -2.043 1.063 -14.756 1.00 0.00 N ATOM 1298 CA ALA A 83 -3.223 1.697 -15.290 1.00 0.00 C ATOM 1299 C ALA A 83 -2.775 2.582 -16.446 1.00 0.00 C ATOM 1300 O ALA A 83 -2.007 3.512 -16.211 1.00 0.00 O ATOM 1301 CB ALA A 83 -3.940 2.474 -14.191 1.00 0.00 C ATOM 0 H ALA A 83 -1.448 1.694 -14.219 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.943 0.968 -15.662 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.830 2.950 -14.603 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.230 1.791 -13.393 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.273 3.237 -13.791 1.00 0.00 H new ATOM 1307 N LEU A 84 -3.211 2.316 -17.675 1.00 0.00 N ATOM 1308 CA LEU A 84 -2.919 3.208 -18.792 1.00 0.00 C ATOM 1309 C LEU A 84 -3.990 4.270 -18.944 1.00 0.00 C ATOM 1310 O LEU A 84 -5.182 3.990 -18.851 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.762 2.444 -20.118 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.496 1.589 -20.235 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -1.396 0.974 -21.629 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -0.242 2.433 -19.969 1.00 0.00 C ATOM 0 H LEU A 84 -3.764 1.495 -17.921 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.969 3.689 -18.560 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.630 1.798 -20.251 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.771 3.164 -20.936 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.559 0.796 -19.489 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.491 0.370 -21.696 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.267 0.345 -21.813 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.358 1.768 -22.375 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.645 1.805 -20.057 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.187 3.243 -20.697 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.291 2.851 -18.964 1.00 0.00 H new ATOM 1326 N TYR A 85 -3.555 5.478 -19.277 1.00 0.00 N ATOM 1327 CA TYR A 85 -4.418 6.565 -19.702 1.00 0.00 C ATOM 1328 C TYR A 85 -3.752 7.255 -20.881 1.00 0.00 C ATOM 1329 O TYR A 85 -2.561 7.061 -21.126 1.00 0.00 O ATOM 1330 CB TYR A 85 -4.724 7.519 -18.539 1.00 0.00 C ATOM 1331 CG TYR A 85 -3.625 8.465 -18.100 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -2.568 8.003 -17.297 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -3.697 9.824 -18.457 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -1.579 8.899 -16.850 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -2.716 10.723 -18.010 1.00 0.00 C ATOM 1336 CZ TYR A 85 -1.659 10.267 -17.197 1.00 0.00 C ATOM 1337 OH TYR A 85 -0.702 11.142 -16.796 1.00 0.00 O ATOM 0 H TYR A 85 -2.567 5.732 -19.258 1.00 0.00 H new ATOM 0 HA TYR A 85 -5.388 6.185 -20.022 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.592 8.118 -18.815 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -5.013 6.917 -17.678 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -2.515 6.960 -17.023 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -4.509 10.176 -19.076 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -0.760 8.542 -16.243 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.771 11.765 -18.289 1.00 0.00 H new ATOM 0 HH TYR A 85 -0.919 12.039 -17.127 1.00 0.00 H new ATOM 1347 N GLY A 86 -4.491 8.031 -21.658 1.00 0.00 N ATOM 1348 CA GLY A 86 -3.882 8.785 -22.732 1.00 0.00 C ATOM 1349 C GLY A 86 -4.774 9.895 -23.215 1.00 0.00 C ATOM 1350 O GLY A 86 -5.902 10.056 -22.741 1.00 0.00 O ATOM 0 H GLY A 86 -5.499 8.152 -21.564 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.935 9.203 -22.390 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.654 8.116 -23.562 1.00 0.00 H new ATOM 1354 N LEU A 87 -4.250 10.654 -24.171 1.00 0.00 N ATOM 1355 CA LEU A 87 -4.917 11.812 -24.744 1.00 0.00 C ATOM 1356 C LEU A 87 -5.031 11.602 -26.246 1.00 0.00 C ATOM 1357 O LEU A 87 -4.146 10.978 -26.842 1.00 0.00 O ATOM 1358 CB LEU A 87 -4.149 13.117 -24.468 1.00 0.00 C ATOM 1359 CG LEU A 87 -3.527 13.292 -23.069 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -2.877 14.668 -23.030 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -4.514 13.228 -21.905 1.00 0.00 C ATOM 0 H LEU A 87 -3.331 10.476 -24.576 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.900 11.908 -24.283 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.350 13.200 -25.205 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.829 13.951 -24.641 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.835 12.460 -22.935 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.424 14.829 -22.052 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.108 14.729 -23.800 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.633 15.433 -23.210 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.978 13.362 -20.966 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.257 14.018 -22.014 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.012 12.259 -21.903 1.00 0.00 H new ATOM 1373 N GLY A 88 -6.065 12.159 -26.856 1.00 0.00 N ATOM 1374 CA GLY A 88 -6.240 12.178 -28.291 1.00 0.00 C ATOM 1375 C GLY A 88 -7.362 13.148 -28.649 1.00 0.00 C ATOM 1376 O GLY A 88 -7.675 14.038 -27.860 1.00 0.00 O ATOM 0 H GLY A 88 -6.821 12.620 -26.351 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.313 12.480 -28.778 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.479 11.178 -28.653 1.00 0.00 H new ATOM 1380 N ASP A 89 -7.972 12.984 -29.823 1.00 0.00 N ATOM 1381 CA ASP A 89 -9.211 13.648 -30.225 1.00 0.00 C ATOM 1382 C ASP A 89 -9.857 12.809 -31.323 1.00 0.00 C ATOM 1383 O ASP A 89 -9.168 12.332 -32.224 1.00 0.00 O ATOM 1384 CB ASP A 89 -9.012 15.085 -30.719 1.00 0.00 C ATOM 1385 CG ASP A 89 -10.231 15.506 -31.555 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -11.383 15.396 -31.061 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -10.038 15.820 -32.748 1.00 0.00 O ATOM 0 H ASP A 89 -7.604 12.364 -30.545 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.847 13.724 -29.343 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.887 15.759 -29.872 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.104 15.154 -31.318 1.00 0.00 H new ATOM 1392 N GLN A 90 -11.176 12.628 -31.254 1.00 0.00 N ATOM 1393 CA GLN A 90 -11.930 11.867 -32.220 1.00 0.00 C ATOM 1394 C GLN A 90 -12.388 12.685 -33.432 1.00 0.00 C ATOM 1395 O GLN A 90 -12.687 12.085 -34.466 1.00 0.00 O ATOM 1396 CB GLN A 90 -13.108 11.167 -31.536 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.075 12.074 -30.743 1.00 0.00 C ATOM 1398 CD GLN A 90 -13.774 12.068 -29.239 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -14.120 11.142 -28.515 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -13.143 13.109 -28.722 1.00 0.00 N ATOM 0 H GLN A 90 -11.750 13.018 -30.507 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.252 11.116 -32.624 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.681 10.639 -32.298 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.711 10.413 -30.856 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.006 13.094 -31.121 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.100 11.741 -30.908 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -12.854 13.881 -29.323 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -12.945 13.140 -27.722 1.00 0.00 H new ATOM 1409 N LEU A 91 -12.470 14.017 -33.338 1.00 0.00 N ATOM 1410 CA LEU A 91 -13.031 14.834 -34.403 1.00 0.00 C ATOM 1411 C LEU A 91 -12.101 14.861 -35.611 1.00 0.00 C ATOM 1412 O LEU A 91 -12.546 14.695 -36.748 1.00 0.00 O ATOM 1413 CB LEU A 91 -13.316 16.260 -33.908 1.00 0.00 C ATOM 1414 CG LEU A 91 -14.345 16.327 -32.769 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -14.505 17.775 -32.287 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -15.715 15.771 -33.186 1.00 0.00 C ATOM 0 H LEU A 91 -12.151 14.548 -32.528 1.00 0.00 H new ATOM 0 HA LEU A 91 -13.976 14.385 -34.709 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -12.383 16.710 -33.569 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.674 16.860 -34.744 1.00 0.00 H new ATOM 0 HG LEU A 91 -13.967 15.703 -31.959 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -15.237 17.811 -31.480 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -13.546 18.146 -31.925 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -14.846 18.398 -33.114 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.407 15.841 -32.347 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -16.103 16.350 -34.025 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -15.609 14.728 -33.483 1.00 0.00 H new ATOM 1428 N GLY A 92 -10.812 15.059 -35.349 1.00 0.00 N ATOM 1429 CA GLY A 92 -9.773 15.118 -36.358 1.00 0.00 C ATOM 1430 C GLY A 92 -9.083 13.773 -36.562 1.00 0.00 C ATOM 1431 O GLY A 92 -8.637 13.491 -37.676 1.00 0.00 O ATOM 0 H GLY A 92 -10.458 15.186 -34.401 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.206 15.448 -37.302 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.032 15.863 -36.069 1.00 0.00 H new ATOM 1435 N TYR A 93 -9.024 12.937 -35.516 1.00 0.00 N ATOM 1436 CA TYR A 93 -8.161 11.765 -35.488 1.00 0.00 C ATOM 1437 C TYR A 93 -8.859 10.480 -35.030 1.00 0.00 C ATOM 1438 O TYR A 93 -8.201 9.643 -34.421 1.00 0.00 O ATOM 1439 CB TYR A 93 -6.888 12.063 -34.661 1.00 0.00 C ATOM 1440 CG TYR A 93 -6.291 13.442 -34.876 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -5.379 13.664 -35.921 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -6.706 14.518 -34.070 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -4.906 14.961 -36.188 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -6.234 15.817 -34.322 1.00 0.00 C ATOM 1445 CZ TYR A 93 -5.341 16.048 -35.393 1.00 0.00 C ATOM 1446 OH TYR A 93 -4.929 17.320 -35.663 1.00 0.00 O ATOM 0 H TYR A 93 -9.577 13.061 -34.668 1.00 0.00 H new ATOM 0 HA TYR A 93 -7.875 11.563 -36.520 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -7.125 11.947 -33.603 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -6.133 11.315 -34.902 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -5.039 12.834 -36.523 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -7.391 14.344 -33.253 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -4.212 15.127 -36.998 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -6.553 16.639 -33.698 1.00 0.00 H new ATOM 0 HH TYR A 93 -5.328 17.938 -35.015 1.00 0.00 H new ATOM 1456 N GLY A 94 -10.149 10.270 -35.331 1.00 0.00 N ATOM 1457 CA GLY A 94 -10.873 9.054 -34.927 1.00 0.00 C ATOM 1458 C GLY A 94 -10.130 7.795 -35.366 1.00 0.00 C ATOM 1459 O GLY A 94 -9.919 6.898 -34.556 1.00 0.00 O ATOM 0 H GLY A 94 -10.717 10.933 -35.858 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.999 9.046 -33.844 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -11.872 9.061 -35.364 1.00 0.00 H new ATOM 1463 N GLU A 95 -9.601 7.779 -36.592 1.00 0.00 N ATOM 1464 CA GLU A 95 -8.903 6.611 -37.144 1.00 0.00 C ATOM 1465 C GLU A 95 -7.625 6.255 -36.359 1.00 0.00 C ATOM 1466 O GLU A 95 -7.132 5.129 -36.479 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.555 6.845 -38.622 1.00 0.00 C ATOM 1468 CG GLU A 95 -9.758 6.816 -39.572 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.324 5.395 -39.753 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -9.819 4.644 -40.625 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -11.284 5.020 -39.038 1.00 0.00 O ATOM 0 H GLU A 95 -9.643 8.573 -37.231 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.586 5.767 -37.053 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.057 7.810 -38.716 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.840 6.085 -38.938 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.540 7.470 -39.185 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.462 7.213 -40.543 1.00 0.00 H new ATOM 1478 N TRP A 96 -7.101 7.183 -35.548 1.00 0.00 N ATOM 1479 CA TRP A 96 -5.884 7.040 -34.759 1.00 0.00 C ATOM 1480 C TRP A 96 -6.109 7.365 -33.274 1.00 0.00 C ATOM 1481 O TRP A 96 -5.138 7.535 -32.538 1.00 0.00 O ATOM 1482 CB TRP A 96 -4.761 7.893 -35.362 1.00 0.00 C ATOM 1483 CG TRP A 96 -4.576 7.800 -36.847 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -3.738 6.975 -37.516 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -5.268 8.568 -37.872 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -3.876 7.180 -38.878 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -4.815 8.148 -39.153 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -6.244 9.581 -37.836 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -5.312 8.696 -40.342 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -6.737 10.164 -39.020 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -6.275 9.718 -40.273 1.00 0.00 C ATOM 0 H TRP A 96 -7.540 8.095 -35.423 1.00 0.00 H new ATOM 0 HA TRP A 96 -5.583 5.993 -34.797 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -4.949 8.936 -35.106 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -3.823 7.611 -34.883 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -3.065 6.266 -37.058 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -3.347 6.676 -39.590 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.622 9.918 -36.882 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -4.960 8.339 -41.299 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -7.471 10.955 -38.966 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -6.660 10.160 -41.180 1.00 0.00 H new ATOM 1502 N PHE A 97 -7.360 7.519 -32.836 1.00 0.00 N ATOM 1503 CA PHE A 97 -7.770 7.748 -31.468 1.00 0.00 C ATOM 1504 C PHE A 97 -6.975 6.864 -30.522 1.00 0.00 C ATOM 1505 O PHE A 97 -6.980 5.647 -30.693 1.00 0.00 O ATOM 1506 CB PHE A 97 -9.272 7.471 -31.318 1.00 0.00 C ATOM 1507 CG PHE A 97 -9.909 8.170 -30.141 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.803 9.567 -30.052 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -10.632 7.451 -29.170 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -10.399 10.250 -28.976 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.261 8.140 -28.116 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.143 9.539 -28.020 1.00 0.00 C ATOM 0 H PHE A 97 -8.155 7.483 -33.474 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.575 8.790 -31.213 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -9.781 7.780 -32.231 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.425 6.397 -31.216 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -9.264 10.117 -30.809 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -10.704 6.375 -29.234 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -10.285 11.320 -28.885 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -11.834 7.595 -27.381 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.625 10.067 -27.210 1.00 0.00 H new ATOM 1522 N LEU A 98 -6.312 7.480 -29.536 1.00 0.00 N ATOM 1523 CA LEU A 98 -5.607 6.786 -28.455 1.00 0.00 C ATOM 1524 C LEU A 98 -4.673 5.679 -28.970 1.00 0.00 C ATOM 1525 O LEU A 98 -4.426 4.687 -28.294 1.00 0.00 O ATOM 1526 CB LEU A 98 -6.602 6.298 -27.397 1.00 0.00 C ATOM 1527 CG LEU A 98 -7.058 7.336 -26.364 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -5.925 7.952 -25.547 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -7.863 8.494 -26.950 1.00 0.00 C ATOM 0 H LEU A 98 -6.250 8.496 -29.467 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.944 7.503 -27.970 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.484 5.914 -27.909 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.152 5.460 -26.865 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.694 6.734 -25.716 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.336 8.674 -24.842 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.403 7.167 -25.000 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.226 8.455 -26.215 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.145 9.181 -26.152 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.257 9.022 -27.686 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.762 8.106 -27.430 1.00 0.00 H new ATOM 1541 N ASP A 99 -4.146 5.825 -30.175 1.00 0.00 N ATOM 1542 CA ASP A 99 -3.356 4.776 -30.819 1.00 0.00 C ATOM 1543 C ASP A 99 -2.128 4.444 -29.973 1.00 0.00 C ATOM 1544 O ASP A 99 -1.832 3.267 -29.742 1.00 0.00 O ATOM 1545 CB ASP A 99 -2.969 5.162 -32.247 1.00 0.00 C ATOM 1546 CG ASP A 99 -1.869 4.235 -32.790 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -0.677 4.511 -32.535 1.00 0.00 O1- ATOM 1548 OD2 ASP A 99 -2.203 3.259 -33.503 1.00 0.00 O ATOM 0 H ASP A 99 -4.251 6.670 -30.737 1.00 0.00 H new ATOM 0 HA ASP A 99 -3.972 3.879 -30.891 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -3.846 5.108 -32.892 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.621 6.195 -32.267 1.00 0.00 H new ATOM 1553 N ALA A 100 -1.499 5.472 -29.397 1.00 0.00 N ATOM 1554 CA ALA A 100 -0.360 5.292 -28.516 1.00 0.00 C ATOM 1555 C ALA A 100 -0.749 4.492 -27.268 1.00 0.00 C ATOM 1556 O ALA A 100 0.063 3.726 -26.753 1.00 0.00 O ATOM 1557 CB ALA A 100 0.219 6.659 -28.140 1.00 0.00 C ATOM 0 H ALA A 100 -1.770 6.446 -29.532 1.00 0.00 H new ATOM 0 HA ALA A 100 0.405 4.719 -29.040 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.074 6.522 -27.478 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.538 7.180 -29.043 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.543 7.249 -27.631 1.00 0.00 H new ATOM 1563 N LEU A 101 -1.993 4.634 -26.794 1.00 0.00 N ATOM 1564 CA LEU A 101 -2.538 3.865 -25.689 1.00 0.00 C ATOM 1565 C LEU A 101 -2.559 2.386 -26.026 1.00 0.00 C ATOM 1566 O LEU A 101 -2.113 1.572 -25.222 1.00 0.00 O ATOM 1567 CB LEU A 101 -3.962 4.354 -25.372 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.459 4.034 -23.966 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -3.689 4.820 -22.931 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -5.944 4.412 -23.846 1.00 0.00 C ATOM 0 H LEU A 101 -2.656 5.304 -27.183 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.903 4.009 -24.815 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -3.999 5.434 -25.516 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.650 3.912 -26.093 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.316 2.967 -23.793 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.062 4.575 -21.936 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.631 4.567 -22.995 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.818 5.887 -23.114 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.298 4.183 -22.841 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.065 5.478 -24.039 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.524 3.844 -24.573 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.038 2.051 -27.226 1.00 0.00 N ATOM 1583 CA GLY A 102 -3.033 0.678 -27.712 1.00 0.00 C ATOM 1584 C GLY A 102 -1.602 0.157 -27.778 1.00 0.00 C ATOM 1585 O GLY A 102 -1.337 -0.957 -27.328 1.00 0.00 O ATOM 0 H GLY A 102 -3.437 2.723 -27.882 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -3.629 0.047 -27.052 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.493 0.631 -28.699 1.00 0.00 H new ATOM 1589 N MET A 103 -0.662 0.984 -28.250 1.00 0.00 N ATOM 1590 CA MET A 103 0.726 0.561 -28.380 1.00 0.00 C ATOM 1591 C MET A 103 1.361 0.283 -27.025 1.00 0.00 C ATOM 1592 O MET A 103 1.988 -0.765 -26.864 1.00 0.00 O ATOM 1593 CB MET A 103 1.555 1.534 -29.225 1.00 0.00 C ATOM 1594 CG MET A 103 1.047 1.623 -30.670 1.00 0.00 C ATOM 1595 SD MET A 103 2.333 1.938 -31.912 1.00 0.00 S ATOM 1596 CE MET A 103 2.859 3.586 -31.379 1.00 0.00 C ATOM 0 H MET A 103 -0.841 1.944 -28.545 1.00 0.00 H new ATOM 0 HA MET A 103 0.719 -0.383 -28.924 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.526 2.524 -28.770 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.597 1.214 -29.227 1.00 0.00 H new ATOM 0 HG2 MET A 103 0.541 0.691 -30.920 1.00 0.00 H new ATOM 0 HG3 MET A 103 0.302 2.416 -30.730 1.00 0.00 H new ATOM 0 HE1 MET A 103 3.828 3.819 -31.820 1.00 0.00 H new ATOM 0 HE2 MET A 103 2.126 4.325 -31.704 1.00 0.00 H new ATOM 0 HE3 MET A 103 2.940 3.608 -30.292 1.00 0.00 H new ATOM 1606 N LEU A 104 1.163 1.146 -26.024 1.00 0.00 N ATOM 1607 CA LEU A 104 1.679 0.834 -24.702 1.00 0.00 C ATOM 1608 C LEU A 104 1.002 -0.385 -24.127 1.00 0.00 C ATOM 1609 O LEU A 104 1.646 -1.133 -23.404 1.00 0.00 O ATOM 1610 CB LEU A 104 1.544 1.966 -23.672 1.00 0.00 C ATOM 1611 CG LEU A 104 2.831 2.768 -23.436 1.00 0.00 C ATOM 1612 CD1 LEU A 104 2.733 3.550 -22.132 1.00 0.00 C ATOM 1613 CD2 LEU A 104 4.116 1.942 -23.420 1.00 0.00 C ATOM 0 H LEU A 104 0.667 2.034 -26.104 1.00 0.00 H new ATOM 0 HA LEU A 104 2.742 0.663 -24.871 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.761 2.649 -24.002 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.217 1.540 -22.723 1.00 0.00 H new ATOM 0 HG LEU A 104 2.906 3.432 -24.297 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.652 4.115 -21.976 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.889 4.238 -22.183 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.588 2.858 -21.303 1.00 0.00 H new ATOM 0 HD21 LEU A 104 4.969 2.599 -23.247 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.062 1.200 -22.623 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.236 1.437 -24.379 1.00 0.00 H new ATOM 1625 N HIS A 105 -0.280 -0.586 -24.399 1.00 0.00 N ATOM 1626 CA HIS A 105 -0.970 -1.710 -23.796 1.00 0.00 C ATOM 1627 C HIS A 105 -0.356 -3.019 -24.282 1.00 0.00 C ATOM 1628 O HIS A 105 -0.064 -3.903 -23.484 1.00 0.00 O ATOM 1629 CB HIS A 105 -2.477 -1.616 -24.048 1.00 0.00 C ATOM 1630 CG HIS A 105 -3.245 -2.281 -22.944 1.00 0.00 C ATOM 1631 ND1 HIS A 105 -3.735 -1.636 -21.811 1.00 0.00 N ATOM 1632 CD2 HIS A 105 -3.459 -3.616 -22.821 1.00 0.00 C ATOM 1633 CE1 HIS A 105 -4.258 -2.599 -21.043 1.00 0.00 C ATOM 1634 NE2 HIS A 105 -4.126 -3.799 -21.631 1.00 0.00 N ATOM 0 H HIS A 105 -0.847 -0.003 -25.015 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.842 -1.684 -22.714 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -2.773 -0.570 -24.124 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.721 -2.086 -25.001 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.164 -4.384 -23.520 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -4.723 -2.434 -20.082 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -4.461 -4.689 -21.261 1.00 0.00 H new ATOM 1642 N ASP A 106 -0.047 -3.103 -25.571 1.00 0.00 N ATOM 1643 CA ASP A 106 0.627 -4.239 -26.189 1.00 0.00 C ATOM 1644 C ASP A 106 2.058 -4.397 -25.672 1.00 0.00 C ATOM 1645 O ASP A 106 2.476 -5.500 -25.314 1.00 0.00 O ATOM 1646 CB ASP A 106 0.636 -4.090 -27.711 1.00 0.00 C ATOM 1647 CG ASP A 106 1.422 -5.243 -28.355 1.00 0.00 C ATOM 1648 OD1 ASP A 106 0.882 -6.373 -28.427 1.00 0.00 O1- ATOM 1649 OD2 ASP A 106 2.571 -5.019 -28.800 1.00 0.00 O ATOM 0 H ASP A 106 -0.265 -2.360 -26.235 1.00 0.00 H new ATOM 0 HA ASP A 106 0.071 -5.136 -25.918 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -0.387 -4.082 -28.089 1.00 0.00 H new ATOM 0 HB3 ASP A 106 1.085 -3.136 -27.987 1.00 0.00 H new ATOM 1654 N LYS A 107 2.778 -3.275 -25.561 1.00 0.00 N ATOM 1655 CA LYS A 107 4.123 -3.208 -25.000 1.00 0.00 C ATOM 1656 C LYS A 107 4.099 -3.831 -23.618 1.00 0.00 C ATOM 1657 O LYS A 107 4.800 -4.800 -23.345 1.00 0.00 O ATOM 1658 CB LYS A 107 4.589 -1.742 -24.989 1.00 0.00 C ATOM 1659 CG LYS A 107 5.991 -1.562 -24.403 1.00 0.00 C ATOM 1660 CD LYS A 107 7.115 -2.112 -25.283 1.00 0.00 C ATOM 1661 CE LYS A 107 8.247 -1.084 -25.452 1.00 0.00 C ATOM 1662 NZ LYS A 107 9.290 -1.546 -26.420 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.428 -2.367 -25.868 1.00 0.00 H new ATOM 0 HA LYS A 107 4.839 -3.767 -25.602 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.575 -1.355 -26.008 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.881 -1.146 -24.412 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.167 -0.500 -24.230 1.00 0.00 H new ATOM 0 HG3 LYS A 107 6.032 -2.054 -23.431 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.513 -3.025 -24.840 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.716 -2.380 -26.261 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.828 -0.138 -25.796 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.711 -0.894 -24.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 10.032 -0.822 -26.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.709 -2.435 -26.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 8.854 -1.702 -27.351 1.00 0.00 H new ATOM 1676 N LEU A 108 3.282 -3.288 -22.730 1.00 0.00 N ATOM 1677 CA LEU A 108 3.326 -3.661 -21.328 1.00 0.00 C ATOM 1678 C LEU A 108 2.647 -5.009 -21.106 1.00 0.00 C ATOM 1679 O LEU A 108 2.992 -5.693 -20.148 1.00 0.00 O ATOM 1680 CB LEU A 108 2.829 -2.513 -20.440 1.00 0.00 C ATOM 1681 CG LEU A 108 3.566 -1.184 -20.710 1.00 0.00 C ATOM 1682 CD1 LEU A 108 3.024 -0.117 -19.761 1.00 0.00 C ATOM 1683 CD2 LEU A 108 5.100 -1.276 -20.624 1.00 0.00 C ATOM 0 H LEU A 108 2.579 -2.585 -22.958 1.00 0.00 H new ATOM 0 HA LEU A 108 4.358 -3.818 -21.016 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.761 -2.370 -20.603 1.00 0.00 H new ATOM 0 HB3 LEU A 108 2.958 -2.788 -19.393 1.00 0.00 H new ATOM 0 HG LEU A 108 3.366 -0.914 -21.747 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.538 0.827 -19.943 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.955 0.013 -19.932 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.191 -0.428 -18.730 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.535 -0.298 -20.827 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.390 -1.601 -19.625 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.463 -1.994 -21.359 1.00 0.00 H new ATOM 1695 N SER A 109 1.803 -5.477 -22.029 1.00 0.00 N ATOM 1696 CA SER A 109 1.308 -6.848 -21.991 1.00 0.00 C ATOM 1697 C SER A 109 2.472 -7.846 -22.133 1.00 0.00 C ATOM 1698 O SER A 109 2.427 -8.922 -21.529 1.00 0.00 O ATOM 1699 CB SER A 109 0.230 -7.034 -23.072 1.00 0.00 C ATOM 1700 OG SER A 109 -0.456 -8.268 -22.925 1.00 0.00 O ATOM 0 H SER A 109 1.450 -4.924 -22.810 1.00 0.00 H new ATOM 0 HA SER A 109 0.844 -7.049 -21.025 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.484 -6.212 -23.018 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.693 -6.990 -24.058 1.00 0.00 H new ATOM 0 HG SER A 109 -1.134 -8.351 -23.628 1.00 0.00 H new ATOM 1706 N THR A 110 3.569 -7.496 -22.827 1.00 0.00 N ATOM 1707 CA THR A 110 4.711 -8.401 -22.974 1.00 0.00 C ATOM 1708 C THR A 110 5.521 -8.436 -21.660 1.00 0.00 C ATOM 1709 O THR A 110 6.224 -9.406 -21.377 1.00 0.00 O ATOM 1710 CB THR A 110 5.505 -7.995 -24.244 1.00 0.00 C ATOM 1711 OG1 THR A 110 5.804 -9.134 -25.038 1.00 0.00 O ATOM 1712 CG2 THR A 110 6.812 -7.246 -23.968 1.00 0.00 C ATOM 0 H THR A 110 3.684 -6.595 -23.292 1.00 0.00 H new ATOM 0 HA THR A 110 4.402 -9.434 -23.134 1.00 0.00 H new ATOM 0 HB THR A 110 4.844 -7.307 -24.770 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.303 -8.856 -25.834 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.299 -7.003 -24.913 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.596 -6.327 -23.424 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.473 -7.875 -23.371 1.00 0.00 H new ATOM 1720 N LYS A 111 5.390 -7.392 -20.827 1.00 0.00 N ATOM 1721 CA LYS A 111 6.095 -7.207 -19.565 1.00 0.00 C ATOM 1722 C LYS A 111 5.414 -7.912 -18.394 1.00 0.00 C ATOM 1723 O LYS A 111 5.832 -7.727 -17.256 1.00 0.00 O ATOM 1724 CB LYS A 111 6.253 -5.699 -19.304 1.00 0.00 C ATOM 1725 CG LYS A 111 7.007 -4.945 -20.407 1.00 0.00 C ATOM 1726 CD LYS A 111 8.442 -5.454 -20.599 1.00 0.00 C ATOM 1727 CE LYS A 111 9.289 -5.359 -19.314 1.00 0.00 C ATOM 1728 NZ LYS A 111 10.392 -6.347 -19.254 1.00 0.00 N1+ ATOM 0 H LYS A 111 4.756 -6.620 -21.033 1.00 0.00 H new ATOM 0 HA LYS A 111 7.077 -7.672 -19.649 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.264 -5.256 -19.188 1.00 0.00 H new ATOM 0 HB3 LYS A 111 6.778 -5.558 -18.359 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.462 -5.044 -21.346 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.032 -3.883 -20.163 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.413 -6.491 -20.933 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.924 -4.878 -21.389 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.707 -4.355 -19.238 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.640 -5.500 -18.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 11.046 -6.091 -18.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.001 -7.294 -19.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 10.904 -6.351 -20.159 1.00 0.00 H new ATOM 1742 N GLY A 112 4.358 -8.686 -18.649 1.00 0.00 N ATOM 1743 CA GLY A 112 3.754 -9.562 -17.647 1.00 0.00 C ATOM 1744 C GLY A 112 3.118 -8.766 -16.510 1.00 0.00 C ATOM 1745 O GLY A 112 3.203 -9.173 -15.350 1.00 0.00 O ATOM 0 H GLY A 112 3.897 -8.722 -19.558 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.998 -10.188 -18.120 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.514 -10.230 -17.242 1.00 0.00 H new ATOM 1749 N VAL A 113 2.543 -7.604 -16.824 1.00 0.00 N ATOM 1750 CA VAL A 113 1.860 -6.746 -15.874 1.00 0.00 C ATOM 1751 C VAL A 113 0.402 -7.193 -15.743 1.00 0.00 C ATOM 1752 O VAL A 113 -0.068 -8.098 -16.438 1.00 0.00 O ATOM 1753 CB VAL A 113 2.034 -5.255 -16.262 1.00 0.00 C ATOM 1754 CG1 VAL A 113 3.470 -4.957 -16.713 1.00 0.00 C ATOM 1755 CG2 VAL A 113 1.071 -4.751 -17.348 1.00 0.00 C ATOM 0 H VAL A 113 2.543 -7.230 -17.773 1.00 0.00 H new ATOM 0 HA VAL A 113 2.306 -6.841 -14.884 1.00 0.00 H new ATOM 0 HB VAL A 113 1.793 -4.718 -15.345 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.557 -3.903 -16.978 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.161 -5.186 -15.902 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.714 -5.570 -17.581 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.270 -3.699 -17.551 1.00 0.00 H new ATOM 0 HG22 VAL A 113 1.216 -5.330 -18.260 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.043 -4.866 -17.005 1.00 0.00 H new ATOM 1765 N LYS A 114 -0.319 -6.516 -14.856 1.00 0.00 N ATOM 1766 CA LYS A 114 -1.761 -6.653 -14.652 1.00 0.00 C ATOM 1767 C LYS A 114 -2.318 -5.262 -14.895 1.00 0.00 C ATOM 1768 O LYS A 114 -1.658 -4.297 -14.512 1.00 0.00 O ATOM 1769 CB LYS A 114 -2.101 -7.270 -13.274 1.00 0.00 C ATOM 1770 CG LYS A 114 -0.970 -7.128 -12.247 1.00 0.00 C ATOM 1771 CD LYS A 114 -1.260 -7.867 -10.941 1.00 0.00 C ATOM 1772 CE LYS A 114 0.067 -8.045 -10.187 1.00 0.00 C ATOM 1773 NZ LYS A 114 -0.045 -8.985 -9.031 1.00 0.00 N1+ ATOM 0 H LYS A 114 0.101 -5.827 -14.232 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.224 -7.362 -15.338 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.999 -6.793 -12.882 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -2.333 -8.327 -13.405 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -0.044 -7.510 -12.678 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -0.810 -6.071 -12.033 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -1.969 -7.304 -10.335 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.714 -8.836 -11.145 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.825 -8.414 -10.878 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.409 -7.074 -9.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.878 -9.067 -8.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.748 -8.622 -8.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.344 -9.921 -9.372 1.00 0.00 H new ATOM 1787 N PHE A 115 -3.465 -5.125 -15.550 1.00 0.00 N ATOM 1788 CA PHE A 115 -3.979 -3.839 -15.976 1.00 0.00 C ATOM 1789 C PHE A 115 -5.244 -3.472 -15.214 1.00 0.00 C ATOM 1790 O PHE A 115 -6.041 -4.352 -14.880 1.00 0.00 O ATOM 1791 CB PHE A 115 -4.198 -3.799 -17.487 1.00 0.00 C ATOM 1792 CG PHE A 115 -2.928 -3.795 -18.318 1.00 0.00 C ATOM 1793 CD1 PHE A 115 -2.185 -2.604 -18.465 1.00 0.00 C ATOM 1794 CD2 PHE A 115 -2.546 -4.946 -19.034 1.00 0.00 C ATOM 1795 CE1 PHE A 115 -1.114 -2.550 -19.374 1.00 0.00 C ATOM 1796 CE2 PHE A 115 -1.472 -4.891 -19.941 1.00 0.00 C ATOM 1797 CZ PHE A 115 -0.778 -3.687 -20.129 1.00 0.00 C ATOM 0 H PHE A 115 -4.065 -5.911 -15.800 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.227 -3.086 -15.740 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.800 -4.661 -17.775 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -4.778 -2.909 -17.732 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.439 -1.733 -17.879 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.079 -5.874 -18.886 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.550 -1.636 -19.492 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.183 -5.774 -20.491 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.018 -3.633 -20.857 1.00 0.00 H new ATOM 1807 N VAL A 116 -5.442 -2.174 -14.972 1.00 0.00 N ATOM 1808 CA VAL A 116 -6.688 -1.626 -14.453 1.00 0.00 C ATOM 1809 C VAL A 116 -7.135 -0.460 -15.336 1.00 0.00 C ATOM 1810 O VAL A 116 -6.434 -0.096 -16.285 1.00 0.00 O ATOM 1811 CB VAL A 116 -6.522 -1.235 -12.975 1.00 0.00 C ATOM 1812 CG1 VAL A 116 -6.025 -2.414 -12.132 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -5.607 -0.026 -12.769 1.00 0.00 C ATOM 0 H VAL A 116 -4.726 -1.466 -15.135 1.00 0.00 H new ATOM 0 HA VAL A 116 -7.476 -2.378 -14.485 1.00 0.00 H new ATOM 0 HB VAL A 116 -7.518 -0.949 -12.637 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -5.920 -2.100 -11.094 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -6.742 -3.233 -12.193 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -5.059 -2.749 -12.509 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.533 0.197 -11.705 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.615 -0.249 -13.163 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -6.020 0.836 -13.292 1.00 0.00 H new ATOM 1823 N GLY A 117 -8.254 0.183 -14.999 1.00 0.00 N ATOM 1824 CA GLY A 117 -8.646 1.411 -15.644 1.00 0.00 C ATOM 1825 C GLY A 117 -9.260 1.217 -17.028 1.00 0.00 C ATOM 1826 O GLY A 117 -9.080 2.088 -17.877 1.00 0.00 O ATOM 0 H GLY A 117 -8.900 -0.138 -14.278 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.364 1.930 -15.009 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.773 2.058 -15.733 1.00 0.00 H new ATOM 1830 N TYR A 118 -9.998 0.139 -17.276 1.00 0.00 N ATOM 1831 CA TYR A 118 -10.770 0.023 -18.507 1.00 0.00 C ATOM 1832 C TYR A 118 -12.009 0.908 -18.383 1.00 0.00 C ATOM 1833 O TYR A 118 -12.569 1.048 -17.295 1.00 0.00 O ATOM 1834 CB TYR A 118 -11.126 -1.444 -18.800 1.00 0.00 C ATOM 1835 CG TYR A 118 -9.952 -2.390 -19.021 1.00 0.00 C ATOM 1836 CD1 TYR A 118 -8.794 -1.960 -19.696 1.00 0.00 C ATOM 1837 CD2 TYR A 118 -10.041 -3.732 -18.603 1.00 0.00 C ATOM 1838 CE1 TYR A 118 -7.738 -2.850 -19.950 1.00 0.00 C ATOM 1839 CE2 TYR A 118 -8.988 -4.632 -18.853 1.00 0.00 C ATOM 1840 CZ TYR A 118 -7.827 -4.195 -19.535 1.00 0.00 C ATOM 1841 OH TYR A 118 -6.792 -5.045 -19.801 1.00 0.00 O ATOM 0 H TYR A 118 -10.077 -0.660 -16.647 1.00 0.00 H new ATOM 0 HA TYR A 118 -10.178 0.364 -19.356 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -11.721 -1.825 -17.970 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -11.760 -1.472 -19.686 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.717 -0.933 -20.022 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -10.925 -4.074 -18.086 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -6.854 -2.503 -20.465 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -9.066 -5.658 -18.524 1.00 0.00 H new ATOM 0 HH TYR A 118 -7.002 -5.936 -19.452 1.00 0.00 H new ATOM 1851 N TRP A 119 -12.449 1.493 -19.494 1.00 0.00 N ATOM 1852 CA TRP A 119 -13.717 2.221 -19.599 1.00 0.00 C ATOM 1853 C TRP A 119 -14.562 1.562 -20.673 1.00 0.00 C ATOM 1854 O TRP A 119 -13.985 1.173 -21.684 1.00 0.00 O ATOM 1855 CB TRP A 119 -13.513 3.671 -20.022 1.00 0.00 C ATOM 1856 CG TRP A 119 -13.251 4.678 -18.957 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -12.512 5.774 -19.195 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -13.795 4.830 -17.601 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -12.502 6.565 -18.073 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -13.310 6.066 -17.077 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -14.675 4.106 -16.761 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -13.662 6.548 -15.808 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -15.028 4.570 -15.482 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -14.527 5.789 -15.002 1.00 0.00 C ATOM 0 H TRP A 119 -11.924 1.475 -20.368 1.00 0.00 H new ATOM 0 HA TRP A 119 -14.191 2.199 -18.618 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -12.678 3.701 -20.723 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -14.401 3.987 -20.570 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -12.006 5.998 -20.122 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -11.958 7.424 -17.987 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.086 3.171 -17.113 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -13.273 7.491 -15.454 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.691 3.983 -14.864 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.804 6.142 -14.020 1.00 0.00 H new ATOM 1875 N PRO A 120 -15.895 1.494 -20.549 1.00 0.00 N ATOM 1876 CA PRO A 120 -16.727 1.084 -21.664 1.00 0.00 C ATOM 1877 C PRO A 120 -16.701 2.180 -22.746 1.00 0.00 C ATOM 1878 O PRO A 120 -16.759 3.373 -22.444 1.00 0.00 O ATOM 1879 CB PRO A 120 -18.109 0.830 -21.064 1.00 0.00 C ATOM 1880 CG PRO A 120 -18.165 1.813 -19.890 1.00 0.00 C ATOM 1881 CD PRO A 120 -16.711 1.896 -19.414 1.00 0.00 C ATOM 0 HA PRO A 120 -16.384 0.179 -22.166 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.903 1.019 -21.786 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.220 -0.202 -20.731 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.540 2.788 -20.202 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -18.825 1.455 -19.100 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.462 2.908 -19.093 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -16.542 1.240 -18.560 1.00 0.00 H new ATOM 1889 N THR A 121 -16.621 1.775 -24.008 1.00 0.00 N ATOM 1890 CA THR A 121 -16.570 2.635 -25.180 1.00 0.00 C ATOM 1891 C THR A 121 -17.923 3.284 -25.519 1.00 0.00 C ATOM 1892 O THR A 121 -18.004 4.101 -26.440 1.00 0.00 O ATOM 1893 CB THR A 121 -15.994 1.830 -26.361 1.00 0.00 C ATOM 1894 OG1 THR A 121 -16.843 0.734 -26.662 1.00 0.00 O ATOM 1895 CG2 THR A 121 -14.594 1.268 -26.085 1.00 0.00 C ATOM 0 H THR A 121 -16.588 0.785 -24.252 1.00 0.00 H new ATOM 0 HA THR A 121 -15.913 3.476 -24.960 1.00 0.00 H new ATOM 0 HB THR A 121 -15.927 2.530 -27.194 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.353 0.080 -27.203 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.247 0.712 -26.956 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.906 2.089 -25.880 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.632 0.603 -25.222 1.00 0.00 H new ATOM 1946 N GLU A 125 -17.228 8.252 -29.642 1.00 0.00 N ATOM 1947 CA GLU A 125 -17.147 8.072 -31.084 1.00 0.00 C ATOM 1948 C GLU A 125 -15.654 8.039 -31.414 1.00 0.00 C ATOM 1949 O GLU A 125 -14.924 8.881 -30.899 1.00 0.00 O ATOM 1950 CB GLU A 125 -17.871 9.214 -31.824 1.00 0.00 C ATOM 1951 CG GLU A 125 -19.288 9.460 -31.291 1.00 0.00 C ATOM 1952 CD GLU A 125 -20.023 10.532 -32.114 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -20.694 10.182 -33.116 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -19.952 11.735 -31.757 1.00 0.00 O ATOM 0 HA GLU A 125 -17.638 7.154 -31.405 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.288 10.130 -31.730 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -17.923 8.977 -32.887 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -19.854 8.529 -31.317 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -19.236 9.773 -30.248 1.00 0.00 H new ATOM 1961 N PHE A 126 -15.173 7.059 -32.188 1.00 0.00 N ATOM 1962 CA PHE A 126 -13.739 6.886 -32.467 1.00 0.00 C ATOM 1963 C PHE A 126 -13.533 5.894 -33.617 1.00 0.00 C ATOM 1964 O PHE A 126 -12.782 6.186 -34.540 1.00 0.00 O ATOM 1965 CB PHE A 126 -12.987 6.404 -31.209 1.00 0.00 C ATOM 1966 CG PHE A 126 -13.437 5.074 -30.635 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -14.662 4.975 -29.946 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -12.665 3.917 -30.849 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -15.144 3.722 -29.535 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -13.140 2.667 -30.419 1.00 0.00 C ATOM 1971 CZ PHE A 126 -14.384 2.564 -29.772 1.00 0.00 C ATOM 0 H PHE A 126 -15.766 6.362 -32.640 1.00 0.00 H new ATOM 0 HA PHE A 126 -13.333 7.854 -32.760 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -11.926 6.334 -31.449 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -13.089 7.165 -30.435 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -15.233 5.867 -29.733 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.708 3.990 -31.344 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -16.099 3.648 -29.037 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -12.546 1.780 -30.586 1.00 0.00 H new ATOM 0 HZ PHE A 126 -14.754 1.599 -29.458 1.00 0.00 H new ATOM 1981 N THR A 127 -14.239 4.754 -33.567 1.00 0.00 N ATOM 1982 CA THR A 127 -14.362 3.705 -34.584 1.00 0.00 C ATOM 1983 C THR A 127 -13.035 3.027 -34.993 1.00 0.00 C ATOM 1984 O THR A 127 -13.012 2.211 -35.920 1.00 0.00 O ATOM 1985 CB THR A 127 -15.283 4.195 -35.727 1.00 0.00 C ATOM 1986 OG1 THR A 127 -15.818 3.130 -36.498 1.00 0.00 O ATOM 1987 CG2 THR A 127 -14.665 5.252 -36.650 1.00 0.00 C ATOM 0 H THR A 127 -14.787 4.525 -32.738 1.00 0.00 H new ATOM 0 HA THR A 127 -14.864 2.847 -34.136 1.00 0.00 H new ATOM 0 HB THR A 127 -16.096 4.689 -35.195 1.00 0.00 H new ATOM 0 HG1 THR A 127 -15.143 2.427 -36.598 1.00 0.00 H new ATOM 0 HG21 THR A 127 -15.387 5.531 -37.418 1.00 0.00 H new ATOM 0 HG22 THR A 127 -14.397 6.133 -36.066 1.00 0.00 H new ATOM 0 HG23 THR A 127 -13.771 4.844 -37.123 1.00 0.00 H new ATOM 1995 N SER A 128 -11.938 3.307 -34.290 1.00 0.00 N ATOM 1996 CA SER A 128 -10.624 2.704 -34.511 1.00 0.00 C ATOM 1997 C SER A 128 -10.441 1.425 -33.668 1.00 0.00 C ATOM 1998 O SER A 128 -10.964 1.353 -32.555 1.00 0.00 O ATOM 1999 CB SER A 128 -9.543 3.760 -34.250 1.00 0.00 C ATOM 2000 OG SER A 128 -9.892 4.619 -33.178 1.00 0.00 O ATOM 0 H SER A 128 -11.940 3.982 -33.526 1.00 0.00 H new ATOM 0 HA SER A 128 -10.535 2.379 -35.548 1.00 0.00 H new ATOM 0 HB2 SER A 128 -8.598 3.265 -34.026 1.00 0.00 H new ATOM 0 HB3 SER A 128 -9.387 4.351 -35.153 1.00 0.00 H new ATOM 0 HG SER A 128 -9.720 5.549 -33.435 1.00 0.00 H new ATOM 2006 N PRO A 129 -9.683 0.415 -34.148 1.00 0.00 N ATOM 2007 CA PRO A 129 -9.554 -0.877 -33.469 1.00 0.00 C ATOM 2008 C PRO A 129 -8.428 -0.927 -32.415 1.00 0.00 C ATOM 2009 O PRO A 129 -8.323 -1.912 -31.684 1.00 0.00 O ATOM 2010 CB PRO A 129 -9.302 -1.871 -34.609 1.00 0.00 C ATOM 2011 CG PRO A 129 -8.487 -1.050 -35.607 1.00 0.00 C ATOM 2012 CD PRO A 129 -9.118 0.335 -35.492 1.00 0.00 C ATOM 0 HA PRO A 129 -10.449 -1.100 -32.888 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -8.754 -2.748 -34.266 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -10.234 -2.228 -35.046 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -7.428 -1.035 -35.351 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -8.565 -1.448 -36.619 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -8.374 1.116 -35.649 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -9.891 0.475 -36.248 1.00 0.00 H new ATOM 2020 N LYS A 130 -7.563 0.096 -32.337 1.00 0.00 N ATOM 2021 CA LYS A 130 -6.333 0.045 -31.539 1.00 0.00 C ATOM 2022 C LYS A 130 -6.564 0.122 -30.025 1.00 0.00 C ATOM 2023 O LYS A 130 -6.075 -0.759 -29.321 1.00 0.00 O ATOM 2024 CB LYS A 130 -5.310 1.092 -32.030 1.00 0.00 C ATOM 2025 CG LYS A 130 -4.585 0.658 -33.311 1.00 0.00 C ATOM 2026 CD LYS A 130 -3.471 -0.366 -33.025 1.00 0.00 C ATOM 2027 CE LYS A 130 -2.457 -0.446 -34.174 1.00 0.00 C ATOM 2028 NZ LYS A 130 -3.006 -1.060 -35.417 1.00 0.00 N1+ ATOM 0 H LYS A 130 -7.699 0.981 -32.826 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.909 -0.946 -31.702 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.822 2.037 -32.210 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -4.575 1.272 -31.245 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.305 0.226 -34.006 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.156 1.533 -33.799 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.955 -0.093 -32.104 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.914 -1.349 -32.863 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -2.100 0.558 -34.402 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.593 -1.024 -33.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -2.268 -1.081 -36.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -3.321 -2.030 -35.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -3.813 -0.497 -35.755 1.00 0.00 H new ATOM 2042 N PRO A 131 -7.256 1.135 -29.468 1.00 0.00 N ATOM 2043 CA PRO A 131 -7.275 1.340 -28.020 1.00 0.00 C ATOM 2044 C PRO A 131 -8.393 0.555 -27.335 1.00 0.00 C ATOM 2045 O PRO A 131 -9.024 1.079 -26.421 1.00 0.00 O ATOM 2046 CB PRO A 131 -7.419 2.855 -27.861 1.00 0.00 C ATOM 2047 CG PRO A 131 -8.362 3.205 -29.007 1.00 0.00 C ATOM 2048 CD PRO A 131 -7.888 2.281 -30.130 1.00 0.00 C ATOM 0 HA PRO A 131 -6.373 0.967 -27.534 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -7.837 3.126 -26.891 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -6.461 3.368 -27.950 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -9.404 3.021 -28.744 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -8.285 4.255 -29.288 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -8.724 1.961 -30.751 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -7.182 2.792 -30.785 1.00 0.00 H new ATOM 2056 N VAL A 132 -8.662 -0.686 -27.731 1.00 0.00 N ATOM 2057 CA VAL A 132 -9.862 -1.414 -27.348 1.00 0.00 C ATOM 2058 C VAL A 132 -9.538 -2.885 -27.067 1.00 0.00 C ATOM 2059 O VAL A 132 -8.615 -3.432 -27.672 1.00 0.00 O ATOM 2060 CB VAL A 132 -10.969 -1.245 -28.418 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -12.293 -0.849 -27.759 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -10.709 -0.212 -29.532 1.00 0.00 C ATOM 0 H VAL A 132 -8.040 -1.221 -28.337 1.00 0.00 H new ATOM 0 HA VAL A 132 -10.249 -0.992 -26.420 1.00 0.00 H new ATOM 0 HB VAL A 132 -10.991 -2.225 -28.894 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.060 -0.734 -28.525 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.595 -1.625 -27.055 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -12.167 0.094 -27.227 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -11.559 -0.191 -30.215 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -10.575 0.775 -29.089 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -9.809 -0.488 -30.081 1.00 0.00 H new ATOM 2072 N ILE A 133 -10.285 -3.521 -26.153 1.00 0.00 N ATOM 2073 CA ILE A 133 -10.175 -4.924 -25.777 1.00 0.00 C ATOM 2074 C ILE A 133 -11.537 -5.588 -25.859 1.00 0.00 C ATOM 2075 O ILE A 133 -12.528 -4.960 -26.242 1.00 0.00 O ATOM 2076 CB ILE A 133 -9.511 -5.152 -24.398 1.00 0.00 C ATOM 2077 CG1 ILE A 133 -10.346 -4.642 -23.207 1.00 0.00 C ATOM 2078 CG2 ILE A 133 -8.108 -4.572 -24.465 1.00 0.00 C ATOM 2079 CD1 ILE A 133 -10.087 -3.179 -22.894 1.00 0.00 C ATOM 0 H ILE A 133 -11.018 -3.039 -25.633 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.501 -5.393 -26.494 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.452 -6.221 -24.196 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -11.405 -4.781 -23.425 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -10.120 -5.243 -22.326 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.609 -4.715 -23.507 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -7.542 -5.077 -25.248 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.165 -3.507 -24.688 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -10.702 -2.874 -22.047 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -9.034 -3.041 -22.647 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -10.339 -2.571 -23.763 1.00 0.00 H new ATOM 2091 N ALA A 134 -11.590 -6.832 -25.386 1.00 0.00 N ATOM 2092 CA ALA A 134 -12.767 -7.661 -25.367 1.00 0.00 C ATOM 2093 C ALA A 134 -13.252 -7.819 -26.811 1.00 0.00 C ATOM 2094 O ALA A 134 -12.510 -8.333 -27.650 1.00 0.00 O ATOM 2095 CB ALA A 134 -13.747 -7.106 -24.318 1.00 0.00 C ATOM 0 H ALA A 134 -10.773 -7.298 -24.992 1.00 0.00 H new ATOM 0 HA ALA A 134 -12.600 -8.684 -25.030 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -14.643 -7.726 -24.294 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -13.273 -7.115 -23.337 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -14.020 -6.084 -24.580 1.00 0.00 H new ATOM 2101 N ASP A 135 -14.452 -7.323 -27.114 1.00 0.00 N ATOM 2102 CA ASP A 135 -15.033 -7.298 -28.452 1.00 0.00 C ATOM 2103 C ASP A 135 -15.003 -5.887 -29.064 1.00 0.00 C ATOM 2104 O ASP A 135 -15.618 -5.624 -30.098 1.00 0.00 O ATOM 2105 CB ASP A 135 -16.450 -7.862 -28.388 1.00 0.00 C ATOM 2106 CG ASP A 135 -17.049 -8.145 -29.779 1.00 0.00 C ATOM 2107 OD1 ASP A 135 -16.415 -8.876 -30.581 1.00 0.00 O ATOM 2108 OD2 ASP A 135 -18.189 -7.695 -30.054 1.00 0.00 O ATOM 0 H ASP A 135 -15.065 -6.914 -26.409 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.432 -7.923 -29.113 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -16.442 -8.785 -27.807 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -17.092 -7.158 -27.859 1.00 0.00 H new ATOM 2113 N GLY A 136 -14.321 -4.951 -28.393 1.00 0.00 N ATOM 2114 CA GLY A 136 -14.290 -3.536 -28.742 1.00 0.00 C ATOM 2115 C GLY A 136 -15.271 -2.706 -27.917 1.00 0.00 C ATOM 2116 O GLY A 136 -15.650 -1.611 -28.333 1.00 0.00 O ATOM 0 H GLY A 136 -13.761 -5.169 -27.569 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -13.281 -3.151 -28.595 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.523 -3.421 -29.801 1.00 0.00 H new ATOM 2120 N GLN A 137 -15.695 -3.226 -26.756 1.00 0.00 N ATOM 2121 CA GLN A 137 -16.735 -2.646 -25.917 1.00 0.00 C ATOM 2122 C GLN A 137 -16.123 -1.859 -24.763 1.00 0.00 C ATOM 2123 O GLN A 137 -16.809 -1.069 -24.120 1.00 0.00 O ATOM 2124 CB GLN A 137 -17.670 -3.738 -25.370 1.00 0.00 C ATOM 2125 CG GLN A 137 -17.843 -4.917 -26.325 1.00 0.00 C ATOM 2126 CD GLN A 137 -18.754 -5.995 -25.745 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -19.923 -6.125 -26.103 1.00 0.00 O ATOM 2128 NE2 GLN A 137 -18.226 -6.778 -24.812 1.00 0.00 N ATOM 0 H GLN A 137 -15.308 -4.087 -26.370 1.00 0.00 H new ATOM 0 HA GLN A 137 -17.319 -1.964 -26.535 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -17.276 -4.102 -24.421 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -18.647 -3.300 -25.163 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -18.258 -4.561 -27.268 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -16.867 -5.349 -26.548 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -17.254 -6.652 -24.531 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -18.793 -7.506 -24.376 1.00 0.00 H new ATOM 2137 N LEU A 138 -14.840 -2.112 -24.467 1.00 0.00 N ATOM 2138 CA LEU A 138 -14.078 -1.348 -23.470 1.00 0.00 C ATOM 2139 C LEU A 138 -12.730 -0.920 -24.028 1.00 0.00 C ATOM 2140 O LEU A 138 -12.105 -1.673 -24.771 1.00 0.00 O ATOM 2141 CB LEU A 138 -13.925 -2.032 -22.084 1.00 0.00 C ATOM 2142 CG LEU A 138 -14.034 -3.565 -21.992 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -13.329 -4.087 -20.735 1.00 0.00 C ATOM 2144 CD2 LEU A 138 -15.504 -3.995 -21.898 1.00 0.00 C ATOM 0 H LEU A 138 -14.301 -2.854 -24.913 1.00 0.00 H new ATOM 0 HA LEU A 138 -14.685 -0.465 -23.271 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -12.953 -1.747 -21.682 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -14.681 -1.608 -21.423 1.00 0.00 H new ATOM 0 HG LEU A 138 -13.568 -3.974 -22.888 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -13.419 -5.172 -20.691 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -12.275 -3.812 -20.768 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -13.791 -3.649 -19.850 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -15.562 -5.082 -21.834 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -15.956 -3.554 -21.009 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -16.040 -3.655 -22.784 1.00 0.00 H new ATOM 2156 N PHE A 139 -12.283 0.281 -23.659 1.00 0.00 N ATOM 2157 CA PHE A 139 -10.995 0.836 -24.011 1.00 0.00 C ATOM 2158 C PHE A 139 -9.917 0.217 -23.139 1.00 0.00 C ATOM 2159 O PHE A 139 -10.169 -0.139 -21.988 1.00 0.00 O ATOM 2160 CB PHE A 139 -10.955 2.358 -23.804 1.00 0.00 C ATOM 2161 CG PHE A 139 -11.883 3.163 -24.681 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -11.719 3.150 -26.079 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -12.911 3.927 -24.101 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -12.561 3.928 -26.890 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -13.766 4.680 -24.917 1.00 0.00 C ATOM 2166 CZ PHE A 139 -13.579 4.698 -26.309 1.00 0.00 C ATOM 0 H PHE A 139 -12.839 0.912 -23.083 1.00 0.00 H new ATOM 0 HA PHE A 139 -10.824 0.616 -25.065 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -11.194 2.571 -22.762 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -9.935 2.702 -23.974 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -10.947 2.543 -26.527 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -13.041 3.934 -23.029 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.425 3.933 -27.961 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -14.571 5.248 -24.474 1.00 0.00 H new ATOM 0 HZ PHE A 139 -14.219 5.305 -26.932 1.00 0.00 H new ATOM 2176 N VAL A 140 -8.689 0.218 -23.647 1.00 0.00 N ATOM 2177 CA VAL A 140 -7.509 -0.216 -22.923 1.00 0.00 C ATOM 2178 C VAL A 140 -7.191 0.692 -21.719 1.00 0.00 C ATOM 2179 O VAL A 140 -6.385 0.304 -20.874 1.00 0.00 O ATOM 2180 CB VAL A 140 -6.318 -0.307 -23.901 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -6.443 -1.429 -24.934 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -6.044 1.019 -24.601 1.00 0.00 C ATOM 0 H VAL A 140 -8.486 0.529 -24.597 1.00 0.00 H new ATOM 0 HA VAL A 140 -7.705 -1.203 -22.505 1.00 0.00 H new ATOM 0 HB VAL A 140 -5.466 -0.554 -23.268 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.567 -1.426 -25.583 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.512 -2.389 -24.422 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -7.339 -1.273 -25.534 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.198 0.905 -25.278 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -6.925 1.320 -25.168 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.813 1.782 -23.858 1.00 0.00 H new ATOM 2192 N GLY A 141 -7.777 1.896 -21.619 1.00 0.00 N ATOM 2193 CA GLY A 141 -7.399 2.850 -20.578 1.00 0.00 C ATOM 2194 C GLY A 141 -8.315 4.066 -20.560 1.00 0.00 C ATOM 2195 O GLY A 141 -9.239 4.149 -21.371 1.00 0.00 O ATOM 0 H GLY A 141 -8.511 2.226 -22.246 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.431 2.358 -19.606 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.370 3.173 -20.738 1.00 0.00 H new ATOM 2199 N LEU A 142 -8.038 5.024 -19.670 1.00 0.00 N ATOM 2200 CA LEU A 142 -8.722 6.317 -19.648 1.00 0.00 C ATOM 2201 C LEU A 142 -8.382 7.053 -20.933 1.00 0.00 C ATOM 2202 O LEU A 142 -7.212 7.186 -21.288 1.00 0.00 O ATOM 2203 CB LEU A 142 -8.346 7.116 -18.386 1.00 0.00 C ATOM 2204 CG LEU A 142 -8.561 8.641 -18.350 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.041 9.010 -18.416 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -7.996 9.234 -17.059 1.00 0.00 C ATOM 0 H LEU A 142 -7.330 4.922 -18.943 1.00 0.00 H new ATOM 0 HA LEU A 142 -9.802 6.179 -19.600 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -8.905 6.690 -17.553 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.290 6.932 -18.188 1.00 0.00 H new ATOM 0 HG LEU A 142 -8.045 9.045 -19.221 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.147 10.094 -18.388 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -10.470 8.627 -19.342 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -10.563 8.572 -17.565 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.158 10.312 -17.053 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -8.500 8.786 -16.202 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.927 9.027 -17.001 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.420 7.539 -21.603 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.311 8.195 -22.893 1.00 0.00 C ATOM 2220 C ALA A 143 -9.745 9.645 -22.718 1.00 0.00 C ATOM 2221 O ALA A 143 -10.924 9.894 -22.463 1.00 0.00 O ATOM 2222 CB ALA A 143 -10.175 7.430 -23.905 1.00 0.00 C ATOM 0 H ALA A 143 -10.377 7.485 -21.255 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.290 8.194 -23.274 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.104 7.911 -24.881 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -9.822 6.401 -23.981 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -11.213 7.434 -23.573 1.00 0.00 H new ATOM 2228 N LEU A 144 -8.808 10.588 -22.808 1.00 0.00 N ATOM 2229 CA LEU A 144 -9.091 12.016 -22.688 1.00 0.00 C ATOM 2230 C LEU A 144 -9.005 12.672 -24.055 1.00 0.00 C ATOM 2231 O LEU A 144 -8.235 12.246 -24.914 1.00 0.00 O ATOM 2232 CB LEU A 144 -8.098 12.699 -21.737 1.00 0.00 C ATOM 2233 CG LEU A 144 -8.144 12.246 -20.274 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -7.144 13.032 -19.424 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -9.546 12.433 -19.679 1.00 0.00 C ATOM 0 H LEU A 144 -7.822 10.379 -22.968 1.00 0.00 H new ATOM 0 HA LEU A 144 -10.096 12.129 -22.282 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.090 12.532 -22.116 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.277 13.774 -21.769 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.883 11.188 -20.261 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.198 12.690 -18.390 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -6.136 12.872 -19.807 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.385 14.094 -19.468 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.547 12.103 -18.640 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -9.824 13.486 -19.726 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.264 11.843 -20.248 1.00 0.00 H new ATOM 2247 N ASP A 145 -9.767 13.743 -24.227 1.00 0.00 N ATOM 2248 CA ASP A 145 -9.675 14.651 -25.354 1.00 0.00 C ATOM 2249 C ASP A 145 -9.998 16.036 -24.833 1.00 0.00 C ATOM 2250 O ASP A 145 -10.892 16.211 -24.005 1.00 0.00 O ATOM 2251 CB ASP A 145 -10.537 14.193 -26.527 1.00 0.00 C ATOM 2252 CG ASP A 145 -11.939 14.746 -26.451 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -12.113 15.900 -26.887 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -12.865 14.006 -26.064 1.00 0.00 O ATOM 0 H ASP A 145 -10.491 14.010 -23.560 1.00 0.00 H new ATOM 0 HA ASP A 145 -8.670 14.665 -25.775 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -10.074 14.508 -27.462 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -10.578 13.104 -26.543 1.00 0.00 H new ATOM 2259 N GLU A 146 -9.222 17.010 -25.298 1.00 0.00 N ATOM 2260 CA GLU A 146 -9.258 18.373 -24.792 1.00 0.00 C ATOM 2261 C GLU A 146 -9.913 19.278 -25.836 1.00 0.00 C ATOM 2262 O GLU A 146 -9.561 20.456 -25.946 1.00 0.00 O ATOM 2263 CB GLU A 146 -7.866 18.844 -24.325 1.00 0.00 C ATOM 2264 CG GLU A 146 -7.188 17.924 -23.295 1.00 0.00 C ATOM 2265 CD GLU A 146 -8.069 17.561 -22.078 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -8.774 18.440 -21.520 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -8.018 16.388 -21.644 1.00 0.00 O1- ATOM 0 H GLU A 146 -8.543 16.871 -26.046 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.874 18.422 -23.894 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -7.216 18.933 -25.196 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.960 19.841 -23.895 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -6.884 17.004 -23.794 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -6.279 18.408 -22.938 1.00 0.00 H new ATOM 2274 N THR A 147 -10.851 18.731 -26.628 1.00 0.00 N ATOM 2275 CA THR A 147 -11.602 19.539 -27.596 1.00 0.00 C ATOM 2276 C THR A 147 -13.125 19.306 -27.586 1.00 0.00 C ATOM 2277 O THR A 147 -13.900 20.260 -27.647 1.00 0.00 O ATOM 2278 CB THR A 147 -10.917 19.411 -28.982 1.00 0.00 C ATOM 2279 OG1 THR A 147 -11.225 20.502 -29.831 1.00 0.00 O ATOM 2280 CG2 THR A 147 -11.259 18.118 -29.730 1.00 0.00 C ATOM 0 H THR A 147 -11.103 17.743 -26.616 1.00 0.00 H new ATOM 0 HA THR A 147 -11.555 20.585 -27.293 1.00 0.00 H new ATOM 0 HB THR A 147 -9.853 19.400 -28.748 1.00 0.00 H new ATOM 0 HG1 THR A 147 -10.773 20.384 -30.692 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.741 18.105 -30.689 1.00 0.00 H new ATOM 0 HG22 THR A 147 -10.945 17.260 -29.136 1.00 0.00 H new ATOM 0 HG23 THR A 147 -12.335 18.068 -29.898 1.00 0.00 H new ATOM 2288 N ASN A 148 -13.568 18.061 -27.423 1.00 0.00 N ATOM 2289 CA ASN A 148 -14.958 17.667 -27.206 1.00 0.00 C ATOM 2290 C ASN A 148 -15.199 17.717 -25.704 1.00 0.00 C ATOM 2291 O ASN A 148 -16.109 18.388 -25.226 1.00 0.00 O ATOM 2292 CB ASN A 148 -15.279 16.237 -27.717 1.00 0.00 C ATOM 2293 CG ASN A 148 -14.815 15.901 -29.122 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -15.627 15.632 -29.996 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -13.511 15.835 -29.327 1.00 0.00 N ATOM 0 H ASN A 148 -12.936 17.261 -27.440 1.00 0.00 H new ATOM 0 HA ASN A 148 -15.602 18.346 -27.765 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -14.831 15.520 -27.029 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -16.358 16.092 -27.670 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -13.152 15.552 -30.239 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -12.864 16.067 -28.573 1.00 0.00 H new ATOM 2302 N GLN A 149 -14.332 17.022 -24.959 1.00 0.00 N ATOM 2303 CA GLN A 149 -14.453 16.800 -23.528 1.00 0.00 C ATOM 2304 C GLN A 149 -13.558 17.730 -22.707 1.00 0.00 C ATOM 2305 O GLN A 149 -13.377 17.483 -21.519 1.00 0.00 O ATOM 2306 CB GLN A 149 -14.207 15.321 -23.210 1.00 0.00 C ATOM 2307 CG GLN A 149 -15.239 14.400 -23.879 1.00 0.00 C ATOM 2308 CD GLN A 149 -14.985 12.944 -23.510 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -15.706 12.325 -22.731 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -13.917 12.385 -24.033 1.00 0.00 N ATOM 0 H GLN A 149 -13.500 16.587 -25.357 1.00 0.00 H new ATOM 0 HA GLN A 149 -15.472 17.051 -23.232 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -13.207 15.042 -23.541 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -14.238 15.174 -22.130 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -16.244 14.688 -23.570 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -15.192 14.519 -24.961 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -13.329 12.913 -24.678 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -13.676 11.423 -23.794 1.00 0.00 H new ATOM 2319 N TYR A 150 -13.052 18.824 -23.283 1.00 0.00 N ATOM 2320 CA TYR A 150 -12.221 19.812 -22.580 1.00 0.00 C ATOM 2321 C TYR A 150 -12.878 20.322 -21.286 1.00 0.00 C ATOM 2322 O TYR A 150 -12.186 20.741 -20.357 1.00 0.00 O ATOM 2323 CB TYR A 150 -11.957 21.020 -23.497 1.00 0.00 C ATOM 2324 CG TYR A 150 -13.119 21.996 -23.638 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -14.245 21.648 -24.405 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -13.092 23.232 -22.963 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -15.336 22.530 -24.514 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -14.174 24.124 -23.069 1.00 0.00 C ATOM 2329 CZ TYR A 150 -15.303 23.779 -23.848 1.00 0.00 C ATOM 2330 OH TYR A 150 -16.348 24.653 -23.942 1.00 0.00 O ATOM 0 H TYR A 150 -13.209 19.054 -24.264 1.00 0.00 H new ATOM 0 HA TYR A 150 -11.291 19.309 -22.316 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.092 21.563 -23.116 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.691 20.652 -24.488 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -14.273 20.696 -24.915 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -12.235 23.496 -22.361 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -16.197 22.255 -25.105 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -14.143 25.073 -22.555 1.00 0.00 H new ATOM 0 HH TYR A 150 -16.150 25.458 -23.419 1.00 0.00 H new ATOM 2340 N ASP A 151 -14.216 20.310 -21.246 1.00 0.00 N ATOM 2341 CA ASP A 151 -14.985 20.880 -20.140 1.00 0.00 C ATOM 2342 C ASP A 151 -15.167 19.878 -18.994 1.00 0.00 C ATOM 2343 O ASP A 151 -15.428 20.275 -17.856 1.00 0.00 O ATOM 2344 CB ASP A 151 -16.332 21.371 -20.682 1.00 0.00 C ATOM 2345 CG ASP A 151 -17.198 22.002 -19.578 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -16.849 23.101 -19.080 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -18.261 21.426 -19.238 1.00 0.00 O ATOM 0 H ASP A 151 -14.794 19.904 -21.982 1.00 0.00 H new ATOM 0 HA ASP A 151 -14.436 21.722 -19.718 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -16.161 22.102 -21.472 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -16.869 20.536 -21.132 1.00 0.00 H new ATOM 2352 N LEU A 152 -14.996 18.578 -19.276 1.00 0.00 N ATOM 2353 CA LEU A 152 -15.275 17.480 -18.358 1.00 0.00 C ATOM 2354 C LEU A 152 -14.075 16.565 -18.161 1.00 0.00 C ATOM 2355 O LEU A 152 -14.164 15.629 -17.374 1.00 0.00 O ATOM 2356 CB LEU A 152 -16.509 16.721 -18.867 1.00 0.00 C ATOM 2357 CG LEU A 152 -16.284 15.902 -20.156 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -15.738 14.490 -19.898 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -17.590 15.840 -20.947 1.00 0.00 C ATOM 0 H LEU A 152 -14.648 18.259 -20.180 1.00 0.00 H new ATOM 0 HA LEU A 152 -15.485 17.887 -17.369 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -16.852 16.048 -18.082 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -17.310 17.438 -19.045 1.00 0.00 H new ATOM 0 HG LEU A 152 -15.515 16.414 -20.735 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -15.604 13.972 -20.848 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -14.779 14.559 -19.384 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -16.442 13.935 -19.278 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -17.436 15.262 -21.859 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.360 15.363 -20.341 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -17.906 16.850 -21.207 1.00 0.00 H new ATOM 2371 N SER A 153 -12.954 16.785 -18.845 1.00 0.00 N ATOM 2372 CA SER A 153 -11.781 15.918 -18.757 1.00 0.00 C ATOM 2373 C SER A 153 -11.327 15.784 -17.299 1.00 0.00 C ATOM 2374 O SER A 153 -10.951 14.700 -16.861 1.00 0.00 O ATOM 2375 CB SER A 153 -10.672 16.438 -19.694 1.00 0.00 C ATOM 2376 OG SER A 153 -10.485 17.837 -19.622 1.00 0.00 O ATOM 0 H SER A 153 -12.833 17.574 -19.480 1.00 0.00 H new ATOM 0 HA SER A 153 -12.034 14.913 -19.095 1.00 0.00 H new ATOM 0 HB2 SER A 153 -9.734 15.941 -19.446 1.00 0.00 H new ATOM 0 HB3 SER A 153 -10.916 16.164 -20.720 1.00 0.00 H new ATOM 0 HG SER A 153 -9.638 18.077 -20.054 1.00 0.00 H new ATOM 2382 N ASP A 154 -11.518 16.841 -16.507 1.00 0.00 N ATOM 2383 CA ASP A 154 -11.255 16.854 -15.072 1.00 0.00 C ATOM 2384 C ASP A 154 -12.085 15.800 -14.341 1.00 0.00 C ATOM 2385 O ASP A 154 -11.574 15.065 -13.494 1.00 0.00 O ATOM 2386 CB ASP A 154 -11.560 18.251 -14.523 1.00 0.00 C ATOM 2387 CG ASP A 154 -11.262 18.342 -13.020 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -10.063 18.430 -12.670 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -12.213 18.364 -12.204 1.00 0.00 O ATOM 0 H ASP A 154 -11.869 17.732 -16.857 1.00 0.00 H new ATOM 0 HA ASP A 154 -10.206 16.611 -14.905 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -10.965 18.991 -15.058 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.607 18.493 -14.703 1.00 0.00 H new ATOM 2394 N GLU A 155 -13.357 15.663 -14.714 1.00 0.00 N ATOM 2395 CA GLU A 155 -14.316 14.779 -14.071 1.00 0.00 C ATOM 2396 C GLU A 155 -14.064 13.333 -14.503 1.00 0.00 C ATOM 2397 O GLU A 155 -14.203 12.387 -13.728 1.00 0.00 O ATOM 2398 CB GLU A 155 -15.749 15.288 -14.324 1.00 0.00 C ATOM 2399 CG GLU A 155 -16.561 14.497 -15.359 1.00 0.00 C ATOM 2400 CD GLU A 155 -18.012 15.005 -15.484 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -18.244 16.229 -15.634 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -18.948 14.169 -15.433 1.00 0.00 O ATOM 0 H GLU A 155 -13.756 16.182 -15.496 1.00 0.00 H new ATOM 0 HA GLU A 155 -14.188 14.788 -12.989 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -16.291 15.278 -13.378 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -15.694 16.327 -14.649 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -16.071 14.565 -16.330 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -16.571 13.443 -15.080 1.00 0.00 H new ATOM 2409 N ARG A 156 -13.623 13.168 -15.749 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.347 11.871 -16.359 1.00 0.00 C ATOM 2411 C ARG A 156 -12.110 11.282 -15.697 1.00 0.00 C ATOM 2412 O ARG A 156 -12.043 10.071 -15.506 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.224 12.077 -17.886 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.016 10.786 -18.691 1.00 0.00 C ATOM 2415 CD ARG A 156 -14.247 9.897 -18.850 1.00 0.00 C ATOM 2416 NE ARG A 156 -15.179 10.425 -19.867 1.00 0.00 N ATOM 2417 CZ ARG A 156 -16.461 10.069 -20.038 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -17.052 9.205 -19.213 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -17.150 10.583 -21.051 1.00 0.00 N ATOM 0 H ARG A 156 -13.444 13.952 -16.376 1.00 0.00 H new ATOM 0 HA ARG A 156 -14.148 11.148 -16.205 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.125 12.573 -18.246 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.390 12.750 -18.082 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.654 11.053 -19.684 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.230 10.203 -18.211 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -13.935 8.891 -19.131 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -14.762 9.815 -17.893 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.811 11.132 -20.504 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -16.529 8.802 -18.436 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -18.028 8.946 -19.359 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -16.704 11.241 -21.689 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -18.125 10.319 -21.190 1.00 0.00 H new ATOM 2433 N ILE A 157 -11.164 12.126 -15.285 1.00 0.00 N ATOM 2434 CA ILE A 157 -9.970 11.675 -14.597 1.00 0.00 C ATOM 2435 C ILE A 157 -10.377 11.129 -13.240 1.00 0.00 C ATOM 2436 O ILE A 157 -10.112 9.974 -12.948 1.00 0.00 O ATOM 2437 CB ILE A 157 -8.916 12.801 -14.484 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -8.286 13.133 -15.848 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -7.811 12.337 -13.515 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -7.645 14.527 -15.875 1.00 0.00 C ATOM 0 H ILE A 157 -11.210 13.136 -15.421 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.492 10.882 -15.172 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.409 13.702 -14.118 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.531 12.385 -16.088 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -9.051 13.073 -16.622 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -7.057 13.119 -13.422 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -8.247 12.135 -12.537 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -7.347 11.429 -13.900 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -7.215 14.711 -16.860 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -8.404 15.281 -15.664 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -6.860 14.581 -15.121 1.00 0.00 H new ATOM 2452 N GLN A 158 -10.998 11.939 -12.392 1.00 0.00 N ATOM 2453 CA GLN A 158 -11.332 11.533 -11.028 1.00 0.00 C ATOM 2454 C GLN A 158 -12.215 10.307 -10.981 1.00 0.00 C ATOM 2455 O GLN A 158 -11.991 9.419 -10.167 1.00 0.00 O ATOM 2456 CB GLN A 158 -11.942 12.684 -10.222 1.00 0.00 C ATOM 2457 CG GLN A 158 -13.134 13.377 -10.867 1.00 0.00 C ATOM 2458 CD GLN A 158 -13.317 14.796 -10.337 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -13.997 15.042 -9.346 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.685 15.734 -11.016 1.00 0.00 N ATOM 0 H GLN A 158 -11.284 12.890 -12.626 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.388 11.260 -10.557 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -12.250 12.300 -9.249 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -11.166 13.428 -10.040 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -12.996 13.407 -11.948 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -14.038 12.798 -10.677 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.130 15.485 -11.835 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -12.751 16.709 -10.722 1.00 0.00 H new ATOM 2469 N SER A 159 -13.155 10.219 -11.905 1.00 0.00 N ATOM 2470 CA SER A 159 -13.992 9.023 -11.999 1.00 0.00 C ATOM 2471 C SER A 159 -13.146 7.798 -12.362 1.00 0.00 C ATOM 2472 O SER A 159 -13.360 6.716 -11.817 1.00 0.00 O ATOM 2473 CB SER A 159 -15.102 9.223 -13.022 1.00 0.00 C ATOM 2474 OG SER A 159 -15.876 10.381 -12.736 1.00 0.00 O ATOM 0 H SER A 159 -13.361 10.944 -12.592 1.00 0.00 H new ATOM 0 HA SER A 159 -14.448 8.850 -11.024 1.00 0.00 H new ATOM 0 HB2 SER A 159 -14.668 9.312 -14.018 1.00 0.00 H new ATOM 0 HB3 SER A 159 -15.749 8.346 -13.033 1.00 0.00 H new ATOM 0 HG SER A 159 -15.401 11.178 -13.052 1.00 0.00 H new ATOM 2480 N TRP A 160 -12.141 7.955 -13.234 1.00 0.00 N ATOM 2481 CA TRP A 160 -11.241 6.857 -13.566 1.00 0.00 C ATOM 2482 C TRP A 160 -10.410 6.476 -12.353 1.00 0.00 C ATOM 2483 O TRP A 160 -10.279 5.311 -11.999 1.00 0.00 O ATOM 2484 CB TRP A 160 -10.322 7.299 -14.699 1.00 0.00 C ATOM 2485 CG TRP A 160 -9.467 6.200 -15.200 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -9.924 5.134 -15.889 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -8.015 6.076 -15.163 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -8.852 4.366 -16.283 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -7.656 4.892 -15.863 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.963 6.884 -14.690 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -6.329 4.513 -16.064 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -5.618 6.534 -14.919 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.302 5.347 -15.601 1.00 0.00 C ATOM 0 H TRP A 160 -11.936 8.830 -13.717 1.00 0.00 H new ATOM 0 HA TRP A 160 -11.824 5.990 -13.876 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -10.925 7.689 -15.520 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.690 8.116 -14.351 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -10.962 4.918 -16.097 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -8.937 3.506 -16.824 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.191 7.787 -14.143 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -6.096 3.588 -16.570 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.827 7.180 -14.569 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.270 5.078 -15.768 1.00 0.00 H new ATOM 2504 N CYS A 161 -9.894 7.493 -11.679 1.00 0.00 N ATOM 2505 CA CYS A 161 -9.101 7.347 -10.480 1.00 0.00 C ATOM 2506 C CYS A 161 -9.893 6.583 -9.431 1.00 0.00 C ATOM 2507 O CYS A 161 -9.310 5.771 -8.718 1.00 0.00 O ATOM 2508 CB CYS A 161 -8.710 8.727 -9.962 1.00 0.00 C ATOM 2509 SG CYS A 161 -7.601 9.536 -11.144 1.00 0.00 S ATOM 0 H CYS A 161 -10.022 8.464 -11.963 1.00 0.00 H new ATOM 0 HA CYS A 161 -8.194 6.785 -10.703 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -9.602 9.335 -9.812 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.219 8.636 -8.993 1.00 0.00 H new ATOM 0 HG CYS A 161 -8.278 9.910 -12.189 1.00 0.00 H new ATOM 2515 N GLU A 162 -11.210 6.796 -9.382 1.00 0.00 N ATOM 2516 CA GLU A 162 -12.047 6.239 -8.345 1.00 0.00 C ATOM 2517 C GLU A 162 -12.176 4.723 -8.538 1.00 0.00 C ATOM 2518 O GLU A 162 -12.246 3.986 -7.552 1.00 0.00 O ATOM 2519 CB GLU A 162 -13.361 7.032 -8.364 1.00 0.00 C ATOM 2520 CG GLU A 162 -14.572 6.316 -7.780 1.00 0.00 C ATOM 2521 CD GLU A 162 -14.448 5.946 -6.285 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -13.690 6.603 -5.532 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -15.157 5.005 -5.846 1.00 0.00 O ATOM 0 H GLU A 162 -11.715 7.361 -10.065 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.626 6.340 -7.345 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.211 7.961 -7.814 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.585 7.304 -9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -15.449 6.950 -7.911 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -14.748 5.405 -8.352 1.00 0.00 H new ATOM 2530 N GLN A 163 -12.117 4.237 -9.784 1.00 0.00 N ATOM 2531 CA GLN A 163 -12.027 2.805 -10.026 1.00 0.00 C ATOM 2532 C GLN A 163 -10.605 2.295 -9.837 1.00 0.00 C ATOM 2533 O GLN A 163 -10.435 1.320 -9.113 1.00 0.00 O ATOM 2534 CB GLN A 163 -12.664 2.371 -11.349 1.00 0.00 C ATOM 2535 CG GLN A 163 -12.102 3.021 -12.613 1.00 0.00 C ATOM 2536 CD GLN A 163 -12.633 2.350 -13.883 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -13.632 1.631 -13.880 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -11.961 2.563 -15.002 1.00 0.00 N ATOM 0 H GLN A 163 -12.130 4.812 -10.626 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.634 2.318 -9.263 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.557 1.290 -11.443 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -13.732 2.582 -11.301 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -12.364 4.079 -12.625 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -11.014 2.962 -12.599 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -11.134 3.160 -14.995 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -12.269 2.130 -15.872 1.00 0.00 H new ATOM 2547 N ILE A 164 -9.563 2.931 -10.386 1.00 0.00 N ATOM 2548 CA ILE A 164 -8.243 2.310 -10.383 1.00 0.00 C ATOM 2549 C ILE A 164 -7.740 2.141 -8.955 1.00 0.00 C ATOM 2550 O ILE A 164 -7.194 1.093 -8.620 1.00 0.00 O ATOM 2551 CB ILE A 164 -7.236 3.032 -11.299 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -6.614 4.335 -10.748 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -7.789 3.170 -12.719 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.694 5.081 -11.734 1.00 0.00 C ATOM 0 H ILE A 164 -9.609 3.850 -10.826 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.343 1.315 -10.816 1.00 0.00 H new ATOM 0 HB ILE A 164 -6.368 2.373 -11.332 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.419 5.005 -10.446 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -6.044 4.097 -9.850 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -7.059 3.683 -13.345 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -7.988 2.180 -13.130 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -8.714 3.745 -12.695 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.305 5.981 -11.259 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.864 4.434 -12.018 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -6.261 5.356 -12.623 1.00 0.00 H new ATOM 2566 N LEU A 165 -7.979 3.130 -8.088 1.00 0.00 N ATOM 2567 CA LEU A 165 -7.545 3.098 -6.691 1.00 0.00 C ATOM 2568 C LEU A 165 -8.230 1.982 -5.900 1.00 0.00 C ATOM 2569 O LEU A 165 -7.786 1.657 -4.802 1.00 0.00 O ATOM 2570 CB LEU A 165 -7.735 4.485 -6.035 1.00 0.00 C ATOM 2571 CG LEU A 165 -9.176 4.936 -5.691 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -9.719 4.373 -4.370 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -9.211 6.468 -5.559 1.00 0.00 C ATOM 0 H LEU A 165 -8.483 3.981 -8.339 1.00 0.00 H new ATOM 0 HA LEU A 165 -6.480 2.865 -6.675 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.151 4.502 -5.115 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.302 5.231 -6.701 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.797 4.557 -6.503 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.733 4.739 -4.208 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.730 3.284 -4.416 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -9.081 4.695 -3.547 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.224 6.789 -5.317 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.532 6.780 -4.766 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.902 6.921 -6.501 1.00 0.00 H new ATOM 2585 N ASN A 166 -9.296 1.400 -6.453 1.00 0.00 N ATOM 2586 CA ASN A 166 -9.970 0.240 -5.907 1.00 0.00 C ATOM 2587 C ASN A 166 -9.430 -0.979 -6.619 1.00 0.00 C ATOM 2588 O ASN A 166 -9.036 -1.923 -5.954 1.00 0.00 O ATOM 2589 CB ASN A 166 -11.494 0.354 -6.065 1.00 0.00 C ATOM 2590 CG ASN A 166 -12.134 1.155 -4.936 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -12.266 0.662 -3.819 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -12.532 2.394 -5.181 1.00 0.00 N ATOM 0 H ASN A 166 -9.719 1.739 -7.317 1.00 0.00 H new ATOM 0 HA ASN A 166 -9.779 0.163 -4.837 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -11.724 0.828 -7.019 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -11.930 -0.645 -6.092 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -12.954 2.951 -4.438 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -12.417 2.792 -6.113 1.00 0.00 H new ATOM 2599 N GLU A 167 -9.313 -0.947 -7.947 1.00 0.00 N ATOM 2600 CA GLU A 167 -8.935 -2.112 -8.737 1.00 0.00 C ATOM 2601 C GLU A 167 -7.575 -2.624 -8.272 1.00 0.00 C ATOM 2602 O GLU A 167 -7.397 -3.820 -8.079 1.00 0.00 O ATOM 2603 CB GLU A 167 -8.886 -1.759 -10.235 1.00 0.00 C ATOM 2604 CG GLU A 167 -10.245 -1.559 -10.908 1.00 0.00 C ATOM 2605 CD GLU A 167 -10.078 -1.111 -12.373 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -9.894 0.104 -12.621 1.00 0.00 O ATOM 2607 OE2 GLU A 167 -10.070 -1.978 -13.279 1.00 0.00 O ATOM 0 H GLU A 167 -9.479 -0.108 -8.504 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.683 -2.892 -8.595 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.302 -0.847 -10.357 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.353 -2.552 -10.760 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.813 -2.489 -10.871 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.820 -0.813 -10.359 1.00 0.00 H new ATOM 2614 N MET A 168 -6.632 -1.714 -8.030 1.00 0.00 N ATOM 2615 CA MET A 168 -5.247 -2.051 -7.688 1.00 0.00 C ATOM 2616 C MET A 168 -5.138 -2.501 -6.236 1.00 0.00 C ATOM 2617 O MET A 168 -4.375 -3.412 -5.922 1.00 0.00 O ATOM 2618 CB MET A 168 -4.339 -0.837 -7.985 1.00 0.00 C ATOM 2619 CG MET A 168 -4.431 -0.547 -9.484 1.00 0.00 C ATOM 2620 SD MET A 168 -3.483 0.812 -10.207 1.00 0.00 S ATOM 2621 CE MET A 168 -4.223 2.208 -9.343 1.00 0.00 C ATOM 0 H MET A 168 -6.808 -0.710 -8.066 1.00 0.00 H new ATOM 0 HA MET A 168 -4.915 -2.889 -8.301 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.658 0.030 -7.407 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.309 -1.050 -7.699 1.00 0.00 H new ATOM 0 HG2 MET A 168 -4.141 -1.458 -10.008 1.00 0.00 H new ATOM 0 HG3 MET A 168 -5.481 -0.367 -9.715 1.00 0.00 H new ATOM 0 HE1 MET A 168 -3.881 3.139 -9.796 1.00 0.00 H new ATOM 0 HE2 MET A 168 -5.309 2.147 -9.416 1.00 0.00 H new ATOM 0 HE3 MET A 168 -3.928 2.185 -8.294 1.00 0.00 H new ATOM 2631 N ALA A 169 -5.928 -1.880 -5.362 1.00 0.00 N ATOM 2632 CA ALA A 169 -5.947 -2.162 -3.935 1.00 0.00 C ATOM 2633 C ALA A 169 -6.549 -3.539 -3.685 1.00 0.00 C ATOM 2634 O ALA A 169 -5.984 -4.360 -2.964 1.00 0.00 O ATOM 2635 CB ALA A 169 -6.764 -1.083 -3.211 1.00 0.00 C ATOM 0 H ALA A 169 -6.586 -1.151 -5.637 1.00 0.00 H new ATOM 0 HA ALA A 169 -4.927 -2.154 -3.550 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -6.779 -1.294 -2.142 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -6.310 -0.107 -3.382 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -7.784 -1.081 -3.594 1.00 0.00 H new ATOM 2641 N GLU A 170 -7.683 -3.786 -4.331 1.00 0.00 N ATOM 2642 CA GLU A 170 -8.438 -5.023 -4.254 1.00 0.00 C ATOM 2643 C GLU A 170 -7.632 -6.171 -4.886 1.00 0.00 C ATOM 2644 O GLU A 170 -7.709 -7.306 -4.413 1.00 0.00 O ATOM 2645 CB GLU A 170 -9.797 -4.816 -4.953 1.00 0.00 C ATOM 2646 CG GLU A 170 -10.694 -3.780 -4.242 1.00 0.00 C ATOM 2647 CD GLU A 170 -11.398 -4.378 -3.010 1.00 0.00 C ATOM 2648 OE1 GLU A 170 -12.521 -4.921 -3.153 1.00 0.00 O ATOM 2649 OE2 GLU A 170 -10.845 -4.298 -1.885 1.00 0.00 O ATOM 0 H GLU A 170 -8.116 -3.098 -4.947 1.00 0.00 H new ATOM 0 HA GLU A 170 -8.623 -5.295 -3.215 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -9.625 -4.494 -5.980 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -10.322 -5.770 -5.002 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -10.090 -2.926 -3.936 1.00 0.00 H new ATOM 0 HG3 GLU A 170 -11.442 -3.407 -4.942 1.00 0.00 H new ATOM 2656 N HIS A 171 -6.813 -5.882 -5.911 1.00 0.00 N ATOM 2657 CA HIS A 171 -5.890 -6.852 -6.494 1.00 0.00 C ATOM 2658 C HIS A 171 -4.843 -7.282 -5.459 1.00 0.00 C ATOM 2659 O HIS A 171 -4.602 -8.476 -5.262 1.00 0.00 O ATOM 2660 CB HIS A 171 -5.201 -6.265 -7.735 1.00 0.00 C ATOM 2661 CG HIS A 171 -4.744 -7.330 -8.701 1.00 0.00 C ATOM 2662 ND1 HIS A 171 -3.955 -8.441 -8.393 1.00 0.00 N ATOM 2663 CD2 HIS A 171 -5.178 -7.437 -9.991 1.00 0.00 C ATOM 2664 CE1 HIS A 171 -3.968 -9.212 -9.495 1.00 0.00 C ATOM 2665 NE2 HIS A 171 -4.679 -8.627 -10.474 1.00 0.00 N ATOM 0 H HIS A 171 -6.777 -4.964 -6.355 1.00 0.00 H new ATOM 0 HA HIS A 171 -6.461 -7.729 -6.799 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -5.889 -5.589 -8.243 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -4.343 -5.670 -7.423 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -5.792 -6.728 -10.527 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -3.475 -10.169 -9.581 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -4.824 -9.000 -11.412 1.00 0.00 H new ATOM 2673 N TYR A 172 -4.242 -6.303 -4.771 1.00 0.00 N ATOM 2674 CA TYR A 172 -3.190 -6.520 -3.788 1.00 0.00 C ATOM 2675 C TYR A 172 -3.699 -7.078 -2.453 1.00 0.00 C ATOM 2676 O TYR A 172 -2.876 -7.396 -1.586 1.00 0.00 O ATOM 2677 CB TYR A 172 -2.371 -5.228 -3.605 1.00 0.00 C ATOM 2678 CG TYR A 172 -0.957 -5.308 -4.143 1.00 0.00 C ATOM 2679 CD1 TYR A 172 0.019 -6.054 -3.456 1.00 0.00 C ATOM 2680 CD2 TYR A 172 -0.615 -4.620 -5.320 1.00 0.00 C ATOM 2681 CE1 TYR A 172 1.335 -6.117 -3.950 1.00 0.00 C ATOM 2682 CE2 TYR A 172 0.701 -4.669 -5.815 1.00 0.00 C ATOM 2683 CZ TYR A 172 1.683 -5.425 -5.132 1.00 0.00 C ATOM 2684 OH TYR A 172 2.957 -5.498 -5.611 1.00 0.00 O ATOM 0 H TYR A 172 -4.484 -5.319 -4.890 1.00 0.00 H new ATOM 0 HA TYR A 172 -2.537 -7.299 -4.180 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -2.891 -4.408 -4.101 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -2.331 -4.984 -2.543 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -0.242 -6.579 -2.549 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -1.366 -4.051 -5.847 1.00 0.00 H new ATOM 0 HE1 TYR A 172 2.081 -6.695 -3.425 1.00 0.00 H new ATOM 0 HE2 TYR A 172 0.961 -4.131 -6.714 1.00 0.00 H new ATOM 0 HH TYR A 172 3.029 -4.966 -6.431 1.00 0.00 H new ATOM 2694 N ALA A 173 -5.016 -7.192 -2.264 1.00 0.00 N ATOM 2695 CA ALA A 173 -5.582 -7.680 -1.024 1.00 0.00 C ATOM 2696 C ALA A 173 -5.332 -9.183 -0.871 1.00 0.00 C ATOM 2697 O ALA A 173 -5.510 -9.940 -1.856 1.00 0.00 O ATOM 2698 CB ALA A 173 -7.074 -7.342 -0.930 1.00 0.00 C ATOM 2699 OXT ALA A 173 -4.985 -9.615 0.252 1.00 0.00 O1- ATOM 0 H ALA A 173 -5.710 -6.947 -2.970 1.00 0.00 H new ATOM 0 HA ALA A 173 -5.083 -7.175 -0.197 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.474 -7.720 0.011 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -7.205 -6.261 -0.972 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.605 -7.805 -1.762 1.00 0.00 H new