USER MOD reduce.3.24.130724 H: found=0, std=0, add=990, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1004 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 91 CYS SG : rot 122:sc= -0.934 USER MOD Set 1.2: A 94 CYS SG : rot 176:sc= -0.356! USER MOD Set 1.3: A 116 HIS : no HE2:sc= -4.34! C(o=-5.6!,f=-6.9!) USER MOD Set 1.4: A 138 TYR OH : rot 70:sc= 0 USER MOD Set 2.1: A 5 ASN : amide:sc= -1.78 X(o=-1.7,f=-2.1!) USER MOD Set 2.2: A 35 SER OG : rot 70:sc= 0.121 USER MOD Set 3.1: A 9 SER OG : rot 178:sc= 0.0129 USER MOD Set 3.2: A 28 HIS : no HE2:sc= -0.574 K(o=-0.56,f=-3.7!) USER MOD Single : A 6 TYR OH : rot 180:sc= -0.151 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -130:sc= -3.95! USER MOD Single : A 17 SER OG : rot -37:sc= 0.38 USER MOD Single : A 18 TYR OH : rot 180:sc= -1.93! USER MOD Single : A 19 SER OG : rot 160:sc= -3.08! USER MOD Single : A 22 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.25) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -10.2! C(o=-10!,f=-10!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -1.18 K(o=-1.2,f=-2.6!) USER MOD Single : A 75 ASN : amide:sc= -0.0046 K(o=-0.0046,f=-1.2!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN :FLIP amide:sc= -2.31 F(o=-4.3!,f=-2.3) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.0507 X(o=-0.051,f=-0.01) USER MOD Single : A 95 TYR OH : rot -162:sc= 0.269 USER MOD Single : A 111 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -9.86! C(o=-9.9!,f=-12!) USER MOD Single : A 125 ASN : amide:sc= -0.305 X(o=-0.31,f=0) USER MOD Single : A 126 SER OG : rot -97:sc= 0.35 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 142:sc= -0.12 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -9.59! C(o=-9.6!,f=-14!) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 38 N GLU A 4 11.796 -3.057 -14.098 1.00 0.00 N ATOM 39 CA GLU A 4 12.071 -1.820 -14.819 1.00 0.00 C ATOM 40 C GLU A 4 11.511 -0.613 -14.072 1.00 0.00 C ATOM 41 O GLU A 4 12.147 0.439 -14.005 1.00 0.00 O ATOM 42 CB GLU A 4 11.477 -1.883 -16.228 1.00 0.00 C ATOM 43 CG GLU A 4 12.195 -2.860 -17.147 1.00 0.00 C ATOM 44 CD GLU A 4 11.591 -2.912 -18.540 1.00 0.00 C ATOM 45 OE1 GLU A 4 10.504 -2.331 -18.741 1.00 0.00 O ATOM 46 OE2 GLU A 4 12.207 -3.538 -19.428 1.00 0.00 O ATOM 0 HA GLU A 4 13.153 -1.707 -14.892 1.00 0.00 H new ATOM 0 HB2 GLU A 4 10.427 -2.167 -16.158 1.00 0.00 H new ATOM 0 HB3 GLU A 4 11.510 -0.888 -16.672 1.00 0.00 H new ATOM 0 HG2 GLU A 4 13.245 -2.577 -17.222 1.00 0.00 H new ATOM 0 HG3 GLU A 4 12.164 -3.856 -16.706 1.00 0.00 H new ATOM 54 N ASN A 5 10.319 -0.774 -13.506 1.00 0.00 N ATOM 55 CA ASN A 5 9.676 0.299 -12.755 1.00 0.00 C ATOM 56 C ASN A 5 9.643 -0.030 -11.268 1.00 0.00 C ATOM 57 O ASN A 5 8.868 0.551 -10.509 1.00 0.00 O ATOM 58 CB ASN A 5 8.254 0.531 -13.272 1.00 0.00 C ATOM 59 CG ASN A 5 8.236 1.145 -14.658 1.00 0.00 C ATOM 60 OD1 ASN A 5 9.218 1.742 -15.098 1.00 0.00 O ATOM 61 ND2 ASN A 5 7.114 1.003 -15.354 1.00 0.00 N ATOM 0 H ASN A 5 9.778 -1.638 -13.553 1.00 0.00 H new ATOM 0 HA ASN A 5 10.257 1.210 -12.896 1.00 0.00 H new ATOM 0 HB2 ASN A 5 7.718 -0.418 -13.291 1.00 0.00 H new ATOM 0 HB3 ASN A 5 7.721 1.184 -12.581 1.00 0.00 H new ATOM 0 HD21 ASN A 5 7.043 1.397 -16.292 1.00 0.00 H new ATOM 0 HD22 ASN A 5 6.324 0.500 -14.950 1.00 0.00 H new ATOM 68 N TYR A 6 10.475 -0.983 -10.865 1.00 0.00 N ATOM 69 CA TYR A 6 10.531 -1.414 -9.477 1.00 0.00 C ATOM 70 C TYR A 6 11.717 -0.786 -8.752 1.00 0.00 C ATOM 71 O TYR A 6 12.868 -0.969 -9.148 1.00 0.00 O ATOM 72 CB TYR A 6 10.635 -2.936 -9.424 1.00 0.00 C ATOM 73 CG TYR A 6 10.403 -3.512 -8.051 1.00 0.00 C ATOM 74 CD1 TYR A 6 11.453 -3.695 -7.163 1.00 0.00 C ATOM 75 CD2 TYR A 6 9.128 -3.871 -7.648 1.00 0.00 C ATOM 76 CE1 TYR A 6 11.237 -4.224 -5.905 1.00 0.00 C ATOM 77 CE2 TYR A 6 8.900 -4.400 -6.392 1.00 0.00 C ATOM 78 CZ TYR A 6 9.957 -4.575 -5.524 1.00 0.00 C ATOM 79 OH TYR A 6 9.737 -5.102 -4.272 1.00 0.00 O ATOM 0 H TYR A 6 11.122 -1.472 -11.484 1.00 0.00 H new ATOM 0 HA TYR A 6 9.620 -1.088 -8.975 1.00 0.00 H new ATOM 0 HB2 TYR A 6 9.910 -3.365 -10.116 1.00 0.00 H new ATOM 0 HB3 TYR A 6 11.623 -3.236 -9.772 1.00 0.00 H new ATOM 0 HD1 TYR A 6 12.454 -3.420 -7.459 1.00 0.00 H new ATOM 0 HD2 TYR A 6 8.298 -3.735 -8.326 1.00 0.00 H new ATOM 0 HE1 TYR A 6 12.064 -4.362 -5.224 1.00 0.00 H new ATOM 0 HE2 TYR A 6 7.900 -4.675 -6.092 1.00 0.00 H new ATOM 0 HH TYR A 6 8.782 -5.294 -4.161 1.00 0.00 H new ATOM 89 N TYR A 7 11.428 -0.047 -7.685 1.00 0.00 N ATOM 90 CA TYR A 7 12.471 0.604 -6.900 1.00 0.00 C ATOM 91 C TYR A 7 12.147 0.534 -5.409 1.00 0.00 C ATOM 92 O TYR A 7 10.981 0.445 -5.019 1.00 0.00 O ATOM 93 CB TYR A 7 12.639 2.061 -7.342 1.00 0.00 C ATOM 94 CG TYR A 7 11.467 2.950 -6.987 1.00 0.00 C ATOM 95 CD1 TYR A 7 11.427 3.621 -5.773 1.00 0.00 C ATOM 96 CD2 TYR A 7 10.401 3.114 -7.864 1.00 0.00 C ATOM 97 CE1 TYR A 7 10.360 4.430 -5.440 1.00 0.00 C ATOM 98 CE2 TYR A 7 9.329 3.922 -7.537 1.00 0.00 C ATOM 99 CZ TYR A 7 9.314 4.578 -6.325 1.00 0.00 C ATOM 100 OH TYR A 7 8.248 5.385 -5.995 1.00 0.00 O ATOM 0 H TYR A 7 10.480 0.116 -7.344 1.00 0.00 H new ATOM 0 HA TYR A 7 13.410 0.077 -7.072 1.00 0.00 H new ATOM 0 HB2 TYR A 7 13.541 2.467 -6.885 1.00 0.00 H new ATOM 0 HB3 TYR A 7 12.789 2.088 -8.421 1.00 0.00 H new ATOM 0 HD1 TYR A 7 12.245 3.508 -5.077 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.411 2.602 -8.815 1.00 0.00 H new ATOM 0 HE1 TYR A 7 10.345 4.945 -4.491 1.00 0.00 H new ATOM 0 HE2 TYR A 7 8.507 4.039 -8.228 1.00 0.00 H new ATOM 0 HH TYR A 7 7.597 5.382 -6.727 1.00 0.00 H new ATOM 110 N ILE A 8 13.183 0.579 -4.576 1.00 0.00 N ATOM 111 CA ILE A 8 13.002 0.524 -3.130 1.00 0.00 C ATOM 112 C ILE A 8 13.781 1.641 -2.430 1.00 0.00 C ATOM 113 O ILE A 8 14.948 1.893 -2.733 1.00 0.00 O ATOM 114 CB ILE A 8 13.445 -0.836 -2.550 1.00 0.00 C ATOM 115 CG1 ILE A 8 12.861 -1.988 -3.372 1.00 0.00 C ATOM 116 CG2 ILE A 8 13.013 -0.957 -1.097 1.00 0.00 C ATOM 117 CD1 ILE A 8 13.878 -2.676 -4.257 1.00 0.00 C ATOM 0 H ILE A 8 14.155 0.653 -4.878 1.00 0.00 H new ATOM 0 HA ILE A 8 11.936 0.656 -2.946 1.00 0.00 H new ATOM 0 HB ILE A 8 14.532 -0.892 -2.599 1.00 0.00 H new ATOM 0 HG12 ILE A 8 12.425 -2.722 -2.695 1.00 0.00 H new ATOM 0 HG13 ILE A 8 12.050 -1.606 -3.993 1.00 0.00 H new ATOM 0 HG21 ILE A 8 13.332 -1.921 -0.702 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.469 -0.157 -0.514 1.00 0.00 H new ATOM 0 HG23 ILE A 8 11.928 -0.880 -1.032 1.00 0.00 H new ATOM 0 HD11 ILE A 8 13.394 -3.481 -4.810 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.297 -1.955 -4.959 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.677 -3.088 -3.641 1.00 0.00 H new ATOM 129 N SER A 9 13.091 2.333 -1.505 1.00 0.00 N ATOM 130 CA SER A 9 13.679 3.440 -0.707 1.00 0.00 C ATOM 131 C SER A 9 14.282 2.955 0.641 1.00 0.00 C ATOM 132 O SER A 9 13.684 3.219 1.688 1.00 0.00 O ATOM 133 CB SER A 9 12.626 4.526 -0.457 1.00 0.00 C ATOM 134 OG SER A 9 13.222 5.702 0.065 1.00 0.00 O ATOM 0 H SER A 9 12.113 2.146 -1.285 1.00 0.00 H new ATOM 0 HA SER A 9 14.501 3.853 -1.291 1.00 0.00 H new ATOM 0 HB2 SER A 9 12.110 4.758 -1.389 1.00 0.00 H new ATOM 0 HB3 SER A 9 11.874 4.155 0.240 1.00 0.00 H new ATOM 0 HG SER A 9 12.536 6.391 0.185 1.00 0.00 H new ATOM 140 N PRO A 10 15.366 2.143 0.662 1.00 0.00 N ATOM 141 CA PRO A 10 16.167 1.749 -0.483 1.00 0.00 C ATOM 142 C PRO A 10 16.156 0.244 -0.747 1.00 0.00 C ATOM 143 O PRO A 10 15.491 -0.516 -0.045 1.00 0.00 O ATOM 144 CB PRO A 10 17.542 2.144 0.043 1.00 0.00 C ATOM 145 CG PRO A 10 17.485 1.807 1.512 1.00 0.00 C ATOM 146 CD PRO A 10 16.020 1.653 1.873 1.00 0.00 C ATOM 0 HA PRO A 10 15.832 2.192 -1.421 1.00 0.00 H new ATOM 0 HB2 PRO A 10 18.335 1.593 -0.462 1.00 0.00 H new ATOM 0 HB3 PRO A 10 17.740 3.204 -0.115 1.00 0.00 H new ATOM 0 HG2 PRO A 10 18.032 0.887 1.719 1.00 0.00 H new ATOM 0 HG3 PRO A 10 17.948 2.594 2.107 1.00 0.00 H new ATOM 0 HD2 PRO A 10 15.758 0.617 2.090 1.00 0.00 H new ATOM 0 HD3 PRO A 10 15.750 2.240 2.751 1.00 0.00 H new ATOM 154 N SER A 11 16.895 -0.167 -1.781 1.00 0.00 N ATOM 155 CA SER A 11 16.980 -1.576 -2.183 1.00 0.00 C ATOM 156 C SER A 11 17.099 -2.506 -0.980 1.00 0.00 C ATOM 157 O SER A 11 17.430 -2.073 0.125 1.00 0.00 O ATOM 158 CB SER A 11 18.175 -1.784 -3.115 1.00 0.00 C ATOM 159 OG SER A 11 18.075 -0.963 -4.266 1.00 0.00 O ATOM 0 H SER A 11 17.449 0.463 -2.361 1.00 0.00 H new ATOM 0 HA SER A 11 16.056 -1.823 -2.706 1.00 0.00 H new ATOM 0 HB2 SER A 11 19.099 -1.558 -2.583 1.00 0.00 H new ATOM 0 HB3 SER A 11 18.228 -2.831 -3.415 1.00 0.00 H new ATOM 0 HG SER A 11 18.852 -1.114 -4.844 1.00 0.00 H new ATOM 165 N LEU A 12 16.811 -3.785 -1.197 1.00 0.00 N ATOM 166 CA LEU A 12 16.867 -4.771 -0.125 1.00 0.00 C ATOM 167 C LEU A 12 18.270 -4.843 0.462 1.00 0.00 C ATOM 168 O LEU A 12 18.441 -4.943 1.677 1.00 0.00 O ATOM 169 CB LEU A 12 16.445 -6.144 -0.650 1.00 0.00 C ATOM 170 CG LEU A 12 15.028 -6.206 -1.222 1.00 0.00 C ATOM 171 CD1 LEU A 12 14.705 -7.612 -1.699 1.00 0.00 C ATOM 172 CD2 LEU A 12 14.011 -5.736 -0.191 1.00 0.00 C ATOM 0 H LEU A 12 16.537 -4.162 -2.104 1.00 0.00 H new ATOM 0 HA LEU A 12 16.178 -4.466 0.662 1.00 0.00 H new ATOM 0 HB2 LEU A 12 17.148 -6.453 -1.424 1.00 0.00 H new ATOM 0 HB3 LEU A 12 16.526 -6.868 0.161 1.00 0.00 H new ATOM 0 HG LEU A 12 14.974 -5.536 -2.080 1.00 0.00 H new ATOM 0 HD11 LEU A 12 13.693 -7.636 -2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 12 15.412 -7.904 -2.475 1.00 0.00 H new ATOM 0 HD13 LEU A 12 14.778 -8.306 -0.862 1.00 0.00 H new ATOM 0 HD21 LEU A 12 13.009 -5.788 -0.618 1.00 0.00 H new ATOM 0 HD22 LEU A 12 14.064 -6.376 0.690 1.00 0.00 H new ATOM 0 HD23 LEU A 12 14.231 -4.707 0.094 1.00 0.00 H new ATOM 184 N ASP A 13 19.274 -4.776 -0.405 1.00 0.00 N ATOM 185 CA ASP A 13 20.660 -4.814 0.038 1.00 0.00 C ATOM 186 C ASP A 13 21.002 -3.554 0.827 1.00 0.00 C ATOM 187 O ASP A 13 21.696 -3.614 1.842 1.00 0.00 O ATOM 188 CB ASP A 13 21.602 -4.956 -1.159 1.00 0.00 C ATOM 189 CG ASP A 13 21.513 -6.324 -1.807 1.00 0.00 C ATOM 190 OD1 ASP A 13 21.039 -7.268 -1.141 1.00 0.00 O ATOM 191 OD2 ASP A 13 21.918 -6.452 -2.982 1.00 0.00 O ATOM 0 H ASP A 13 19.154 -4.695 -1.415 1.00 0.00 H new ATOM 0 HA ASP A 13 20.788 -5.680 0.688 1.00 0.00 H new ATOM 0 HB2 ASP A 13 21.364 -4.191 -1.898 1.00 0.00 H new ATOM 0 HB3 ASP A 13 22.627 -4.777 -0.834 1.00 0.00 H new ATOM 197 N THR A 14 20.511 -2.411 0.349 1.00 0.00 N ATOM 198 CA THR A 14 20.763 -1.137 1.013 1.00 0.00 C ATOM 199 C THR A 14 20.216 -1.152 2.439 1.00 0.00 C ATOM 200 O THR A 14 20.850 -0.642 3.364 1.00 0.00 O ATOM 201 CB THR A 14 20.138 0.019 0.216 1.00 0.00 C ATOM 202 OG1 THR A 14 20.682 0.072 -1.091 1.00 0.00 O ATOM 203 CG2 THR A 14 20.370 1.375 0.852 1.00 0.00 C ATOM 0 H THR A 14 19.939 -2.343 -0.493 1.00 0.00 H new ATOM 0 HA THR A 14 21.842 -0.986 1.059 1.00 0.00 H new ATOM 0 HB THR A 14 19.067 -0.185 0.198 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.273 0.812 -1.586 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.904 2.148 0.241 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.932 1.388 1.850 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.441 1.565 0.923 1.00 0.00 H new ATOM 211 N LEU A 15 19.038 -1.745 2.609 1.00 0.00 N ATOM 212 CA LEU A 15 18.404 -1.831 3.922 1.00 0.00 C ATOM 213 C LEU A 15 19.279 -2.612 4.900 1.00 0.00 C ATOM 214 O LEU A 15 19.401 -2.249 6.068 1.00 0.00 O ATOM 215 CB LEU A 15 17.032 -2.495 3.802 1.00 0.00 C ATOM 216 CG LEU A 15 16.264 -2.642 5.116 1.00 0.00 C ATOM 217 CD1 LEU A 15 14.765 -2.606 4.866 1.00 0.00 C ATOM 218 CD2 LEU A 15 16.657 -3.931 5.820 1.00 0.00 C ATOM 0 H LEU A 15 18.502 -2.173 1.854 1.00 0.00 H new ATOM 0 HA LEU A 15 18.279 -0.819 4.307 1.00 0.00 H new ATOM 0 HB2 LEU A 15 16.425 -1.915 3.107 1.00 0.00 H new ATOM 0 HB3 LEU A 15 17.162 -3.484 3.363 1.00 0.00 H new ATOM 0 HG LEU A 15 16.524 -1.803 5.762 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.236 -2.712 5.813 1.00 0.00 H new ATOM 0 HD12 LEU A 15 14.496 -1.656 4.404 1.00 0.00 H new ATOM 0 HD13 LEU A 15 14.487 -3.424 4.201 1.00 0.00 H new ATOM 0 HD21 LEU A 15 16.101 -4.020 6.753 1.00 0.00 H new ATOM 0 HD22 LEU A 15 16.426 -4.781 5.178 1.00 0.00 H new ATOM 0 HD23 LEU A 15 17.726 -3.917 6.034 1.00 0.00 H new ATOM 230 N SER A 16 19.886 -3.685 4.408 1.00 0.00 N ATOM 231 CA SER A 16 20.755 -4.526 5.228 1.00 0.00 C ATOM 232 C SER A 16 22.079 -3.825 5.532 1.00 0.00 C ATOM 233 O SER A 16 22.869 -4.300 6.347 1.00 0.00 O ATOM 234 CB SER A 16 21.024 -5.854 4.518 1.00 0.00 C ATOM 235 OG SER A 16 19.819 -6.562 4.280 1.00 0.00 O ATOM 0 H SER A 16 19.793 -3.996 3.441 1.00 0.00 H new ATOM 0 HA SER A 16 20.244 -4.716 6.172 1.00 0.00 H new ATOM 0 HB2 SER A 16 21.532 -5.667 3.572 1.00 0.00 H new ATOM 0 HB3 SER A 16 21.694 -6.464 5.124 1.00 0.00 H new ATOM 0 HG SER A 16 19.915 -7.486 4.593 1.00 0.00 H new ATOM 241 N SER A 17 22.323 -2.707 4.855 1.00 0.00 N ATOM 242 CA SER A 17 23.560 -1.955 5.032 1.00 0.00 C ATOM 243 C SER A 17 23.588 -1.191 6.356 1.00 0.00 C ATOM 244 O SER A 17 24.612 -0.607 6.710 1.00 0.00 O ATOM 245 CB SER A 17 23.752 -0.980 3.869 1.00 0.00 C ATOM 246 OG SER A 17 25.046 -0.404 3.896 1.00 0.00 O ATOM 0 H SER A 17 21.678 -2.301 4.177 1.00 0.00 H new ATOM 0 HA SER A 17 24.377 -2.676 5.050 1.00 0.00 H new ATOM 0 HB2 SER A 17 23.602 -1.502 2.924 1.00 0.00 H new ATOM 0 HB3 SER A 17 22.999 -0.194 3.921 1.00 0.00 H new ATOM 0 HG SER A 17 25.316 -0.250 4.825 1.00 0.00 H new ATOM 252 N TYR A 18 22.475 -1.190 7.090 1.00 0.00 N ATOM 253 CA TYR A 18 22.432 -0.479 8.367 1.00 0.00 C ATOM 254 C TYR A 18 22.861 -1.397 9.515 1.00 0.00 C ATOM 255 O TYR A 18 23.992 -1.313 9.997 1.00 0.00 O ATOM 256 CB TYR A 18 21.034 0.089 8.670 1.00 0.00 C ATOM 257 CG TYR A 18 20.155 0.351 7.465 1.00 0.00 C ATOM 258 CD1 TYR A 18 20.656 0.946 6.315 1.00 0.00 C ATOM 259 CD2 TYR A 18 18.808 0.012 7.493 1.00 0.00 C ATOM 260 CE1 TYR A 18 19.838 1.191 5.227 1.00 0.00 C ATOM 261 CE2 TYR A 18 17.986 0.253 6.419 1.00 0.00 C ATOM 262 CZ TYR A 18 18.503 0.843 5.285 1.00 0.00 C ATOM 263 OH TYR A 18 17.684 1.085 4.205 1.00 0.00 O ATOM 0 H TYR A 18 21.609 -1.662 6.830 1.00 0.00 H new ATOM 0 HA TYR A 18 23.129 0.355 8.282 1.00 0.00 H new ATOM 0 HB2 TYR A 18 20.515 -0.606 9.331 1.00 0.00 H new ATOM 0 HB3 TYR A 18 21.153 1.023 9.220 1.00 0.00 H new ATOM 0 HD1 TYR A 18 21.699 1.221 6.269 1.00 0.00 H new ATOM 0 HD2 TYR A 18 18.398 -0.451 8.378 1.00 0.00 H new ATOM 0 HE1 TYR A 18 20.241 1.652 4.337 1.00 0.00 H new ATOM 0 HE2 TYR A 18 16.941 -0.018 6.463 1.00 0.00 H new ATOM 0 HH TYR A 18 16.775 0.780 4.409 1.00 0.00 H new ATOM 273 N SER A 19 21.952 -2.268 9.952 1.00 0.00 N ATOM 274 CA SER A 19 22.235 -3.194 11.043 1.00 0.00 C ATOM 275 C SER A 19 21.122 -4.231 11.168 1.00 0.00 C ATOM 276 O SER A 19 20.095 -4.133 10.496 1.00 0.00 O ATOM 277 CB SER A 19 22.392 -2.437 12.363 1.00 0.00 C ATOM 278 OG SER A 19 21.152 -1.914 12.802 1.00 0.00 O ATOM 0 H SER A 19 21.012 -2.350 9.565 1.00 0.00 H new ATOM 0 HA SER A 19 23.170 -3.707 10.819 1.00 0.00 H new ATOM 0 HB2 SER A 19 22.798 -3.105 13.123 1.00 0.00 H new ATOM 0 HB3 SER A 19 23.108 -1.625 12.237 1.00 0.00 H new ATOM 0 HG SER A 19 21.198 -1.725 13.762 1.00 0.00 H new ATOM 284 N LEU A 20 21.328 -5.224 12.029 1.00 0.00 N ATOM 285 CA LEU A 20 20.334 -6.274 12.230 1.00 0.00 C ATOM 286 C LEU A 20 19.014 -5.688 12.728 1.00 0.00 C ATOM 287 O LEU A 20 17.952 -5.977 12.177 1.00 0.00 O ATOM 288 CB LEU A 20 20.853 -7.307 13.232 1.00 0.00 C ATOM 289 CG LEU A 20 19.894 -8.460 13.531 1.00 0.00 C ATOM 290 CD1 LEU A 20 19.603 -9.253 12.267 1.00 0.00 C ATOM 291 CD2 LEU A 20 20.467 -9.366 14.612 1.00 0.00 C ATOM 0 H LEU A 20 22.170 -5.324 12.596 1.00 0.00 H new ATOM 0 HA LEU A 20 20.156 -6.760 11.271 1.00 0.00 H new ATOM 0 HB2 LEU A 20 21.787 -7.721 12.852 1.00 0.00 H new ATOM 0 HB3 LEU A 20 21.087 -6.798 14.167 1.00 0.00 H new ATOM 0 HG LEU A 20 18.957 -8.041 13.897 1.00 0.00 H new ATOM 0 HD11 LEU A 20 18.919 -10.069 12.499 1.00 0.00 H new ATOM 0 HD12 LEU A 20 19.148 -8.599 11.524 1.00 0.00 H new ATOM 0 HD13 LEU A 20 20.533 -9.661 11.871 1.00 0.00 H new ATOM 0 HD21 LEU A 20 19.770 -10.180 14.811 1.00 0.00 H new ATOM 0 HD22 LEU A 20 21.419 -9.777 14.276 1.00 0.00 H new ATOM 0 HD23 LEU A 20 20.622 -8.790 15.524 1.00 0.00 H new ATOM 303 N LEU A 21 19.086 -4.853 13.762 1.00 0.00 N ATOM 304 CA LEU A 21 17.890 -4.224 14.315 1.00 0.00 C ATOM 305 C LEU A 21 17.261 -3.281 13.292 1.00 0.00 C ATOM 306 O LEU A 21 16.040 -3.232 13.138 1.00 0.00 O ATOM 307 CB LEU A 21 18.237 -3.457 15.592 1.00 0.00 C ATOM 308 CG LEU A 21 17.058 -2.753 16.268 1.00 0.00 C ATOM 309 CD1 LEU A 21 17.308 -2.613 17.763 1.00 0.00 C ATOM 310 CD2 LEU A 21 16.816 -1.390 15.638 1.00 0.00 C ATOM 0 H LEU A 21 19.955 -4.598 14.231 1.00 0.00 H new ATOM 0 HA LEU A 21 17.170 -5.006 14.558 1.00 0.00 H new ATOM 0 HB2 LEU A 21 18.682 -4.151 16.305 1.00 0.00 H new ATOM 0 HB3 LEU A 21 18.997 -2.713 15.355 1.00 0.00 H new ATOM 0 HG LEU A 21 16.165 -3.361 16.123 1.00 0.00 H new ATOM 0 HD11 LEU A 21 16.460 -2.110 18.228 1.00 0.00 H new ATOM 0 HD12 LEU A 21 17.431 -3.602 18.205 1.00 0.00 H new ATOM 0 HD13 LEU A 21 18.212 -2.027 17.927 1.00 0.00 H new ATOM 0 HD21 LEU A 21 15.974 -0.905 16.132 1.00 0.00 H new ATOM 0 HD22 LEU A 21 17.708 -0.773 15.752 1.00 0.00 H new ATOM 0 HD23 LEU A 21 16.593 -1.513 14.578 1.00 0.00 H new ATOM 322 N GLN A 22 18.116 -2.548 12.587 1.00 0.00 N ATOM 323 CA GLN A 22 17.675 -1.603 11.566 1.00 0.00 C ATOM 324 C GLN A 22 16.926 -2.320 10.449 1.00 0.00 C ATOM 325 O GLN A 22 15.945 -1.798 9.917 1.00 0.00 O ATOM 326 CB GLN A 22 18.880 -0.851 11.004 1.00 0.00 C ATOM 327 CG GLN A 22 19.502 0.121 11.994 1.00 0.00 C ATOM 328 CD GLN A 22 18.530 1.193 12.445 1.00 0.00 C ATOM 329 OE1 GLN A 22 17.880 1.843 11.625 1.00 0.00 O ATOM 330 NE2 GLN A 22 18.424 1.383 13.755 1.00 0.00 N ATOM 0 H GLN A 22 19.128 -2.591 12.706 1.00 0.00 H new ATOM 0 HA GLN A 22 16.991 -0.889 12.024 1.00 0.00 H new ATOM 0 HB2 GLN A 22 19.635 -1.572 10.691 1.00 0.00 H new ATOM 0 HB3 GLN A 22 18.574 -0.304 10.113 1.00 0.00 H new ATOM 0 HG2 GLN A 22 19.859 -0.430 12.864 1.00 0.00 H new ATOM 0 HG3 GLN A 22 20.372 0.593 11.537 1.00 0.00 H new ATOM 0 HE21 GLN A 22 18.982 0.822 14.399 1.00 0.00 H new ATOM 0 HE22 GLN A 22 17.785 2.090 14.118 1.00 0.00 H new ATOM 339 N LEU A 23 17.381 -3.521 10.104 1.00 0.00 N ATOM 340 CA LEU A 23 16.744 -4.307 9.055 1.00 0.00 C ATOM 341 C LEU A 23 15.296 -4.606 9.426 1.00 0.00 C ATOM 342 O LEU A 23 14.403 -4.564 8.579 1.00 0.00 O ATOM 343 CB LEU A 23 17.505 -5.619 8.845 1.00 0.00 C ATOM 344 CG LEU A 23 18.682 -5.541 7.872 1.00 0.00 C ATOM 345 CD1 LEU A 23 19.939 -6.114 8.509 1.00 0.00 C ATOM 346 CD2 LEU A 23 18.354 -6.284 6.585 1.00 0.00 C ATOM 0 H LEU A 23 18.188 -3.970 10.536 1.00 0.00 H new ATOM 0 HA LEU A 23 16.762 -3.731 8.130 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.875 -5.964 9.810 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.805 -6.372 8.484 1.00 0.00 H new ATOM 0 HG LEU A 23 18.864 -4.493 7.632 1.00 0.00 H new ATOM 0 HD11 LEU A 23 20.766 -6.050 7.802 1.00 0.00 H new ATOM 0 HD12 LEU A 23 20.184 -5.546 9.406 1.00 0.00 H new ATOM 0 HD13 LEU A 23 19.769 -7.157 8.775 1.00 0.00 H new ATOM 0 HD21 LEU A 23 19.201 -6.220 5.902 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.149 -7.330 6.811 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.477 -5.835 6.119 1.00 0.00 H new ATOM 358 N ARG A 24 15.076 -4.905 10.700 1.00 0.00 N ATOM 359 CA ARG A 24 13.742 -5.209 11.197 1.00 0.00 C ATOM 360 C ARG A 24 12.988 -3.941 11.594 1.00 0.00 C ATOM 361 O ARG A 24 11.788 -3.982 11.862 1.00 0.00 O ATOM 362 CB ARG A 24 13.836 -6.145 12.400 1.00 0.00 C ATOM 363 CG ARG A 24 14.290 -7.551 12.051 1.00 0.00 C ATOM 364 CD ARG A 24 14.593 -8.355 13.301 1.00 0.00 C ATOM 365 NE ARG A 24 13.425 -8.482 14.170 1.00 0.00 N ATOM 366 CZ ARG A 24 13.349 -9.328 15.197 1.00 0.00 C ATOM 367 NH1 ARG A 24 14.369 -10.125 15.490 1.00 0.00 N ATOM 368 NH2 ARG A 24 12.247 -9.378 15.933 1.00 0.00 N ATOM 0 H ARG A 24 15.808 -4.943 11.410 1.00 0.00 H new ATOM 0 HA ARG A 24 13.190 -5.694 10.392 1.00 0.00 H new ATOM 0 HB2 ARG A 24 14.529 -5.720 13.126 1.00 0.00 H new ATOM 0 HB3 ARG A 24 12.861 -6.198 12.884 1.00 0.00 H new ATOM 0 HG2 ARG A 24 13.515 -8.053 11.471 1.00 0.00 H new ATOM 0 HG3 ARG A 24 15.179 -7.503 11.422 1.00 0.00 H new ATOM 0 HD2 ARG A 24 14.943 -9.348 13.017 1.00 0.00 H new ATOM 0 HD3 ARG A 24 15.403 -7.877 13.851 1.00 0.00 H new ATOM 0 HE ARG A 24 12.619 -7.887 13.979 1.00 0.00 H new ATOM 0 HH11 ARG A 24 15.219 -10.093 14.927 1.00 0.00 H new ATOM 0 HH12 ARG A 24 14.303 -10.770 16.278 1.00 0.00 H new ATOM 0 HH21 ARG A 24 11.459 -8.769 15.713 1.00 0.00 H new ATOM 0 HH22 ARG A 24 12.188 -10.025 16.719 1.00 0.00 H new ATOM 382 N LYS A 25 13.697 -2.819 11.633 1.00 0.00 N ATOM 383 CA LYS A 25 13.091 -1.546 12.000 1.00 0.00 C ATOM 384 C LYS A 25 13.378 -0.494 10.932 1.00 0.00 C ATOM 385 O LYS A 25 13.886 0.580 11.230 1.00 0.00 O ATOM 386 CB LYS A 25 13.615 -1.083 13.364 1.00 0.00 C ATOM 387 CG LYS A 25 13.019 0.235 13.829 1.00 0.00 C ATOM 388 CD LYS A 25 13.570 0.647 15.186 1.00 0.00 C ATOM 389 CE LYS A 25 12.972 1.964 15.653 1.00 0.00 C ATOM 390 NZ LYS A 25 13.433 2.328 17.022 1.00 0.00 N ATOM 0 H LYS A 25 14.692 -2.765 11.415 1.00 0.00 H new ATOM 0 HA LYS A 25 12.012 -1.680 12.070 1.00 0.00 H new ATOM 0 HB2 LYS A 25 13.400 -1.851 14.106 1.00 0.00 H new ATOM 0 HB3 LYS A 25 14.699 -0.984 13.313 1.00 0.00 H new ATOM 0 HG2 LYS A 25 13.235 1.012 13.096 1.00 0.00 H new ATOM 0 HG3 LYS A 25 11.934 0.145 13.887 1.00 0.00 H new ATOM 0 HD2 LYS A 25 13.356 -0.131 15.918 1.00 0.00 H new ATOM 0 HD3 LYS A 25 14.654 0.739 15.127 1.00 0.00 H new ATOM 0 HE2 LYS A 25 13.246 2.755 14.955 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.884 1.893 15.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 13.003 3.232 17.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 13.149 1.585 17.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 14.469 2.421 17.026 1.00 0.00 H new ATOM 404 N VAL A 26 13.040 -0.837 9.689 1.00 0.00 N ATOM 405 CA VAL A 26 13.244 0.036 8.526 1.00 0.00 C ATOM 406 C VAL A 26 12.292 1.246 8.536 1.00 0.00 C ATOM 407 O VAL A 26 11.151 1.152 8.087 1.00 0.00 O ATOM 408 CB VAL A 26 13.088 -0.754 7.208 1.00 0.00 C ATOM 409 CG1 VAL A 26 11.677 -1.299 7.050 1.00 0.00 C ATOM 410 CG2 VAL A 26 13.479 0.111 6.021 1.00 0.00 C ATOM 0 H VAL A 26 12.614 -1.734 9.456 1.00 0.00 H new ATOM 0 HA VAL A 26 14.263 0.416 8.591 1.00 0.00 H new ATOM 0 HB VAL A 26 13.763 -1.609 7.245 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.602 -1.849 6.112 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.449 -1.966 7.881 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.966 -0.473 7.043 1.00 0.00 H new ATOM 0 HG21 VAL A 26 13.363 -0.461 5.100 1.00 0.00 H new ATOM 0 HG22 VAL A 26 12.837 0.991 5.985 1.00 0.00 H new ATOM 0 HG23 VAL A 26 14.518 0.424 6.125 1.00 0.00 H new ATOM 420 N PRO A 27 12.742 2.411 9.060 1.00 0.00 N ATOM 421 CA PRO A 27 11.906 3.616 9.135 1.00 0.00 C ATOM 422 C PRO A 27 11.242 3.970 7.802 1.00 0.00 C ATOM 423 O PRO A 27 10.071 3.656 7.588 1.00 0.00 O ATOM 424 CB PRO A 27 12.885 4.723 9.570 1.00 0.00 C ATOM 425 CG PRO A 27 14.248 4.133 9.420 1.00 0.00 C ATOM 426 CD PRO A 27 14.079 2.656 9.617 1.00 0.00 C ATOM 0 HA PRO A 27 11.074 3.476 9.825 1.00 0.00 H new ATOM 0 HB2 PRO A 27 12.772 5.612 8.950 1.00 0.00 H new ATOM 0 HB3 PRO A 27 12.700 5.027 10.600 1.00 0.00 H new ATOM 0 HG2 PRO A 27 14.662 4.351 8.436 1.00 0.00 H new ATOM 0 HG3 PRO A 27 14.937 4.549 10.155 1.00 0.00 H new ATOM 0 HD2 PRO A 27 14.847 2.086 9.094 1.00 0.00 H new ATOM 0 HD3 PRO A 27 14.137 2.378 10.669 1.00 0.00 H new ATOM 434 N HIS A 28 11.979 4.638 6.915 1.00 0.00 N ATOM 435 CA HIS A 28 11.428 5.037 5.623 1.00 0.00 C ATOM 436 C HIS A 28 11.764 4.020 4.535 1.00 0.00 C ATOM 437 O HIS A 28 12.868 4.019 3.988 1.00 0.00 O ATOM 438 CB HIS A 28 11.959 6.420 5.231 1.00 0.00 C ATOM 439 CG HIS A 28 11.441 6.920 3.918 1.00 0.00 C ATOM 440 ND1 HIS A 28 10.131 7.304 3.724 1.00 0.00 N ATOM 441 CD2 HIS A 28 12.063 7.101 2.728 1.00 0.00 C ATOM 442 CE1 HIS A 28 9.971 7.698 2.472 1.00 0.00 C ATOM 443 NE2 HIS A 28 11.128 7.585 1.848 1.00 0.00 N ATOM 0 H HIS A 28 12.950 4.912 7.066 1.00 0.00 H new ATOM 0 HA HIS A 28 10.343 5.079 5.719 1.00 0.00 H new ATOM 0 HB2 HIS A 28 11.694 7.134 6.011 1.00 0.00 H new ATOM 0 HB3 HIS A 28 13.048 6.382 5.190 1.00 0.00 H new ATOM 0 HD1 HIS A 28 9.400 7.287 4.435 1.00 0.00 H new ATOM 0 HD2 HIS A 28 13.102 6.901 2.512 1.00 0.00 H new ATOM 0 HE1 HIS A 28 9.049 8.052 2.034 1.00 0.00 H new ATOM 452 N LEU A 29 10.796 3.168 4.217 1.00 0.00 N ATOM 453 CA LEU A 29 10.971 2.155 3.183 1.00 0.00 C ATOM 454 C LEU A 29 9.928 2.330 2.083 1.00 0.00 C ATOM 455 O LEU A 29 8.731 2.389 2.362 1.00 0.00 O ATOM 456 CB LEU A 29 10.864 0.753 3.785 1.00 0.00 C ATOM 457 CG LEU A 29 11.031 -0.393 2.786 1.00 0.00 C ATOM 458 CD1 LEU A 29 12.398 -0.328 2.124 1.00 0.00 C ATOM 459 CD2 LEU A 29 10.834 -1.734 3.477 1.00 0.00 C ATOM 0 H LEU A 29 9.878 3.159 4.662 1.00 0.00 H new ATOM 0 HA LEU A 29 11.963 2.277 2.749 1.00 0.00 H new ATOM 0 HB2 LEU A 29 11.620 0.649 4.564 1.00 0.00 H new ATOM 0 HB3 LEU A 29 9.892 0.655 4.269 1.00 0.00 H new ATOM 0 HG LEU A 29 10.270 -0.290 2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 29 12.499 -1.151 1.416 1.00 0.00 H new ATOM 0 HD12 LEU A 29 12.502 0.620 1.596 1.00 0.00 H new ATOM 0 HD13 LEU A 29 13.175 -0.406 2.885 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.956 -2.538 2.752 1.00 0.00 H new ATOM 0 HD22 LEU A 29 11.572 -1.846 4.271 1.00 0.00 H new ATOM 0 HD23 LEU A 29 9.832 -1.780 3.904 1.00 0.00 H new ATOM 471 N VAL A 30 10.379 2.404 0.835 1.00 0.00 N ATOM 472 CA VAL A 30 9.459 2.563 -0.286 1.00 0.00 C ATOM 473 C VAL A 30 9.584 1.392 -1.257 1.00 0.00 C ATOM 474 O VAL A 30 10.647 1.151 -1.825 1.00 0.00 O ATOM 475 CB VAL A 30 9.718 3.885 -1.040 1.00 0.00 C ATOM 476 CG1 VAL A 30 8.708 4.081 -2.164 1.00 0.00 C ATOM 477 CG2 VAL A 30 9.685 5.062 -0.077 1.00 0.00 C ATOM 0 H VAL A 30 11.364 2.357 0.576 1.00 0.00 H new ATOM 0 HA VAL A 30 8.449 2.586 0.123 1.00 0.00 H new ATOM 0 HB VAL A 30 10.711 3.831 -1.487 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.914 5.020 -2.678 1.00 0.00 H new ATOM 0 HG12 VAL A 30 8.786 3.255 -2.871 1.00 0.00 H new ATOM 0 HG13 VAL A 30 7.701 4.109 -1.748 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.869 5.986 -0.625 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.707 5.113 0.402 1.00 0.00 H new ATOM 0 HG23 VAL A 30 10.455 4.932 0.684 1.00 0.00 H new ATOM 487 N VAL A 31 8.483 0.672 -1.439 1.00 0.00 N ATOM 488 CA VAL A 31 8.453 -0.474 -2.339 1.00 0.00 C ATOM 489 C VAL A 31 7.259 -0.380 -3.288 1.00 0.00 C ATOM 490 O VAL A 31 6.130 -0.156 -2.851 1.00 0.00 O ATOM 491 CB VAL A 31 8.385 -1.802 -1.551 1.00 0.00 C ATOM 492 CG1 VAL A 31 8.358 -3.002 -2.489 1.00 0.00 C ATOM 493 CG2 VAL A 31 9.552 -1.903 -0.581 1.00 0.00 C ATOM 0 H VAL A 31 7.596 0.863 -0.973 1.00 0.00 H new ATOM 0 HA VAL A 31 9.376 -0.461 -2.919 1.00 0.00 H new ATOM 0 HB VAL A 31 7.456 -1.808 -0.980 1.00 0.00 H new ATOM 0 HG11 VAL A 31 8.310 -3.920 -1.904 1.00 0.00 H new ATOM 0 HG12 VAL A 31 7.483 -2.938 -3.136 1.00 0.00 H new ATOM 0 HG13 VAL A 31 9.261 -3.007 -3.099 1.00 0.00 H new ATOM 0 HG21 VAL A 31 9.490 -2.844 -0.034 1.00 0.00 H new ATOM 0 HG22 VAL A 31 10.490 -1.867 -1.135 1.00 0.00 H new ATOM 0 HG23 VAL A 31 9.514 -1.071 0.122 1.00 0.00 H new ATOM 503 N GLY A 32 7.508 -0.549 -4.584 1.00 0.00 N ATOM 504 CA GLY A 32 6.426 -0.481 -5.551 1.00 0.00 C ATOM 505 C GLY A 32 6.897 -0.136 -6.949 1.00 0.00 C ATOM 506 O GLY A 32 8.098 -0.043 -7.207 1.00 0.00 O ATOM 0 H GLY A 32 8.431 -0.730 -4.979 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.908 -1.440 -5.575 1.00 0.00 H new ATOM 0 HA3 GLY A 32 5.701 0.265 -5.224 1.00 0.00 H new ATOM 510 N HIS A 33 5.941 0.058 -7.851 1.00 0.00 N ATOM 511 CA HIS A 33 6.244 0.400 -9.235 1.00 0.00 C ATOM 512 C HIS A 33 5.627 1.746 -9.596 1.00 0.00 C ATOM 513 O HIS A 33 4.478 2.022 -9.252 1.00 0.00 O ATOM 514 CB HIS A 33 5.707 -0.677 -10.181 1.00 0.00 C ATOM 515 CG HIS A 33 6.368 -2.011 -10.019 1.00 0.00 C ATOM 516 ND1 HIS A 33 7.521 -2.366 -10.686 1.00 0.00 N ATOM 517 CD2 HIS A 33 6.023 -3.085 -9.269 1.00 0.00 C ATOM 518 CE1 HIS A 33 7.855 -3.600 -10.355 1.00 0.00 C ATOM 519 NE2 HIS A 33 6.964 -4.058 -9.496 1.00 0.00 N ATOM 0 H HIS A 33 4.945 -0.016 -7.646 1.00 0.00 H new ATOM 0 HA HIS A 33 7.327 0.462 -9.341 1.00 0.00 H new ATOM 0 HB2 HIS A 33 4.636 -0.791 -10.015 1.00 0.00 H new ATOM 0 HB3 HIS A 33 5.837 -0.341 -11.210 1.00 0.00 H new ATOM 0 HD2 HIS A 33 5.167 -3.161 -8.615 1.00 0.00 H new ATOM 0 HE1 HIS A 33 8.712 -4.143 -10.725 1.00 0.00 H new ATOM 0 HE2 HIS A 33 6.973 -4.985 -9.070 1.00 0.00 H new ATOM 528 N LYS A 34 6.392 2.581 -10.290 1.00 0.00 N ATOM 529 CA LYS A 34 5.908 3.896 -10.693 1.00 0.00 C ATOM 530 C LYS A 34 4.681 3.768 -11.590 1.00 0.00 C ATOM 531 O LYS A 34 3.728 4.538 -11.472 1.00 0.00 O ATOM 532 CB LYS A 34 7.010 4.665 -11.425 1.00 0.00 C ATOM 533 CG LYS A 34 8.152 5.097 -10.520 1.00 0.00 C ATOM 534 CD LYS A 34 9.217 5.860 -11.294 1.00 0.00 C ATOM 535 CE LYS A 34 9.979 4.944 -12.239 1.00 0.00 C ATOM 536 NZ LYS A 34 10.957 5.695 -13.072 1.00 0.00 N ATOM 0 H LYS A 34 7.346 2.372 -10.584 1.00 0.00 H new ATOM 0 HA LYS A 34 5.626 4.445 -9.795 1.00 0.00 H new ATOM 0 HB2 LYS A 34 7.407 4.041 -12.225 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.576 5.547 -11.895 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.764 5.724 -9.717 1.00 0.00 H new ATOM 0 HG3 LYS A 34 8.599 4.220 -10.052 1.00 0.00 H new ATOM 0 HD2 LYS A 34 8.750 6.664 -11.862 1.00 0.00 H new ATOM 0 HD3 LYS A 34 9.913 6.325 -10.596 1.00 0.00 H new ATOM 0 HE2 LYS A 34 10.503 4.182 -11.662 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.274 4.424 -12.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 11.455 5.035 -13.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 10.454 6.405 -13.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 11.646 6.171 -12.455 1.00 0.00 H new ATOM 550 N SER A 35 4.716 2.786 -12.485 1.00 0.00 N ATOM 551 CA SER A 35 3.612 2.548 -13.408 1.00 0.00 C ATOM 552 C SER A 35 2.331 2.183 -12.663 1.00 0.00 C ATOM 553 O SER A 35 1.243 2.621 -13.034 1.00 0.00 O ATOM 554 CB SER A 35 3.978 1.434 -14.392 1.00 0.00 C ATOM 555 OG SER A 35 4.038 0.177 -13.741 1.00 0.00 O ATOM 0 H SER A 35 5.499 2.141 -12.591 1.00 0.00 H new ATOM 0 HA SER A 35 3.432 3.472 -13.958 1.00 0.00 H new ATOM 0 HB2 SER A 35 3.241 1.397 -15.194 1.00 0.00 H new ATOM 0 HB3 SER A 35 4.941 1.654 -14.854 1.00 0.00 H new ATOM 0 HG SER A 35 3.134 -0.101 -13.483 1.00 0.00 H new ATOM 561 N TYR A 36 2.464 1.371 -11.616 1.00 0.00 N ATOM 562 CA TYR A 36 1.306 0.943 -10.837 1.00 0.00 C ATOM 563 C TYR A 36 1.017 1.910 -9.691 1.00 0.00 C ATOM 564 O TYR A 36 0.074 2.695 -9.758 1.00 0.00 O ATOM 565 CB TYR A 36 1.536 -0.464 -10.285 1.00 0.00 C ATOM 566 CG TYR A 36 1.688 -1.518 -11.357 1.00 0.00 C ATOM 567 CD1 TYR A 36 0.584 -2.200 -11.850 1.00 0.00 C ATOM 568 CD2 TYR A 36 2.939 -1.833 -11.875 1.00 0.00 C ATOM 569 CE1 TYR A 36 0.719 -3.165 -12.831 1.00 0.00 C ATOM 570 CE2 TYR A 36 3.082 -2.796 -12.857 1.00 0.00 C ATOM 571 CZ TYR A 36 1.970 -3.458 -13.331 1.00 0.00 C ATOM 572 OH TYR A 36 2.109 -4.417 -14.308 1.00 0.00 O ATOM 0 H TYR A 36 3.356 0.999 -11.290 1.00 0.00 H new ATOM 0 HA TYR A 36 0.441 0.936 -11.500 1.00 0.00 H new ATOM 0 HB2 TYR A 36 2.431 -0.459 -9.663 1.00 0.00 H new ATOM 0 HB3 TYR A 36 0.700 -0.733 -9.639 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -0.397 -1.973 -11.461 1.00 0.00 H new ATOM 0 HD2 TYR A 36 3.813 -1.318 -11.505 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -0.150 -3.686 -13.203 1.00 0.00 H new ATOM 0 HE2 TYR A 36 4.060 -3.028 -13.251 1.00 0.00 H new ATOM 0 HH TYR A 36 3.055 -4.502 -14.551 1.00 0.00 H new ATOM 582 N GLY A 37 1.833 1.850 -8.642 1.00 0.00 N ATOM 583 CA GLY A 37 1.635 2.729 -7.504 1.00 0.00 C ATOM 584 C GLY A 37 2.729 2.596 -6.463 1.00 0.00 C ATOM 585 O GLY A 37 3.296 1.520 -6.279 1.00 0.00 O ATOM 0 H GLY A 37 2.624 1.211 -8.560 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.593 3.761 -7.851 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.672 2.508 -7.043 1.00 0.00 H new ATOM 589 N LYS A 38 3.024 3.699 -5.782 1.00 0.00 N ATOM 590 CA LYS A 38 4.058 3.713 -4.751 1.00 0.00 C ATOM 591 C LYS A 38 3.451 3.619 -3.353 1.00 0.00 C ATOM 592 O LYS A 38 2.431 4.243 -3.065 1.00 0.00 O ATOM 593 CB LYS A 38 4.903 4.983 -4.865 1.00 0.00 C ATOM 594 CG LYS A 38 4.105 6.263 -4.683 1.00 0.00 C ATOM 595 CD LYS A 38 4.990 7.492 -4.807 1.00 0.00 C ATOM 596 CE LYS A 38 4.193 8.774 -4.621 1.00 0.00 C ATOM 597 NZ LYS A 38 4.260 9.649 -5.824 1.00 0.00 N ATOM 0 H LYS A 38 2.561 4.597 -5.925 1.00 0.00 H new ATOM 0 HA LYS A 38 4.693 2.841 -4.906 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.696 4.950 -4.118 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.386 5.002 -5.842 1.00 0.00 H new ATOM 0 HG2 LYS A 38 3.312 6.308 -5.429 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.623 6.257 -3.705 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.785 7.446 -4.063 1.00 0.00 H new ATOM 0 HD3 LYS A 38 5.469 7.499 -5.786 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.153 8.527 -4.409 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.574 9.316 -3.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.704 10.512 -5.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 5.250 9.906 -6.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.872 9.141 -6.645 1.00 0.00 H new ATOM 611 N ILE A 39 4.089 2.840 -2.484 1.00 0.00 N ATOM 612 CA ILE A 39 3.620 2.673 -1.112 1.00 0.00 C ATOM 613 C ILE A 39 4.763 2.900 -0.123 1.00 0.00 C ATOM 614 O ILE A 39 5.895 2.482 -0.366 1.00 0.00 O ATOM 615 CB ILE A 39 3.006 1.273 -0.888 1.00 0.00 C ATOM 616 CG1 ILE A 39 2.398 1.175 0.512 1.00 0.00 C ATOM 617 CG2 ILE A 39 4.048 0.182 -1.097 1.00 0.00 C ATOM 618 CD1 ILE A 39 1.479 -0.014 0.691 1.00 0.00 C ATOM 0 H ILE A 39 4.934 2.314 -2.706 1.00 0.00 H new ATOM 0 HA ILE A 39 2.842 3.417 -0.941 1.00 0.00 H new ATOM 0 HB ILE A 39 2.213 1.127 -1.622 1.00 0.00 H new ATOM 0 HG12 ILE A 39 3.202 1.116 1.245 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.842 2.089 0.722 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.591 -0.794 -0.933 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.433 0.236 -2.115 1.00 0.00 H new ATOM 0 HG23 ILE A 39 4.867 0.322 -0.392 1.00 0.00 H new ATOM 0 HD11 ILE A 39 1.085 -0.019 1.707 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.654 0.054 -0.018 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.036 -0.934 0.513 1.00 0.00 H new ATOM 630 N GLU A 40 4.465 3.571 0.986 1.00 0.00 N ATOM 631 CA GLU A 40 5.480 3.856 1.998 1.00 0.00 C ATOM 632 C GLU A 40 5.078 3.284 3.353 1.00 0.00 C ATOM 633 O GLU A 40 3.999 3.578 3.868 1.00 0.00 O ATOM 634 CB GLU A 40 5.693 5.369 2.112 1.00 0.00 C ATOM 635 CG GLU A 40 6.737 5.766 3.145 1.00 0.00 C ATOM 636 CD GLU A 40 6.929 7.269 3.238 1.00 0.00 C ATOM 637 OE1 GLU A 40 6.394 7.995 2.373 1.00 0.00 O ATOM 638 OE2 GLU A 40 7.611 7.721 4.182 1.00 0.00 O ATOM 0 H GLU A 40 3.535 3.926 1.207 1.00 0.00 H new ATOM 0 HA GLU A 40 6.412 3.381 1.690 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.992 5.759 1.139 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.745 5.842 2.367 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.441 5.381 4.121 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.688 5.297 2.892 1.00 0.00 H new ATOM 646 N PHE A 41 5.958 2.467 3.924 1.00 0.00 N ATOM 647 CA PHE A 41 5.705 1.851 5.220 1.00 0.00 C ATOM 648 C PHE A 41 6.609 2.434 6.301 1.00 0.00 C ATOM 649 O PHE A 41 7.834 2.376 6.193 1.00 0.00 O ATOM 650 CB PHE A 41 5.909 0.338 5.132 1.00 0.00 C ATOM 651 CG PHE A 41 4.883 -0.359 4.283 1.00 0.00 C ATOM 652 CD1 PHE A 41 5.094 -0.536 2.925 1.00 0.00 C ATOM 653 CD2 PHE A 41 3.709 -0.836 4.843 1.00 0.00 C ATOM 654 CE1 PHE A 41 4.153 -1.175 2.142 1.00 0.00 C ATOM 655 CE2 PHE A 41 2.764 -1.477 4.065 1.00 0.00 C ATOM 656 CZ PHE A 41 2.987 -1.648 2.713 1.00 0.00 C ATOM 0 H PHE A 41 6.855 2.216 3.507 1.00 0.00 H new ATOM 0 HA PHE A 41 4.671 2.063 5.494 1.00 0.00 H new ATOM 0 HB2 PHE A 41 6.901 0.136 4.727 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.883 -0.083 6.137 1.00 0.00 H new ATOM 0 HD1 PHE A 41 6.005 -0.170 2.474 1.00 0.00 H new ATOM 0 HD2 PHE A 41 3.530 -0.705 5.900 1.00 0.00 H new ATOM 0 HE1 PHE A 41 4.328 -1.305 1.084 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.853 -1.844 4.514 1.00 0.00 H new ATOM 0 HZ PHE A 41 2.251 -2.151 2.103 1.00 0.00 H new ATOM 666 N LEU A 42 6.003 2.974 7.356 1.00 0.00 N ATOM 667 CA LEU A 42 6.769 3.541 8.466 1.00 0.00 C ATOM 668 C LEU A 42 6.842 2.562 9.635 1.00 0.00 C ATOM 669 O LEU A 42 7.288 2.903 10.731 1.00 0.00 O ATOM 670 CB LEU A 42 6.163 4.869 8.921 1.00 0.00 C ATOM 671 CG LEU A 42 6.114 5.959 7.850 1.00 0.00 C ATOM 672 CD1 LEU A 42 5.494 7.230 8.409 1.00 0.00 C ATOM 673 CD2 LEU A 42 7.510 6.238 7.312 1.00 0.00 C ATOM 0 H LEU A 42 4.991 3.031 7.467 1.00 0.00 H new ATOM 0 HA LEU A 42 7.783 3.727 8.112 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.149 4.685 9.277 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.737 5.241 9.770 1.00 0.00 H new ATOM 0 HG LEU A 42 5.491 5.607 7.028 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.468 7.994 7.632 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.479 7.021 8.747 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.090 7.587 9.249 1.00 0.00 H new ATOM 0 HD21 LEU A 42 7.458 7.016 6.551 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.154 6.570 8.126 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.919 5.328 6.873 1.00 0.00 H new ATOM 685 N GLU A 43 6.402 1.347 9.372 1.00 0.00 N ATOM 686 CA GLU A 43 6.399 0.272 10.358 1.00 0.00 C ATOM 687 C GLU A 43 7.797 -0.341 10.499 1.00 0.00 C ATOM 688 O GLU A 43 8.755 0.155 9.907 1.00 0.00 O ATOM 689 CB GLU A 43 5.388 -0.801 9.941 1.00 0.00 C ATOM 690 CG GLU A 43 5.698 -1.438 8.596 1.00 0.00 C ATOM 691 CD GLU A 43 5.692 -2.952 8.653 1.00 0.00 C ATOM 692 OE1 GLU A 43 4.956 -3.574 7.857 1.00 0.00 O ATOM 693 OE2 GLU A 43 6.422 -3.518 9.494 1.00 0.00 O ATOM 0 H GLU A 43 6.033 1.071 8.462 1.00 0.00 H new ATOM 0 HA GLU A 43 6.112 0.683 11.326 1.00 0.00 H new ATOM 0 HB2 GLU A 43 5.360 -1.579 10.704 1.00 0.00 H new ATOM 0 HB3 GLU A 43 4.394 -0.356 9.903 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.965 -1.103 7.862 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.674 -1.095 8.252 1.00 0.00 H new ATOM 701 N PRO A 44 7.945 -1.406 11.314 1.00 0.00 N ATOM 702 CA PRO A 44 9.214 -2.058 11.568 1.00 0.00 C ATOM 703 C PRO A 44 9.240 -3.471 10.985 1.00 0.00 C ATOM 704 O PRO A 44 8.961 -4.457 11.671 1.00 0.00 O ATOM 705 CB PRO A 44 9.163 -2.130 13.089 1.00 0.00 C ATOM 706 CG PRO A 44 7.710 -2.406 13.394 1.00 0.00 C ATOM 707 CD PRO A 44 6.918 -2.035 12.150 1.00 0.00 C ATOM 0 HA PRO A 44 10.079 -1.552 11.140 1.00 0.00 H new ATOM 0 HB2 PRO A 44 9.808 -2.920 13.473 1.00 0.00 H new ATOM 0 HB3 PRO A 44 9.496 -1.197 13.544 1.00 0.00 H new ATOM 0 HG2 PRO A 44 7.561 -3.456 13.647 1.00 0.00 H new ATOM 0 HG3 PRO A 44 7.378 -1.821 14.252 1.00 0.00 H new ATOM 0 HD2 PRO A 44 6.479 -2.909 11.669 1.00 0.00 H new ATOM 0 HD3 PRO A 44 6.100 -1.351 12.376 1.00 0.00 H new ATOM 715 N VAL A 45 9.542 -3.543 9.693 1.00 0.00 N ATOM 716 CA VAL A 45 9.577 -4.803 8.962 1.00 0.00 C ATOM 717 C VAL A 45 10.714 -5.714 9.415 1.00 0.00 C ATOM 718 O VAL A 45 11.817 -5.651 8.874 1.00 0.00 O ATOM 719 CB VAL A 45 9.705 -4.569 7.444 1.00 0.00 C ATOM 720 CG1 VAL A 45 9.488 -5.866 6.680 1.00 0.00 C ATOM 721 CG2 VAL A 45 8.727 -3.501 6.977 1.00 0.00 C ATOM 0 H VAL A 45 9.770 -2.728 9.123 1.00 0.00 H new ATOM 0 HA VAL A 45 8.630 -5.297 9.181 1.00 0.00 H new ATOM 0 HB VAL A 45 10.716 -4.217 7.240 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.583 -5.678 5.610 1.00 0.00 H new ATOM 0 HG12 VAL A 45 10.234 -6.599 6.987 1.00 0.00 H new ATOM 0 HG13 VAL A 45 8.491 -6.252 6.894 1.00 0.00 H new ATOM 0 HG21 VAL A 45 8.836 -3.353 5.903 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.708 -3.819 7.198 1.00 0.00 H new ATOM 0 HG23 VAL A 45 8.936 -2.565 7.495 1.00 0.00 H new ATOM 731 N ASP A 46 10.436 -6.565 10.402 1.00 0.00 N ATOM 732 CA ASP A 46 11.435 -7.504 10.906 1.00 0.00 C ATOM 733 C ASP A 46 11.899 -8.429 9.782 1.00 0.00 C ATOM 734 O ASP A 46 11.338 -9.505 9.583 1.00 0.00 O ATOM 735 CB ASP A 46 10.851 -8.331 12.053 1.00 0.00 C ATOM 736 CG ASP A 46 10.621 -7.505 13.305 1.00 0.00 C ATOM 737 OD1 ASP A 46 9.821 -7.938 14.161 1.00 0.00 O ATOM 738 OD2 ASP A 46 11.239 -6.428 13.429 1.00 0.00 O ATOM 0 H ASP A 46 9.530 -6.623 10.867 1.00 0.00 H new ATOM 0 HA ASP A 46 12.290 -6.939 11.277 1.00 0.00 H new ATOM 0 HB2 ASP A 46 9.907 -8.773 11.734 1.00 0.00 H new ATOM 0 HB3 ASP A 46 11.527 -9.155 12.284 1.00 0.00 H new ATOM 744 N LEU A 47 12.910 -7.989 9.034 1.00 0.00 N ATOM 745 CA LEU A 47 13.424 -8.770 7.913 1.00 0.00 C ATOM 746 C LEU A 47 14.700 -9.526 8.275 1.00 0.00 C ATOM 747 O LEU A 47 15.250 -10.250 7.444 1.00 0.00 O ATOM 748 CB LEU A 47 13.691 -7.853 6.719 1.00 0.00 C ATOM 749 CG LEU A 47 12.443 -7.239 6.081 1.00 0.00 C ATOM 750 CD1 LEU A 47 12.831 -6.167 5.074 1.00 0.00 C ATOM 751 CD2 LEU A 47 11.601 -8.318 5.416 1.00 0.00 C ATOM 0 H LEU A 47 13.387 -7.100 9.184 1.00 0.00 H new ATOM 0 HA LEU A 47 12.665 -9.508 7.654 1.00 0.00 H new ATOM 0 HB2 LEU A 47 14.350 -7.047 7.040 1.00 0.00 H new ATOM 0 HB3 LEU A 47 14.228 -8.420 5.958 1.00 0.00 H new ATOM 0 HG LEU A 47 11.848 -6.772 6.866 1.00 0.00 H new ATOM 0 HD11 LEU A 47 11.931 -5.742 4.630 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.394 -5.381 5.578 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.447 -6.609 4.291 1.00 0.00 H new ATOM 0 HD21 LEU A 47 10.717 -7.865 4.967 1.00 0.00 H new ATOM 0 HD22 LEU A 47 12.188 -8.812 4.642 1.00 0.00 H new ATOM 0 HD23 LEU A 47 11.294 -9.051 6.162 1.00 0.00 H new ATOM 763 N ALA A 48 15.170 -9.372 9.510 1.00 0.00 N ATOM 764 CA ALA A 48 16.380 -10.064 9.944 1.00 0.00 C ATOM 765 C ALA A 48 16.199 -11.575 9.851 1.00 0.00 C ATOM 766 O ALA A 48 17.105 -12.297 9.433 1.00 0.00 O ATOM 767 CB ALA A 48 16.748 -9.656 11.362 1.00 0.00 C ATOM 0 H ALA A 48 14.738 -8.782 10.220 1.00 0.00 H new ATOM 0 HA ALA A 48 17.195 -9.776 9.280 1.00 0.00 H new ATOM 0 HB1 ALA A 48 17.652 -10.182 11.669 1.00 0.00 H new ATOM 0 HB2 ALA A 48 16.924 -8.581 11.397 1.00 0.00 H new ATOM 0 HB3 ALA A 48 15.932 -9.913 12.038 1.00 0.00 H new ATOM 773 N GLY A 49 15.014 -12.047 10.233 1.00 0.00 N ATOM 774 CA GLY A 49 14.726 -13.469 10.175 1.00 0.00 C ATOM 775 C GLY A 49 14.193 -13.890 8.819 1.00 0.00 C ATOM 776 O GLY A 49 14.696 -14.833 8.224 1.00 0.00 O ATOM 0 H GLY A 49 14.249 -11.469 10.581 1.00 0.00 H new ATOM 0 HA2 GLY A 49 15.633 -14.031 10.398 1.00 0.00 H new ATOM 0 HA3 GLY A 49 13.997 -13.722 10.945 1.00 0.00 H new ATOM 780 N ILE A 50 13.167 -13.174 8.356 1.00 0.00 N ATOM 781 CA ILE A 50 12.505 -13.414 7.063 1.00 0.00 C ATOM 782 C ILE A 50 13.389 -13.045 5.865 1.00 0.00 C ATOM 783 O ILE A 50 13.389 -11.888 5.440 1.00 0.00 O ATOM 784 CB ILE A 50 11.179 -12.637 6.951 1.00 0.00 C ATOM 785 CG1 ILE A 50 11.366 -11.186 7.392 1.00 0.00 C ATOM 786 CG2 ILE A 50 10.097 -13.312 7.780 1.00 0.00 C ATOM 787 CD1 ILE A 50 10.131 -10.332 7.203 1.00 0.00 C ATOM 0 H ILE A 50 12.762 -12.395 8.876 1.00 0.00 H new ATOM 0 HA ILE A 50 12.310 -14.486 7.034 1.00 0.00 H new ATOM 0 HB ILE A 50 10.866 -12.639 5.907 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.652 -11.169 8.444 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.190 -10.747 6.830 1.00 0.00 H new ATOM 0 HG21 ILE A 50 9.167 -12.751 7.690 1.00 0.00 H new ATOM 0 HG22 ILE A 50 9.944 -14.329 7.419 1.00 0.00 H new ATOM 0 HG23 ILE A 50 10.404 -13.340 8.825 1.00 0.00 H new ATOM 0 HD11 ILE A 50 10.337 -9.315 7.537 1.00 0.00 H new ATOM 0 HD12 ILE A 50 9.856 -10.319 6.148 1.00 0.00 H new ATOM 0 HD13 ILE A 50 9.309 -10.746 7.787 1.00 0.00 H new ATOM 799 N PRO A 51 14.169 -13.996 5.304 1.00 0.00 N ATOM 800 CA PRO A 51 15.040 -13.715 4.156 1.00 0.00 C ATOM 801 C PRO A 51 14.254 -13.447 2.874 1.00 0.00 C ATOM 802 O PRO A 51 14.560 -14.000 1.818 1.00 0.00 O ATOM 803 CB PRO A 51 15.871 -14.992 4.017 1.00 0.00 C ATOM 804 CG PRO A 51 15.010 -16.062 4.590 1.00 0.00 C ATOM 805 CD PRO A 51 14.236 -15.415 5.707 1.00 0.00 C ATOM 0 HA PRO A 51 15.637 -12.816 4.313 1.00 0.00 H new ATOM 0 HB2 PRO A 51 16.115 -15.195 2.974 1.00 0.00 H new ATOM 0 HB3 PRO A 51 16.815 -14.912 4.556 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.338 -16.469 3.834 1.00 0.00 H new ATOM 0 HG3 PRO A 51 15.612 -16.891 4.961 1.00 0.00 H new ATOM 0 HD2 PRO A 51 13.242 -15.850 5.811 1.00 0.00 H new ATOM 0 HD3 PRO A 51 14.739 -15.536 6.666 1.00 0.00 H new ATOM 813 N LEU A 52 13.241 -12.592 2.976 1.00 0.00 N ATOM 814 CA LEU A 52 12.408 -12.245 1.830 1.00 0.00 C ATOM 815 C LEU A 52 13.239 -11.612 0.721 1.00 0.00 C ATOM 816 O LEU A 52 13.022 -11.883 -0.459 1.00 0.00 O ATOM 817 CB LEU A 52 11.297 -11.282 2.249 1.00 0.00 C ATOM 818 CG LEU A 52 10.209 -11.891 3.131 1.00 0.00 C ATOM 819 CD1 LEU A 52 9.302 -10.800 3.681 1.00 0.00 C ATOM 820 CD2 LEU A 52 9.404 -12.917 2.347 1.00 0.00 C ATOM 0 H LEU A 52 12.977 -12.125 3.844 1.00 0.00 H new ATOM 0 HA LEU A 52 11.964 -13.166 1.452 1.00 0.00 H new ATOM 0 HB2 LEU A 52 11.746 -10.443 2.780 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.830 -10.877 1.351 1.00 0.00 H new ATOM 0 HG LEU A 52 10.683 -12.398 3.971 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.531 -11.249 4.308 1.00 0.00 H new ATOM 0 HD12 LEU A 52 9.892 -10.102 4.275 1.00 0.00 H new ATOM 0 HD13 LEU A 52 8.832 -10.266 2.855 1.00 0.00 H new ATOM 0 HD21 LEU A 52 8.633 -13.342 2.989 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.936 -12.434 1.489 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.066 -13.711 2.000 1.00 0.00 H new ATOM 906 N ILE A 59 6.290 -12.309 0.440 1.00 0.00 N ATOM 907 CA ILE A 59 5.264 -11.876 1.381 1.00 0.00 C ATOM 908 C ILE A 59 4.589 -10.590 0.898 1.00 0.00 C ATOM 909 O ILE A 59 3.376 -10.428 1.030 1.00 0.00 O ATOM 910 CB ILE A 59 5.848 -11.662 2.801 1.00 0.00 C ATOM 911 CG1 ILE A 59 6.451 -12.967 3.327 1.00 0.00 C ATOM 912 CG2 ILE A 59 4.779 -11.158 3.768 1.00 0.00 C ATOM 913 CD1 ILE A 59 7.087 -12.836 4.695 1.00 0.00 C ATOM 0 HA ILE A 59 4.519 -12.670 1.433 1.00 0.00 H new ATOM 0 HB ILE A 59 6.630 -10.906 2.731 1.00 0.00 H new ATOM 0 HG12 ILE A 59 5.670 -13.726 3.370 1.00 0.00 H new ATOM 0 HG13 ILE A 59 7.201 -13.321 2.620 1.00 0.00 H new ATOM 0 HG21 ILE A 59 5.219 -11.017 4.755 1.00 0.00 H new ATOM 0 HG22 ILE A 59 4.382 -10.208 3.409 1.00 0.00 H new ATOM 0 HG23 ILE A 59 3.972 -11.888 3.831 1.00 0.00 H new ATOM 0 HD11 ILE A 59 7.492 -13.800 5.002 1.00 0.00 H new ATOM 0 HD12 ILE A 59 7.891 -12.101 4.654 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.336 -12.512 5.416 1.00 0.00 H new ATOM 925 N ILE A 60 5.381 -9.677 0.343 1.00 0.00 N ATOM 926 CA ILE A 60 4.856 -8.408 -0.146 1.00 0.00 C ATOM 927 C ILE A 60 4.486 -8.510 -1.627 1.00 0.00 C ATOM 928 O ILE A 60 5.334 -8.800 -2.472 1.00 0.00 O ATOM 929 CB ILE A 60 5.880 -7.264 0.059 1.00 0.00 C ATOM 930 CG1 ILE A 60 6.210 -7.116 1.546 1.00 0.00 C ATOM 931 CG2 ILE A 60 5.349 -5.944 -0.490 1.00 0.00 C ATOM 932 CD1 ILE A 60 7.375 -6.190 1.816 1.00 0.00 C ATOM 0 H ILE A 60 6.387 -9.793 0.221 1.00 0.00 H new ATOM 0 HA ILE A 60 3.959 -8.179 0.430 1.00 0.00 H new ATOM 0 HB ILE A 60 6.787 -7.520 -0.489 1.00 0.00 H new ATOM 0 HG12 ILE A 60 5.330 -6.742 2.070 1.00 0.00 H new ATOM 0 HG13 ILE A 60 6.434 -8.099 1.960 1.00 0.00 H new ATOM 0 HG21 ILE A 60 6.089 -5.160 -0.332 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.152 -6.047 -1.557 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.426 -5.680 0.026 1.00 0.00 H new ATOM 0 HD11 ILE A 60 7.553 -6.132 2.890 1.00 0.00 H new ATOM 0 HD12 ILE A 60 8.267 -6.573 1.321 1.00 0.00 H new ATOM 0 HD13 ILE A 60 7.146 -5.196 1.432 1.00 0.00 H new ATOM 944 N THR A 61 3.213 -8.273 -1.928 1.00 0.00 N ATOM 945 CA THR A 61 2.722 -8.336 -3.301 1.00 0.00 C ATOM 946 C THR A 61 1.968 -7.060 -3.667 1.00 0.00 C ATOM 947 O THR A 61 1.217 -6.518 -2.856 1.00 0.00 O ATOM 948 CB THR A 61 1.812 -9.551 -3.483 1.00 0.00 C ATOM 949 OG1 THR A 61 2.487 -10.743 -3.123 1.00 0.00 O ATOM 950 CG2 THR A 61 1.313 -9.718 -4.903 1.00 0.00 C ATOM 0 H THR A 61 2.501 -8.035 -1.238 1.00 0.00 H new ATOM 0 HA THR A 61 3.581 -8.432 -3.965 1.00 0.00 H new ATOM 0 HB THR A 61 0.956 -9.370 -2.832 1.00 0.00 H new ATOM 0 HG1 THR A 61 1.887 -11.508 -3.245 1.00 0.00 H new ATOM 0 HG21 THR A 61 0.673 -10.598 -4.963 1.00 0.00 H new ATOM 0 HG22 THR A 61 0.744 -8.835 -5.195 1.00 0.00 H new ATOM 0 HG23 THR A 61 2.162 -9.841 -5.575 1.00 0.00 H new ATOM 958 N PHE A 62 2.173 -6.585 -4.892 1.00 0.00 N ATOM 959 CA PHE A 62 1.512 -5.372 -5.361 1.00 0.00 C ATOM 960 C PHE A 62 0.988 -5.550 -6.783 1.00 0.00 C ATOM 961 O PHE A 62 1.434 -6.434 -7.515 1.00 0.00 O ATOM 962 CB PHE A 62 2.472 -4.180 -5.304 1.00 0.00 C ATOM 963 CG PHE A 62 1.836 -2.878 -5.709 1.00 0.00 C ATOM 964 CD1 PHE A 62 1.850 -2.464 -7.031 1.00 0.00 C ATOM 965 CD2 PHE A 62 1.224 -2.069 -4.764 1.00 0.00 C ATOM 966 CE1 PHE A 62 1.264 -1.268 -7.403 1.00 0.00 C ATOM 967 CE2 PHE A 62 0.637 -0.872 -5.131 1.00 0.00 C ATOM 968 CZ PHE A 62 0.657 -0.472 -6.453 1.00 0.00 C ATOM 0 H PHE A 62 2.791 -7.021 -5.577 1.00 0.00 H new ATOM 0 HA PHE A 62 0.666 -5.177 -4.702 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.861 -4.085 -4.290 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.323 -4.378 -5.955 1.00 0.00 H new ATOM 0 HD1 PHE A 62 2.324 -3.082 -7.779 1.00 0.00 H new ATOM 0 HD2 PHE A 62 1.206 -2.377 -3.729 1.00 0.00 H new ATOM 0 HE1 PHE A 62 1.281 -0.957 -8.437 1.00 0.00 H new ATOM 0 HE2 PHE A 62 0.164 -0.251 -4.385 1.00 0.00 H new ATOM 0 HZ PHE A 62 0.198 0.462 -6.743 1.00 0.00 H new ATOM 978 N GLU A 63 0.035 -4.706 -7.161 1.00 0.00 N ATOM 979 CA GLU A 63 -0.561 -4.764 -8.491 1.00 0.00 C ATOM 980 C GLU A 63 -1.257 -3.438 -8.817 1.00 0.00 C ATOM 981 O GLU A 63 -1.153 -2.484 -8.051 1.00 0.00 O ATOM 982 CB GLU A 63 -1.558 -5.926 -8.548 1.00 0.00 C ATOM 983 CG GLU A 63 -0.921 -7.256 -8.917 1.00 0.00 C ATOM 984 CD GLU A 63 -1.931 -8.262 -9.435 1.00 0.00 C ATOM 985 OE1 GLU A 63 -2.209 -8.250 -10.653 1.00 0.00 O ATOM 986 OE2 GLU A 63 -2.442 -9.062 -8.625 1.00 0.00 O ATOM 0 H GLU A 63 -0.343 -3.971 -6.563 1.00 0.00 H new ATOM 0 HA GLU A 63 0.220 -4.928 -9.233 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.046 -6.023 -7.578 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.336 -5.691 -9.274 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.156 -7.090 -9.676 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.418 -7.669 -8.043 1.00 0.00 H new ATOM 994 N PRO A 64 -1.990 -3.343 -9.943 1.00 0.00 N ATOM 995 CA PRO A 64 -2.654 -2.119 -10.342 1.00 0.00 C ATOM 996 C PRO A 64 -4.127 -2.221 -10.033 1.00 0.00 C ATOM 997 O PRO A 64 -4.946 -2.610 -10.864 1.00 0.00 O ATOM 998 CB PRO A 64 -2.423 -2.126 -11.850 1.00 0.00 C ATOM 999 CG PRO A 64 -2.422 -3.581 -12.229 1.00 0.00 C ATOM 1000 CD PRO A 64 -2.195 -4.381 -10.959 1.00 0.00 C ATOM 0 HA PRO A 64 -2.294 -1.219 -9.843 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -3.208 -1.581 -12.373 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -1.478 -1.649 -12.108 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -3.369 -3.857 -12.693 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -1.638 -3.787 -12.958 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -3.051 -5.013 -10.722 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -1.329 -5.037 -11.045 1.00 0.00 H new ATOM 1008 N LYS A 65 -4.400 -1.927 -8.761 1.00 0.00 N ATOM 1009 CA LYS A 65 -5.721 -2.022 -8.147 1.00 0.00 C ATOM 1010 C LYS A 65 -5.835 -3.392 -7.488 1.00 0.00 C ATOM 1011 O LYS A 65 -6.934 -3.876 -7.216 1.00 0.00 O ATOM 1012 CB LYS A 65 -6.869 -1.811 -9.149 1.00 0.00 C ATOM 1013 CG LYS A 65 -6.982 -0.382 -9.655 1.00 0.00 C ATOM 1014 CD LYS A 65 -8.132 -0.229 -10.637 1.00 0.00 C ATOM 1015 CE LYS A 65 -7.843 -0.936 -11.951 1.00 0.00 C ATOM 1016 NZ LYS A 65 -9.002 -0.874 -12.883 1.00 0.00 N ATOM 0 H LYS A 65 -3.683 -1.606 -8.110 1.00 0.00 H new ATOM 0 HA LYS A 65 -5.817 -1.222 -7.413 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -6.725 -2.478 -9.999 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -7.809 -2.095 -8.676 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.130 0.293 -8.812 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.049 -0.091 -10.137 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -9.043 -0.635 -10.197 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -8.313 0.829 -10.825 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.973 -0.481 -12.424 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -7.591 -1.978 -11.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.764 -1.368 -13.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -9.826 -1.331 -12.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -9.227 0.120 -13.091 1.00 0.00 H new ATOM 1030 N THR A 66 -4.671 -4.014 -7.231 1.00 0.00 N ATOM 1031 CA THR A 66 -4.636 -5.330 -6.601 1.00 0.00 C ATOM 1032 C THR A 66 -3.504 -5.421 -5.582 1.00 0.00 C ATOM 1033 O THR A 66 -2.332 -5.266 -5.924 1.00 0.00 O ATOM 1034 CB THR A 66 -4.473 -6.419 -7.661 1.00 0.00 C ATOM 1035 OG1 THR A 66 -5.508 -6.338 -8.626 1.00 0.00 O ATOM 1036 CG2 THR A 66 -4.491 -7.821 -7.088 1.00 0.00 C ATOM 0 H THR A 66 -3.754 -3.625 -7.450 1.00 0.00 H new ATOM 0 HA THR A 66 -5.580 -5.478 -6.077 1.00 0.00 H new ATOM 0 HB THR A 66 -3.497 -6.240 -8.111 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.386 -7.042 -9.297 1.00 0.00 H new ATOM 0 HG21 THR A 66 -4.371 -8.545 -7.894 1.00 0.00 H new ATOM 0 HG22 THR A 66 -3.674 -7.933 -6.375 1.00 0.00 H new ATOM 0 HG23 THR A 66 -5.441 -7.995 -6.582 1.00 0.00 H new ATOM 1044 N CYS A 67 -3.863 -5.683 -4.330 1.00 0.00 N ATOM 1045 CA CYS A 67 -2.879 -5.806 -3.260 1.00 0.00 C ATOM 1046 C CYS A 67 -2.952 -7.193 -2.628 1.00 0.00 C ATOM 1047 O CYS A 67 -4.032 -7.663 -2.270 1.00 0.00 O ATOM 1048 CB CYS A 67 -3.111 -4.733 -2.196 1.00 0.00 C ATOM 1049 SG CYS A 67 -2.713 -3.056 -2.740 1.00 0.00 S ATOM 0 H CYS A 67 -4.829 -5.814 -4.031 1.00 0.00 H new ATOM 0 HA CYS A 67 -1.886 -5.667 -3.688 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -4.155 -4.764 -1.885 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -2.510 -4.971 -1.318 1.00 0.00 H new ATOM 0 HG CYS A 67 -2.944 -2.219 -1.772 1.00 0.00 H new ATOM 1055 N ILE A 68 -1.804 -7.848 -2.499 1.00 0.00 N ATOM 1056 CA ILE A 68 -1.754 -9.182 -1.914 1.00 0.00 C ATOM 1057 C ILE A 68 -0.919 -9.187 -0.636 1.00 0.00 C ATOM 1058 O ILE A 68 0.268 -8.860 -0.657 1.00 0.00 O ATOM 1059 CB ILE A 68 -1.170 -10.203 -2.915 1.00 0.00 C ATOM 1060 CG1 ILE A 68 -1.963 -10.173 -4.222 1.00 0.00 C ATOM 1061 CG2 ILE A 68 -1.178 -11.608 -2.325 1.00 0.00 C ATOM 1062 CD1 ILE A 68 -3.427 -10.511 -4.049 1.00 0.00 C ATOM 0 H ILE A 68 -0.899 -7.479 -2.790 1.00 0.00 H new ATOM 0 HA ILE A 68 -2.777 -9.470 -1.670 1.00 0.00 H new ATOM 0 HB ILE A 68 -0.136 -9.926 -3.122 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.878 -9.181 -4.667 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -1.517 -10.877 -4.924 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -0.762 -12.309 -3.049 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -0.576 -11.625 -1.416 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.202 -11.897 -2.087 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -3.927 -10.470 -5.017 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -3.522 -11.514 -3.634 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.889 -9.793 -3.372 1.00 0.00 H new ATOM 1074 N ILE A 69 -1.547 -9.562 0.474 1.00 0.00 N ATOM 1075 CA ILE A 69 -0.862 -9.615 1.760 1.00 0.00 C ATOM 1076 C ILE A 69 -1.294 -10.834 2.569 1.00 0.00 C ATOM 1077 O ILE A 69 -0.489 -11.444 3.275 1.00 0.00 O ATOM 1078 CB ILE A 69 -1.121 -8.339 2.588 1.00 0.00 C ATOM 1079 CG1 ILE A 69 -2.618 -8.169 2.858 1.00 0.00 C ATOM 1080 CG2 ILE A 69 -0.566 -7.120 1.867 1.00 0.00 C ATOM 1081 CD1 ILE A 69 -2.931 -7.079 3.861 1.00 0.00 C ATOM 0 H ILE A 69 -2.530 -9.834 0.508 1.00 0.00 H new ATOM 0 HA ILE A 69 0.204 -9.689 1.546 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.610 -8.437 3.546 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.125 -7.945 1.920 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -3.023 -9.113 3.221 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.756 -6.227 2.463 1.00 0.00 H new ATOM 0 HG22 ILE A 69 0.508 -7.239 1.724 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -1.052 -7.019 0.897 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.010 -7.014 4.003 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -2.453 -7.312 4.812 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -2.556 -6.125 3.490 1.00 0.00 H new ATOM 1093 N TYR A 70 -2.574 -11.181 2.466 1.00 0.00 N ATOM 1094 CA TYR A 70 -3.122 -12.323 3.192 1.00 0.00 C ATOM 1095 C TYR A 70 -2.800 -13.644 2.492 1.00 0.00 C ATOM 1096 O TYR A 70 -2.997 -14.718 3.061 1.00 0.00 O ATOM 1097 CB TYR A 70 -4.636 -12.175 3.347 1.00 0.00 C ATOM 1098 CG TYR A 70 -5.042 -11.073 4.300 1.00 0.00 C ATOM 1099 CD1 TYR A 70 -5.216 -11.328 5.654 1.00 0.00 C ATOM 1100 CD2 TYR A 70 -5.253 -9.778 3.844 1.00 0.00 C ATOM 1101 CE1 TYR A 70 -5.586 -10.324 6.528 1.00 0.00 C ATOM 1102 CE2 TYR A 70 -5.623 -8.768 4.712 1.00 0.00 C ATOM 1103 CZ TYR A 70 -5.789 -9.045 6.052 1.00 0.00 C ATOM 1104 OH TYR A 70 -6.157 -8.043 6.919 1.00 0.00 O ATOM 0 H TYR A 70 -3.252 -10.687 1.886 1.00 0.00 H new ATOM 0 HA TYR A 70 -2.656 -12.341 4.177 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -5.075 -11.978 2.369 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -5.051 -13.120 3.699 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -5.059 -12.328 6.030 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -5.126 -9.557 2.795 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -5.716 -10.539 7.578 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -5.781 -7.766 4.342 1.00 0.00 H new ATOM 0 HH TYR A 70 -6.258 -7.203 6.424 1.00 0.00 H new ATOM 1114 N ALA A 71 -2.312 -13.562 1.259 1.00 0.00 N ATOM 1115 CA ALA A 71 -1.976 -14.757 0.493 1.00 0.00 C ATOM 1116 C ALA A 71 -0.910 -15.585 1.203 1.00 0.00 C ATOM 1117 O ALA A 71 -0.978 -16.814 1.225 1.00 0.00 O ATOM 1118 CB ALA A 71 -1.504 -14.374 -0.902 1.00 0.00 C ATOM 0 H ALA A 71 -2.141 -12.684 0.770 1.00 0.00 H new ATOM 0 HA ALA A 71 -2.875 -15.367 0.408 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.257 -15.275 -1.463 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.296 -13.832 -1.418 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.621 -13.740 -0.826 1.00 0.00 H new ATOM 1124 N ASN A 72 0.072 -14.905 1.786 1.00 0.00 N ATOM 1125 CA ASN A 72 1.152 -15.581 2.500 1.00 0.00 C ATOM 1126 C ASN A 72 0.860 -15.670 4.000 1.00 0.00 C ATOM 1127 O ASN A 72 1.551 -16.380 4.718 1.00 0.00 O ATOM 1128 CB ASN A 72 2.475 -14.850 2.273 1.00 0.00 C ATOM 1129 CG ASN A 72 2.979 -14.994 0.851 1.00 0.00 C ATOM 1130 OD1 ASN A 72 3.251 -14.003 0.173 1.00 0.00 O ATOM 1131 ND2 ASN A 72 3.106 -16.233 0.390 1.00 0.00 N ATOM 0 H ASN A 72 0.143 -13.888 1.779 1.00 0.00 H new ATOM 0 HA ASN A 72 1.226 -16.595 2.107 1.00 0.00 H new ATOM 0 HB2 ASN A 72 2.347 -13.793 2.505 1.00 0.00 H new ATOM 0 HB3 ASN A 72 3.225 -15.239 2.962 1.00 0.00 H new ATOM 0 HD21 ASN A 72 3.440 -16.392 -0.560 1.00 0.00 H new ATOM 0 HD22 ASN A 72 2.869 -17.026 0.986 1.00 0.00 H new ATOM 1138 N LEU A 73 -0.160 -14.932 4.443 1.00 0.00 N ATOM 1139 CA LEU A 73 -0.595 -14.879 5.851 1.00 0.00 C ATOM 1140 C LEU A 73 -1.256 -16.184 6.324 1.00 0.00 C ATOM 1141 O LEU A 73 -2.469 -16.344 6.179 1.00 0.00 O ATOM 1142 CB LEU A 73 -1.562 -13.711 6.055 1.00 0.00 C ATOM 1143 CG LEU A 73 -1.628 -13.165 7.482 1.00 0.00 C ATOM 1144 CD1 LEU A 73 -2.139 -14.232 8.438 1.00 0.00 C ATOM 1145 CD2 LEU A 73 -0.261 -12.662 7.924 1.00 0.00 C ATOM 0 H LEU A 73 -0.720 -14.342 3.827 1.00 0.00 H new ATOM 0 HA LEU A 73 0.303 -14.737 6.453 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.275 -12.900 5.385 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -2.561 -14.031 5.758 1.00 0.00 H new ATOM 0 HG LEU A 73 -2.325 -12.327 7.498 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.179 -13.826 9.449 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.137 -14.546 8.133 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -1.467 -15.090 8.418 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -0.327 -12.277 8.942 1.00 0.00 H new ATOM 0 HD22 LEU A 73 0.456 -13.482 7.892 1.00 0.00 H new ATOM 0 HD23 LEU A 73 0.067 -11.866 7.256 1.00 0.00 H new ATOM 1157 N PRO A 74 -0.492 -17.140 6.893 1.00 0.00 N ATOM 1158 CA PRO A 74 -1.048 -18.402 7.370 1.00 0.00 C ATOM 1159 C PRO A 74 -1.536 -18.311 8.814 1.00 0.00 C ATOM 1160 O PRO A 74 -1.084 -19.057 9.684 1.00 0.00 O ATOM 1161 CB PRO A 74 0.147 -19.341 7.260 1.00 0.00 C ATOM 1162 CG PRO A 74 1.329 -18.478 7.555 1.00 0.00 C ATOM 1163 CD PRO A 74 0.957 -17.066 7.157 1.00 0.00 C ATOM 0 HA PRO A 74 -1.923 -18.721 6.804 1.00 0.00 H new ATOM 0 HB2 PRO A 74 0.071 -20.165 7.969 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.215 -19.781 6.265 1.00 0.00 H new ATOM 0 HG2 PRO A 74 1.586 -18.525 8.613 1.00 0.00 H new ATOM 0 HG3 PRO A 74 2.203 -18.818 6.999 1.00 0.00 H new ATOM 0 HD2 PRO A 74 1.182 -16.355 7.952 1.00 0.00 H new ATOM 0 HD3 PRO A 74 1.508 -16.742 6.274 1.00 0.00 H new ATOM 1171 N ASN A 75 -2.460 -17.388 9.066 1.00 0.00 N ATOM 1172 CA ASN A 75 -3.004 -17.195 10.406 1.00 0.00 C ATOM 1173 C ASN A 75 -1.897 -16.828 11.391 1.00 0.00 C ATOM 1174 O ASN A 75 -1.906 -17.272 12.531 1.00 0.00 O ATOM 1175 CB ASN A 75 -3.726 -18.462 10.873 1.00 0.00 C ATOM 1176 CG ASN A 75 -5.013 -18.712 10.109 1.00 0.00 C ATOM 1177 OD1 ASN A 75 -5.580 -17.798 9.510 1.00 0.00 O ATOM 1178 ND2 ASN A 75 -5.481 -19.953 10.130 1.00 0.00 N ATOM 0 H ASN A 75 -2.847 -16.762 8.360 1.00 0.00 H new ATOM 0 HA ASN A 75 -3.719 -16.374 10.370 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -3.063 -19.319 10.753 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.949 -18.378 11.937 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -6.344 -20.181 9.636 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -4.978 -20.679 10.640 1.00 0.00 H new ATOM 1185 N ARG A 76 -0.948 -16.022 10.911 1.00 0.00 N ATOM 1186 CA ARG A 76 0.210 -15.548 11.689 1.00 0.00 C ATOM 1187 C ARG A 76 -0.176 -14.537 12.778 1.00 0.00 C ATOM 1188 O ARG A 76 -0.219 -13.335 12.512 1.00 0.00 O ATOM 1189 CB ARG A 76 1.244 -14.922 10.752 1.00 0.00 C ATOM 1190 CG ARG A 76 2.587 -14.660 11.416 1.00 0.00 C ATOM 1191 CD ARG A 76 3.691 -15.492 10.785 1.00 0.00 C ATOM 1192 NE ARG A 76 3.555 -16.914 11.098 1.00 0.00 N ATOM 1193 CZ ARG A 76 4.582 -17.723 11.352 1.00 0.00 C ATOM 1194 NH1 ARG A 76 5.825 -17.257 11.330 1.00 0.00 N ATOM 1195 NH2 ARG A 76 4.367 -19.002 11.628 1.00 0.00 N ATOM 0 H ARG A 76 -0.958 -15.671 9.953 1.00 0.00 H new ATOM 0 HA ARG A 76 0.631 -16.418 12.192 1.00 0.00 H new ATOM 0 HB2 ARG A 76 1.393 -15.581 9.897 1.00 0.00 H new ATOM 0 HB3 ARG A 76 0.850 -13.982 10.365 1.00 0.00 H new ATOM 0 HG2 ARG A 76 2.835 -13.602 11.333 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.519 -14.889 12.479 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.674 -15.356 9.704 1.00 0.00 H new ATOM 0 HD3 ARG A 76 4.659 -15.135 11.136 1.00 0.00 H new ATOM 0 HE ARG A 76 2.616 -17.311 11.123 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.998 -16.274 11.118 1.00 0.00 H new ATOM 0 HH12 ARG A 76 6.607 -17.882 11.525 1.00 0.00 H new ATOM 0 HH21 ARG A 76 3.415 -19.367 11.646 1.00 0.00 H new ATOM 0 HH22 ARG A 76 5.154 -19.621 11.822 1.00 0.00 H new ATOM 1209 N PRO A 77 -0.461 -14.983 14.022 1.00 0.00 N ATOM 1210 CA PRO A 77 -0.831 -14.073 15.107 1.00 0.00 C ATOM 1211 C PRO A 77 0.386 -13.397 15.733 1.00 0.00 C ATOM 1212 O PRO A 77 0.386 -13.072 16.919 1.00 0.00 O ATOM 1213 CB PRO A 77 -1.505 -15.001 16.112 1.00 0.00 C ATOM 1214 CG PRO A 77 -0.810 -16.306 15.936 1.00 0.00 C ATOM 1215 CD PRO A 77 -0.414 -16.385 14.480 1.00 0.00 C ATOM 0 HA PRO A 77 -1.464 -13.254 14.766 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -1.398 -14.628 17.131 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -2.573 -15.090 15.916 1.00 0.00 H new ATOM 0 HG2 PRO A 77 0.066 -16.369 16.581 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -1.465 -17.134 16.206 1.00 0.00 H new ATOM 0 HD2 PRO A 77 0.582 -16.811 14.360 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -1.101 -17.014 13.913 1.00 0.00 H new ATOM 1223 N LYS A 78 1.422 -13.193 14.923 1.00 0.00 N ATOM 1224 CA LYS A 78 2.661 -12.563 15.384 1.00 0.00 C ATOM 1225 C LYS A 78 3.207 -13.260 16.632 1.00 0.00 C ATOM 1226 O LYS A 78 3.429 -12.630 17.668 1.00 0.00 O ATOM 1227 CB LYS A 78 2.413 -11.079 15.678 1.00 0.00 C ATOM 1228 CG LYS A 78 2.162 -10.244 14.433 1.00 0.00 C ATOM 1229 CD LYS A 78 1.929 -8.783 14.783 1.00 0.00 C ATOM 1230 CE LYS A 78 0.600 -8.585 15.492 1.00 0.00 C ATOM 1231 NZ LYS A 78 -0.300 -7.669 14.738 1.00 0.00 N ATOM 0 H LYS A 78 1.429 -13.456 13.938 1.00 0.00 H new ATOM 0 HA LYS A 78 3.405 -12.657 14.593 1.00 0.00 H new ATOM 0 HB2 LYS A 78 1.556 -10.988 16.345 1.00 0.00 H new ATOM 0 HB3 LYS A 78 3.274 -10.674 16.209 1.00 0.00 H new ATOM 0 HG2 LYS A 78 3.015 -10.327 13.759 1.00 0.00 H new ATOM 0 HG3 LYS A 78 1.295 -10.635 13.900 1.00 0.00 H new ATOM 0 HD2 LYS A 78 2.739 -8.427 15.420 1.00 0.00 H new ATOM 0 HD3 LYS A 78 1.951 -8.182 13.874 1.00 0.00 H new ATOM 0 HE2 LYS A 78 0.110 -9.550 15.621 1.00 0.00 H new ATOM 0 HE3 LYS A 78 0.777 -8.181 16.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -1.196 -7.560 15.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 0.156 -6.740 14.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -0.490 -8.067 13.796 1.00 0.00 H new ATOM 1245 N ARG A 79 3.429 -14.567 16.520 1.00 0.00 N ATOM 1246 CA ARG A 79 3.950 -15.350 17.634 1.00 0.00 C ATOM 1247 C ARG A 79 5.334 -14.860 18.050 1.00 0.00 C ATOM 1248 O ARG A 79 5.646 -14.784 19.238 1.00 0.00 O ATOM 1249 CB ARG A 79 4.015 -16.831 17.255 1.00 0.00 C ATOM 1250 CG ARG A 79 2.649 -17.484 17.121 1.00 0.00 C ATOM 1251 CD ARG A 79 2.768 -18.952 16.742 1.00 0.00 C ATOM 1252 NE ARG A 79 1.458 -19.589 16.609 1.00 0.00 N ATOM 1253 CZ ARG A 79 1.284 -20.887 16.360 1.00 0.00 C ATOM 1254 NH1 ARG A 79 2.331 -21.692 16.219 1.00 0.00 N ATOM 1255 NH2 ARG A 79 0.058 -21.382 16.254 1.00 0.00 N ATOM 0 H ARG A 79 3.256 -15.104 15.670 1.00 0.00 H new ATOM 0 HA ARG A 79 3.273 -15.225 18.479 1.00 0.00 H new ATOM 0 HB2 ARG A 79 4.552 -16.933 16.312 1.00 0.00 H new ATOM 0 HB3 ARG A 79 4.592 -17.366 18.009 1.00 0.00 H new ATOM 0 HG2 ARG A 79 2.107 -17.393 18.062 1.00 0.00 H new ATOM 0 HG3 ARG A 79 2.066 -16.958 16.365 1.00 0.00 H new ATOM 0 HD2 ARG A 79 3.312 -19.041 15.802 1.00 0.00 H new ATOM 0 HD3 ARG A 79 3.351 -19.476 17.499 1.00 0.00 H new ATOM 0 HE ARG A 79 0.628 -19.005 16.713 1.00 0.00 H new ATOM 0 HH11 ARG A 79 3.276 -21.318 16.301 1.00 0.00 H new ATOM 0 HH12 ARG A 79 2.190 -22.684 16.029 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -0.750 -20.770 16.363 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -0.076 -22.375 16.063 1.00 0.00 H new ATOM 1269 N GLY A 80 6.159 -14.524 17.062 1.00 0.00 N ATOM 1270 CA GLY A 80 7.500 -14.044 17.346 1.00 0.00 C ATOM 1271 C GLY A 80 7.758 -12.666 16.772 1.00 0.00 C ATOM 1272 O GLY A 80 8.393 -11.828 17.412 1.00 0.00 O ATOM 0 H GLY A 80 5.923 -14.576 16.071 1.00 0.00 H new ATOM 0 HA2 GLY A 80 7.652 -14.019 18.425 1.00 0.00 H new ATOM 0 HA3 GLY A 80 8.227 -14.746 16.938 1.00 0.00 H new ATOM 1276 N GLU A 81 7.267 -12.431 15.560 1.00 0.00 N ATOM 1277 CA GLU A 81 7.450 -11.146 14.895 1.00 0.00 C ATOM 1278 C GLU A 81 6.118 -10.420 14.737 1.00 0.00 C ATOM 1279 O GLU A 81 5.096 -11.035 14.431 1.00 0.00 O ATOM 1280 CB GLU A 81 8.100 -11.346 13.525 1.00 0.00 C ATOM 1281 CG GLU A 81 9.553 -11.786 13.599 1.00 0.00 C ATOM 1282 CD GLU A 81 10.175 -11.978 12.229 1.00 0.00 C ATOM 1283 OE1 GLU A 81 10.894 -11.067 11.771 1.00 0.00 O ATOM 1284 OE2 GLU A 81 9.942 -13.041 11.616 1.00 0.00 O ATOM 0 H GLU A 81 6.739 -13.114 15.018 1.00 0.00 H new ATOM 0 HA GLU A 81 8.105 -10.534 15.515 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.532 -12.091 12.968 1.00 0.00 H new ATOM 0 HB3 GLU A 81 8.040 -10.413 12.964 1.00 0.00 H new ATOM 0 HG2 GLU A 81 10.126 -11.043 14.153 1.00 0.00 H new ATOM 0 HG3 GLU A 81 9.618 -12.720 14.158 1.00 0.00 H new ATOM 1292 N GLY A 82 6.137 -9.108 14.948 1.00 0.00 N ATOM 1293 CA GLY A 82 4.926 -8.319 14.822 1.00 0.00 C ATOM 1294 C GLY A 82 4.951 -7.411 13.611 1.00 0.00 C ATOM 1295 O GLY A 82 5.918 -6.681 13.393 1.00 0.00 O ATOM 0 H GLY A 82 6.970 -8.577 15.204 1.00 0.00 H new ATOM 0 HA2 GLY A 82 4.067 -8.986 14.755 1.00 0.00 H new ATOM 0 HA3 GLY A 82 4.793 -7.717 15.721 1.00 0.00 H new ATOM 1299 N ILE A 83 3.886 -7.454 12.817 1.00 0.00 N ATOM 1300 CA ILE A 83 3.793 -6.628 11.621 1.00 0.00 C ATOM 1301 C ILE A 83 2.931 -5.394 11.884 1.00 0.00 C ATOM 1302 O ILE A 83 1.753 -5.506 12.224 1.00 0.00 O ATOM 1303 CB ILE A 83 3.207 -7.433 10.435 1.00 0.00 C ATOM 1304 CG1 ILE A 83 4.098 -8.638 10.128 1.00 0.00 C ATOM 1305 CG2 ILE A 83 3.063 -6.560 9.193 1.00 0.00 C ATOM 1306 CD1 ILE A 83 3.482 -9.611 9.146 1.00 0.00 C ATOM 0 H ILE A 83 3.076 -8.052 12.981 1.00 0.00 H new ATOM 0 HA ILE A 83 4.802 -6.307 11.360 1.00 0.00 H new ATOM 0 HB ILE A 83 2.215 -7.782 10.721 1.00 0.00 H new ATOM 0 HG12 ILE A 83 5.049 -8.284 9.729 1.00 0.00 H new ATOM 0 HG13 ILE A 83 4.318 -9.163 11.058 1.00 0.00 H new ATOM 0 HG21 ILE A 83 2.649 -7.153 8.377 1.00 0.00 H new ATOM 0 HG22 ILE A 83 2.396 -5.726 9.410 1.00 0.00 H new ATOM 0 HG23 ILE A 83 4.041 -6.176 8.903 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.169 -10.440 8.976 1.00 0.00 H new ATOM 0 HD12 ILE A 83 2.545 -9.994 9.552 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.287 -9.101 8.202 1.00 0.00 H new ATOM 1318 N ASN A 84 3.529 -4.218 11.723 1.00 0.00 N ATOM 1319 CA ASN A 84 2.820 -2.961 11.936 1.00 0.00 C ATOM 1320 C ASN A 84 2.310 -2.401 10.613 1.00 0.00 C ATOM 1321 O ASN A 84 3.006 -2.452 9.600 1.00 0.00 O ATOM 1322 CB ASN A 84 3.737 -1.943 12.617 1.00 0.00 C ATOM 1323 CG ASN A 84 4.038 -2.308 14.057 1.00 0.00 C ATOM 1324 OD1 ASN A 84 5.116 -1.751 14.596 1.00 0.00 O flip ATOM 1325 ND2 ASN A 84 3.310 -3.081 14.679 1.00 0.00 N flip ATOM 0 H ASN A 84 4.504 -4.109 11.445 1.00 0.00 H new ATOM 0 HA ASN A 84 1.965 -3.156 12.584 1.00 0.00 H new ATOM 0 HB2 ASN A 84 4.671 -1.871 12.061 1.00 0.00 H new ATOM 0 HB3 ASN A 84 3.270 -0.959 12.585 1.00 0.00 H new ATOM 0 HD21 ASN A 84 2.491 -3.486 14.226 1.00 0.00 H new ATOM 0 HD22 ASN A 84 3.525 -3.316 15.648 1.00 0.00 H new ATOM 1332 N VAL A 85 1.093 -1.867 10.626 1.00 0.00 N ATOM 1333 CA VAL A 85 0.502 -1.302 9.419 1.00 0.00 C ATOM 1334 C VAL A 85 0.516 0.223 9.461 1.00 0.00 C ATOM 1335 O VAL A 85 -0.375 0.880 8.923 1.00 0.00 O ATOM 1336 CB VAL A 85 -0.947 -1.787 9.224 1.00 0.00 C ATOM 1337 CG1 VAL A 85 -0.973 -3.263 8.862 1.00 0.00 C ATOM 1338 CG2 VAL A 85 -1.769 -1.523 10.476 1.00 0.00 C ATOM 0 H VAL A 85 0.500 -1.814 11.454 1.00 0.00 H new ATOM 0 HA VAL A 85 1.108 -1.644 8.580 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.391 -1.228 8.400 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -2.005 -3.587 8.728 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.421 -3.420 7.936 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.512 -3.842 9.662 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.790 -1.872 10.321 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.328 -2.054 11.319 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.779 -0.453 10.686 1.00 0.00 H new ATOM 1348 N ARG A 86 1.545 0.781 10.093 1.00 0.00 N ATOM 1349 CA ARG A 86 1.685 2.229 10.194 1.00 0.00 C ATOM 1350 C ARG A 86 2.277 2.794 8.905 1.00 0.00 C ATOM 1351 O ARG A 86 3.377 3.349 8.900 1.00 0.00 O ATOM 1352 CB ARG A 86 2.569 2.592 11.390 1.00 0.00 C ATOM 1353 CG ARG A 86 1.913 2.317 12.734 1.00 0.00 C ATOM 1354 CD ARG A 86 2.826 2.695 13.889 1.00 0.00 C ATOM 1355 NE ARG A 86 2.204 2.433 15.187 1.00 0.00 N ATOM 1356 CZ ARG A 86 2.761 2.744 16.356 1.00 0.00 C ATOM 1357 NH1 ARG A 86 3.953 3.328 16.400 1.00 0.00 N ATOM 1358 NH2 ARG A 86 2.125 2.468 17.487 1.00 0.00 N ATOM 0 H ARG A 86 2.293 0.252 10.542 1.00 0.00 H new ATOM 0 HA ARG A 86 0.698 2.667 10.344 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.501 2.029 11.327 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.830 3.649 11.331 1.00 0.00 H new ATOM 0 HG2 ARG A 86 0.982 2.878 12.807 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.655 1.260 12.804 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.758 2.134 13.813 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.083 3.752 13.817 1.00 0.00 H new ATOM 0 HE ARG A 86 1.288 1.985 15.197 1.00 0.00 H new ATOM 0 HH11 ARG A 86 4.449 3.541 15.534 1.00 0.00 H new ATOM 0 HH12 ARG A 86 4.373 3.563 17.299 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.210 2.018 17.461 1.00 0.00 H new ATOM 0 HH22 ARG A 86 2.551 2.706 18.383 1.00 0.00 H new ATOM 1372 N ALA A 87 1.544 2.639 7.807 1.00 0.00 N ATOM 1373 CA ALA A 87 2.005 3.119 6.510 1.00 0.00 C ATOM 1374 C ALA A 87 0.846 3.606 5.647 1.00 0.00 C ATOM 1375 O ALA A 87 -0.308 3.243 5.876 1.00 0.00 O ATOM 1376 CB ALA A 87 2.769 2.023 5.788 1.00 0.00 C ATOM 0 H ALA A 87 0.630 2.186 7.790 1.00 0.00 H new ATOM 0 HA ALA A 87 2.668 3.966 6.686 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.108 2.393 4.820 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.631 1.726 6.386 1.00 0.00 H new ATOM 0 HB3 ALA A 87 2.117 1.162 5.639 1.00 0.00 H new ATOM 1382 N ARG A 88 1.167 4.422 4.648 1.00 0.00 N ATOM 1383 CA ARG A 88 0.159 4.954 3.740 1.00 0.00 C ATOM 1384 C ARG A 88 0.283 4.293 2.371 1.00 0.00 C ATOM 1385 O ARG A 88 1.388 4.053 1.886 1.00 0.00 O ATOM 1386 CB ARG A 88 0.311 6.470 3.606 1.00 0.00 C ATOM 1387 CG ARG A 88 -0.073 7.234 4.862 1.00 0.00 C ATOM 1388 CD ARG A 88 0.096 8.732 4.676 1.00 0.00 C ATOM 1389 NE ARG A 88 1.477 9.094 4.362 1.00 0.00 N ATOM 1390 CZ ARG A 88 1.907 10.348 4.228 1.00 0.00 C ATOM 1391 NH1 ARG A 88 1.068 11.367 4.380 1.00 0.00 N ATOM 1392 NH2 ARG A 88 3.180 10.584 3.942 1.00 0.00 N ATOM 0 H ARG A 88 2.119 4.729 4.447 1.00 0.00 H new ATOM 0 HA ARG A 88 -0.827 4.736 4.149 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.345 6.702 3.352 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.306 6.817 2.777 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.108 7.013 5.121 1.00 0.00 H new ATOM 0 HG3 ARG A 88 0.543 6.898 5.696 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -0.559 9.074 3.875 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.216 9.247 5.584 1.00 0.00 H new ATOM 0 HE ARG A 88 2.153 8.340 4.238 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.088 11.192 4.601 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.404 12.324 4.276 1.00 0.00 H new ATOM 0 HH21 ARG A 88 3.829 9.806 3.825 1.00 0.00 H new ATOM 0 HH22 ARG A 88 3.510 11.544 3.839 1.00 0.00 H new ATOM 1406 N ILE A 89 -0.856 3.988 1.758 1.00 0.00 N ATOM 1407 CA ILE A 89 -0.869 3.339 0.454 1.00 0.00 C ATOM 1408 C ILE A 89 -1.241 4.318 -0.655 1.00 0.00 C ATOM 1409 O ILE A 89 -2.331 4.891 -0.652 1.00 0.00 O ATOM 1410 CB ILE A 89 -1.864 2.160 0.430 1.00 0.00 C ATOM 1411 CG1 ILE A 89 -1.628 1.237 1.626 1.00 0.00 C ATOM 1412 CG2 ILE A 89 -1.739 1.382 -0.873 1.00 0.00 C ATOM 1413 CD1 ILE A 89 -2.815 0.357 1.952 1.00 0.00 C ATOM 0 H ILE A 89 -1.781 4.180 2.144 1.00 0.00 H new ATOM 0 HA ILE A 89 0.141 2.968 0.279 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.875 2.562 0.496 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -0.763 0.606 1.423 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.383 1.842 2.499 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.448 0.554 -0.872 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.953 2.043 -1.713 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.726 0.991 -0.968 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -2.577 -0.271 2.810 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -3.677 0.981 2.187 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -3.047 -0.274 1.094 1.00 0.00 H new ATOM 1425 N THR A 90 -0.336 4.490 -1.611 1.00 0.00 N ATOM 1426 CA THR A 90 -0.574 5.382 -2.739 1.00 0.00 C ATOM 1427 C THR A 90 -0.848 4.569 -3.999 1.00 0.00 C ATOM 1428 O THR A 90 -0.012 3.772 -4.427 1.00 0.00 O ATOM 1429 CB THR A 90 0.626 6.306 -2.956 1.00 0.00 C ATOM 1430 OG1 THR A 90 0.895 7.059 -1.786 1.00 0.00 O ATOM 1431 CG2 THR A 90 0.430 7.284 -4.095 1.00 0.00 C ATOM 0 H THR A 90 0.571 4.023 -1.627 1.00 0.00 H new ATOM 0 HA THR A 90 -1.446 5.997 -2.518 1.00 0.00 H new ATOM 0 HB THR A 90 1.458 5.647 -3.203 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.666 7.643 -1.943 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.317 7.909 -4.195 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.267 6.735 -5.022 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.436 7.913 -3.889 1.00 0.00 H new ATOM 1439 N CYS A 91 -2.024 4.761 -4.583 1.00 0.00 N ATOM 1440 CA CYS A 91 -2.407 4.029 -5.784 1.00 0.00 C ATOM 1441 C CYS A 91 -2.603 4.969 -6.969 1.00 0.00 C ATOM 1442 O CYS A 91 -2.801 6.170 -6.800 1.00 0.00 O ATOM 1443 CB CYS A 91 -3.688 3.233 -5.533 1.00 0.00 C ATOM 1444 SG CYS A 91 -5.109 4.250 -5.069 1.00 0.00 S ATOM 0 H CYS A 91 -2.729 5.417 -4.245 1.00 0.00 H new ATOM 0 HA CYS A 91 -1.597 3.341 -6.027 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -3.936 2.670 -6.433 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -3.502 2.505 -4.743 1.00 0.00 H new ATOM 0 HG CYS A 91 -6.072 4.066 -5.923 1.00 0.00 H new ATOM 1450 N PHE A 92 -2.544 4.403 -8.169 1.00 0.00 N ATOM 1451 CA PHE A 92 -2.709 5.177 -9.395 1.00 0.00 C ATOM 1452 C PHE A 92 -4.189 5.451 -9.674 1.00 0.00 C ATOM 1453 O PHE A 92 -5.038 5.276 -8.800 1.00 0.00 O ATOM 1454 CB PHE A 92 -2.071 4.433 -10.577 1.00 0.00 C ATOM 1455 CG PHE A 92 -2.804 3.181 -10.978 1.00 0.00 C ATOM 1456 CD1 PHE A 92 -2.485 1.960 -10.406 1.00 0.00 C ATOM 1457 CD2 PHE A 92 -3.812 3.229 -11.928 1.00 0.00 C ATOM 1458 CE1 PHE A 92 -3.160 0.810 -10.774 1.00 0.00 C ATOM 1459 CE2 PHE A 92 -4.490 2.083 -12.299 1.00 0.00 C ATOM 1460 CZ PHE A 92 -4.162 0.872 -11.721 1.00 0.00 C ATOM 0 H PHE A 92 -2.383 3.407 -8.320 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.206 6.136 -9.267 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -2.024 5.105 -11.434 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -1.044 4.174 -10.319 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.701 1.906 -9.665 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.071 4.173 -12.384 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -2.903 -0.136 -10.320 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.275 2.134 -13.039 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.689 -0.025 -12.010 1.00 0.00 H new ATOM 1470 N ASN A 93 -4.488 5.887 -10.896 1.00 0.00 N ATOM 1471 CA ASN A 93 -5.855 6.190 -11.290 1.00 0.00 C ATOM 1472 C ASN A 93 -6.740 4.958 -11.161 1.00 0.00 C ATOM 1473 O ASN A 93 -6.717 4.061 -12.006 1.00 0.00 O ATOM 1474 CB ASN A 93 -5.891 6.711 -12.728 1.00 0.00 C ATOM 1475 CG ASN A 93 -5.075 7.977 -12.904 1.00 0.00 C ATOM 1476 OD1 ASN A 93 -4.173 8.038 -13.738 1.00 0.00 O ATOM 1477 ND2 ASN A 93 -5.391 8.999 -12.115 1.00 0.00 N ATOM 0 H ASN A 93 -3.796 6.038 -11.630 1.00 0.00 H new ATOM 0 HA ASN A 93 -6.237 6.963 -10.623 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.512 5.941 -13.400 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.924 6.905 -13.016 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -4.878 9.877 -12.188 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -6.147 8.905 -11.437 1.00 0.00 H new ATOM 1484 N CYS A 94 -7.512 4.931 -10.090 1.00 0.00 N ATOM 1485 CA CYS A 94 -8.423 3.824 -9.809 1.00 0.00 C ATOM 1486 C CYS A 94 -9.595 3.800 -10.788 1.00 0.00 C ATOM 1487 O CYS A 94 -10.324 2.816 -10.860 1.00 0.00 O ATOM 1488 CB CYS A 94 -8.946 3.919 -8.375 1.00 0.00 C ATOM 1489 SG CYS A 94 -7.700 3.574 -7.111 1.00 0.00 S ATOM 0 H CYS A 94 -7.529 5.671 -9.389 1.00 0.00 H new ATOM 0 HA CYS A 94 -7.863 2.897 -9.929 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -9.347 4.919 -8.211 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -9.774 3.220 -8.254 1.00 0.00 H new ATOM 0 HG CYS A 94 -8.211 3.773 -5.932 1.00 0.00 H new ATOM 1495 N TYR A 95 -9.771 4.899 -11.521 1.00 0.00 N ATOM 1496 CA TYR A 95 -10.857 5.037 -12.494 1.00 0.00 C ATOM 1497 C TYR A 95 -10.738 4.020 -13.633 1.00 0.00 C ATOM 1498 O TYR A 95 -9.975 4.228 -14.577 1.00 0.00 O ATOM 1499 CB TYR A 95 -10.855 6.454 -13.069 1.00 0.00 C ATOM 1500 CG TYR A 95 -12.201 7.138 -13.014 1.00 0.00 C ATOM 1501 CD1 TYR A 95 -13.330 6.545 -13.566 1.00 0.00 C ATOM 1502 CD2 TYR A 95 -12.340 8.382 -12.412 1.00 0.00 C ATOM 1503 CE1 TYR A 95 -14.560 7.173 -13.518 1.00 0.00 C ATOM 1504 CE2 TYR A 95 -13.566 9.015 -12.360 1.00 0.00 C ATOM 1505 CZ TYR A 95 -14.674 8.408 -12.915 1.00 0.00 C ATOM 1506 OH TYR A 95 -15.897 9.037 -12.866 1.00 0.00 O ATOM 0 H TYR A 95 -9.166 5.718 -11.458 1.00 0.00 H new ATOM 0 HA TYR A 95 -11.795 4.844 -11.973 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -10.129 7.056 -12.522 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -10.520 6.415 -14.106 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -13.245 5.578 -14.040 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -11.475 8.862 -11.978 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -15.428 6.699 -13.951 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -13.657 9.981 -11.887 1.00 0.00 H new ATOM 0 HH TYR A 95 -15.767 9.991 -12.682 1.00 0.00 H new ATOM 1766 N GLN A 111 -17.468 11.591 -12.481 1.00 0.00 N ATOM 1767 CA GLN A 111 -18.761 11.018 -12.836 1.00 0.00 C ATOM 1768 C GLN A 111 -19.215 10.016 -11.777 1.00 0.00 C ATOM 1769 O GLN A 111 -20.390 9.974 -11.410 1.00 0.00 O ATOM 1770 CB GLN A 111 -18.676 10.333 -14.203 1.00 0.00 C ATOM 1771 CG GLN A 111 -19.985 9.704 -14.656 1.00 0.00 C ATOM 1772 CD GLN A 111 -19.871 9.040 -16.015 1.00 0.00 C ATOM 1773 OE1 GLN A 111 -18.871 9.200 -16.716 1.00 0.00 O ATOM 1774 NE2 GLN A 111 -20.898 8.291 -16.397 1.00 0.00 N ATOM 0 HA GLN A 111 -19.493 11.824 -12.886 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -18.358 11.064 -14.946 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -17.907 9.562 -14.166 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -20.303 8.966 -13.920 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -20.759 10.471 -14.694 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -21.707 8.185 -15.785 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -20.878 7.821 -17.302 1.00 0.00 H new ATOM 1783 N LEU A 112 -18.272 9.218 -11.286 1.00 0.00 N ATOM 1784 CA LEU A 112 -18.568 8.219 -10.264 1.00 0.00 C ATOM 1785 C LEU A 112 -17.568 8.292 -9.109 1.00 0.00 C ATOM 1786 O LEU A 112 -17.535 7.412 -8.247 1.00 0.00 O ATOM 1787 CB LEU A 112 -18.555 6.819 -10.879 1.00 0.00 C ATOM 1788 CG LEU A 112 -17.227 6.399 -11.510 1.00 0.00 C ATOM 1789 CD1 LEU A 112 -16.562 5.312 -10.679 1.00 0.00 C ATOM 1790 CD2 LEU A 112 -17.445 5.923 -12.938 1.00 0.00 C ATOM 0 H LEU A 112 -17.295 9.244 -11.579 1.00 0.00 H new ATOM 0 HA LEU A 112 -19.561 8.429 -9.866 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -18.816 6.097 -10.105 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -19.334 6.766 -11.640 1.00 0.00 H new ATOM 0 HG LEU A 112 -16.566 7.265 -11.533 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -15.618 5.025 -11.143 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -16.373 5.687 -9.673 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -17.218 4.443 -10.624 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -16.490 5.628 -13.373 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -18.123 5.069 -12.938 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -17.878 6.730 -13.528 1.00 0.00 H new ATOM 1802 N VAL A 113 -16.748 9.339 -9.104 1.00 0.00 N ATOM 1803 CA VAL A 113 -15.741 9.528 -8.064 1.00 0.00 C ATOM 1804 C VAL A 113 -16.382 9.648 -6.683 1.00 0.00 C ATOM 1805 O VAL A 113 -15.862 9.122 -5.699 1.00 0.00 O ATOM 1806 CB VAL A 113 -14.882 10.781 -8.343 1.00 0.00 C ATOM 1807 CG1 VAL A 113 -13.814 10.976 -7.273 1.00 0.00 C ATOM 1808 CG2 VAL A 113 -14.250 10.697 -9.723 1.00 0.00 C ATOM 0 H VAL A 113 -16.761 10.073 -9.812 1.00 0.00 H new ATOM 0 HA VAL A 113 -15.100 8.647 -8.077 1.00 0.00 H new ATOM 0 HB VAL A 113 -15.541 11.649 -8.313 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -13.229 11.867 -7.501 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -14.291 11.095 -6.300 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -13.158 10.106 -7.251 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -13.648 11.588 -9.903 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -13.615 9.813 -9.779 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -15.033 10.630 -10.478 1.00 0.00 H new ATOM 1818 N LYS A 114 -17.500 10.363 -6.609 1.00 0.00 N ATOM 1819 CA LYS A 114 -18.186 10.569 -5.339 1.00 0.00 C ATOM 1820 C LYS A 114 -18.624 9.248 -4.717 1.00 0.00 C ATOM 1821 O LYS A 114 -18.508 9.059 -3.505 1.00 0.00 O ATOM 1822 CB LYS A 114 -19.405 11.470 -5.540 1.00 0.00 C ATOM 1823 CG LYS A 114 -19.052 12.912 -5.861 1.00 0.00 C ATOM 1824 CD LYS A 114 -20.297 13.762 -6.051 1.00 0.00 C ATOM 1825 CE LYS A 114 -19.943 15.203 -6.372 1.00 0.00 C ATOM 1826 NZ LYS A 114 -21.154 16.021 -6.661 1.00 0.00 N ATOM 0 H LYS A 114 -17.948 10.808 -7.410 1.00 0.00 H new ATOM 0 HA LYS A 114 -17.483 11.048 -4.658 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -20.015 11.066 -6.348 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -20.016 11.447 -4.637 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -18.446 13.327 -5.055 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -18.445 12.946 -6.766 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -20.903 13.347 -6.857 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -20.904 13.728 -5.146 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -19.402 15.640 -5.533 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -19.273 15.230 -7.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -20.870 16.998 -6.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -21.657 15.620 -7.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -21.782 16.017 -5.832 1.00 0.00 H new ATOM 1840 N ARG A 115 -19.120 8.333 -5.543 1.00 0.00 N ATOM 1841 CA ARG A 115 -19.566 7.034 -5.050 1.00 0.00 C ATOM 1842 C ARG A 115 -18.416 6.272 -4.397 1.00 0.00 C ATOM 1843 O ARG A 115 -18.574 5.694 -3.321 1.00 0.00 O ATOM 1844 CB ARG A 115 -20.164 6.208 -6.192 1.00 0.00 C ATOM 1845 CG ARG A 115 -21.496 6.744 -6.692 1.00 0.00 C ATOM 1846 CD ARG A 115 -22.051 5.894 -7.823 1.00 0.00 C ATOM 1847 NE ARG A 115 -22.305 4.518 -7.402 1.00 0.00 N ATOM 1848 CZ ARG A 115 -21.395 3.545 -7.447 1.00 0.00 C ATOM 1849 NH1 ARG A 115 -20.170 3.791 -7.896 1.00 0.00 N ATOM 1850 NH2 ARG A 115 -21.712 2.323 -7.042 1.00 0.00 N ATOM 0 H ARG A 115 -19.223 8.464 -6.549 1.00 0.00 H new ATOM 0 HA ARG A 115 -20.334 7.205 -4.296 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -19.457 6.183 -7.021 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -20.298 5.180 -5.855 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -22.211 6.768 -5.870 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -21.370 7.771 -7.036 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -22.977 6.338 -8.189 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -21.347 5.894 -8.655 1.00 0.00 H new ATOM 0 HE ARG A 115 -23.235 4.288 -7.052 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -19.920 4.729 -8.209 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -19.478 3.042 -7.928 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -22.652 2.128 -6.696 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -21.016 1.578 -7.076 1.00 0.00 H new ATOM 1864 N HIS A 116 -17.260 6.278 -5.055 1.00 0.00 N ATOM 1865 CA HIS A 116 -16.080 5.591 -4.538 1.00 0.00 C ATOM 1866 C HIS A 116 -15.655 6.175 -3.193 1.00 0.00 C ATOM 1867 O HIS A 116 -15.264 5.446 -2.281 1.00 0.00 O ATOM 1868 CB HIS A 116 -14.929 5.697 -5.543 1.00 0.00 C ATOM 1869 CG HIS A 116 -13.672 5.018 -5.094 1.00 0.00 C ATOM 1870 ND1 HIS A 116 -13.547 3.648 -5.006 1.00 0.00 N ATOM 1871 CD2 HIS A 116 -12.476 5.528 -4.713 1.00 0.00 C ATOM 1872 CE1 HIS A 116 -12.331 3.343 -4.588 1.00 0.00 C ATOM 1873 NE2 HIS A 116 -11.662 4.465 -4.403 1.00 0.00 N ATOM 0 H HIS A 116 -17.115 6.751 -5.947 1.00 0.00 H new ATOM 0 HA HIS A 116 -16.332 4.541 -4.391 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -15.246 5.264 -6.492 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -14.716 6.750 -5.728 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -14.280 2.974 -5.229 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -12.212 6.574 -4.662 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -11.950 2.346 -4.426 1.00 0.00 H new ATOM 1882 N ILE A 117 -15.735 7.496 -3.083 1.00 0.00 N ATOM 1883 CA ILE A 117 -15.353 8.192 -1.860 1.00 0.00 C ATOM 1884 C ILE A 117 -16.279 7.815 -0.703 1.00 0.00 C ATOM 1885 O ILE A 117 -15.831 7.647 0.431 1.00 0.00 O ATOM 1886 CB ILE A 117 -15.371 9.728 -2.067 1.00 0.00 C ATOM 1887 CG1 ILE A 117 -14.389 10.119 -3.174 1.00 0.00 C ATOM 1888 CG2 ILE A 117 -15.019 10.463 -0.776 1.00 0.00 C ATOM 1889 CD1 ILE A 117 -12.960 9.709 -2.889 1.00 0.00 C ATOM 0 H ILE A 117 -16.063 8.109 -3.830 1.00 0.00 H new ATOM 0 HA ILE A 117 -14.338 7.884 -1.611 1.00 0.00 H new ATOM 0 HB ILE A 117 -16.380 10.018 -2.359 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -14.709 9.662 -4.110 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -14.427 11.199 -3.317 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -15.040 11.538 -0.952 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -15.744 10.208 -0.003 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -14.022 10.168 -0.450 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -12.321 10.018 -3.716 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -12.621 10.187 -1.970 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -12.908 8.626 -2.776 1.00 0.00 H new ATOM 1901 N GLU A 118 -17.571 7.692 -0.992 1.00 0.00 N ATOM 1902 CA GLU A 118 -18.547 7.348 0.034 1.00 0.00 C ATOM 1903 C GLU A 118 -18.232 5.992 0.661 1.00 0.00 C ATOM 1904 O GLU A 118 -18.336 5.822 1.875 1.00 0.00 O ATOM 1905 CB GLU A 118 -19.958 7.337 -0.557 1.00 0.00 C ATOM 1906 CG GLU A 118 -20.474 8.722 -0.921 1.00 0.00 C ATOM 1907 CD GLU A 118 -21.873 8.695 -1.511 1.00 0.00 C ATOM 1908 OE1 GLU A 118 -22.468 9.781 -1.671 1.00 0.00 O ATOM 1909 OE2 GLU A 118 -22.371 7.590 -1.815 1.00 0.00 O ATOM 0 H GLU A 118 -17.964 7.825 -1.924 1.00 0.00 H new ATOM 0 HA GLU A 118 -18.494 8.106 0.815 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -19.965 6.709 -1.448 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -20.640 6.880 0.160 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -20.473 9.350 -0.030 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -19.792 9.182 -1.636 1.00 0.00 H new ATOM 1917 N ARG A 119 -17.837 5.031 -0.169 1.00 0.00 N ATOM 1918 CA ARG A 119 -17.499 3.700 0.322 1.00 0.00 C ATOM 1919 C ARG A 119 -16.230 3.752 1.167 1.00 0.00 C ATOM 1920 O ARG A 119 -16.128 3.094 2.202 1.00 0.00 O ATOM 1921 CB ARG A 119 -17.310 2.734 -0.848 1.00 0.00 C ATOM 1922 CG ARG A 119 -18.604 2.401 -1.572 1.00 0.00 C ATOM 1923 CD ARG A 119 -18.364 1.441 -2.725 1.00 0.00 C ATOM 1924 NE ARG A 119 -19.603 1.115 -3.432 1.00 0.00 N ATOM 1925 CZ ARG A 119 -19.682 0.234 -4.429 1.00 0.00 C ATOM 1926 NH1 ARG A 119 -18.600 -0.418 -4.837 1.00 0.00 N ATOM 1927 NH2 ARG A 119 -20.847 0.004 -5.018 1.00 0.00 N ATOM 0 H ARG A 119 -17.744 5.148 -1.178 1.00 0.00 H new ATOM 0 HA ARG A 119 -18.320 3.343 0.944 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -16.607 3.169 -1.558 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -16.861 1.812 -0.479 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -19.312 1.959 -0.870 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -19.058 3.318 -1.948 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -17.653 1.883 -3.423 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -17.911 0.525 -2.346 1.00 0.00 H new ATOM 0 HE ARG A 119 -20.458 1.591 -3.144 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -17.701 -0.246 -4.387 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -18.668 -1.091 -5.601 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -21.682 0.501 -4.708 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -20.908 -0.670 -5.781 1.00 0.00 H new ATOM 1941 N LEU A 120 -15.268 4.550 0.713 1.00 0.00 N ATOM 1942 CA LEU A 120 -14.000 4.713 1.415 1.00 0.00 C ATOM 1943 C LEU A 120 -14.211 5.436 2.739 1.00 0.00 C ATOM 1944 O LEU A 120 -13.587 5.114 3.749 1.00 0.00 O ATOM 1945 CB LEU A 120 -13.015 5.492 0.545 1.00 0.00 C ATOM 1946 CG LEU A 120 -12.688 4.839 -0.797 1.00 0.00 C ATOM 1947 CD1 LEU A 120 -11.703 5.691 -1.583 1.00 0.00 C ATOM 1948 CD2 LEU A 120 -12.142 3.434 -0.592 1.00 0.00 C ATOM 0 H LEU A 120 -15.344 5.097 -0.144 1.00 0.00 H new ATOM 0 HA LEU A 120 -13.589 3.725 1.621 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -13.423 6.486 0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -12.088 5.627 1.102 1.00 0.00 H new ATOM 0 HG LEU A 120 -13.610 4.765 -1.374 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -11.483 5.208 -2.535 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -12.137 6.674 -1.766 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -10.781 5.802 -1.012 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.916 2.987 -1.560 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -11.233 3.481 0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -12.886 2.826 -0.077 1.00 0.00 H new ATOM 1960 N LYS A 121 -15.089 6.432 2.708 1.00 0.00 N ATOM 1961 CA LYS A 121 -15.399 7.234 3.881 1.00 0.00 C ATOM 1962 C LYS A 121 -15.939 6.372 5.016 1.00 0.00 C ATOM 1963 O LYS A 121 -15.610 6.589 6.182 1.00 0.00 O ATOM 1964 CB LYS A 121 -16.418 8.307 3.510 1.00 0.00 C ATOM 1965 CG LYS A 121 -16.722 9.276 4.636 1.00 0.00 C ATOM 1966 CD LYS A 121 -17.737 10.316 4.202 1.00 0.00 C ATOM 1967 CE LYS A 121 -17.374 11.688 4.734 1.00 0.00 C ATOM 1968 NZ LYS A 121 -18.306 12.741 4.246 1.00 0.00 N ATOM 0 H LYS A 121 -15.604 6.704 1.870 1.00 0.00 H new ATOM 0 HA LYS A 121 -14.479 7.704 4.228 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -16.047 8.867 2.652 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -17.344 7.824 3.199 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -17.103 8.729 5.498 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -15.803 9.770 4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -17.788 10.346 3.114 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -18.727 10.034 4.560 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -17.387 11.669 5.824 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -16.357 11.936 4.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -18.021 13.663 4.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -18.275 12.778 3.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -19.274 12.519 4.556 1.00 0.00 H new ATOM 1982 N LYS A 122 -16.774 5.395 4.673 1.00 0.00 N ATOM 1983 CA LYS A 122 -17.361 4.508 5.672 1.00 0.00 C ATOM 1984 C LYS A 122 -16.294 3.647 6.353 1.00 0.00 C ATOM 1985 O LYS A 122 -16.609 2.817 7.206 1.00 0.00 O ATOM 1986 CB LYS A 122 -18.413 3.607 5.024 1.00 0.00 C ATOM 1987 CG LYS A 122 -19.428 4.369 4.187 1.00 0.00 C ATOM 1988 CD LYS A 122 -20.186 5.382 5.026 1.00 0.00 C ATOM 1989 CE LYS A 122 -21.360 5.972 4.263 1.00 0.00 C ATOM 1990 NZ LYS A 122 -22.165 6.896 5.109 1.00 0.00 N ATOM 0 H LYS A 122 -17.059 5.198 3.714 1.00 0.00 H new ATOM 0 HA LYS A 122 -17.832 5.131 6.432 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -17.912 2.872 4.394 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -18.938 3.055 5.804 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -18.919 4.879 3.369 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -20.131 3.668 3.737 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -20.546 4.904 5.937 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.511 6.181 5.331 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -20.992 6.509 3.389 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -21.997 5.167 3.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -22.956 7.277 4.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -22.538 6.378 5.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -21.564 7.679 5.437 1.00 0.00 H new ATOM 2004 N ASN A 123 -15.032 3.855 5.980 1.00 0.00 N ATOM 2005 CA ASN A 123 -13.917 3.107 6.560 1.00 0.00 C ATOM 2006 C ASN A 123 -14.143 1.593 6.461 1.00 0.00 C ATOM 2007 O ASN A 123 -14.156 0.891 7.475 1.00 0.00 O ATOM 2008 CB ASN A 123 -13.720 3.517 8.023 1.00 0.00 C ATOM 2009 CG ASN A 123 -12.267 3.791 8.355 1.00 0.00 C ATOM 2010 OD1 ASN A 123 -11.616 3.003 9.043 1.00 0.00 O ATOM 2011 ND2 ASN A 123 -11.751 4.914 7.868 1.00 0.00 N ATOM 0 H ASN A 123 -14.755 4.539 5.275 1.00 0.00 H new ATOM 0 HA ASN A 123 -13.018 3.346 5.992 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -14.312 4.409 8.231 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -14.096 2.727 8.673 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -10.778 5.153 8.059 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -12.328 5.537 7.303 1.00 0.00 H new ATOM 2018 N PRO A 124 -14.321 1.059 5.235 1.00 0.00 N ATOM 2019 CA PRO A 124 -14.541 -0.372 5.034 1.00 0.00 C ATOM 2020 C PRO A 124 -13.235 -1.178 5.111 1.00 0.00 C ATOM 2021 O PRO A 124 -12.744 -1.462 6.203 1.00 0.00 O ATOM 2022 CB PRO A 124 -15.166 -0.424 3.636 1.00 0.00 C ATOM 2023 CG PRO A 124 -14.562 0.733 2.918 1.00 0.00 C ATOM 2024 CD PRO A 124 -14.325 1.803 3.955 1.00 0.00 C ATOM 0 HA PRO A 124 -15.170 -0.819 5.804 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -14.940 -1.365 3.134 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -16.252 -0.340 3.683 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.627 0.446 2.436 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -15.228 1.093 2.134 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.379 2.319 3.789 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -15.109 2.560 3.935 1.00 0.00 H new ATOM 2032 N ASN A 125 -12.674 -1.545 3.958 1.00 0.00 N ATOM 2033 CA ASN A 125 -11.432 -2.312 3.919 1.00 0.00 C ATOM 2034 C ASN A 125 -10.247 -1.473 4.389 1.00 0.00 C ATOM 2035 O ASN A 125 -9.366 -1.963 5.095 1.00 0.00 O ATOM 2036 CB ASN A 125 -11.175 -2.831 2.505 1.00 0.00 C ATOM 2037 CG ASN A 125 -12.150 -3.919 2.100 1.00 0.00 C ATOM 2038 OD1 ASN A 125 -12.766 -3.852 1.036 1.00 0.00 O ATOM 2039 ND2 ASN A 125 -12.299 -4.928 2.950 1.00 0.00 N ATOM 0 H ASN A 125 -13.061 -1.323 3.041 1.00 0.00 H new ATOM 0 HA ASN A 125 -11.540 -3.158 4.598 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -11.245 -2.003 1.799 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -10.158 -3.217 2.443 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -12.944 -5.687 2.732 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -11.768 -4.944 3.821 1.00 0.00 H new ATOM 2046 N SER A 126 -10.226 -0.207 3.982 1.00 0.00 N ATOM 2047 CA SER A 126 -9.144 0.698 4.355 1.00 0.00 C ATOM 2048 C SER A 126 -9.676 2.092 4.671 1.00 0.00 C ATOM 2049 O SER A 126 -10.778 2.455 4.260 1.00 0.00 O ATOM 2050 CB SER A 126 -8.111 0.779 3.230 1.00 0.00 C ATOM 2051 OG SER A 126 -6.946 1.467 3.654 1.00 0.00 O ATOM 0 H SER A 126 -10.945 0.215 3.394 1.00 0.00 H new ATOM 0 HA SER A 126 -8.669 0.301 5.252 1.00 0.00 H new ATOM 0 HB2 SER A 126 -7.845 -0.226 2.904 1.00 0.00 H new ATOM 0 HB3 SER A 126 -8.545 1.289 2.370 1.00 0.00 H new ATOM 0 HG SER A 126 -6.997 2.403 3.369 1.00 0.00 H new ATOM 2057 N LYS A 127 -8.884 2.869 5.406 1.00 0.00 N ATOM 2058 CA LYS A 127 -9.277 4.224 5.778 1.00 0.00 C ATOM 2059 C LYS A 127 -8.917 5.215 4.675 1.00 0.00 C ATOM 2060 O LYS A 127 -7.841 5.136 4.081 1.00 0.00 O ATOM 2061 CB LYS A 127 -8.599 4.634 7.086 1.00 0.00 C ATOM 2062 CG LYS A 127 -9.121 3.890 8.303 1.00 0.00 C ATOM 2063 CD LYS A 127 -8.418 4.335 9.574 1.00 0.00 C ATOM 2064 CE LYS A 127 -8.941 3.590 10.790 1.00 0.00 C ATOM 2065 NZ LYS A 127 -9.995 4.362 11.506 1.00 0.00 N ATOM 0 H LYS A 127 -7.969 2.584 5.755 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.358 4.237 5.918 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -7.526 4.462 6.998 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -8.739 5.704 7.238 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -10.193 4.059 8.401 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.979 2.818 8.164 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -7.346 4.166 9.476 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -8.560 5.407 9.714 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.345 2.627 10.479 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -8.116 3.384 11.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -10.325 3.818 12.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -9.603 5.271 11.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -10.794 4.537 10.864 1.00 0.00 H new ATOM 2079 N PHE A 128 -9.829 6.142 4.403 1.00 0.00 N ATOM 2080 CA PHE A 128 -9.617 7.147 3.367 1.00 0.00 C ATOM 2081 C PHE A 128 -8.948 8.394 3.938 1.00 0.00 C ATOM 2082 O PHE A 128 -9.494 9.054 4.823 1.00 0.00 O ATOM 2083 CB PHE A 128 -10.960 7.519 2.729 1.00 0.00 C ATOM 2084 CG PHE A 128 -10.860 8.556 1.645 1.00 0.00 C ATOM 2085 CD1 PHE A 128 -10.956 9.903 1.950 1.00 0.00 C ATOM 2086 CD2 PHE A 128 -10.677 8.184 0.323 1.00 0.00 C ATOM 2087 CE1 PHE A 128 -10.872 10.861 0.958 1.00 0.00 C ATOM 2088 CE2 PHE A 128 -10.592 9.137 -0.674 1.00 0.00 C ATOM 2089 CZ PHE A 128 -10.689 10.477 -0.355 1.00 0.00 C ATOM 0 H PHE A 128 -10.724 6.219 4.886 1.00 0.00 H new ATOM 0 HA PHE A 128 -8.956 6.726 2.609 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -11.415 6.619 2.315 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -11.630 7.886 3.507 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -11.098 10.209 2.976 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -10.600 7.137 0.069 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -10.949 11.908 1.210 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -10.450 8.834 -1.701 1.00 0.00 H new ATOM 0 HZ PHE A 128 -10.622 11.224 -1.132 1.00 0.00 H new ATOM 2099 N GLU A 129 -7.770 8.723 3.414 1.00 0.00 N ATOM 2100 CA GLU A 129 -7.041 9.903 3.862 1.00 0.00 C ATOM 2101 C GLU A 129 -7.507 11.136 3.099 1.00 0.00 C ATOM 2102 O GLU A 129 -8.100 12.050 3.673 1.00 0.00 O ATOM 2103 CB GLU A 129 -5.533 9.718 3.670 1.00 0.00 C ATOM 2104 CG GLU A 129 -4.916 8.700 4.612 1.00 0.00 C ATOM 2105 CD GLU A 129 -3.423 8.542 4.397 1.00 0.00 C ATOM 2106 OE1 GLU A 129 -3.031 7.827 3.451 1.00 0.00 O ATOM 2107 OE2 GLU A 129 -2.646 9.131 5.177 1.00 0.00 O ATOM 0 H GLU A 129 -7.302 8.190 2.681 1.00 0.00 H new ATOM 0 HA GLU A 129 -7.244 10.040 4.924 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -5.342 9.410 2.642 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -5.037 10.678 3.813 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -5.102 9.004 5.642 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -5.404 7.736 4.471 1.00 0.00 H new ATOM 2115 N SER A 130 -7.238 11.149 1.797 1.00 0.00 N ATOM 2116 CA SER A 130 -7.633 12.263 0.942 1.00 0.00 C ATOM 2117 C SER A 130 -7.490 11.898 -0.530 1.00 0.00 C ATOM 2118 O SER A 130 -6.643 11.084 -0.899 1.00 0.00 O ATOM 2119 CB SER A 130 -6.793 13.502 1.250 1.00 0.00 C ATOM 2120 OG SER A 130 -7.609 14.581 1.673 1.00 0.00 O ATOM 0 H SER A 130 -6.747 10.399 1.310 1.00 0.00 H new ATOM 0 HA SER A 130 -8.681 12.484 1.147 1.00 0.00 H new ATOM 0 HB2 SER A 130 -6.065 13.267 2.026 1.00 0.00 H new ATOM 0 HB3 SER A 130 -6.231 13.793 0.363 1.00 0.00 H new ATOM 0 HG SER A 130 -7.047 15.360 1.865 1.00 0.00 H new ATOM 2126 N TYR A 131 -8.319 12.508 -1.366 1.00 0.00 N ATOM 2127 CA TYR A 131 -8.286 12.253 -2.802 1.00 0.00 C ATOM 2128 C TYR A 131 -8.064 13.547 -3.580 1.00 0.00 C ATOM 2129 O TYR A 131 -8.644 14.584 -3.259 1.00 0.00 O ATOM 2130 CB TYR A 131 -9.590 11.587 -3.253 1.00 0.00 C ATOM 2131 CG TYR A 131 -9.643 11.284 -4.734 1.00 0.00 C ATOM 2132 CD1 TYR A 131 -10.145 12.215 -5.635 1.00 0.00 C ATOM 2133 CD2 TYR A 131 -9.192 10.068 -5.231 1.00 0.00 C ATOM 2134 CE1 TYR A 131 -10.196 11.941 -6.989 1.00 0.00 C ATOM 2135 CE2 TYR A 131 -9.238 9.787 -6.583 1.00 0.00 C ATOM 2136 CZ TYR A 131 -9.741 10.726 -7.457 1.00 0.00 C ATOM 2137 OH TYR A 131 -9.790 10.450 -8.804 1.00 0.00 O ATOM 0 H TYR A 131 -9.025 13.185 -1.075 1.00 0.00 H new ATOM 0 HA TYR A 131 -7.453 11.581 -3.008 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -9.724 10.659 -2.697 1.00 0.00 H new ATOM 0 HB3 TYR A 131 -10.426 12.236 -2.995 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -10.501 13.168 -5.272 1.00 0.00 H new ATOM 0 HD2 TYR A 131 -8.798 9.329 -4.549 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -10.590 12.675 -7.677 1.00 0.00 H new ATOM 0 HE2 TYR A 131 -8.882 8.837 -6.953 1.00 0.00 H new ATOM 0 HH TYR A 131 -8.989 9.949 -9.065 1.00 0.00 H new ATOM 2147 N ASP A 132 -7.227 13.479 -4.611 1.00 0.00 N ATOM 2148 CA ASP A 132 -6.939 14.645 -5.437 1.00 0.00 C ATOM 2149 C ASP A 132 -7.554 14.485 -6.822 1.00 0.00 C ATOM 2150 O ASP A 132 -7.230 13.549 -7.549 1.00 0.00 O ATOM 2151 CB ASP A 132 -5.428 14.853 -5.556 1.00 0.00 C ATOM 2152 CG ASP A 132 -4.801 15.311 -4.253 1.00 0.00 C ATOM 2153 OD1 ASP A 132 -5.540 15.828 -3.389 1.00 0.00 O ATOM 2154 OD2 ASP A 132 -3.572 15.152 -4.098 1.00 0.00 O ATOM 0 H ASP A 132 -6.737 12.630 -4.893 1.00 0.00 H new ATOM 0 HA ASP A 132 -7.379 15.520 -4.959 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -4.960 13.921 -5.873 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -5.226 15.591 -6.332 1.00 0.00 H new ATOM 2160 N ALA A 133 -8.448 15.402 -7.177 1.00 0.00 N ATOM 2161 CA ALA A 133 -9.116 15.356 -8.473 1.00 0.00 C ATOM 2162 C ALA A 133 -8.157 15.683 -9.617 1.00 0.00 C ATOM 2163 O ALA A 133 -8.217 15.070 -10.682 1.00 0.00 O ATOM 2164 CB ALA A 133 -10.299 16.314 -8.484 1.00 0.00 C ATOM 0 H ALA A 133 -8.727 16.185 -6.586 1.00 0.00 H new ATOM 0 HA ALA A 133 -9.475 14.338 -8.627 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -10.791 16.273 -9.456 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -11.007 16.027 -7.706 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -9.947 17.329 -8.298 1.00 0.00 H new ATOM 2170 N ASP A 134 -7.283 16.662 -9.396 1.00 0.00 N ATOM 2171 CA ASP A 134 -6.325 17.081 -10.417 1.00 0.00 C ATOM 2172 C ASP A 134 -5.386 15.946 -10.825 1.00 0.00 C ATOM 2173 O ASP A 134 -5.070 15.789 -12.005 1.00 0.00 O ATOM 2174 CB ASP A 134 -5.506 18.271 -9.913 1.00 0.00 C ATOM 2175 CG ASP A 134 -6.334 19.538 -9.808 1.00 0.00 C ATOM 2176 OD1 ASP A 134 -5.918 20.458 -9.075 1.00 0.00 O ATOM 2177 OD2 ASP A 134 -7.399 19.609 -10.459 1.00 0.00 O ATOM 0 H ASP A 134 -7.218 17.180 -8.520 1.00 0.00 H new ATOM 0 HA ASP A 134 -6.897 17.372 -11.298 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -5.086 18.032 -8.936 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -4.667 18.443 -10.587 1.00 0.00 H new ATOM 2183 N SER A 135 -4.937 15.162 -9.851 1.00 0.00 N ATOM 2184 CA SER A 135 -4.025 14.054 -10.128 1.00 0.00 C ATOM 2185 C SER A 135 -4.759 12.714 -10.149 1.00 0.00 C ATOM 2186 O SER A 135 -4.216 11.707 -10.604 1.00 0.00 O ATOM 2187 CB SER A 135 -2.908 14.017 -9.084 1.00 0.00 C ATOM 2188 OG SER A 135 -2.022 15.112 -9.244 1.00 0.00 O ATOM 0 H SER A 135 -5.187 15.270 -8.868 1.00 0.00 H new ATOM 0 HA SER A 135 -3.595 14.219 -11.116 1.00 0.00 H new ATOM 0 HB2 SER A 135 -3.340 14.039 -8.084 1.00 0.00 H new ATOM 0 HB3 SER A 135 -2.355 13.082 -9.172 1.00 0.00 H new ATOM 0 HG SER A 135 -1.318 15.066 -8.563 1.00 0.00 H new ATOM 2194 N GLY A 136 -5.987 12.706 -9.643 1.00 0.00 N ATOM 2195 CA GLY A 136 -6.767 11.482 -9.606 1.00 0.00 C ATOM 2196 C GLY A 136 -6.252 10.504 -8.567 1.00 0.00 C ATOM 2197 O GLY A 136 -6.975 9.607 -8.133 1.00 0.00 O ATOM 0 H GLY A 136 -6.457 13.525 -9.258 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -7.808 11.723 -9.391 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -6.746 11.010 -10.588 1.00 0.00 H new ATOM 2201 N THR A 137 -4.997 10.682 -8.165 1.00 0.00 N ATOM 2202 CA THR A 137 -4.375 9.817 -7.169 1.00 0.00 C ATOM 2203 C THR A 137 -4.780 10.235 -5.759 1.00 0.00 C ATOM 2204 O THR A 137 -4.861 11.425 -5.454 1.00 0.00 O ATOM 2205 CB THR A 137 -2.853 9.854 -7.310 1.00 0.00 C ATOM 2206 OG1 THR A 137 -2.469 9.633 -8.655 1.00 0.00 O ATOM 2207 CG2 THR A 137 -2.149 8.819 -6.457 1.00 0.00 C ATOM 0 H THR A 137 -4.389 11.422 -8.516 1.00 0.00 H new ATOM 0 HA THR A 137 -4.722 8.798 -7.340 1.00 0.00 H new ATOM 0 HB THR A 137 -2.555 10.846 -6.972 1.00 0.00 H new ATOM 0 HG1 THR A 137 -1.492 9.662 -8.725 1.00 0.00 H new ATOM 0 HG21 THR A 137 -1.072 8.899 -6.603 1.00 0.00 H new ATOM 0 HG22 THR A 137 -2.386 8.991 -5.407 1.00 0.00 H new ATOM 0 HG23 THR A 137 -2.482 7.822 -6.746 1.00 0.00 H new ATOM 2215 N TYR A 138 -5.033 9.252 -4.902 1.00 0.00 N ATOM 2216 CA TYR A 138 -5.428 9.524 -3.524 1.00 0.00 C ATOM 2217 C TYR A 138 -4.573 8.724 -2.545 1.00 0.00 C ATOM 2218 O TYR A 138 -4.016 7.684 -2.900 1.00 0.00 O ATOM 2219 CB TYR A 138 -6.914 9.204 -3.316 1.00 0.00 C ATOM 2220 CG TYR A 138 -7.242 7.727 -3.361 1.00 0.00 C ATOM 2221 CD1 TYR A 138 -7.578 7.101 -4.556 1.00 0.00 C ATOM 2222 CD2 TYR A 138 -7.216 6.959 -2.204 1.00 0.00 C ATOM 2223 CE1 TYR A 138 -7.878 5.752 -4.595 1.00 0.00 C ATOM 2224 CE2 TYR A 138 -7.514 5.611 -2.234 1.00 0.00 C ATOM 2225 CZ TYR A 138 -7.844 5.012 -3.431 1.00 0.00 C ATOM 2226 OH TYR A 138 -8.141 3.668 -3.466 1.00 0.00 O ATOM 0 H TYR A 138 -4.972 8.261 -5.136 1.00 0.00 H new ATOM 0 HA TYR A 138 -5.269 10.585 -3.331 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -7.229 9.606 -2.353 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -7.496 9.718 -4.082 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -7.605 7.678 -5.469 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -6.958 7.424 -1.264 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -8.137 5.280 -5.531 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -7.489 5.029 -1.325 1.00 0.00 H new ATOM 0 HH TYR A 138 -7.420 3.186 -3.922 1.00 0.00 H new ATOM 2236 N VAL A 139 -4.466 9.216 -1.316 1.00 0.00 N ATOM 2237 CA VAL A 139 -3.674 8.544 -0.293 1.00 0.00 C ATOM 2238 C VAL A 139 -4.568 7.831 0.714 1.00 0.00 C ATOM 2239 O VAL A 139 -5.537 8.399 1.215 1.00 0.00 O ATOM 2240 CB VAL A 139 -2.767 9.538 0.456 1.00 0.00 C ATOM 2241 CG1 VAL A 139 -1.657 10.042 -0.453 1.00 0.00 C ATOM 2242 CG2 VAL A 139 -3.586 10.699 1.003 1.00 0.00 C ATOM 0 H VAL A 139 -4.917 10.076 -1.004 1.00 0.00 H new ATOM 0 HA VAL A 139 -3.052 7.810 -0.805 1.00 0.00 H new ATOM 0 HB VAL A 139 -2.307 9.018 1.296 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -1.028 10.743 0.095 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -1.053 9.200 -0.791 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -2.094 10.545 -1.316 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -2.929 11.392 1.529 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -4.076 11.218 0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.340 10.319 1.692 1.00 0.00 H new ATOM 2252 N PHE A 140 -4.234 6.577 1.002 1.00 0.00 N ATOM 2253 CA PHE A 140 -5.002 5.774 1.946 1.00 0.00 C ATOM 2254 C PHE A 140 -4.136 5.342 3.127 1.00 0.00 C ATOM 2255 O PHE A 140 -2.970 4.988 2.958 1.00 0.00 O ATOM 2256 CB PHE A 140 -5.573 4.538 1.249 1.00 0.00 C ATOM 2257 CG PHE A 140 -7.074 4.515 1.192 1.00 0.00 C ATOM 2258 CD1 PHE A 140 -7.790 5.655 0.868 1.00 0.00 C ATOM 2259 CD2 PHE A 140 -7.768 3.348 1.466 1.00 0.00 C ATOM 2260 CE1 PHE A 140 -9.171 5.631 0.817 1.00 0.00 C ATOM 2261 CE2 PHE A 140 -9.148 3.319 1.419 1.00 0.00 C ATOM 2262 CZ PHE A 140 -9.850 4.462 1.094 1.00 0.00 C ATOM 0 H PHE A 140 -3.434 6.094 0.593 1.00 0.00 H new ATOM 0 HA PHE A 140 -5.821 6.388 2.321 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -5.179 4.490 0.234 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -5.224 3.645 1.769 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -7.264 6.573 0.653 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -7.224 2.450 1.719 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -9.718 6.526 0.561 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -9.677 2.403 1.636 1.00 0.00 H new ATOM 0 HZ PHE A 140 -10.929 4.442 1.057 1.00 0.00 H new ATOM 2272 N ILE A 141 -4.716 5.370 4.323 1.00 0.00 N ATOM 2273 CA ILE A 141 -3.995 4.978 5.529 1.00 0.00 C ATOM 2274 C ILE A 141 -4.767 3.921 6.315 1.00 0.00 C ATOM 2275 O ILE A 141 -5.956 4.078 6.584 1.00 0.00 O ATOM 2276 CB ILE A 141 -3.713 6.197 6.437 1.00 0.00 C ATOM 2277 CG1 ILE A 141 -2.811 5.794 7.605 1.00 0.00 C ATOM 2278 CG2 ILE A 141 -5.012 6.810 6.945 1.00 0.00 C ATOM 2279 CD1 ILE A 141 -1.391 5.477 7.191 1.00 0.00 C ATOM 0 H ILE A 141 -5.681 5.659 4.483 1.00 0.00 H new ATOM 0 HA ILE A 141 -3.044 4.553 5.208 1.00 0.00 H new ATOM 0 HB ILE A 141 -3.195 6.952 5.845 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -2.796 6.602 8.337 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -3.239 4.923 8.100 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -4.786 7.666 7.581 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -5.616 7.137 6.098 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -5.565 6.067 7.519 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -0.809 5.199 8.070 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -1.395 4.649 6.482 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -0.944 6.354 6.722 1.00 0.00 H new ATOM 2291 N VAL A 142 -4.080 2.841 6.677 1.00 0.00 N ATOM 2292 CA VAL A 142 -4.701 1.757 7.428 1.00 0.00 C ATOM 2293 C VAL A 142 -3.840 1.357 8.629 1.00 0.00 C ATOM 2294 O VAL A 142 -3.512 0.185 8.813 1.00 0.00 O ATOM 2295 CB VAL A 142 -4.946 0.526 6.527 1.00 0.00 C ATOM 2296 CG1 VAL A 142 -3.633 -0.013 5.979 1.00 0.00 C ATOM 2297 CG2 VAL A 142 -5.700 -0.558 7.287 1.00 0.00 C ATOM 0 H VAL A 142 -3.094 2.694 6.462 1.00 0.00 H new ATOM 0 HA VAL A 142 -5.662 2.121 7.791 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.561 0.840 5.684 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -3.831 -0.879 5.348 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -3.140 0.760 5.390 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -2.987 -0.307 6.806 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -5.862 -1.415 6.633 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -5.116 -0.868 8.154 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -6.662 -0.168 7.618 1.00 0.00 H new ATOM 2307 N ASN A 143 -3.474 2.342 9.445 1.00 0.00 N ATOM 2308 CA ASN A 143 -2.651 2.089 10.622 1.00 0.00 C ATOM 2309 C ASN A 143 -3.495 1.561 11.779 1.00 0.00 C ATOM 2310 O ASN A 143 -4.253 2.306 12.400 1.00 0.00 O ATOM 2311 CB ASN A 143 -1.928 3.368 11.047 1.00 0.00 C ATOM 2312 CG ASN A 143 -0.946 3.129 12.175 1.00 0.00 C ATOM 2313 OD1 ASN A 143 -0.819 2.012 12.677 1.00 0.00 O ATOM 2314 ND2 ASN A 143 -0.243 4.182 12.579 1.00 0.00 N ATOM 0 H ASN A 143 -3.734 3.319 9.313 1.00 0.00 H new ATOM 0 HA ASN A 143 -1.914 1.330 10.360 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -1.398 3.784 10.190 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -2.662 4.110 11.359 1.00 0.00 H new ATOM 0 HD21 ASN A 143 0.435 4.083 13.334 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -0.382 5.089 12.134 1.00 0.00 H new ATOM 2321 N HIS A 144 -3.351 0.271 12.065 1.00 0.00 N ATOM 2322 CA HIS A 144 -4.093 -0.364 13.149 1.00 0.00 C ATOM 2323 C HIS A 144 -3.764 0.291 14.490 1.00 0.00 C ATOM 2324 O HIS A 144 -4.642 0.492 15.327 1.00 0.00 O ATOM 2325 CB HIS A 144 -3.773 -1.861 13.201 1.00 0.00 C ATOM 2326 CG HIS A 144 -4.495 -2.597 14.289 1.00 0.00 C ATOM 2327 ND1 HIS A 144 -5.855 -2.826 14.268 1.00 0.00 N ATOM 2328 CD2 HIS A 144 -4.038 -3.158 15.435 1.00 0.00 C ATOM 2329 CE1 HIS A 144 -6.204 -3.494 15.353 1.00 0.00 C ATOM 2330 NE2 HIS A 144 -5.121 -3.708 16.077 1.00 0.00 N ATOM 0 H HIS A 144 -2.726 -0.357 11.560 1.00 0.00 H new ATOM 0 HA HIS A 144 -5.158 -0.234 12.957 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -4.027 -2.311 12.241 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -2.699 -1.989 13.339 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -3.014 -3.170 15.779 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -7.205 -3.811 15.605 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -5.093 -4.202 16.969 1.00 0.00 H new