USER MOD reduce.3.24.130724 H: found=0, std=0, add=1080, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1082 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: B 162 GLN : amide:sc= 1.88 K(o=3,f=-6.2!) USER MOD Set 1.2: B 165 LYS NZ :NH3+ 169:sc= 1.09 (180deg=0) USER MOD Set 2.1: A 60 SER OG : rot 180:sc= 0.349 USER MOD Set 2.2: B 160 SER OG : rot 38:sc= -0.16 USER MOD Set 3.1: A 24 GLN :FLIP amide:sc= -0.83 F(o=-3.1!,f=-0.83) USER MOD Set 3.2: A 36 LYS NZ :NH3+ 160:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 37:sc= 0.142 USER MOD Single : A 14 THR OG1 : rot 89:sc= 1.02 USER MOD Single : A 17 GLN : amide:sc= -0.0611 K(o=-0.061,f=-1.4!) USER MOD Single : A 21 LYS NZ :NH3+ -135:sc= 0.839 (180deg=-0.00745) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot -152:sc= 1.26 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 TYR OH : rot 28:sc= -0.0202 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc=-0.00104 X(o=-0.001,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.116) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -52:sc= 0.447 USER MOD Single : A 56 ASN : amide:sc= -1.59 K(o=-1.6,f=-2.4) USER MOD Single : A 62 GLN :FLIP amide:sc= 0 F(o=-0.87,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN :FLIP amide:sc= -0.32 F(o=-1.4!,f=-0.32) USER MOD Single : A 74 SER OG : rot -59:sc= 0.101 USER MOD Single : B 108 SER OG : rot -22:sc= 0.293 USER MOD Single : B 114 THR OG1 : rot -140:sc= 0.0311 USER MOD Single : B 117 GLN : amide:sc=-1.94e-05 K(o=-1.9e-05,f=-0.93) USER MOD Single : B 121 LYS NZ :NH3+ 150:sc= 1.22 (180deg=1.15) USER MOD Single : B 122 THR OG1 : rot 180:sc= 0 USER MOD Single : B 124 GLN :FLIP amide:sc= -0.848 F(o=-2.6,f=-0.85) USER MOD Single : B 126 TYR OH : rot -155:sc= 0.898 USER MOD Single : B 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 133 TYR OH : rot 30:sc= -0.11 USER MOD Single : B 136 LYS NZ :NH3+ -111:sc= 0.715 (180deg=0) USER MOD Single : B 140 LYS NZ :NH3+ 165:sc= -0.0293 (180deg=-0.222) USER MOD Single : B 141 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 143 LYS NZ :NH3+ 167:sc= -0.0326 (180deg=-0.305) USER MOD Single : B 145 TYR OH : rot 180:sc= 0 USER MOD Single : B 153 SER OG : rot 180:sc= 0 USER MOD Single : B 156 ASN :FLIP amide:sc= -2.31 F(o=-4.5!,f=-2.3) USER MOD Single : B 169 GLN :FLIP amide:sc= -0.0606 F(o=-1.7!,f=-0.061) USER MOD Single : B 174 SER OG : rot -42:sc= 0.691 USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 8 5.017 10.659 -4.504 1.00 53.12 N ATOM 81 CA SER A 8 4.047 11.107 -3.511 1.00 41.32 C ATOM 82 C SER A 8 3.338 9.911 -2.884 1.00 43.15 C ATOM 83 O SER A 8 2.346 10.050 -2.170 1.00 2.25 O ATOM 84 CB SER A 8 3.038 12.053 -4.156 1.00 3.41 C ATOM 85 OG SER A 8 3.704 13.139 -4.781 1.00 2.12 O ATOM 0 HA SER A 8 4.573 11.644 -2.722 1.00 41.32 H new ATOM 0 HB2 SER A 8 2.442 11.512 -4.891 1.00 3.41 H new ATOM 0 HB3 SER A 8 2.348 12.428 -3.400 1.00 3.41 H new ATOM 0 HG SER A 8 4.542 12.823 -5.179 1.00 2.12 H new ATOM 91 N GLY A 9 3.876 8.739 -3.159 1.00 43.33 N ATOM 92 CA GLY A 9 3.361 7.514 -2.600 1.00 62.33 C ATOM 93 C GLY A 9 4.494 6.653 -2.108 1.00 61.33 C ATOM 94 O GLY A 9 5.196 6.030 -2.901 1.00 75.11 O ATOM 0 H GLY A 9 4.680 8.614 -3.775 1.00 43.33 H new ATOM 0 HA2 GLY A 9 2.681 7.738 -1.778 1.00 62.33 H new ATOM 0 HA3 GLY A 9 2.785 6.976 -3.353 1.00 62.33 H new ATOM 98 N GLU A 10 4.691 6.635 -0.804 1.00 63.21 N ATOM 99 CA GLU A 10 5.813 5.930 -0.218 1.00 55.12 C ATOM 100 C GLU A 10 5.323 4.854 0.734 1.00 63.43 C ATOM 101 O GLU A 10 5.018 5.120 1.895 1.00 35.11 O ATOM 102 CB GLU A 10 6.752 6.908 0.496 1.00 52.34 C ATOM 103 CG GLU A 10 6.053 7.870 1.443 1.00 74.33 C ATOM 104 CD GLU A 10 7.027 8.769 2.174 1.00 24.01 C ATOM 105 OE1 GLU A 10 7.752 8.273 3.061 1.00 34.42 O ATOM 106 OE2 GLU A 10 7.073 9.979 1.867 1.00 22.44 O ATOM 0 H GLU A 10 4.086 7.102 -0.129 1.00 63.21 H new ATOM 0 HA GLU A 10 6.375 5.447 -1.017 1.00 55.12 H new ATOM 0 HB2 GLU A 10 7.492 6.338 1.057 1.00 52.34 H new ATOM 0 HB3 GLU A 10 7.295 7.484 -0.253 1.00 52.34 H new ATOM 0 HG2 GLU A 10 5.349 8.483 0.880 1.00 74.33 H new ATOM 0 HG3 GLU A 10 5.471 7.302 2.169 1.00 74.33 H new ATOM 113 N PRO A 11 5.198 3.625 0.239 1.00 25.55 N ATOM 114 CA PRO A 11 4.741 2.516 1.050 1.00 62.14 C ATOM 115 C PRO A 11 5.846 2.004 1.955 1.00 12.05 C ATOM 116 O PRO A 11 6.546 1.048 1.624 1.00 73.12 O ATOM 117 CB PRO A 11 4.322 1.466 0.025 1.00 22.41 C ATOM 118 CG PRO A 11 5.113 1.765 -1.206 1.00 44.22 C ATOM 119 CD PRO A 11 5.506 3.220 -1.143 1.00 20.50 C ATOM 0 HA PRO A 11 3.928 2.790 1.722 1.00 62.14 H new ATOM 0 HB2 PRO A 11 4.529 0.459 0.389 1.00 22.41 H new ATOM 0 HB3 PRO A 11 3.252 1.519 -0.175 1.00 22.41 H new ATOM 0 HG2 PRO A 11 5.997 1.130 -1.258 1.00 44.22 H new ATOM 0 HG3 PRO A 11 4.523 1.564 -2.100 1.00 44.22 H new ATOM 0 HD2 PRO A 11 6.563 3.356 -1.370 1.00 20.50 H new ATOM 0 HD3 PRO A 11 4.946 3.814 -1.865 1.00 20.50 H new ATOM 127 N ASP A 12 6.033 2.679 3.074 1.00 4.10 N ATOM 128 CA ASP A 12 7.062 2.301 4.017 1.00 65.14 C ATOM 129 C ASP A 12 6.436 1.526 5.159 1.00 34.52 C ATOM 130 O ASP A 12 5.210 1.481 5.297 1.00 73.45 O ATOM 131 CB ASP A 12 7.814 3.531 4.538 1.00 41.43 C ATOM 132 CG ASP A 12 7.103 4.254 5.666 1.00 24.33 C ATOM 133 OD1 ASP A 12 6.196 5.069 5.390 1.00 12.21 O ATOM 134 OD2 ASP A 12 7.481 4.041 6.837 1.00 21.31 O ATOM 0 H ASP A 12 5.483 3.493 3.350 1.00 4.10 H new ATOM 0 HA ASP A 12 7.790 1.667 3.511 1.00 65.14 H new ATOM 0 HB2 ASP A 12 8.801 3.222 4.883 1.00 41.43 H new ATOM 0 HB3 ASP A 12 7.968 4.227 3.713 1.00 41.43 H new ATOM 139 N VAL A 13 7.262 0.910 5.972 1.00 5.23 N ATOM 140 CA VAL A 13 6.760 0.063 7.026 1.00 1.12 C ATOM 141 C VAL A 13 7.314 0.478 8.384 1.00 13.32 C ATOM 142 O VAL A 13 8.514 0.706 8.542 1.00 44.45 O ATOM 143 CB VAL A 13 7.076 -1.422 6.741 1.00 3.21 C ATOM 144 CG1 VAL A 13 8.571 -1.657 6.625 1.00 32.02 C ATOM 145 CG2 VAL A 13 6.477 -2.309 7.813 1.00 3.10 C ATOM 0 H VAL A 13 8.279 0.979 5.924 1.00 5.23 H new ATOM 0 HA VAL A 13 5.677 0.183 7.055 1.00 1.12 H new ATOM 0 HB VAL A 13 6.624 -1.681 5.784 1.00 3.21 H new ATOM 0 HG11 VAL A 13 8.759 -2.712 6.424 1.00 32.02 H new ATOM 0 HG12 VAL A 13 8.972 -1.055 5.809 1.00 32.02 H new ATOM 0 HG13 VAL A 13 9.057 -1.373 7.558 1.00 32.02 H new ATOM 0 HG21 VAL A 13 6.710 -3.351 7.595 1.00 3.10 H new ATOM 0 HG22 VAL A 13 6.894 -2.039 8.783 1.00 3.10 H new ATOM 0 HG23 VAL A 13 5.395 -2.176 7.833 1.00 3.10 H new ATOM 155 N THR A 14 6.425 0.605 9.349 1.00 1.02 N ATOM 156 CA THR A 14 6.809 0.917 10.710 1.00 62.52 C ATOM 157 C THR A 14 7.069 -0.376 11.472 1.00 71.15 C ATOM 158 O THR A 14 6.190 -1.231 11.574 1.00 24.30 O ATOM 159 CB THR A 14 5.712 1.723 11.428 1.00 13.11 C ATOM 160 OG1 THR A 14 5.276 2.810 10.596 1.00 55.12 O ATOM 161 CG2 THR A 14 6.228 2.267 12.749 1.00 25.33 C ATOM 0 H THR A 14 5.420 0.495 9.212 1.00 1.02 H new ATOM 0 HA THR A 14 7.714 1.523 10.680 1.00 62.52 H new ATOM 0 HB THR A 14 4.871 1.059 11.626 1.00 13.11 H new ATOM 0 HG1 THR A 14 4.543 2.507 10.020 1.00 55.12 H new ATOM 0 HG21 THR A 14 5.439 2.834 13.242 1.00 25.33 H new ATOM 0 HG22 THR A 14 6.534 1.439 13.389 1.00 25.33 H new ATOM 0 HG23 THR A 14 7.082 2.919 12.565 1.00 25.33 H new ATOM 169 N ILE A 15 8.274 -0.527 11.988 1.00 32.32 N ATOM 170 CA ILE A 15 8.659 -1.764 12.648 1.00 65.01 C ATOM 171 C ILE A 15 8.374 -1.701 14.146 1.00 55.30 C ATOM 172 O ILE A 15 9.036 -0.969 14.885 1.00 63.32 O ATOM 173 CB ILE A 15 10.153 -2.075 12.414 1.00 13.20 C ATOM 174 CG1 ILE A 15 10.472 -2.042 10.917 1.00 43.52 C ATOM 175 CG2 ILE A 15 10.507 -3.435 13.000 1.00 5.31 C ATOM 176 CD1 ILE A 15 11.938 -2.247 10.598 1.00 71.43 C ATOM 0 H ILE A 15 9.002 0.187 11.964 1.00 32.32 H new ATOM 0 HA ILE A 15 8.061 -2.564 12.212 1.00 65.01 H new ATOM 0 HB ILE A 15 10.751 -1.314 12.915 1.00 13.20 H new ATOM 0 HG12 ILE A 15 9.889 -2.814 10.414 1.00 43.52 H new ATOM 0 HG13 ILE A 15 10.152 -1.084 10.508 1.00 43.52 H new ATOM 0 HG21 ILE A 15 11.563 -3.642 12.828 1.00 5.31 H new ATOM 0 HG22 ILE A 15 10.308 -3.432 14.072 1.00 5.31 H new ATOM 0 HG23 ILE A 15 9.904 -4.206 12.521 1.00 5.31 H new ATOM 0 HD11 ILE A 15 12.084 -2.210 9.518 1.00 71.43 H new ATOM 0 HD12 ILE A 15 12.527 -1.461 11.071 1.00 71.43 H new ATOM 0 HD13 ILE A 15 12.260 -3.218 10.975 1.00 71.43 H new ATOM 188 N ARG A 16 7.372 -2.455 14.585 1.00 31.12 N ATOM 189 CA ARG A 16 7.032 -2.542 16.002 1.00 45.44 C ATOM 190 C ARG A 16 7.491 -3.881 16.563 1.00 33.23 C ATOM 191 O ARG A 16 7.799 -4.802 15.809 1.00 54.33 O ATOM 192 CB ARG A 16 5.521 -2.412 16.213 1.00 71.40 C ATOM 193 CG ARG A 16 4.914 -1.161 15.609 1.00 41.33 C ATOM 194 CD ARG A 16 5.403 0.101 16.296 1.00 51.14 C ATOM 195 NE ARG A 16 4.809 1.300 15.705 1.00 22.02 N ATOM 196 CZ ARG A 16 5.031 2.540 16.143 1.00 72.11 C ATOM 197 NH1 ARG A 16 5.787 2.745 17.215 1.00 63.20 N ATOM 198 NH2 ARG A 16 4.484 3.580 15.518 1.00 22.52 N ATOM 0 H ARG A 16 6.778 -3.018 13.977 1.00 31.12 H new ATOM 0 HA ARG A 16 7.535 -1.725 16.519 1.00 45.44 H new ATOM 0 HB2 ARG A 16 5.029 -3.285 15.783 1.00 71.40 H new ATOM 0 HB3 ARG A 16 5.313 -2.423 17.283 1.00 71.40 H new ATOM 0 HG2 ARG A 16 5.161 -1.115 14.548 1.00 41.33 H new ATOM 0 HG3 ARG A 16 3.828 -1.215 15.681 1.00 41.33 H new ATOM 0 HD2 ARG A 16 5.157 0.057 17.357 1.00 51.14 H new ATOM 0 HD3 ARG A 16 6.489 0.158 16.223 1.00 51.14 H new ATOM 0 HE ARG A 16 4.185 1.180 14.907 1.00 22.02 H new ATOM 0 HH11 ARG A 16 6.200 1.953 17.707 1.00 63.20 H new ATOM 0 HH12 ARG A 16 5.954 3.695 17.547 1.00 63.20 H new ATOM 0 HH21 ARG A 16 3.892 3.430 14.701 1.00 22.52 H new ATOM 0 HH22 ARG A 16 4.656 4.527 15.856 1.00 22.52 H new ATOM 212 N GLN A 17 7.519 -3.992 17.879 1.00 65.55 N ATOM 213 CA GLN A 17 7.878 -5.242 18.531 1.00 33.25 C ATOM 214 C GLN A 17 6.983 -5.512 19.730 1.00 45.45 C ATOM 215 O GLN A 17 6.900 -4.698 20.650 1.00 34.35 O ATOM 216 CB GLN A 17 9.339 -5.238 18.977 1.00 75.35 C ATOM 217 CG GLN A 17 10.327 -5.592 17.875 1.00 40.01 C ATOM 218 CD GLN A 17 11.705 -5.921 18.416 1.00 12.05 C ATOM 219 OE1 GLN A 17 11.841 -6.406 19.540 1.00 53.44 O ATOM 220 NE2 GLN A 17 12.735 -5.676 17.621 1.00 32.31 N ATOM 0 H GLN A 17 7.297 -3.230 18.520 1.00 65.55 H new ATOM 0 HA GLN A 17 7.738 -6.036 17.797 1.00 33.25 H new ATOM 0 HB2 GLN A 17 9.586 -4.251 19.368 1.00 75.35 H new ATOM 0 HB3 GLN A 17 9.459 -5.945 19.798 1.00 75.35 H new ATOM 0 HG2 GLN A 17 9.948 -6.445 17.312 1.00 40.01 H new ATOM 0 HG3 GLN A 17 10.403 -4.758 17.178 1.00 40.01 H new ATOM 0 HE21 GLN A 17 12.581 -5.273 16.696 1.00 32.31 H new ATOM 0 HE22 GLN A 17 13.682 -5.890 17.933 1.00 32.31 H new ATOM 229 N GLU A 18 6.317 -6.653 19.705 1.00 73.04 N ATOM 230 CA GLU A 18 5.484 -7.093 20.811 1.00 4.12 C ATOM 231 C GLU A 18 5.924 -8.479 21.259 1.00 71.32 C ATOM 232 O GLU A 18 5.560 -9.481 20.647 1.00 22.40 O ATOM 233 CB GLU A 18 4.009 -7.115 20.397 1.00 43.51 C ATOM 234 CG GLU A 18 3.382 -5.735 20.260 1.00 52.12 C ATOM 235 CD GLU A 18 3.045 -5.116 21.601 1.00 31.01 C ATOM 236 OE1 GLU A 18 3.972 -4.704 22.326 1.00 71.21 O ATOM 237 OE2 GLU A 18 1.844 -5.061 21.950 1.00 14.12 O ATOM 0 H GLU A 18 6.338 -7.301 18.917 1.00 73.04 H new ATOM 0 HA GLU A 18 5.597 -6.394 21.639 1.00 4.12 H new ATOM 0 HB2 GLU A 18 3.917 -7.640 19.446 1.00 43.51 H new ATOM 0 HB3 GLU A 18 3.445 -7.687 21.133 1.00 43.51 H new ATOM 0 HG2 GLU A 18 4.067 -5.080 19.723 1.00 52.12 H new ATOM 0 HG3 GLU A 18 2.475 -5.809 19.659 1.00 52.12 H new ATOM 244 N GLY A 19 6.746 -8.529 22.293 1.00 50.21 N ATOM 245 CA GLY A 19 7.240 -9.800 22.777 1.00 75.35 C ATOM 246 C GLY A 19 8.201 -10.438 21.796 1.00 60.13 C ATOM 247 O GLY A 19 9.334 -9.983 21.644 1.00 24.30 O ATOM 0 H GLY A 19 7.080 -7.713 22.806 1.00 50.21 H new ATOM 0 HA2 GLY A 19 7.740 -9.655 23.735 1.00 75.35 H new ATOM 0 HA3 GLY A 19 6.401 -10.473 22.954 1.00 75.35 H new ATOM 251 N ASP A 20 7.747 -11.481 21.113 1.00 24.15 N ATOM 252 CA ASP A 20 8.591 -12.177 20.150 1.00 41.31 C ATOM 253 C ASP A 20 8.107 -11.961 18.725 1.00 2.13 C ATOM 254 O ASP A 20 8.623 -12.579 17.798 1.00 14.41 O ATOM 255 CB ASP A 20 8.643 -13.680 20.436 1.00 40.51 C ATOM 256 CG ASP A 20 9.392 -14.017 21.709 1.00 11.24 C ATOM 257 OD1 ASP A 20 8.766 -14.033 22.786 1.00 25.31 O ATOM 258 OD2 ASP A 20 10.607 -14.291 21.633 1.00 33.23 O ATOM 0 H ASP A 20 6.805 -11.862 21.207 1.00 24.15 H new ATOM 0 HA ASP A 20 9.592 -11.757 20.254 1.00 41.31 H new ATOM 0 HB2 ASP A 20 7.626 -14.066 20.507 1.00 40.51 H new ATOM 0 HB3 ASP A 20 9.118 -14.187 19.597 1.00 40.51 H new ATOM 263 N LYS A 21 7.113 -11.106 18.534 1.00 61.44 N ATOM 264 CA LYS A 21 6.650 -10.821 17.184 1.00 41.31 C ATOM 265 C LYS A 21 6.997 -9.403 16.765 1.00 32.24 C ATOM 266 O LYS A 21 6.641 -8.428 17.432 1.00 72.03 O ATOM 267 CB LYS A 21 5.148 -11.088 17.000 1.00 31.33 C ATOM 268 CG LYS A 21 4.232 -10.401 17.995 1.00 14.21 C ATOM 269 CD LYS A 21 3.767 -11.370 19.066 1.00 0.42 C ATOM 270 CE LYS A 21 2.741 -10.732 19.984 1.00 62.33 C ATOM 271 NZ LYS A 21 2.452 -11.585 21.170 1.00 12.13 N ATOM 0 H LYS A 21 6.622 -10.608 19.276 1.00 61.44 H new ATOM 0 HA LYS A 21 7.179 -11.514 16.530 1.00 41.31 H new ATOM 0 HB2 LYS A 21 4.862 -10.776 15.995 1.00 31.33 H new ATOM 0 HB3 LYS A 21 4.979 -12.163 17.060 1.00 31.33 H new ATOM 0 HG2 LYS A 21 4.755 -9.565 18.459 1.00 14.21 H new ATOM 0 HG3 LYS A 21 3.368 -9.987 17.474 1.00 14.21 H new ATOM 0 HD2 LYS A 21 3.337 -12.254 18.596 1.00 0.42 H new ATOM 0 HD3 LYS A 21 4.623 -11.705 19.652 1.00 0.42 H new ATOM 0 HE2 LYS A 21 3.105 -9.760 20.316 1.00 62.33 H new ATOM 0 HE3 LYS A 21 1.819 -10.555 19.431 1.00 62.33 H new ATOM 0 HZ1 LYS A 21 1.425 -11.625 21.327 1.00 12.13 H new ATOM 0 HZ2 LYS A 21 2.815 -12.545 21.004 1.00 12.13 H new ATOM 0 HZ3 LYS A 21 2.915 -11.181 22.009 1.00 12.13 H new ATOM 285 N THR A 22 7.726 -9.309 15.672 1.00 14.51 N ATOM 286 CA THR A 22 8.020 -8.033 15.058 1.00 1.15 C ATOM 287 C THR A 22 6.849 -7.630 14.165 1.00 52.43 C ATOM 288 O THR A 22 6.681 -8.159 13.068 1.00 33.30 O ATOM 289 CB THR A 22 9.320 -8.107 14.234 1.00 31.53 C ATOM 290 OG1 THR A 22 10.388 -8.592 15.063 1.00 61.41 O ATOM 291 CG2 THR A 22 9.691 -6.746 13.666 1.00 13.42 C ATOM 0 H THR A 22 8.129 -10.111 15.187 1.00 14.51 H new ATOM 0 HA THR A 22 8.162 -7.285 15.838 1.00 1.15 H new ATOM 0 HB THR A 22 9.158 -8.790 13.400 1.00 31.53 H new ATOM 0 HG1 THR A 22 11.214 -8.640 14.538 1.00 61.41 H new ATOM 0 HG21 THR A 22 10.612 -6.831 13.090 1.00 13.42 H new ATOM 0 HG22 THR A 22 8.889 -6.391 13.018 1.00 13.42 H new ATOM 0 HG23 THR A 22 9.838 -6.039 14.482 1.00 13.42 H new ATOM 299 N ILE A 23 6.016 -6.734 14.665 1.00 11.24 N ATOM 300 CA ILE A 23 4.813 -6.330 13.959 1.00 12.25 C ATOM 301 C ILE A 23 5.101 -5.131 13.070 1.00 71.44 C ATOM 302 O ILE A 23 5.352 -4.029 13.551 1.00 33.14 O ATOM 303 CB ILE A 23 3.678 -5.998 14.946 1.00 11.02 C ATOM 304 CG1 ILE A 23 3.415 -7.202 15.857 1.00 24.43 C ATOM 305 CG2 ILE A 23 2.412 -5.605 14.196 1.00 15.41 C ATOM 306 CD1 ILE A 23 2.346 -6.958 16.898 1.00 65.33 C ATOM 0 H ILE A 23 6.152 -6.270 15.563 1.00 11.24 H new ATOM 0 HA ILE A 23 4.490 -7.164 13.336 1.00 12.25 H new ATOM 0 HB ILE A 23 3.981 -5.150 15.561 1.00 11.02 H new ATOM 0 HG12 ILE A 23 3.123 -8.054 15.243 1.00 24.43 H new ATOM 0 HG13 ILE A 23 4.343 -7.475 16.360 1.00 24.43 H new ATOM 0 HG21 ILE A 23 1.622 -5.374 14.911 1.00 15.41 H new ATOM 0 HG22 ILE A 23 2.611 -4.728 13.580 1.00 15.41 H new ATOM 0 HG23 ILE A 23 2.095 -6.431 13.559 1.00 15.41 H new ATOM 0 HD11 ILE A 23 2.217 -7.855 17.504 1.00 65.33 H new ATOM 0 HD12 ILE A 23 2.644 -6.128 17.538 1.00 65.33 H new ATOM 0 HD13 ILE A 23 1.405 -6.715 16.404 1.00 65.33 H new ATOM 318 N GLN A 24 5.088 -5.363 11.772 1.00 52.11 N ATOM 319 CA GLN A 24 5.437 -4.341 10.804 1.00 14.33 C ATOM 320 C GLN A 24 4.186 -3.709 10.200 1.00 64.02 C ATOM 321 O GLN A 24 3.375 -4.386 9.568 1.00 4.14 O ATOM 322 CB GLN A 24 6.310 -4.955 9.709 1.00 73.22 C ATOM 323 CG GLN A 24 7.514 -5.714 10.245 1.00 64.40 C ATOM 324 CD GLN A 24 8.470 -6.160 9.153 1.00 73.02 C ATOM 325 OE1 GLN A 24 8.575 -5.370 8.095 1.00 61.00 O flip ATOM 326 NE2 GLN A 24 9.122 -7.198 9.266 1.00 65.41 N flip ATOM 0 H GLN A 24 4.836 -6.261 11.360 1.00 52.11 H new ATOM 0 HA GLN A 24 5.994 -3.553 11.310 1.00 14.33 H new ATOM 0 HB2 GLN A 24 5.702 -5.632 9.108 1.00 73.22 H new ATOM 0 HB3 GLN A 24 6.656 -4.163 9.045 1.00 73.22 H new ATOM 0 HG2 GLN A 24 8.050 -5.081 10.953 1.00 64.40 H new ATOM 0 HG3 GLN A 24 7.169 -6.588 10.797 1.00 64.40 H new ATOM 0 HE21 GLN A 24 9.014 -7.781 10.096 1.00 65.41 H new ATOM 0 HE22 GLN A 24 9.771 -7.476 8.529 1.00 65.41 H new ATOM 335 N GLU A 25 4.046 -2.406 10.395 1.00 53.30 N ATOM 336 CA GLU A 25 2.886 -1.663 9.919 1.00 35.23 C ATOM 337 C GLU A 25 3.170 -1.043 8.553 1.00 33.20 C ATOM 338 O GLU A 25 3.947 -0.095 8.447 1.00 14.14 O ATOM 339 CB GLU A 25 2.537 -0.559 10.919 1.00 53.14 C ATOM 340 CG GLU A 25 2.488 -1.035 12.363 1.00 71.21 C ATOM 341 CD GLU A 25 2.190 0.090 13.331 1.00 12.54 C ATOM 342 OE1 GLU A 25 3.121 0.855 13.663 1.00 74.24 O ATOM 343 OE2 GLU A 25 1.028 0.217 13.766 1.00 64.34 O ATOM 0 H GLU A 25 4.732 -1.833 10.887 1.00 53.30 H new ATOM 0 HA GLU A 25 2.046 -2.351 9.824 1.00 35.23 H new ATOM 0 HB2 GLU A 25 3.272 0.241 10.834 1.00 53.14 H new ATOM 0 HB3 GLU A 25 1.570 -0.133 10.653 1.00 53.14 H new ATOM 0 HG2 GLU A 25 1.726 -1.808 12.462 1.00 71.21 H new ATOM 0 HG3 GLU A 25 3.442 -1.493 12.625 1.00 71.21 H new ATOM 350 N TYR A 26 2.544 -1.577 7.513 1.00 63.11 N ATOM 351 CA TYR A 26 2.741 -1.077 6.157 1.00 42.14 C ATOM 352 C TYR A 26 1.795 0.077 5.857 1.00 22.42 C ATOM 353 O TYR A 26 0.573 -0.098 5.817 1.00 22.32 O ATOM 354 CB TYR A 26 2.526 -2.199 5.138 1.00 13.41 C ATOM 355 CG TYR A 26 3.702 -3.139 4.994 1.00 43.54 C ATOM 356 CD1 TYR A 26 3.994 -4.095 5.961 1.00 21.35 C ATOM 357 CD2 TYR A 26 4.519 -3.071 3.875 1.00 75.12 C ATOM 358 CE1 TYR A 26 5.074 -4.949 5.816 1.00 42.43 C ATOM 359 CE2 TYR A 26 5.593 -3.919 3.723 1.00 60.21 C ATOM 360 CZ TYR A 26 5.868 -4.854 4.691 1.00 5.00 C ATOM 361 OH TYR A 26 6.948 -5.692 4.534 1.00 14.31 O ATOM 0 H TYR A 26 1.893 -2.359 7.582 1.00 63.11 H new ATOM 0 HA TYR A 26 3.766 -0.714 6.081 1.00 42.14 H new ATOM 0 HB2 TYR A 26 1.648 -2.775 5.429 1.00 13.41 H new ATOM 0 HB3 TYR A 26 2.309 -1.755 4.166 1.00 13.41 H new ATOM 0 HD1 TYR A 26 3.369 -4.172 6.838 1.00 21.35 H new ATOM 0 HD2 TYR A 26 4.309 -2.339 3.109 1.00 75.12 H new ATOM 0 HE1 TYR A 26 5.293 -5.683 6.577 1.00 42.43 H new ATOM 0 HE2 TYR A 26 6.218 -3.849 2.845 1.00 60.21 H new ATOM 0 HH TYR A 26 7.631 -5.247 3.990 1.00 14.31 H new ATOM 371 N ARG A 27 2.363 1.254 5.648 1.00 11.21 N ATOM 372 CA ARG A 27 1.578 2.435 5.337 1.00 13.05 C ATOM 373 C ARG A 27 2.154 3.151 4.124 1.00 60.24 C ATOM 374 O ARG A 27 3.341 3.469 4.079 1.00 20.21 O ATOM 375 CB ARG A 27 1.519 3.378 6.541 1.00 52.33 C ATOM 376 CG ARG A 27 0.736 2.813 7.716 1.00 52.44 C ATOM 377 CD ARG A 27 0.748 3.761 8.904 1.00 20.54 C ATOM 378 NE ARG A 27 2.095 3.935 9.444 1.00 30.41 N ATOM 379 CZ ARG A 27 2.540 5.064 9.993 1.00 20.52 C ATOM 380 NH1 ARG A 27 1.736 6.113 10.120 1.00 44.30 N ATOM 381 NH2 ARG A 27 3.787 5.134 10.439 1.00 73.12 N ATOM 0 H ARG A 27 3.369 1.416 5.689 1.00 11.21 H new ATOM 0 HA ARG A 27 0.561 2.120 5.102 1.00 13.05 H new ATOM 0 HB2 ARG A 27 2.535 3.603 6.866 1.00 52.33 H new ATOM 0 HB3 ARG A 27 1.067 4.320 6.233 1.00 52.33 H new ATOM 0 HG2 ARG A 27 -0.293 2.624 7.411 1.00 52.44 H new ATOM 0 HG3 ARG A 27 1.162 1.854 8.011 1.00 52.44 H new ATOM 0 HD2 ARG A 27 0.350 4.729 8.601 1.00 20.54 H new ATOM 0 HD3 ARG A 27 0.091 3.376 9.683 1.00 20.54 H new ATOM 0 HE ARG A 27 2.735 3.142 9.397 1.00 30.41 H new ATOM 0 HH11 ARG A 27 0.770 6.058 9.796 1.00 44.30 H new ATOM 0 HH12 ARG A 27 2.084 6.974 10.541 1.00 44.30 H new ATOM 0 HH21 ARG A 27 4.403 4.325 10.361 1.00 73.12 H new ATOM 0 HH22 ARG A 27 4.130 5.997 10.860 1.00 73.12 H new ATOM 395 N VAL A 28 1.307 3.395 3.136 1.00 63.35 N ATOM 396 CA VAL A 28 1.745 4.006 1.889 1.00 53.51 C ATOM 397 C VAL A 28 1.627 5.528 1.947 1.00 1.34 C ATOM 398 O VAL A 28 2.385 6.249 1.294 1.00 70.11 O ATOM 399 CB VAL A 28 0.940 3.455 0.688 1.00 3.41 C ATOM 400 CG1 VAL A 28 -0.551 3.685 0.873 1.00 61.41 C ATOM 401 CG2 VAL A 28 1.422 4.069 -0.616 1.00 54.42 C ATOM 0 H VAL A 28 0.311 3.179 3.173 1.00 63.35 H new ATOM 0 HA VAL A 28 2.795 3.748 1.751 1.00 53.51 H new ATOM 0 HB VAL A 28 1.109 2.379 0.641 1.00 3.41 H new ATOM 0 HG11 VAL A 28 -1.090 3.287 0.013 1.00 61.41 H new ATOM 0 HG12 VAL A 28 -0.888 3.179 1.778 1.00 61.41 H new ATOM 0 HG13 VAL A 28 -0.746 4.754 0.961 1.00 61.41 H new ATOM 0 HG21 VAL A 28 0.841 3.666 -1.445 1.00 54.42 H new ATOM 0 HG22 VAL A 28 1.296 5.151 -0.577 1.00 54.42 H new ATOM 0 HG23 VAL A 28 2.476 3.831 -0.762 1.00 54.42 H new ATOM 411 N ASN A 29 0.679 6.010 2.738 1.00 20.43 N ATOM 412 CA ASN A 29 0.461 7.445 2.883 1.00 43.13 C ATOM 413 C ASN A 29 -0.576 7.697 3.965 1.00 62.31 C ATOM 414 O ASN A 29 -1.718 8.057 3.677 1.00 41.43 O ATOM 415 CB ASN A 29 -0.004 8.062 1.556 1.00 45.02 C ATOM 416 CG ASN A 29 0.493 9.482 1.364 1.00 21.44 C ATOM 417 OD1 ASN A 29 -0.153 10.448 1.774 1.00 12.04 O ATOM 418 ND2 ASN A 29 1.645 9.614 0.723 1.00 11.13 N ATOM 0 H ASN A 29 0.048 5.429 3.290 1.00 20.43 H new ATOM 0 HA ASN A 29 1.403 7.914 3.167 1.00 43.13 H new ATOM 0 HB2 ASN A 29 0.347 7.444 0.730 1.00 45.02 H new ATOM 0 HB3 ASN A 29 -1.093 8.055 1.519 1.00 45.02 H new ATOM 0 HD21 ASN A 29 2.030 10.543 0.552 1.00 11.13 H new ATOM 0 HD22 ASN A 29 2.147 8.787 0.401 1.00 11.13 H new ATOM 425 N GLY A 30 -0.192 7.430 5.207 1.00 41.42 N ATOM 426 CA GLY A 30 -1.094 7.626 6.327 1.00 63.12 C ATOM 427 C GLY A 30 -2.036 6.453 6.531 1.00 60.41 C ATOM 428 O GLY A 30 -2.514 6.218 7.641 1.00 40.20 O ATOM 0 H GLY A 30 0.732 7.080 5.460 1.00 41.42 H new ATOM 0 HA2 GLY A 30 -0.511 7.781 7.235 1.00 63.12 H new ATOM 0 HA3 GLY A 30 -1.678 8.532 6.164 1.00 63.12 H new ATOM 432 N PHE A 31 -2.283 5.704 5.468 1.00 61.23 N ATOM 433 CA PHE A 31 -3.230 4.600 5.509 1.00 44.52 C ATOM 434 C PHE A 31 -2.514 3.272 5.728 1.00 11.00 C ATOM 435 O PHE A 31 -1.560 2.943 5.019 1.00 20.30 O ATOM 436 CB PHE A 31 -4.041 4.549 4.210 1.00 44.41 C ATOM 437 CG PHE A 31 -5.036 3.426 4.174 1.00 55.44 C ATOM 438 CD1 PHE A 31 -6.200 3.501 4.914 1.00 20.14 C ATOM 439 CD2 PHE A 31 -4.799 2.292 3.414 1.00 75.25 C ATOM 440 CE1 PHE A 31 -7.113 2.468 4.897 1.00 72.45 C ATOM 441 CE2 PHE A 31 -5.707 1.255 3.394 1.00 42.15 C ATOM 442 CZ PHE A 31 -6.868 1.344 4.137 1.00 11.15 C ATOM 0 H PHE A 31 -1.838 5.842 4.561 1.00 61.23 H new ATOM 0 HA PHE A 31 -3.907 4.767 6.347 1.00 44.52 H new ATOM 0 HB2 PHE A 31 -4.567 5.495 4.081 1.00 44.41 H new ATOM 0 HB3 PHE A 31 -3.358 4.447 3.367 1.00 44.41 H new ATOM 0 HD1 PHE A 31 -6.397 4.378 5.512 1.00 20.14 H new ATOM 0 HD2 PHE A 31 -3.893 2.220 2.831 1.00 75.25 H new ATOM 0 HE1 PHE A 31 -8.020 2.539 5.479 1.00 72.45 H new ATOM 0 HE2 PHE A 31 -5.511 0.375 2.799 1.00 42.15 H new ATOM 0 HZ PHE A 31 -7.583 0.534 4.123 1.00 11.15 H new ATOM 452 N LEU A 32 -2.982 2.528 6.716 1.00 42.35 N ATOM 453 CA LEU A 32 -2.477 1.191 6.989 1.00 53.35 C ATOM 454 C LEU A 32 -3.109 0.216 6.002 1.00 54.11 C ATOM 455 O LEU A 32 -4.307 -0.054 6.075 1.00 22.04 O ATOM 456 CB LEU A 32 -2.815 0.805 8.443 1.00 42.12 C ATOM 457 CG LEU A 32 -2.158 -0.469 9.003 1.00 14.41 C ATOM 458 CD1 LEU A 32 -2.756 -1.730 8.396 1.00 42.40 C ATOM 459 CD2 LEU A 32 -0.654 -0.435 8.786 1.00 3.01 C ATOM 0 H LEU A 32 -3.721 2.832 7.350 1.00 42.35 H new ATOM 0 HA LEU A 32 -1.394 1.159 6.870 1.00 53.35 H new ATOM 0 HB2 LEU A 32 -2.538 1.639 9.087 1.00 42.12 H new ATOM 0 HB3 LEU A 32 -3.896 0.689 8.519 1.00 42.12 H new ATOM 0 HG LEU A 32 -2.359 -0.495 10.074 1.00 14.41 H new ATOM 0 HD11 LEU A 32 -2.264 -2.606 8.819 1.00 42.40 H new ATOM 0 HD12 LEU A 32 -3.822 -1.770 8.618 1.00 42.40 H new ATOM 0 HD13 LEU A 32 -2.611 -1.718 7.316 1.00 42.40 H new ATOM 0 HD21 LEU A 32 -0.208 -1.344 9.189 1.00 3.01 H new ATOM 0 HD22 LEU A 32 -0.442 -0.368 7.719 1.00 3.01 H new ATOM 0 HD23 LEU A 32 -0.233 0.432 9.295 1.00 3.01 H new ATOM 471 N TYR A 33 -2.314 -0.296 5.071 1.00 20.53 N ATOM 472 CA TYR A 33 -2.850 -1.181 4.046 1.00 35.14 C ATOM 473 C TYR A 33 -2.454 -2.630 4.298 1.00 3.44 C ATOM 474 O TYR A 33 -3.022 -3.544 3.703 1.00 61.22 O ATOM 475 CB TYR A 33 -2.420 -0.733 2.637 1.00 4.45 C ATOM 476 CG TYR A 33 -0.951 -0.924 2.314 1.00 14.52 C ATOM 477 CD1 TYR A 33 -0.493 -2.115 1.764 1.00 3.15 C ATOM 478 CD2 TYR A 33 -0.030 0.089 2.538 1.00 24.42 C ATOM 479 CE1 TYR A 33 0.840 -2.292 1.451 1.00 13.44 C ATOM 480 CE2 TYR A 33 1.308 -0.081 2.228 1.00 63.32 C ATOM 481 CZ TYR A 33 1.736 -1.273 1.684 1.00 13.32 C ATOM 482 OH TYR A 33 3.065 -1.445 1.372 1.00 4.25 O ATOM 0 H TYR A 33 -1.312 -0.118 5.004 1.00 20.53 H new ATOM 0 HA TYR A 33 -3.937 -1.118 4.101 1.00 35.14 H new ATOM 0 HB2 TYR A 33 -3.010 -1.282 1.904 1.00 4.45 H new ATOM 0 HB3 TYR A 33 -2.666 0.322 2.519 1.00 4.45 H new ATOM 0 HD1 TYR A 33 -1.192 -2.917 1.578 1.00 3.15 H new ATOM 0 HD2 TYR A 33 -0.363 1.025 2.961 1.00 24.42 H new ATOM 0 HE1 TYR A 33 1.178 -3.225 1.025 1.00 13.44 H new ATOM 0 HE2 TYR A 33 2.013 0.716 2.411 1.00 63.32 H new ATOM 0 HH TYR A 33 3.148 -2.086 0.635 1.00 4.25 H new ATOM 492 N ALA A 34 -1.491 -2.847 5.186 1.00 10.42 N ATOM 493 CA ALA A 34 -1.039 -4.198 5.492 1.00 12.44 C ATOM 494 C ALA A 34 -0.275 -4.249 6.805 1.00 15.40 C ATOM 495 O ALA A 34 0.364 -3.277 7.206 1.00 31.21 O ATOM 496 CB ALA A 34 -0.173 -4.741 4.363 1.00 24.15 C ATOM 0 H ALA A 34 -1.011 -2.110 5.703 1.00 10.42 H new ATOM 0 HA ALA A 34 -1.926 -4.824 5.594 1.00 12.44 H new ATOM 0 HB1 ALA A 34 0.155 -5.751 4.610 1.00 24.15 H new ATOM 0 HB2 ALA A 34 -0.751 -4.763 3.439 1.00 24.15 H new ATOM 0 HB3 ALA A 34 0.698 -4.099 4.231 1.00 24.15 H new ATOM 502 N ILE A 35 -0.366 -5.385 7.477 1.00 51.43 N ATOM 503 CA ILE A 35 0.395 -5.632 8.690 1.00 34.22 C ATOM 504 C ILE A 35 1.179 -6.928 8.548 1.00 24.22 C ATOM 505 O ILE A 35 0.621 -7.965 8.186 1.00 62.11 O ATOM 506 CB ILE A 35 -0.510 -5.724 9.940 1.00 54.52 C ATOM 507 CG1 ILE A 35 -1.305 -4.430 10.121 1.00 72.51 C ATOM 508 CG2 ILE A 35 0.332 -6.002 11.179 1.00 3.23 C ATOM 509 CD1 ILE A 35 -2.270 -4.464 11.288 1.00 54.40 C ATOM 0 H ILE A 35 -0.968 -6.160 7.198 1.00 51.43 H new ATOM 0 HA ILE A 35 1.071 -4.788 8.826 1.00 34.22 H new ATOM 0 HB ILE A 35 -1.212 -6.546 9.800 1.00 54.52 H new ATOM 0 HG12 ILE A 35 -0.609 -3.603 10.261 1.00 72.51 H new ATOM 0 HG13 ILE A 35 -1.862 -4.226 9.207 1.00 72.51 H new ATOM 0 HG21 ILE A 35 -0.316 -6.065 12.053 1.00 3.23 H new ATOM 0 HG22 ILE A 35 0.864 -6.945 11.053 1.00 3.23 H new ATOM 0 HG23 ILE A 35 1.052 -5.195 11.318 1.00 3.23 H new ATOM 0 HD11 ILE A 35 -2.797 -3.512 11.352 1.00 54.40 H new ATOM 0 HD12 ILE A 35 -2.991 -5.268 11.141 1.00 54.40 H new ATOM 0 HD13 ILE A 35 -1.718 -4.636 12.212 1.00 54.40 H new ATOM 521 N LYS A 36 2.471 -6.862 8.811 1.00 32.21 N ATOM 522 CA LYS A 36 3.322 -8.033 8.729 1.00 44.11 C ATOM 523 C LYS A 36 3.805 -8.426 10.117 1.00 74.53 C ATOM 524 O LYS A 36 4.663 -7.764 10.691 1.00 32.30 O ATOM 525 CB LYS A 36 4.516 -7.754 7.817 1.00 51.23 C ATOM 526 CG LYS A 36 5.509 -8.901 7.730 1.00 15.31 C ATOM 527 CD LYS A 36 6.760 -8.488 6.976 1.00 0.45 C ATOM 528 CE LYS A 36 7.797 -9.599 6.964 1.00 5.23 C ATOM 529 NZ LYS A 36 9.089 -9.140 6.387 1.00 5.41 N ATOM 0 H LYS A 36 2.955 -6.007 9.084 1.00 32.21 H new ATOM 0 HA LYS A 36 2.745 -8.857 8.310 1.00 44.11 H new ATOM 0 HB2 LYS A 36 4.150 -7.527 6.816 1.00 51.23 H new ATOM 0 HB3 LYS A 36 5.034 -6.865 8.176 1.00 51.23 H new ATOM 0 HG2 LYS A 36 5.778 -9.229 8.734 1.00 15.31 H new ATOM 0 HG3 LYS A 36 5.044 -9.751 7.230 1.00 15.31 H new ATOM 0 HD2 LYS A 36 6.498 -8.223 5.952 1.00 0.45 H new ATOM 0 HD3 LYS A 36 7.186 -7.597 7.437 1.00 0.45 H new ATOM 0 HE2 LYS A 36 7.959 -9.956 7.981 1.00 5.23 H new ATOM 0 HE3 LYS A 36 7.420 -10.443 6.386 1.00 5.23 H new ATOM 0 HZ1 LYS A 36 9.852 -9.778 6.692 1.00 5.41 H new ATOM 0 HZ2 LYS A 36 9.027 -9.146 5.349 1.00 5.41 H new ATOM 0 HZ3 LYS A 36 9.293 -8.175 6.716 1.00 5.41 H new ATOM 543 N VAL A 37 3.243 -9.483 10.666 1.00 22.22 N ATOM 544 CA VAL A 37 3.683 -9.963 11.965 1.00 62.10 C ATOM 545 C VAL A 37 4.799 -10.960 11.762 1.00 22.40 C ATOM 546 O VAL A 37 4.647 -11.902 10.991 1.00 41.25 O ATOM 547 CB VAL A 37 2.560 -10.661 12.761 1.00 62.23 C ATOM 548 CG1 VAL A 37 2.945 -10.806 14.227 1.00 3.14 C ATOM 549 CG2 VAL A 37 1.246 -9.924 12.627 1.00 60.13 C ATOM 0 H VAL A 37 2.489 -10.023 10.241 1.00 22.22 H new ATOM 0 HA VAL A 37 4.007 -9.093 12.535 1.00 62.10 H new ATOM 0 HB VAL A 37 2.428 -11.657 12.338 1.00 62.23 H new ATOM 0 HG11 VAL A 37 2.138 -11.301 14.768 1.00 3.14 H new ATOM 0 HG12 VAL A 37 3.854 -11.402 14.307 1.00 3.14 H new ATOM 0 HG13 VAL A 37 3.119 -9.820 14.657 1.00 3.14 H new ATOM 0 HG21 VAL A 37 0.478 -10.443 13.200 1.00 60.13 H new ATOM 0 HG22 VAL A 37 1.358 -8.908 13.007 1.00 60.13 H new ATOM 0 HG23 VAL A 37 0.954 -9.889 11.577 1.00 60.13 H new ATOM 559 N VAL A 38 5.923 -10.746 12.421 1.00 11.41 N ATOM 560 CA VAL A 38 6.994 -11.727 12.410 1.00 71.20 C ATOM 561 C VAL A 38 7.192 -12.297 13.816 1.00 3.11 C ATOM 562 O VAL A 38 8.126 -11.913 14.523 1.00 73.22 O ATOM 563 CB VAL A 38 8.329 -11.130 11.900 1.00 14.45 C ATOM 564 CG1 VAL A 38 9.370 -12.224 11.695 1.00 23.50 C ATOM 565 CG2 VAL A 38 8.111 -10.342 10.614 1.00 23.12 C ATOM 0 H VAL A 38 6.118 -9.907 12.968 1.00 11.41 H new ATOM 0 HA VAL A 38 6.701 -12.520 11.722 1.00 71.20 H new ATOM 0 HB VAL A 38 8.706 -10.444 12.659 1.00 14.45 H new ATOM 0 HG11 VAL A 38 10.299 -11.780 11.337 1.00 23.50 H new ATOM 0 HG12 VAL A 38 9.553 -12.734 12.641 1.00 23.50 H new ATOM 0 HG13 VAL A 38 9.004 -12.942 10.961 1.00 23.50 H new ATOM 0 HG21 VAL A 38 9.061 -9.931 10.273 1.00 23.12 H new ATOM 0 HG22 VAL A 38 7.705 -11.002 9.847 1.00 23.12 H new ATOM 0 HG23 VAL A 38 7.410 -9.528 10.800 1.00 23.12 H new ATOM 575 N PRO A 39 6.271 -13.165 14.275 1.00 32.14 N ATOM 576 CA PRO A 39 6.405 -13.824 15.566 1.00 31.45 C ATOM 577 C PRO A 39 7.397 -14.977 15.535 1.00 34.10 C ATOM 578 O PRO A 39 7.360 -15.825 14.645 1.00 1.41 O ATOM 579 CB PRO A 39 4.996 -14.335 15.871 1.00 20.15 C ATOM 580 CG PRO A 39 4.317 -14.465 14.550 1.00 65.42 C ATOM 581 CD PRO A 39 5.011 -13.528 13.597 1.00 22.31 C ATOM 0 HA PRO A 39 6.791 -13.141 16.323 1.00 31.45 H new ATOM 0 HB2 PRO A 39 5.031 -15.294 16.389 1.00 20.15 H new ATOM 0 HB3 PRO A 39 4.460 -13.642 16.520 1.00 20.15 H new ATOM 0 HG2 PRO A 39 4.373 -15.492 14.189 1.00 65.42 H new ATOM 0 HG3 PRO A 39 3.260 -14.214 14.635 1.00 65.42 H new ATOM 0 HD2 PRO A 39 5.202 -14.009 12.638 1.00 22.31 H new ATOM 0 HD3 PRO A 39 4.402 -12.647 13.395 1.00 22.31 H new ATOM 589 N LYS A 40 8.286 -14.992 16.517 1.00 2.41 N ATOM 590 CA LYS A 40 9.236 -16.085 16.683 1.00 13.50 C ATOM 591 C LYS A 40 8.500 -17.393 16.911 1.00 52.11 C ATOM 592 O LYS A 40 8.994 -18.473 16.591 1.00 61.43 O ATOM 593 CB LYS A 40 10.160 -15.808 17.864 1.00 12.44 C ATOM 594 CG LYS A 40 11.058 -14.607 17.655 1.00 24.50 C ATOM 595 CD LYS A 40 12.107 -14.512 18.740 1.00 70.20 C ATOM 596 CE LYS A 40 13.012 -15.732 18.754 1.00 23.52 C ATOM 597 NZ LYS A 40 14.131 -15.577 19.718 1.00 23.33 N ATOM 0 H LYS A 40 8.370 -14.254 17.216 1.00 2.41 H new ATOM 0 HA LYS A 40 9.831 -16.163 15.773 1.00 13.50 H new ATOM 0 HB2 LYS A 40 9.557 -15.651 18.758 1.00 12.44 H new ATOM 0 HB3 LYS A 40 10.778 -16.687 18.047 1.00 12.44 H new ATOM 0 HG2 LYS A 40 11.543 -14.678 16.682 1.00 24.50 H new ATOM 0 HG3 LYS A 40 10.457 -13.698 17.646 1.00 24.50 H new ATOM 0 HD2 LYS A 40 12.707 -13.615 18.588 1.00 70.20 H new ATOM 0 HD3 LYS A 40 11.620 -14.409 19.710 1.00 70.20 H new ATOM 0 HE2 LYS A 40 12.428 -16.615 19.014 1.00 23.52 H new ATOM 0 HE3 LYS A 40 13.414 -15.898 17.754 1.00 23.52 H new ATOM 0 HZ1 LYS A 40 14.726 -16.430 19.699 1.00 23.33 H new ATOM 0 HZ2 LYS A 40 14.703 -14.749 19.456 1.00 23.33 H new ATOM 0 HZ3 LYS A 40 13.748 -15.444 20.676 1.00 23.33 H new ATOM 611 N HIS A 41 7.314 -17.282 17.484 1.00 3.14 N ATOM 612 CA HIS A 41 6.473 -18.436 17.729 1.00 20.42 C ATOM 613 C HIS A 41 5.182 -18.275 16.945 1.00 13.45 C ATOM 614 O HIS A 41 4.255 -17.596 17.385 1.00 24.21 O ATOM 615 CB HIS A 41 6.198 -18.592 19.228 1.00 74.53 C ATOM 616 CG HIS A 41 7.452 -18.683 20.049 1.00 15.43 C ATOM 617 ND1 HIS A 41 8.048 -19.876 20.394 1.00 43.10 N ATOM 618 CD2 HIS A 41 8.250 -17.710 20.555 1.00 73.11 C ATOM 619 CE1 HIS A 41 9.158 -19.632 21.069 1.00 13.51 C ATOM 620 NE2 HIS A 41 9.300 -18.327 21.180 1.00 63.44 N ATOM 0 H HIS A 41 6.911 -16.396 17.790 1.00 3.14 H new ATOM 0 HA HIS A 41 6.981 -19.342 17.397 1.00 20.42 H new ATOM 0 HB2 HIS A 41 5.605 -17.745 19.573 1.00 74.53 H new ATOM 0 HB3 HIS A 41 5.598 -19.488 19.390 1.00 74.53 H new ATOM 0 HD2 HIS A 41 8.087 -16.645 20.479 1.00 73.11 H new ATOM 0 HE1 HIS A 41 9.834 -20.376 21.463 1.00 13.51 H new ATOM 0 HE2 HIS A 41 10.068 -17.853 21.655 1.00 63.44 H new ATOM 629 N GLY A 42 5.161 -18.858 15.754 1.00 51.21 N ATOM 630 CA GLY A 42 4.035 -18.696 14.856 1.00 52.41 C ATOM 631 C GLY A 42 4.489 -18.389 13.445 1.00 15.43 C ATOM 632 O GLY A 42 3.830 -18.776 12.480 1.00 73.32 O ATOM 0 H GLY A 42 5.912 -19.446 15.391 1.00 51.21 H new ATOM 0 HA2 GLY A 42 3.435 -19.606 14.856 1.00 52.41 H new ATOM 0 HA3 GLY A 42 3.394 -17.891 15.216 1.00 52.41 H new ATOM 636 N LYS A 43 5.631 -17.702 13.347 1.00 60.21 N ATOM 637 CA LYS A 43 6.265 -17.359 12.067 1.00 33.43 C ATOM 638 C LYS A 43 5.525 -16.234 11.336 1.00 21.44 C ATOM 639 O LYS A 43 4.330 -16.022 11.544 1.00 21.32 O ATOM 640 CB LYS A 43 6.424 -18.600 11.180 1.00 41.23 C ATOM 641 CG LYS A 43 7.498 -19.553 11.687 1.00 52.55 C ATOM 642 CD LYS A 43 8.861 -18.876 11.728 1.00 12.43 C ATOM 643 CE LYS A 43 9.926 -19.768 12.347 1.00 15.23 C ATOM 644 NZ LYS A 43 10.066 -21.058 11.629 1.00 51.44 N ATOM 0 H LYS A 43 6.147 -17.365 14.160 1.00 60.21 H new ATOM 0 HA LYS A 43 7.262 -16.980 12.293 1.00 33.43 H new ATOM 0 HB2 LYS A 43 5.472 -19.128 11.127 1.00 41.23 H new ATOM 0 HB3 LYS A 43 6.672 -18.287 10.166 1.00 41.23 H new ATOM 0 HG2 LYS A 43 7.234 -19.905 12.684 1.00 52.55 H new ATOM 0 HG3 LYS A 43 7.544 -20.430 11.041 1.00 52.55 H new ATOM 0 HD2 LYS A 43 9.160 -18.604 10.716 1.00 12.43 H new ATOM 0 HD3 LYS A 43 8.788 -17.950 12.299 1.00 12.43 H new ATOM 0 HE2 LYS A 43 10.883 -19.246 12.341 1.00 15.23 H new ATOM 0 HE3 LYS A 43 9.674 -19.961 13.390 1.00 15.23 H new ATOM 0 HZ1 LYS A 43 10.880 -21.581 12.011 1.00 51.44 H new ATOM 0 HZ2 LYS A 43 9.201 -21.622 11.756 1.00 51.44 H new ATOM 0 HZ3 LYS A 43 10.215 -20.877 10.616 1.00 51.44 H new ATOM 658 N PRO A 44 6.249 -15.474 10.487 1.00 25.05 N ATOM 659 CA PRO A 44 5.712 -14.279 9.825 1.00 63.21 C ATOM 660 C PRO A 44 4.545 -14.557 8.884 1.00 63.53 C ATOM 661 O PRO A 44 4.599 -15.457 8.045 1.00 11.35 O ATOM 662 CB PRO A 44 6.903 -13.727 9.034 1.00 42.12 C ATOM 663 CG PRO A 44 7.836 -14.875 8.884 1.00 64.14 C ATOM 664 CD PRO A 44 7.655 -15.714 10.115 1.00 74.34 C ATOM 0 HA PRO A 44 5.303 -13.590 10.564 1.00 63.21 H new ATOM 0 HB2 PRO A 44 6.588 -13.346 8.063 1.00 42.12 H new ATOM 0 HB3 PRO A 44 7.378 -12.900 9.562 1.00 42.12 H new ATOM 0 HG2 PRO A 44 7.610 -15.447 7.984 1.00 64.14 H new ATOM 0 HG3 PRO A 44 8.867 -14.532 8.793 1.00 64.14 H new ATOM 0 HD2 PRO A 44 7.843 -16.769 9.914 1.00 74.34 H new ATOM 0 HD3 PRO A 44 8.338 -15.414 10.910 1.00 74.34 H new ATOM 672 N TYR A 45 3.497 -13.757 9.024 1.00 2.41 N ATOM 673 CA TYR A 45 2.347 -13.828 8.139 1.00 31.54 C ATOM 674 C TYR A 45 1.851 -12.420 7.818 1.00 14.31 C ATOM 675 O TYR A 45 2.070 -11.486 8.592 1.00 72.13 O ATOM 676 CB TYR A 45 1.223 -14.677 8.751 1.00 25.34 C ATOM 677 CG TYR A 45 0.652 -14.138 10.048 1.00 51.43 C ATOM 678 CD1 TYR A 45 1.274 -14.393 11.266 1.00 32.44 C ATOM 679 CD2 TYR A 45 -0.520 -13.390 10.056 1.00 41.35 C ATOM 680 CE1 TYR A 45 0.748 -13.914 12.451 1.00 41.32 C ATOM 681 CE2 TYR A 45 -1.053 -12.911 11.237 1.00 53.24 C ATOM 682 CZ TYR A 45 -0.416 -13.174 12.431 1.00 34.42 C ATOM 683 OH TYR A 45 -0.953 -12.704 13.608 1.00 23.33 O ATOM 0 H TYR A 45 3.422 -13.045 9.750 1.00 2.41 H new ATOM 0 HA TYR A 45 2.655 -14.314 7.213 1.00 31.54 H new ATOM 0 HB2 TYR A 45 0.416 -14.764 8.024 1.00 25.34 H new ATOM 0 HB3 TYR A 45 1.602 -15.683 8.928 1.00 25.34 H new ATOM 0 HD1 TYR A 45 2.183 -14.975 11.286 1.00 32.44 H new ATOM 0 HD2 TYR A 45 -1.022 -13.180 9.123 1.00 41.35 H new ATOM 0 HE1 TYR A 45 1.246 -14.118 13.388 1.00 41.32 H new ATOM 0 HE2 TYR A 45 -1.965 -12.333 11.225 1.00 53.24 H new ATOM 0 HH TYR A 45 -1.772 -12.201 13.416 1.00 23.33 H new ATOM 693 N PHE A 46 1.191 -12.268 6.674 1.00 73.42 N ATOM 694 CA PHE A 46 0.749 -10.953 6.215 1.00 73.22 C ATOM 695 C PHE A 46 -0.761 -10.788 6.356 1.00 50.32 C ATOM 696 O PHE A 46 -1.528 -11.707 6.052 1.00 44.34 O ATOM 697 CB PHE A 46 1.140 -10.737 4.748 1.00 44.21 C ATOM 698 CG PHE A 46 2.622 -10.681 4.499 1.00 65.23 C ATOM 699 CD1 PHE A 46 3.353 -11.843 4.310 1.00 13.42 C ATOM 700 CD2 PHE A 46 3.281 -9.462 4.441 1.00 32.40 C ATOM 701 CE1 PHE A 46 4.713 -11.791 4.069 1.00 71.22 C ATOM 702 CE2 PHE A 46 4.642 -9.405 4.202 1.00 40.02 C ATOM 703 CZ PHE A 46 5.358 -10.570 4.016 1.00 33.44 C ATOM 0 H PHE A 46 0.950 -13.037 6.048 1.00 73.42 H new ATOM 0 HA PHE A 46 1.242 -10.211 6.842 1.00 73.22 H new ATOM 0 HB2 PHE A 46 0.714 -11.542 4.149 1.00 44.21 H new ATOM 0 HB3 PHE A 46 0.690 -9.808 4.398 1.00 44.21 H new ATOM 0 HD1 PHE A 46 2.854 -12.800 4.351 1.00 13.42 H new ATOM 0 HD2 PHE A 46 2.725 -8.547 4.584 1.00 32.40 H new ATOM 0 HE1 PHE A 46 5.271 -12.704 3.922 1.00 71.22 H new ATOM 0 HE2 PHE A 46 5.144 -8.450 4.161 1.00 40.02 H new ATOM 0 HZ PHE A 46 6.421 -10.528 3.829 1.00 33.44 H new ATOM 713 N LEU A 47 -1.173 -9.622 6.834 1.00 4.15 N ATOM 714 CA LEU A 47 -2.580 -9.237 6.859 1.00 60.14 C ATOM 715 C LEU A 47 -2.791 -7.994 6.007 1.00 12.21 C ATOM 716 O LEU A 47 -2.380 -6.898 6.385 1.00 53.32 O ATOM 717 CB LEU A 47 -3.055 -8.956 8.288 1.00 3.02 C ATOM 718 CG LEU A 47 -3.241 -10.181 9.183 1.00 43.04 C ATOM 719 CD1 LEU A 47 -3.722 -9.758 10.561 1.00 2.41 C ATOM 720 CD2 LEU A 47 -4.228 -11.148 8.559 1.00 25.10 C ATOM 0 H LEU A 47 -0.543 -8.916 7.215 1.00 4.15 H new ATOM 0 HA LEU A 47 -3.161 -10.067 6.458 1.00 60.14 H new ATOM 0 HB2 LEU A 47 -2.337 -8.288 8.764 1.00 3.02 H new ATOM 0 HB3 LEU A 47 -4.003 -8.421 8.236 1.00 3.02 H new ATOM 0 HG LEU A 47 -2.279 -10.684 9.286 1.00 43.04 H new ATOM 0 HD11 LEU A 47 -3.850 -10.640 11.188 1.00 2.41 H new ATOM 0 HD12 LEU A 47 -2.987 -9.094 11.015 1.00 2.41 H new ATOM 0 HD13 LEU A 47 -4.675 -9.236 10.470 1.00 2.41 H new ATOM 0 HD21 LEU A 47 -4.349 -12.015 9.209 1.00 25.10 H new ATOM 0 HD22 LEU A 47 -5.191 -10.653 8.431 1.00 25.10 H new ATOM 0 HD23 LEU A 47 -3.855 -11.472 7.588 1.00 25.10 H new ATOM 732 N VAL A 48 -3.418 -8.164 4.857 1.00 21.25 N ATOM 733 CA VAL A 48 -3.663 -7.046 3.957 1.00 11.01 C ATOM 734 C VAL A 48 -5.060 -6.477 4.184 1.00 51.13 C ATOM 735 O VAL A 48 -6.022 -7.226 4.323 1.00 52.25 O ATOM 736 CB VAL A 48 -3.515 -7.474 2.481 1.00 53.25 C ATOM 737 CG1 VAL A 48 -3.696 -6.288 1.544 1.00 24.02 C ATOM 738 CG2 VAL A 48 -2.166 -8.136 2.250 1.00 61.50 C ATOM 0 H VAL A 48 -3.767 -9.062 4.523 1.00 21.25 H new ATOM 0 HA VAL A 48 -2.919 -6.279 4.173 1.00 11.01 H new ATOM 0 HB VAL A 48 -4.299 -8.198 2.261 1.00 53.25 H new ATOM 0 HG11 VAL A 48 -3.586 -6.620 0.512 1.00 24.02 H new ATOM 0 HG12 VAL A 48 -4.689 -5.862 1.684 1.00 24.02 H new ATOM 0 HG13 VAL A 48 -2.942 -5.532 1.764 1.00 24.02 H new ATOM 0 HG21 VAL A 48 -2.080 -8.431 1.204 1.00 61.50 H new ATOM 0 HG22 VAL A 48 -1.369 -7.434 2.496 1.00 61.50 H new ATOM 0 HG23 VAL A 48 -2.080 -9.018 2.884 1.00 61.50 H new ATOM 748 N ARG A 49 -5.164 -5.158 4.248 1.00 52.20 N ATOM 749 CA ARG A 49 -6.449 -4.500 4.401 1.00 75.14 C ATOM 750 C ARG A 49 -7.279 -4.671 3.136 1.00 33.24 C ATOM 751 O ARG A 49 -6.855 -4.288 2.049 1.00 2.44 O ATOM 752 CB ARG A 49 -6.242 -3.012 4.699 1.00 13.05 C ATOM 753 CG ARG A 49 -7.530 -2.206 4.772 1.00 54.40 C ATOM 754 CD ARG A 49 -8.421 -2.651 5.924 1.00 21.23 C ATOM 755 NE ARG A 49 -7.756 -2.547 7.230 1.00 63.04 N ATOM 756 CZ ARG A 49 -7.359 -1.398 7.787 1.00 43.03 C ATOM 757 NH1 ARG A 49 -7.484 -0.252 7.133 1.00 74.12 N ATOM 758 NH2 ARG A 49 -6.834 -1.394 9.004 1.00 73.12 N ATOM 0 H ARG A 49 -4.369 -4.521 4.196 1.00 52.20 H new ATOM 0 HA ARG A 49 -6.983 -4.956 5.234 1.00 75.14 H new ATOM 0 HB2 ARG A 49 -5.710 -2.913 5.645 1.00 13.05 H new ATOM 0 HB3 ARG A 49 -5.602 -2.584 3.928 1.00 13.05 H new ATOM 0 HG2 ARG A 49 -7.289 -1.149 4.888 1.00 54.40 H new ATOM 0 HG3 ARG A 49 -8.074 -2.308 3.833 1.00 54.40 H new ATOM 0 HD2 ARG A 49 -9.326 -2.044 5.933 1.00 21.23 H new ATOM 0 HD3 ARG A 49 -8.731 -3.683 5.760 1.00 21.23 H new ATOM 0 HE ARG A 49 -7.586 -3.410 7.747 1.00 63.04 H new ATOM 0 HH11 ARG A 49 -7.886 -0.241 6.196 1.00 74.12 H new ATOM 0 HH12 ARG A 49 -7.178 0.619 7.567 1.00 74.12 H new ATOM 0 HH21 ARG A 49 -6.732 -2.269 9.518 1.00 73.12 H new ATOM 0 HH22 ARG A 49 -6.532 -0.516 9.426 1.00 73.12 H new ATOM 772 N ALA A 50 -8.457 -5.257 3.286 1.00 12.42 N ATOM 773 CA ALA A 50 -9.344 -5.471 2.154 1.00 3.01 C ATOM 774 C ALA A 50 -9.983 -4.158 1.711 1.00 72.23 C ATOM 775 O ALA A 50 -10.059 -3.199 2.490 1.00 14.21 O ATOM 776 CB ALA A 50 -10.411 -6.498 2.502 1.00 52.24 C ATOM 0 H ALA A 50 -8.820 -5.592 4.178 1.00 12.42 H new ATOM 0 HA ALA A 50 -8.753 -5.856 1.323 1.00 3.01 H new ATOM 0 HB1 ALA A 50 -11.067 -6.647 1.644 1.00 52.24 H new ATOM 0 HB2 ALA A 50 -9.935 -7.443 2.763 1.00 52.24 H new ATOM 0 HB3 ALA A 50 -10.997 -6.141 3.349 1.00 52.24 H new ATOM 782 N ASP A 51 -10.438 -4.129 0.461 1.00 3.35 N ATOM 783 CA ASP A 51 -11.071 -2.942 -0.113 1.00 24.32 C ATOM 784 C ASP A 51 -12.215 -2.452 0.761 1.00 42.25 C ATOM 785 O ASP A 51 -12.925 -3.245 1.386 1.00 54.51 O ATOM 786 CB ASP A 51 -11.583 -3.232 -1.532 1.00 42.44 C ATOM 787 CG ASP A 51 -12.437 -4.486 -1.610 1.00 63.14 C ATOM 788 OD1 ASP A 51 -11.867 -5.586 -1.798 1.00 50.21 O ATOM 789 OD2 ASP A 51 -13.677 -4.381 -1.496 1.00 33.00 O ATOM 0 H ASP A 51 -10.380 -4.921 -0.179 1.00 3.35 H new ATOM 0 HA ASP A 51 -10.316 -2.158 -0.163 1.00 24.32 H new ATOM 0 HB2 ASP A 51 -12.165 -2.380 -1.883 1.00 42.44 H new ATOM 0 HB3 ASP A 51 -10.732 -3.336 -2.205 1.00 42.44 H new ATOM 794 N GLY A 52 -12.364 -1.138 0.833 1.00 30.32 N ATOM 795 CA GLY A 52 -13.404 -0.554 1.655 1.00 3.22 C ATOM 796 C GLY A 52 -12.887 -0.145 3.017 1.00 73.22 C ATOM 797 O GLY A 52 -13.338 0.849 3.583 1.00 63.20 O ATOM 0 H GLY A 52 -11.782 -0.464 0.336 1.00 30.32 H new ATOM 0 HA2 GLY A 52 -13.820 0.317 1.149 1.00 3.22 H new ATOM 0 HA3 GLY A 52 -14.216 -1.271 1.776 1.00 3.22 H new ATOM 801 N SER A 53 -11.930 -0.917 3.533 1.00 60.23 N ATOM 802 CA SER A 53 -11.310 -0.640 4.826 1.00 75.13 C ATOM 803 C SER A 53 -12.338 -0.724 5.956 1.00 43.12 C ATOM 804 O SER A 53 -12.276 0.029 6.926 1.00 62.33 O ATOM 805 CB SER A 53 -10.635 0.740 4.809 1.00 31.15 C ATOM 806 OG SER A 53 -9.849 0.942 5.970 1.00 71.42 O ATOM 0 H SER A 53 -11.565 -1.748 3.068 1.00 60.23 H new ATOM 0 HA SER A 53 -10.548 -1.398 5.009 1.00 75.13 H new ATOM 0 HB2 SER A 53 -10.008 0.830 3.922 1.00 31.15 H new ATOM 0 HB3 SER A 53 -11.395 1.518 4.742 1.00 31.15 H new ATOM 0 HG SER A 53 -10.388 0.755 6.767 1.00 71.42 H new ATOM 812 N ASP A 54 -13.250 -1.685 5.850 1.00 13.04 N ATOM 813 CA ASP A 54 -14.310 -1.857 6.842 1.00 73.35 C ATOM 814 C ASP A 54 -13.765 -2.518 8.112 1.00 14.31 C ATOM 815 O ASP A 54 -14.470 -2.678 9.107 1.00 2.23 O ATOM 816 CB ASP A 54 -15.447 -2.694 6.241 1.00 41.02 C ATOM 817 CG ASP A 54 -16.607 -2.912 7.192 1.00 31.51 C ATOM 818 OD1 ASP A 54 -17.359 -1.948 7.450 1.00 33.11 O ATOM 819 OD2 ASP A 54 -16.788 -4.056 7.662 1.00 45.12 O ATOM 0 H ASP A 54 -13.278 -2.359 5.085 1.00 13.04 H new ATOM 0 HA ASP A 54 -14.698 -0.876 7.117 1.00 73.35 H new ATOM 0 HB2 ASP A 54 -15.814 -2.201 5.341 1.00 41.02 H new ATOM 0 HB3 ASP A 54 -15.052 -3.663 5.935 1.00 41.02 H new ATOM 824 N GLY A 55 -12.492 -2.882 8.075 1.00 40.11 N ATOM 825 CA GLY A 55 -11.878 -3.535 9.213 1.00 2.11 C ATOM 826 C GLY A 55 -11.542 -4.976 8.915 1.00 3.15 C ATOM 827 O GLY A 55 -11.065 -5.709 9.782 1.00 54.20 O ATOM 0 H GLY A 55 -11.873 -2.737 7.277 1.00 40.11 H new ATOM 0 HA2 GLY A 55 -10.971 -3.000 9.494 1.00 2.11 H new ATOM 0 HA3 GLY A 55 -12.553 -3.488 10.068 1.00 2.11 H new ATOM 831 N ASN A 56 -11.805 -5.382 7.684 1.00 20.32 N ATOM 832 CA ASN A 56 -11.513 -6.735 7.245 1.00 35.35 C ATOM 833 C ASN A 56 -10.072 -6.840 6.763 1.00 64.25 C ATOM 834 O ASN A 56 -9.584 -5.981 6.019 1.00 71.32 O ATOM 835 CB ASN A 56 -12.465 -7.145 6.120 1.00 45.44 C ATOM 836 CG ASN A 56 -12.194 -8.552 5.615 1.00 51.22 C ATOM 837 OD1 ASN A 56 -11.799 -9.436 6.375 1.00 73.22 O ATOM 838 ND2 ASN A 56 -12.397 -8.768 4.328 1.00 63.14 N ATOM 0 H ASN A 56 -12.223 -4.789 6.967 1.00 20.32 H new ATOM 0 HA ASN A 56 -11.652 -7.407 8.092 1.00 35.35 H new ATOM 0 HB2 ASN A 56 -13.493 -7.082 6.477 1.00 45.44 H new ATOM 0 HB3 ASN A 56 -12.371 -6.441 5.293 1.00 45.44 H new ATOM 0 HD21 ASN A 56 -12.226 -9.693 3.933 1.00 63.14 H new ATOM 0 HD22 ASN A 56 -12.725 -8.010 3.729 1.00 63.14 H new ATOM 845 N PHE A 57 -9.397 -7.888 7.194 1.00 30.21 N ATOM 846 CA PHE A 57 -8.044 -8.160 6.750 1.00 43.15 C ATOM 847 C PHE A 57 -8.001 -9.464 5.978 1.00 1.22 C ATOM 848 O PHE A 57 -8.726 -10.409 6.289 1.00 43.11 O ATOM 849 CB PHE A 57 -7.073 -8.223 7.933 1.00 54.23 C ATOM 850 CG PHE A 57 -6.645 -6.877 8.444 1.00 63.44 C ATOM 851 CD1 PHE A 57 -7.431 -6.174 9.341 1.00 4.30 C ATOM 852 CD2 PHE A 57 -5.448 -6.317 8.027 1.00 32.02 C ATOM 853 CE1 PHE A 57 -7.032 -4.938 9.813 1.00 22.22 C ATOM 854 CE2 PHE A 57 -5.043 -5.085 8.496 1.00 35.40 C ATOM 855 CZ PHE A 57 -5.836 -4.394 9.389 1.00 70.45 C ATOM 0 H PHE A 57 -9.767 -8.570 7.856 1.00 30.21 H new ATOM 0 HA PHE A 57 -7.734 -7.343 6.098 1.00 43.15 H new ATOM 0 HB2 PHE A 57 -7.543 -8.777 8.746 1.00 54.23 H new ATOM 0 HB3 PHE A 57 -6.188 -8.785 7.634 1.00 54.23 H new ATOM 0 HD1 PHE A 57 -8.367 -6.596 9.676 1.00 4.30 H new ATOM 0 HD2 PHE A 57 -4.825 -6.852 7.326 1.00 32.02 H new ATOM 0 HE1 PHE A 57 -7.654 -4.399 10.512 1.00 22.22 H new ATOM 0 HE2 PHE A 57 -4.106 -4.662 8.165 1.00 35.40 H new ATOM 0 HZ PHE A 57 -5.521 -3.428 9.756 1.00 70.45 H new ATOM 865 N ILE A 58 -7.165 -9.503 4.964 1.00 43.52 N ATOM 866 CA ILE A 58 -6.973 -10.703 4.183 1.00 1.10 C ATOM 867 C ILE A 58 -5.635 -11.326 4.538 1.00 23.13 C ATOM 868 O ILE A 58 -4.570 -10.809 4.192 1.00 73.22 O ATOM 869 CB ILE A 58 -7.057 -10.430 2.664 1.00 2.32 C ATOM 870 CG1 ILE A 58 -8.448 -9.892 2.298 1.00 22.24 C ATOM 871 CG2 ILE A 58 -6.744 -11.695 1.870 1.00 40.13 C ATOM 872 CD1 ILE A 58 -9.591 -10.818 2.684 1.00 12.42 C ATOM 0 H ILE A 58 -6.603 -8.708 4.660 1.00 43.52 H new ATOM 0 HA ILE A 58 -7.779 -11.396 4.425 1.00 1.10 H new ATOM 0 HB ILE A 58 -6.313 -9.676 2.406 1.00 2.32 H new ATOM 0 HG12 ILE A 58 -8.594 -8.929 2.787 1.00 22.24 H new ATOM 0 HG13 ILE A 58 -8.486 -9.713 1.223 1.00 22.24 H new ATOM 0 HG21 ILE A 58 -6.809 -11.480 0.803 1.00 40.13 H new ATOM 0 HG22 ILE A 58 -5.737 -12.036 2.111 1.00 40.13 H new ATOM 0 HG23 ILE A 58 -7.462 -12.473 2.128 1.00 40.13 H new ATOM 0 HD11 ILE A 58 -10.539 -10.367 2.392 1.00 12.42 H new ATOM 0 HD12 ILE A 58 -9.472 -11.774 2.175 1.00 12.42 H new ATOM 0 HD13 ILE A 58 -9.582 -10.977 3.762 1.00 12.42 H new ATOM 884 N ARG A 59 -5.714 -12.406 5.286 1.00 33.13 N ATOM 885 CA ARG A 59 -4.547 -13.141 5.727 1.00 62.14 C ATOM 886 C ARG A 59 -3.905 -13.834 4.536 1.00 21.15 C ATOM 887 O ARG A 59 -4.540 -14.645 3.884 1.00 71.54 O ATOM 888 CB ARG A 59 -4.999 -14.153 6.788 1.00 61.15 C ATOM 889 CG ARG A 59 -3.911 -15.018 7.398 1.00 11.32 C ATOM 890 CD ARG A 59 -4.463 -15.781 8.598 1.00 22.24 C ATOM 891 NE ARG A 59 -3.640 -16.928 8.977 1.00 40.52 N ATOM 892 CZ ARG A 59 -3.411 -17.302 10.235 1.00 24.12 C ATOM 893 NH1 ARG A 59 -3.906 -16.599 11.251 1.00 32.31 N ATOM 894 NH2 ARG A 59 -2.699 -18.396 10.467 1.00 5.13 N ATOM 0 H ARG A 59 -6.597 -12.802 5.608 1.00 33.13 H new ATOM 0 HA ARG A 59 -3.803 -12.474 6.162 1.00 62.14 H new ATOM 0 HB2 ARG A 59 -5.494 -13.608 7.592 1.00 61.15 H new ATOM 0 HB3 ARG A 59 -5.746 -14.808 6.340 1.00 61.15 H new ATOM 0 HG2 ARG A 59 -3.532 -15.719 6.654 1.00 11.32 H new ATOM 0 HG3 ARG A 59 -3.071 -14.396 7.707 1.00 11.32 H new ATOM 0 HD2 ARG A 59 -4.542 -15.102 9.447 1.00 22.24 H new ATOM 0 HD3 ARG A 59 -5.472 -16.125 8.369 1.00 22.24 H new ATOM 0 HE ARG A 59 -3.214 -17.477 8.231 1.00 40.52 H new ATOM 0 HH11 ARG A 59 -4.466 -15.766 11.070 1.00 32.31 H new ATOM 0 HH12 ARG A 59 -3.725 -16.893 12.211 1.00 32.31 H new ATOM 0 HH21 ARG A 59 -2.333 -18.941 9.687 1.00 5.13 H new ATOM 0 HH22 ARG A 59 -2.517 -18.692 11.426 1.00 5.13 H new ATOM 908 N SER A 60 -2.654 -13.506 4.247 1.00 4.11 N ATOM 909 CA SER A 60 -1.956 -14.096 3.108 1.00 52.24 C ATOM 910 C SER A 60 -1.809 -15.608 3.297 1.00 71.22 C ATOM 911 O SER A 60 -1.578 -16.354 2.345 1.00 14.54 O ATOM 912 CB SER A 60 -0.584 -13.438 2.933 1.00 12.12 C ATOM 913 OG SER A 60 -0.012 -13.777 1.686 1.00 34.24 O ATOM 0 H SER A 60 -2.101 -12.837 4.782 1.00 4.11 H new ATOM 0 HA SER A 60 -2.543 -13.920 2.207 1.00 52.24 H new ATOM 0 HB2 SER A 60 -0.684 -12.355 3.008 1.00 12.12 H new ATOM 0 HB3 SER A 60 0.079 -13.753 3.738 1.00 12.12 H new ATOM 0 HG SER A 60 0.862 -13.343 1.598 1.00 34.24 H new ATOM 919 N ASP A 61 -1.959 -16.044 4.540 1.00 34.13 N ATOM 920 CA ASP A 61 -1.945 -17.459 4.890 1.00 33.20 C ATOM 921 C ASP A 61 -3.246 -18.131 4.453 1.00 45.24 C ATOM 922 O ASP A 61 -3.275 -19.319 4.133 1.00 10.41 O ATOM 923 CB ASP A 61 -1.768 -17.590 6.402 1.00 72.31 C ATOM 924 CG ASP A 61 -1.844 -19.015 6.902 1.00 74.50 C ATOM 925 OD1 ASP A 61 -1.051 -19.856 6.447 1.00 63.34 O ATOM 926 OD2 ASP A 61 -2.686 -19.282 7.783 1.00 43.34 O ATOM 0 H ASP A 61 -2.095 -15.424 5.338 1.00 34.13 H new ATOM 0 HA ASP A 61 -1.120 -17.952 4.377 1.00 33.20 H new ATOM 0 HB2 ASP A 61 -0.804 -17.166 6.684 1.00 72.31 H new ATOM 0 HB3 ASP A 61 -2.535 -16.998 6.901 1.00 72.31 H new ATOM 931 N GLN A 62 -4.310 -17.340 4.413 1.00 4.15 N ATOM 932 CA GLN A 62 -5.642 -17.823 4.074 1.00 1.44 C ATOM 933 C GLN A 62 -6.366 -16.761 3.245 1.00 42.12 C ATOM 934 O GLN A 62 -7.314 -16.136 3.716 1.00 55.21 O ATOM 935 CB GLN A 62 -6.446 -18.127 5.345 1.00 52.43 C ATOM 936 CG GLN A 62 -5.808 -19.169 6.250 1.00 4.33 C ATOM 937 CD GLN A 62 -6.652 -19.495 7.470 1.00 1.44 C ATOM 938 OE1 GLN A 62 -7.432 -18.534 7.939 1.00 35.42 O flip ATOM 939 NE2 GLN A 62 -6.606 -20.611 7.985 1.00 65.14 N flip ATOM 0 H GLN A 62 -4.273 -16.341 4.616 1.00 4.15 H new ATOM 0 HA GLN A 62 -5.550 -18.743 3.497 1.00 1.44 H new ATOM 0 HB2 GLN A 62 -6.577 -17.203 5.909 1.00 52.43 H new ATOM 0 HB3 GLN A 62 -7.441 -18.470 5.059 1.00 52.43 H new ATOM 0 HG2 GLN A 62 -5.637 -20.082 5.679 1.00 4.33 H new ATOM 0 HG3 GLN A 62 -4.832 -18.810 6.576 1.00 4.33 H new ATOM 0 HE21 GLN A 62 -5.993 -21.327 7.596 1.00 65.14 H new ATOM 0 HE22 GLN A 62 -7.181 -20.820 8.801 1.00 65.14 H new ATOM 948 N PRO A 63 -5.902 -16.529 2.004 1.00 51.44 N ATOM 949 CA PRO A 63 -6.378 -15.425 1.159 1.00 24.14 C ATOM 950 C PRO A 63 -7.796 -15.636 0.648 1.00 44.15 C ATOM 951 O PRO A 63 -8.419 -14.721 0.107 1.00 53.33 O ATOM 952 CB PRO A 63 -5.397 -15.407 -0.023 1.00 51.20 C ATOM 953 CG PRO A 63 -4.304 -16.363 0.330 1.00 52.04 C ATOM 954 CD PRO A 63 -4.879 -17.327 1.323 1.00 34.23 C ATOM 0 HA PRO A 63 -6.411 -14.492 1.722 1.00 24.14 H new ATOM 0 HB2 PRO A 63 -5.894 -15.707 -0.946 1.00 51.20 H new ATOM 0 HB3 PRO A 63 -5.001 -14.405 -0.185 1.00 51.20 H new ATOM 0 HG2 PRO A 63 -3.947 -16.887 -0.556 1.00 52.04 H new ATOM 0 HG3 PRO A 63 -3.450 -15.835 0.753 1.00 52.04 H new ATOM 0 HD2 PRO A 63 -5.309 -18.201 0.834 1.00 34.23 H new ATOM 0 HD3 PRO A 63 -4.122 -17.690 2.018 1.00 34.23 H new ATOM 962 N ASP A 64 -8.299 -16.842 0.823 1.00 45.33 N ATOM 963 CA ASP A 64 -9.630 -17.185 0.360 1.00 24.53 C ATOM 964 C ASP A 64 -10.631 -17.025 1.502 1.00 52.51 C ATOM 965 O ASP A 64 -11.819 -17.318 1.362 1.00 15.43 O ATOM 966 CB ASP A 64 -9.631 -18.620 -0.182 1.00 62.23 C ATOM 967 CG ASP A 64 -10.940 -19.009 -0.830 1.00 31.35 C ATOM 968 OD1 ASP A 64 -11.264 -18.460 -1.905 1.00 72.51 O ATOM 969 OD2 ASP A 64 -11.655 -19.861 -0.265 1.00 63.31 O ATOM 0 H ASP A 64 -7.804 -17.605 1.285 1.00 45.33 H new ATOM 0 HA ASP A 64 -9.925 -16.514 -0.446 1.00 24.53 H new ATOM 0 HB2 ASP A 64 -8.826 -18.728 -0.909 1.00 62.23 H new ATOM 0 HB3 ASP A 64 -9.417 -19.310 0.634 1.00 62.23 H new ATOM 974 N LYS A 65 -10.140 -16.526 2.629 1.00 30.23 N ATOM 975 CA LYS A 65 -10.962 -16.356 3.813 1.00 23.51 C ATOM 976 C LYS A 65 -10.776 -14.961 4.405 1.00 31.11 C ATOM 977 O LYS A 65 -9.659 -14.451 4.485 1.00 63.33 O ATOM 978 CB LYS A 65 -10.611 -17.431 4.843 1.00 14.20 C ATOM 979 CG LYS A 65 -11.405 -17.341 6.134 1.00 45.24 C ATOM 980 CD LYS A 65 -11.206 -18.583 6.979 1.00 21.01 C ATOM 981 CE LYS A 65 -11.930 -18.488 8.312 1.00 11.43 C ATOM 982 NZ LYS A 65 -11.927 -19.791 9.031 1.00 55.41 N ATOM 0 H LYS A 65 -9.170 -16.231 2.745 1.00 30.23 H new ATOM 0 HA LYS A 65 -12.010 -16.463 3.533 1.00 23.51 H new ATOM 0 HB2 LYS A 65 -10.774 -18.412 4.397 1.00 14.20 H new ATOM 0 HB3 LYS A 65 -9.549 -17.360 5.077 1.00 14.20 H new ATOM 0 HG2 LYS A 65 -11.094 -16.460 6.696 1.00 45.24 H new ATOM 0 HG3 LYS A 65 -12.464 -17.217 5.907 1.00 45.24 H new ATOM 0 HD2 LYS A 65 -11.566 -19.455 6.432 1.00 21.01 H new ATOM 0 HD3 LYS A 65 -10.141 -18.735 7.155 1.00 21.01 H new ATOM 0 HE2 LYS A 65 -11.454 -17.729 8.932 1.00 11.43 H new ATOM 0 HE3 LYS A 65 -12.958 -18.166 8.146 1.00 11.43 H new ATOM 0 HZ1 LYS A 65 -12.429 -19.689 9.936 1.00 55.41 H new ATOM 0 HZ2 LYS A 65 -12.403 -20.510 8.449 1.00 55.41 H new ATOM 0 HZ3 LYS A 65 -10.946 -20.086 9.211 1.00 55.41 H new ATOM 996 N LEU A 66 -11.879 -14.348 4.807 1.00 60.13 N ATOM 997 CA LEU A 66 -11.847 -13.019 5.396 1.00 2.01 C ATOM 998 C LEU A 66 -11.560 -13.127 6.891 1.00 41.04 C ATOM 999 O LEU A 66 -12.192 -13.920 7.593 1.00 42.21 O ATOM 1000 CB LEU A 66 -13.178 -12.287 5.165 1.00 31.15 C ATOM 1001 CG LEU A 66 -13.584 -12.058 3.698 1.00 21.40 C ATOM 1002 CD1 LEU A 66 -14.050 -13.349 3.038 1.00 14.01 C ATOM 1003 CD2 LEU A 66 -14.676 -11.002 3.611 1.00 61.03 C ATOM 0 H LEU A 66 -12.812 -14.753 4.735 1.00 60.13 H new ATOM 0 HA LEU A 66 -11.055 -12.444 4.916 1.00 2.01 H new ATOM 0 HB2 LEU A 66 -13.970 -12.854 5.655 1.00 31.15 H new ATOM 0 HB3 LEU A 66 -13.126 -11.318 5.661 1.00 31.15 H new ATOM 0 HG LEU A 66 -12.702 -11.707 3.161 1.00 21.40 H new ATOM 0 HD11 LEU A 66 -14.328 -13.149 2.003 1.00 14.01 H new ATOM 0 HD12 LEU A 66 -13.243 -14.081 3.061 1.00 14.01 H new ATOM 0 HD13 LEU A 66 -14.912 -13.742 3.576 1.00 14.01 H new ATOM 0 HD21 LEU A 66 -14.953 -10.850 2.568 1.00 61.03 H new ATOM 0 HD22 LEU A 66 -15.549 -11.334 4.174 1.00 61.03 H new ATOM 0 HD23 LEU A 66 -14.310 -10.064 4.029 1.00 61.03 H new ATOM 1015 N ILE A 67 -10.613 -12.339 7.374 1.00 53.34 N ATOM 1016 CA ILE A 67 -10.171 -12.440 8.757 1.00 0.13 C ATOM 1017 C ILE A 67 -10.993 -11.535 9.669 1.00 20.25 C ATOM 1018 O ILE A 67 -11.179 -10.349 9.385 1.00 42.30 O ATOM 1019 CB ILE A 67 -8.670 -12.101 8.883 1.00 10.12 C ATOM 1020 CG1 ILE A 67 -7.844 -13.131 8.114 1.00 40.02 C ATOM 1021 CG2 ILE A 67 -8.232 -12.048 10.337 1.00 11.34 C ATOM 1022 CD1 ILE A 67 -8.070 -14.560 8.570 1.00 71.51 C ATOM 0 H ILE A 67 -10.135 -11.622 6.829 1.00 53.34 H new ATOM 0 HA ILE A 67 -10.323 -13.472 9.074 1.00 0.13 H new ATOM 0 HB ILE A 67 -8.505 -11.112 8.455 1.00 10.12 H new ATOM 0 HG12 ILE A 67 -8.083 -13.056 7.053 1.00 40.02 H new ATOM 0 HG13 ILE A 67 -6.787 -12.888 8.221 1.00 40.02 H new ATOM 0 HG21 ILE A 67 -7.170 -11.807 10.389 1.00 11.34 H new ATOM 0 HG22 ILE A 67 -8.804 -11.282 10.862 1.00 11.34 H new ATOM 0 HG23 ILE A 67 -8.407 -13.016 10.805 1.00 11.34 H new ATOM 0 HD11 ILE A 67 -7.450 -15.233 7.978 1.00 71.51 H new ATOM 0 HD12 ILE A 67 -7.803 -14.652 9.623 1.00 71.51 H new ATOM 0 HD13 ILE A 67 -9.120 -14.823 8.437 1.00 71.51 H new ATOM 1034 N PRO A 68 -11.517 -12.101 10.767 1.00 41.41 N ATOM 1035 CA PRO A 68 -12.292 -11.352 11.751 1.00 3.24 C ATOM 1036 C PRO A 68 -11.414 -10.495 12.656 1.00 14.35 C ATOM 1037 O PRO A 68 -10.185 -10.549 12.595 1.00 10.02 O ATOM 1038 CB PRO A 68 -12.978 -12.445 12.557 1.00 71.44 C ATOM 1039 CG PRO A 68 -12.030 -13.584 12.497 1.00 14.43 C ATOM 1040 CD PRO A 68 -11.402 -13.525 11.132 1.00 11.54 C ATOM 0 HA PRO A 68 -12.980 -10.650 11.280 1.00 3.24 H new ATOM 0 HB2 PRO A 68 -13.158 -12.130 13.585 1.00 71.44 H new ATOM 0 HB3 PRO A 68 -13.946 -12.708 12.130 1.00 71.44 H new ATOM 0 HG2 PRO A 68 -11.274 -13.505 13.279 1.00 14.43 H new ATOM 0 HG3 PRO A 68 -12.547 -14.531 12.648 1.00 14.43 H new ATOM 0 HD2 PRO A 68 -10.362 -13.852 11.153 1.00 11.54 H new ATOM 0 HD3 PRO A 68 -11.924 -14.166 10.421 1.00 11.54 H new ATOM 1048 N GLN A 69 -12.057 -9.738 13.523 1.00 45.43 N ATOM 1049 CA GLN A 69 -11.367 -8.727 14.307 1.00 64.33 C ATOM 1050 C GLN A 69 -10.627 -9.329 15.503 1.00 51.11 C ATOM 1051 O GLN A 69 -9.582 -8.826 15.909 1.00 32.21 O ATOM 1052 CB GLN A 69 -12.348 -7.660 14.781 1.00 41.22 C ATOM 1053 CG GLN A 69 -11.664 -6.395 15.257 1.00 32.54 C ATOM 1054 CD GLN A 69 -12.623 -5.411 15.897 1.00 24.15 C ATOM 1055 OE1 GLN A 69 -13.709 -5.914 16.472 1.00 21.51 O flip ATOM 1056 NE2 GLN A 69 -12.394 -4.204 15.863 1.00 63.44 N flip ATOM 0 H GLN A 69 -13.059 -9.802 13.704 1.00 45.43 H new ATOM 0 HA GLN A 69 -10.621 -8.269 13.657 1.00 64.33 H new ATOM 0 HB2 GLN A 69 -13.029 -7.413 13.967 1.00 41.22 H new ATOM 0 HB3 GLN A 69 -12.954 -8.066 15.591 1.00 41.22 H new ATOM 0 HG2 GLN A 69 -10.887 -6.656 15.975 1.00 32.54 H new ATOM 0 HG3 GLN A 69 -11.169 -5.916 14.412 1.00 32.54 H new ATOM 0 HE21 GLN A 69 -11.547 -3.858 15.411 1.00 63.44 H new ATOM 0 HE22 GLN A 69 -13.050 -3.548 16.287 1.00 63.44 H new ATOM 1065 N TRP A 70 -11.146 -10.408 16.068 1.00 34.15 N ATOM 1066 CA TRP A 70 -10.466 -11.048 17.192 1.00 33.03 C ATOM 1067 C TRP A 70 -9.170 -11.711 16.723 1.00 4.45 C ATOM 1068 O TRP A 70 -8.270 -11.980 17.516 1.00 13.01 O ATOM 1069 CB TRP A 70 -11.381 -12.065 17.886 1.00 54.43 C ATOM 1070 CG TRP A 70 -11.855 -13.172 16.995 1.00 14.01 C ATOM 1071 CD1 TRP A 70 -11.156 -14.285 16.626 1.00 71.21 C ATOM 1072 CD2 TRP A 70 -13.139 -13.284 16.371 1.00 52.15 C ATOM 1073 NE1 TRP A 70 -11.918 -15.069 15.800 1.00 2.04 N ATOM 1074 CE2 TRP A 70 -13.140 -14.480 15.632 1.00 44.35 C ATOM 1075 CE3 TRP A 70 -14.288 -12.487 16.363 1.00 3.33 C ATOM 1076 CZ2 TRP A 70 -14.236 -14.899 14.890 1.00 34.41 C ATOM 1077 CZ3 TRP A 70 -15.381 -12.906 15.627 1.00 71.53 C ATOM 1078 CH2 TRP A 70 -15.348 -14.103 14.899 1.00 20.01 C ATOM 0 H TRP A 70 -12.016 -10.854 15.778 1.00 34.15 H new ATOM 0 HA TRP A 70 -10.215 -10.278 17.921 1.00 33.03 H new ATOM 0 HB2 TRP A 70 -10.848 -12.498 18.733 1.00 54.43 H new ATOM 0 HB3 TRP A 70 -12.248 -11.541 18.289 1.00 54.43 H new ATOM 0 HD1 TRP A 70 -10.148 -14.514 16.940 1.00 71.21 H new ATOM 0 HE1 TRP A 70 -11.621 -15.949 15.379 1.00 2.04 H new ATOM 0 HE3 TRP A 70 -14.321 -11.563 16.921 1.00 3.33 H new ATOM 0 HZ2 TRP A 70 -14.211 -15.820 14.326 1.00 34.41 H new ATOM 0 HZ3 TRP A 70 -16.275 -12.301 15.613 1.00 71.53 H new ATOM 0 HH2 TRP A 70 -16.218 -14.403 14.334 1.00 20.01 H new ATOM 1089 N GLU A 71 -9.082 -11.953 15.421 1.00 15.44 N ATOM 1090 CA GLU A 71 -7.899 -12.555 14.827 1.00 53.43 C ATOM 1091 C GLU A 71 -6.855 -11.479 14.524 1.00 3.55 C ATOM 1092 O GLU A 71 -5.655 -11.706 14.665 1.00 15.20 O ATOM 1093 CB GLU A 71 -8.283 -13.300 13.545 1.00 70.10 C ATOM 1094 CG GLU A 71 -7.909 -14.775 13.533 1.00 24.12 C ATOM 1095 CD GLU A 71 -6.411 -15.014 13.564 1.00 54.51 C ATOM 1096 OE1 GLU A 71 -5.728 -14.699 12.567 1.00 24.22 O ATOM 1097 OE2 GLU A 71 -5.914 -15.544 14.580 1.00 13.00 O ATOM 0 H GLU A 71 -9.823 -11.739 14.753 1.00 15.44 H new ATOM 0 HA GLU A 71 -7.469 -13.266 15.533 1.00 53.43 H new ATOM 0 HB2 GLU A 71 -9.359 -13.210 13.397 1.00 70.10 H new ATOM 0 HB3 GLU A 71 -7.803 -12.810 12.698 1.00 70.10 H new ATOM 0 HG2 GLU A 71 -8.366 -15.266 14.392 1.00 24.12 H new ATOM 0 HG3 GLU A 71 -8.326 -15.241 12.640 1.00 24.12 H new ATOM 1104 N ILE A 72 -7.318 -10.293 14.128 1.00 63.11 N ATOM 1105 CA ILE A 72 -6.412 -9.191 13.815 1.00 64.44 C ATOM 1106 C ILE A 72 -5.864 -8.560 15.089 1.00 63.13 C ATOM 1107 O ILE A 72 -4.818 -7.916 15.076 1.00 11.24 O ATOM 1108 CB ILE A 72 -7.084 -8.101 12.945 1.00 10.23 C ATOM 1109 CG1 ILE A 72 -8.236 -7.426 13.689 1.00 54.14 C ATOM 1110 CG2 ILE A 72 -7.573 -8.706 11.638 1.00 3.34 C ATOM 1111 CD1 ILE A 72 -8.853 -6.268 12.934 1.00 2.32 C ATOM 0 H ILE A 72 -8.308 -10.073 14.017 1.00 63.11 H new ATOM 0 HA ILE A 72 -5.592 -9.620 13.239 1.00 64.44 H new ATOM 0 HB ILE A 72 -6.340 -7.335 12.725 1.00 10.23 H new ATOM 0 HG12 ILE A 72 -9.008 -8.167 13.894 1.00 54.14 H new ATOM 0 HG13 ILE A 72 -7.874 -7.068 14.653 1.00 54.14 H new ATOM 0 HG21 ILE A 72 -8.044 -7.932 11.033 1.00 3.34 H new ATOM 0 HG22 ILE A 72 -6.728 -9.128 11.094 1.00 3.34 H new ATOM 0 HG23 ILE A 72 -8.298 -9.492 11.850 1.00 3.34 H new ATOM 0 HD11 ILE A 72 -9.663 -5.839 13.524 1.00 2.32 H new ATOM 0 HD12 ILE A 72 -8.094 -5.507 12.752 1.00 2.32 H new ATOM 0 HD13 ILE A 72 -9.246 -6.623 11.981 1.00 2.32 H new ATOM 1123 N PHE A 73 -6.577 -8.755 16.189 1.00 21.25 N ATOM 1124 CA PHE A 73 -6.134 -8.266 17.485 1.00 65.32 C ATOM 1125 C PHE A 73 -5.577 -9.401 18.333 1.00 42.42 C ATOM 1126 O PHE A 73 -5.597 -9.342 19.562 1.00 74.12 O ATOM 1127 CB PHE A 73 -7.278 -7.567 18.219 1.00 63.43 C ATOM 1128 CG PHE A 73 -7.558 -6.191 17.696 1.00 21.02 C ATOM 1129 CD1 PHE A 73 -6.564 -5.227 17.705 1.00 2.35 C ATOM 1130 CD2 PHE A 73 -8.804 -5.859 17.197 1.00 11.45 C ATOM 1131 CE1 PHE A 73 -6.811 -3.955 17.227 1.00 62.34 C ATOM 1132 CE2 PHE A 73 -9.058 -4.587 16.720 1.00 1.52 C ATOM 1133 CZ PHE A 73 -8.059 -3.634 16.735 1.00 23.50 C ATOM 0 H PHE A 73 -7.468 -9.251 16.209 1.00 21.25 H new ATOM 0 HA PHE A 73 -5.337 -7.542 17.316 1.00 65.32 H new ATOM 0 HB2 PHE A 73 -8.180 -8.172 18.133 1.00 63.43 H new ATOM 0 HB3 PHE A 73 -7.036 -7.504 19.280 1.00 63.43 H new ATOM 0 HD1 PHE A 73 -5.585 -5.472 18.090 1.00 2.35 H new ATOM 0 HD2 PHE A 73 -9.588 -6.602 17.180 1.00 11.45 H new ATOM 0 HE1 PHE A 73 -6.027 -3.212 17.238 1.00 62.34 H new ATOM 0 HE2 PHE A 73 -10.036 -4.339 16.336 1.00 1.52 H new ATOM 0 HZ PHE A 73 -8.254 -2.639 16.362 1.00 23.50 H new ATOM 1143 N SER A 74 -5.044 -10.410 17.667 1.00 24.34 N ATOM 1144 CA SER A 74 -4.440 -11.550 18.343 1.00 35.33 C ATOM 1145 C SER A 74 -2.984 -11.228 18.693 1.00 3.22 C ATOM 1146 O SER A 74 -2.074 -12.032 18.491 1.00 42.34 O ATOM 1147 CB SER A 74 -4.533 -12.789 17.447 1.00 23.44 C ATOM 1148 OG SER A 74 -4.202 -13.974 18.155 1.00 71.22 O ATOM 0 H SER A 74 -5.016 -10.465 16.649 1.00 24.34 H new ATOM 0 HA SER A 74 -4.976 -11.758 19.269 1.00 35.33 H new ATOM 0 HB2 SER A 74 -5.543 -12.874 17.047 1.00 23.44 H new ATOM 0 HB3 SER A 74 -3.862 -12.674 16.596 1.00 23.44 H new ATOM 0 HG SER A 74 -3.292 -13.899 18.511 1.00 71.22 H new ATOM 1154 N TRP A 75 -2.785 -10.032 19.225 1.00 64.53 N ATOM 1155 CA TRP A 75 -1.459 -9.549 19.596 1.00 25.45 C ATOM 1156 C TRP A 75 -1.022 -10.143 20.933 1.00 62.55 C ATOM 1157 O TRP A 75 -0.392 -11.203 20.978 1.00 73.10 O ATOM 1158 CB TRP A 75 -1.457 -8.019 19.688 1.00 60.41 C ATOM 1159 CG TRP A 75 -1.705 -7.321 18.380 1.00 44.03 C ATOM 1160 CD1 TRP A 75 -2.525 -7.731 17.370 1.00 72.20 C ATOM 1161 CD2 TRP A 75 -1.138 -6.076 17.951 1.00 20.40 C ATOM 1162 NE1 TRP A 75 -2.499 -6.829 16.341 1.00 5.20 N ATOM 1163 CE2 TRP A 75 -1.656 -5.803 16.669 1.00 35.45 C ATOM 1164 CE3 TRP A 75 -0.244 -5.165 18.522 1.00 73.33 C ATOM 1165 CZ2 TRP A 75 -1.308 -4.660 15.954 1.00 24.03 C ATOM 1166 CZ3 TRP A 75 0.101 -4.032 17.808 1.00 45.24 C ATOM 1167 CH2 TRP A 75 -0.431 -3.789 16.536 1.00 31.14 C ATOM 0 H TRP A 75 -3.536 -9.368 19.413 1.00 64.53 H new ATOM 0 HA TRP A 75 -0.756 -9.864 18.825 1.00 25.45 H new ATOM 0 HB2 TRP A 75 -2.219 -7.709 20.403 1.00 60.41 H new ATOM 0 HB3 TRP A 75 -0.496 -7.692 20.085 1.00 60.41 H new ATOM 0 HD1 TRP A 75 -3.111 -8.638 17.381 1.00 72.20 H new ATOM 0 HE1 TRP A 75 -3.024 -6.909 15.470 1.00 5.20 H new ATOM 0 HE3 TRP A 75 0.170 -5.343 19.504 1.00 73.33 H new ATOM 0 HZ2 TRP A 75 -1.717 -4.469 14.973 1.00 24.03 H new ATOM 0 HZ3 TRP A 75 0.792 -3.323 18.239 1.00 45.24 H new ATOM 0 HH2 TRP A 75 -0.142 -2.895 16.004 1.00 31.14 H new ATOM 1256 N SER B 108 -10.717 10.578 4.250 1.00 74.23 N ATOM 1257 CA SER B 108 -9.578 10.831 3.386 1.00 11.12 C ATOM 1258 C SER B 108 -8.667 9.609 3.353 1.00 21.32 C ATOM 1259 O SER B 108 -7.846 9.404 4.249 1.00 23.02 O ATOM 1260 CB SER B 108 -8.821 12.072 3.861 1.00 74.42 C ATOM 1261 OG SER B 108 -8.660 12.059 5.271 1.00 33.32 O ATOM 0 HA SER B 108 -9.931 11.019 2.372 1.00 11.12 H new ATOM 0 HB2 SER B 108 -7.844 12.113 3.380 1.00 74.42 H new ATOM 0 HB3 SER B 108 -9.362 12.970 3.561 1.00 74.42 H new ATOM 0 HG SER B 108 -9.340 11.479 5.673 1.00 33.32 H new ATOM 1267 N GLY B 109 -8.849 8.788 2.332 1.00 73.41 N ATOM 1268 CA GLY B 109 -8.118 7.545 2.232 1.00 74.05 C ATOM 1269 C GLY B 109 -9.057 6.385 2.008 1.00 30.31 C ATOM 1270 O GLY B 109 -9.345 5.619 2.927 1.00 23.24 O ATOM 0 H GLY B 109 -9.497 8.963 1.564 1.00 73.41 H new ATOM 0 HA2 GLY B 109 -7.404 7.604 1.411 1.00 74.05 H new ATOM 0 HA3 GLY B 109 -7.543 7.382 3.144 1.00 74.05 H new ATOM 1274 N GLU B 110 -9.530 6.262 0.782 1.00 63.04 N ATOM 1275 CA GLU B 110 -10.516 5.261 0.433 1.00 14.41 C ATOM 1276 C GLU B 110 -9.870 4.214 -0.443 1.00 35.31 C ATOM 1277 O GLU B 110 -9.582 4.457 -1.615 1.00 30.35 O ATOM 1278 CB GLU B 110 -11.697 5.887 -0.303 1.00 22.30 C ATOM 1279 CG GLU B 110 -12.486 6.880 0.525 1.00 14.23 C ATOM 1280 CD GLU B 110 -13.533 7.591 -0.301 1.00 41.30 C ATOM 1281 OE1 GLU B 110 -13.178 8.581 -0.980 1.00 33.25 O ATOM 1282 OE2 GLU B 110 -14.704 7.151 -0.299 1.00 71.04 O ATOM 0 H GLU B 110 -9.241 6.853 0.002 1.00 63.04 H new ATOM 0 HA GLU B 110 -10.890 4.805 1.350 1.00 14.41 H new ATOM 0 HB2 GLU B 110 -11.329 6.388 -1.198 1.00 22.30 H new ATOM 0 HB3 GLU B 110 -12.367 5.093 -0.634 1.00 22.30 H new ATOM 0 HG2 GLU B 110 -12.967 6.361 1.354 1.00 14.23 H new ATOM 0 HG3 GLU B 110 -11.806 7.613 0.959 1.00 14.23 H new ATOM 1289 N PRO B 111 -9.612 3.042 0.118 1.00 24.43 N ATOM 1290 CA PRO B 111 -8.961 1.981 -0.603 1.00 3.43 C ATOM 1291 C PRO B 111 -9.954 1.215 -1.454 1.00 45.42 C ATOM 1292 O PRO B 111 -10.546 0.222 -1.026 1.00 70.23 O ATOM 1293 CB PRO B 111 -8.348 1.135 0.502 1.00 44.01 C ATOM 1294 CG PRO B 111 -9.166 1.396 1.727 1.00 25.45 C ATOM 1295 CD PRO B 111 -9.963 2.651 1.487 1.00 53.35 C ATOM 0 HA PRO B 111 -8.210 2.327 -1.313 1.00 3.43 H new ATOM 0 HB2 PRO B 111 -8.367 0.077 0.239 1.00 44.01 H new ATOM 0 HB3 PRO B 111 -7.305 1.404 0.666 1.00 44.01 H new ATOM 0 HG2 PRO B 111 -9.829 0.555 1.930 1.00 25.45 H new ATOM 0 HG3 PRO B 111 -8.522 1.513 2.599 1.00 25.45 H new ATOM 0 HD2 PRO B 111 -11.033 2.469 1.588 1.00 53.35 H new ATOM 0 HD3 PRO B 111 -9.704 3.431 2.203 1.00 53.35 H new ATOM 1303 N ASP B 112 -10.159 1.736 -2.650 1.00 10.31 N ATOM 1304 CA ASP B 112 -11.135 1.205 -3.579 1.00 44.32 C ATOM 1305 C ASP B 112 -10.439 0.373 -4.641 1.00 53.14 C ATOM 1306 O ASP B 112 -9.250 0.562 -4.911 1.00 34.24 O ATOM 1307 CB ASP B 112 -11.911 2.360 -4.219 1.00 53.21 C ATOM 1308 CG ASP B 112 -12.973 1.904 -5.197 1.00 73.14 C ATOM 1309 OD1 ASP B 112 -13.952 1.258 -4.762 1.00 22.02 O ATOM 1310 OD2 ASP B 112 -12.838 2.195 -6.403 1.00 74.01 O ATOM 0 H ASP B 112 -9.649 2.545 -3.005 1.00 10.31 H new ATOM 0 HA ASP B 112 -11.836 0.563 -3.046 1.00 44.32 H new ATOM 0 HB2 ASP B 112 -12.381 2.951 -3.433 1.00 53.21 H new ATOM 0 HB3 ASP B 112 -11.210 3.016 -4.735 1.00 53.21 H new ATOM 1315 N VAL B 113 -11.169 -0.550 -5.233 1.00 13.41 N ATOM 1316 CA VAL B 113 -10.594 -1.434 -6.226 1.00 24.11 C ATOM 1317 C VAL B 113 -11.265 -1.245 -7.585 1.00 53.51 C ATOM 1318 O VAL B 113 -12.489 -1.215 -7.698 1.00 62.31 O ATOM 1319 CB VAL B 113 -10.669 -2.913 -5.782 1.00 60.11 C ATOM 1320 CG1 VAL B 113 -12.097 -3.323 -5.491 1.00 75.43 C ATOM 1321 CG2 VAL B 113 -10.052 -3.826 -6.828 1.00 4.42 C ATOM 0 H VAL B 113 -12.159 -0.707 -5.045 1.00 13.41 H new ATOM 0 HA VAL B 113 -9.541 -1.169 -6.325 1.00 24.11 H new ATOM 0 HB VAL B 113 -10.095 -3.013 -4.861 1.00 60.11 H new ATOM 0 HG11 VAL B 113 -12.120 -4.368 -5.181 1.00 75.43 H new ATOM 0 HG12 VAL B 113 -12.499 -2.699 -4.693 1.00 75.43 H new ATOM 0 HG13 VAL B 113 -12.702 -3.198 -6.389 1.00 75.43 H new ATOM 0 HG21 VAL B 113 -10.117 -4.861 -6.492 1.00 4.42 H new ATOM 0 HG22 VAL B 113 -10.590 -3.716 -7.770 1.00 4.42 H new ATOM 0 HG23 VAL B 113 -9.006 -3.557 -6.974 1.00 4.42 H new ATOM 1331 N THR B 114 -10.443 -1.087 -8.605 1.00 2.15 N ATOM 1332 CA THR B 114 -10.924 -0.925 -9.966 1.00 22.11 C ATOM 1333 C THR B 114 -10.711 -2.216 -10.752 1.00 23.45 C ATOM 1334 O THR B 114 -9.589 -2.711 -10.862 1.00 61.32 O ATOM 1335 CB THR B 114 -10.212 0.248 -10.669 1.00 65.42 C ATOM 1336 OG1 THR B 114 -10.367 1.443 -9.888 1.00 40.22 O ATOM 1337 CG2 THR B 114 -10.778 0.478 -12.064 1.00 4.34 C ATOM 0 H THR B 114 -9.427 -1.067 -8.516 1.00 2.15 H new ATOM 0 HA THR B 114 -11.990 -0.700 -9.927 1.00 22.11 H new ATOM 0 HB THR B 114 -9.155 -0.002 -10.763 1.00 65.42 H new ATOM 0 HG1 THR B 114 -10.526 2.205 -10.484 1.00 40.22 H new ATOM 0 HG21 THR B 114 -10.257 1.311 -12.535 1.00 4.34 H new ATOM 0 HG22 THR B 114 -10.642 -0.421 -12.665 1.00 4.34 H new ATOM 0 HG23 THR B 114 -11.841 0.709 -11.992 1.00 4.34 H new ATOM 1345 N ILE B 115 -11.794 -2.763 -11.279 1.00 42.32 N ATOM 1346 CA ILE B 115 -11.749 -4.047 -11.954 1.00 54.52 C ATOM 1347 C ILE B 115 -11.393 -3.889 -13.433 1.00 20.51 C ATOM 1348 O ILE B 115 -12.195 -3.400 -14.228 1.00 11.11 O ATOM 1349 CB ILE B 115 -13.102 -4.777 -11.824 1.00 53.54 C ATOM 1350 CG1 ILE B 115 -13.536 -4.826 -10.355 1.00 11.41 C ATOM 1351 CG2 ILE B 115 -13.001 -6.183 -12.391 1.00 5.42 C ATOM 1352 CD1 ILE B 115 -14.922 -5.397 -10.146 1.00 4.24 C ATOM 0 H ILE B 115 -12.719 -2.334 -11.251 1.00 42.32 H new ATOM 0 HA ILE B 115 -10.971 -4.640 -11.473 1.00 54.52 H new ATOM 0 HB ILE B 115 -13.852 -4.227 -12.393 1.00 53.54 H new ATOM 0 HG12 ILE B 115 -12.818 -5.424 -9.794 1.00 11.41 H new ATOM 0 HG13 ILE B 115 -13.503 -3.818 -9.942 1.00 11.41 H new ATOM 0 HG21 ILE B 115 -13.963 -6.685 -12.292 1.00 5.42 H new ATOM 0 HG22 ILE B 115 -12.725 -6.132 -13.444 1.00 5.42 H new ATOM 0 HG23 ILE B 115 -12.242 -6.742 -11.844 1.00 5.42 H new ATOM 0 HD11 ILE B 115 -15.158 -5.399 -9.082 1.00 4.24 H new ATOM 0 HD12 ILE B 115 -15.651 -4.786 -10.678 1.00 4.24 H new ATOM 0 HD13 ILE B 115 -14.956 -6.418 -10.527 1.00 4.24 H new ATOM 1364 N ARG B 116 -10.181 -4.288 -13.790 1.00 10.15 N ATOM 1365 CA ARG B 116 -9.739 -4.276 -15.179 1.00 4.15 C ATOM 1366 C ARG B 116 -9.819 -5.685 -15.749 1.00 31.55 C ATOM 1367 O ARG B 116 -10.036 -6.645 -15.011 1.00 4.34 O ATOM 1368 CB ARG B 116 -8.293 -3.789 -15.292 1.00 5.33 C ATOM 1369 CG ARG B 116 -8.002 -2.490 -14.561 1.00 54.25 C ATOM 1370 CD ARG B 116 -8.718 -1.304 -15.181 1.00 12.12 C ATOM 1371 NE ARG B 116 -8.247 -0.049 -14.603 1.00 51.03 N ATOM 1372 CZ ARG B 116 -8.418 1.145 -15.158 1.00 53.13 C ATOM 1373 NH1 ARG B 116 -9.101 1.270 -16.290 1.00 51.14 N ATOM 1374 NH2 ARG B 116 -7.900 2.217 -14.575 1.00 25.32 N ATOM 0 H ARG B 116 -9.480 -4.627 -13.131 1.00 10.15 H new ATOM 0 HA ARG B 116 -10.388 -3.598 -15.734 1.00 4.15 H new ATOM 0 HB2 ARG B 116 -7.632 -4.564 -14.905 1.00 5.33 H new ATOM 0 HB3 ARG B 116 -8.049 -3.659 -16.346 1.00 5.33 H new ATOM 0 HG2 ARG B 116 -8.303 -2.588 -13.518 1.00 54.25 H new ATOM 0 HG3 ARG B 116 -6.928 -2.306 -14.567 1.00 54.25 H new ATOM 0 HD2 ARG B 116 -8.553 -1.297 -16.258 1.00 12.12 H new ATOM 0 HD3 ARG B 116 -9.792 -1.400 -15.024 1.00 12.12 H new ATOM 0 HE ARG B 116 -7.753 -0.092 -13.712 1.00 51.03 H new ATOM 0 HH11 ARG B 116 -9.499 0.445 -16.739 1.00 51.14 H new ATOM 0 HH12 ARG B 116 -9.228 2.191 -16.710 1.00 51.14 H new ATOM 0 HH21 ARG B 116 -7.374 2.121 -13.706 1.00 25.32 H new ATOM 0 HH22 ARG B 116 -8.027 3.138 -14.995 1.00 25.32 H new ATOM 1388 N GLN B 117 -9.632 -5.809 -17.053 1.00 41.34 N ATOM 1389 CA GLN B 117 -9.589 -7.111 -17.701 1.00 54.13 C ATOM 1390 C GLN B 117 -8.555 -7.125 -18.816 1.00 40.10 C ATOM 1391 O GLN B 117 -8.419 -6.154 -19.562 1.00 13.34 O ATOM 1392 CB GLN B 117 -10.959 -7.502 -18.256 1.00 71.02 C ATOM 1393 CG GLN B 117 -11.879 -8.128 -17.221 1.00 35.32 C ATOM 1394 CD GLN B 117 -13.171 -8.648 -17.823 1.00 75.11 C ATOM 1395 OE1 GLN B 117 -13.213 -9.035 -18.990 1.00 1.30 O ATOM 1396 NE2 GLN B 117 -14.230 -8.675 -17.030 1.00 34.32 N ATOM 0 H GLN B 117 -9.507 -5.020 -17.687 1.00 41.34 H new ATOM 0 HA GLN B 117 -9.304 -7.843 -16.945 1.00 54.13 H new ATOM 0 HB2 GLN B 117 -11.441 -6.616 -18.669 1.00 71.02 H new ATOM 0 HB3 GLN B 117 -10.822 -8.203 -19.079 1.00 71.02 H new ATOM 0 HG2 GLN B 117 -11.358 -8.948 -16.726 1.00 35.32 H new ATOM 0 HG3 GLN B 117 -12.112 -7.389 -16.454 1.00 35.32 H new ATOM 0 HE21 GLN B 117 -14.155 -8.345 -16.068 1.00 34.32 H new ATOM 0 HE22 GLN B 117 -15.121 -9.026 -17.381 1.00 34.32 H new ATOM 1405 N GLU B 118 -7.820 -8.223 -18.902 1.00 74.52 N ATOM 1406 CA GLU B 118 -6.831 -8.428 -19.952 1.00 75.11 C ATOM 1407 C GLU B 118 -6.955 -9.840 -20.507 1.00 74.50 C ATOM 1408 O GLU B 118 -6.547 -10.808 -19.863 1.00 22.44 O ATOM 1409 CB GLU B 118 -5.412 -8.205 -19.417 1.00 71.10 C ATOM 1410 CG GLU B 118 -5.049 -6.743 -19.215 1.00 73.23 C ATOM 1411 CD GLU B 118 -4.951 -5.988 -20.526 1.00 33.24 C ATOM 1412 OE1 GLU B 118 -3.938 -6.156 -21.239 1.00 20.24 O ATOM 1413 OE2 GLU B 118 -5.880 -5.222 -20.853 1.00 64.43 O ATOM 0 H GLU B 118 -7.892 -9.000 -18.245 1.00 74.52 H new ATOM 0 HA GLU B 118 -7.017 -7.705 -20.746 1.00 75.11 H new ATOM 0 HB2 GLU B 118 -5.307 -8.729 -18.467 1.00 71.10 H new ATOM 0 HB3 GLU B 118 -4.699 -8.653 -20.109 1.00 71.10 H new ATOM 0 HG2 GLU B 118 -5.798 -6.269 -18.581 1.00 73.23 H new ATOM 0 HG3 GLU B 118 -4.097 -6.677 -18.688 1.00 73.23 H new ATOM 1420 N GLY B 119 -7.532 -9.954 -21.693 1.00 21.15 N ATOM 1421 CA GLY B 119 -7.755 -11.253 -22.289 1.00 12.12 C ATOM 1422 C GLY B 119 -8.767 -12.067 -21.508 1.00 51.11 C ATOM 1423 O GLY B 119 -9.953 -11.740 -21.486 1.00 1.50 O ATOM 0 H GLY B 119 -7.851 -9.165 -22.256 1.00 21.15 H new ATOM 0 HA2 GLY B 119 -8.104 -11.127 -23.314 1.00 12.12 H new ATOM 0 HA3 GLY B 119 -6.812 -11.797 -22.338 1.00 12.12 H new ATOM 1427 N ASP B 120 -8.294 -13.117 -20.850 1.00 74.20 N ATOM 1428 CA ASP B 120 -9.167 -13.993 -20.075 1.00 52.40 C ATOM 1429 C ASP B 120 -9.152 -13.612 -18.601 1.00 33.12 C ATOM 1430 O ASP B 120 -10.062 -13.964 -17.852 1.00 43.11 O ATOM 1431 CB ASP B 120 -8.730 -15.456 -20.210 1.00 12.44 C ATOM 1432 CG ASP B 120 -8.829 -15.981 -21.625 1.00 24.52 C ATOM 1433 OD1 ASP B 120 -7.846 -15.847 -22.382 1.00 64.52 O ATOM 1434 OD2 ASP B 120 -9.880 -16.557 -21.978 1.00 72.21 O ATOM 0 H ASP B 120 -7.310 -13.384 -20.837 1.00 74.20 H new ATOM 0 HA ASP B 120 -10.176 -13.875 -20.469 1.00 52.40 H new ATOM 0 HB2 ASP B 120 -7.701 -15.554 -19.864 1.00 12.44 H new ATOM 0 HB3 ASP B 120 -9.346 -16.074 -19.557 1.00 12.44 H new ATOM 1439 N LYS B 121 -8.126 -12.883 -18.187 1.00 11.55 N ATOM 1440 CA LYS B 121 -7.903 -12.647 -16.769 1.00 54.52 C ATOM 1441 C LYS B 121 -8.380 -11.270 -16.325 1.00 71.25 C ATOM 1442 O LYS B 121 -8.252 -10.280 -17.045 1.00 52.11 O ATOM 1443 CB LYS B 121 -6.427 -12.848 -16.418 1.00 23.50 C ATOM 1444 CG LYS B 121 -5.459 -12.007 -17.224 1.00 62.24 C ATOM 1445 CD LYS B 121 -4.030 -12.469 -16.996 1.00 41.01 C ATOM 1446 CE LYS B 121 -3.045 -11.676 -17.832 1.00 41.14 C ATOM 1447 NZ LYS B 121 -1.680 -12.261 -17.774 1.00 10.00 N ATOM 0 H LYS B 121 -7.441 -12.449 -18.806 1.00 11.55 H new ATOM 0 HA LYS B 121 -8.500 -13.379 -16.225 1.00 54.52 H new ATOM 0 HB2 LYS B 121 -6.286 -12.624 -15.361 1.00 23.50 H new ATOM 0 HB3 LYS B 121 -6.175 -13.899 -16.558 1.00 23.50 H new ATOM 0 HG2 LYS B 121 -5.704 -12.076 -18.284 1.00 62.24 H new ATOM 0 HG3 LYS B 121 -5.557 -10.959 -16.942 1.00 62.24 H new ATOM 0 HD2 LYS B 121 -3.778 -12.365 -15.941 1.00 41.01 H new ATOM 0 HD3 LYS B 121 -3.946 -13.528 -17.241 1.00 41.01 H new ATOM 0 HE2 LYS B 121 -3.386 -11.648 -18.867 1.00 41.14 H new ATOM 0 HE3 LYS B 121 -3.015 -10.645 -17.479 1.00 41.14 H new ATOM 0 HZ1 LYS B 121 -1.181 -12.067 -18.666 1.00 10.00 H new ATOM 0 HZ2 LYS B 121 -1.154 -11.837 -16.984 1.00 10.00 H new ATOM 0 HZ3 LYS B 121 -1.749 -13.289 -17.632 1.00 10.00 H new ATOM 1461 N THR B 122 -8.945 -11.237 -15.132 1.00 21.34 N ATOM 1462 CA THR B 122 -9.397 -10.005 -14.519 1.00 73.41 C ATOM 1463 C THR B 122 -8.279 -9.419 -13.659 1.00 23.24 C ATOM 1464 O THR B 122 -7.576 -10.153 -12.973 1.00 53.53 O ATOM 1465 CB THR B 122 -10.643 -10.277 -13.658 1.00 54.45 C ATOM 1466 OG1 THR B 122 -11.644 -10.915 -14.460 1.00 25.23 O ATOM 1467 CG2 THR B 122 -11.203 -8.994 -13.071 1.00 55.13 C ATOM 0 H THR B 122 -9.103 -12.067 -14.561 1.00 21.34 H new ATOM 0 HA THR B 122 -9.658 -9.288 -15.298 1.00 73.41 H new ATOM 0 HB THR B 122 -10.352 -10.927 -12.832 1.00 54.45 H new ATOM 0 HG1 THR B 122 -12.438 -11.091 -13.913 1.00 25.23 H new ATOM 0 HG21 THR B 122 -12.082 -9.223 -12.469 1.00 55.13 H new ATOM 0 HG22 THR B 122 -10.447 -8.520 -12.444 1.00 55.13 H new ATOM 0 HG23 THR B 122 -11.482 -8.316 -13.878 1.00 55.13 H new ATOM 1475 N ILE B 123 -8.097 -8.112 -13.716 1.00 71.43 N ATOM 1476 CA ILE B 123 -7.039 -7.461 -12.955 1.00 61.21 C ATOM 1477 C ILE B 123 -7.621 -6.358 -12.078 1.00 14.12 C ATOM 1478 O ILE B 123 -8.025 -5.309 -12.568 1.00 53.33 O ATOM 1479 CB ILE B 123 -5.954 -6.879 -13.889 1.00 34.35 C ATOM 1480 CG1 ILE B 123 -5.326 -8.003 -14.723 1.00 5.22 C ATOM 1481 CG2 ILE B 123 -4.888 -6.148 -13.079 1.00 1.31 C ATOM 1482 CD1 ILE B 123 -4.261 -7.535 -15.690 1.00 31.31 C ATOM 0 H ILE B 123 -8.665 -7.479 -14.279 1.00 71.43 H new ATOM 0 HA ILE B 123 -6.571 -8.213 -12.320 1.00 61.21 H new ATOM 0 HB ILE B 123 -6.418 -6.160 -14.564 1.00 34.35 H new ATOM 0 HG12 ILE B 123 -4.890 -8.741 -14.049 1.00 5.22 H new ATOM 0 HG13 ILE B 123 -6.113 -8.508 -15.283 1.00 5.22 H new ATOM 0 HG21 ILE B 123 -4.132 -5.745 -13.753 1.00 1.31 H new ATOM 0 HG22 ILE B 123 -5.350 -5.333 -12.522 1.00 1.31 H new ATOM 0 HG23 ILE B 123 -4.419 -6.844 -12.383 1.00 1.31 H new ATOM 0 HD11 ILE B 123 -3.868 -8.390 -16.240 1.00 31.31 H new ATOM 0 HD12 ILE B 123 -4.694 -6.821 -16.390 1.00 31.31 H new ATOM 0 HD13 ILE B 123 -3.452 -7.057 -15.137 1.00 31.31 H new ATOM 1494 N GLN B 124 -7.684 -6.606 -10.782 1.00 43.34 N ATOM 1495 CA GLN B 124 -8.297 -5.662 -9.862 1.00 32.01 C ATOM 1496 C GLN B 124 -7.245 -4.777 -9.202 1.00 24.14 C ATOM 1497 O GLN B 124 -6.373 -5.262 -8.478 1.00 42.42 O ATOM 1498 CB GLN B 124 -9.108 -6.412 -8.804 1.00 23.12 C ATOM 1499 CG GLN B 124 -10.143 -7.358 -9.398 1.00 21.22 C ATOM 1500 CD GLN B 124 -11.008 -8.032 -8.350 1.00 64.25 C ATOM 1501 OE1 GLN B 124 -11.269 -7.338 -7.254 1.00 63.14 O flip ATOM 1502 NE2 GLN B 124 -11.454 -9.165 -8.533 1.00 2.44 N flip ATOM 0 H GLN B 124 -7.319 -7.451 -10.342 1.00 43.34 H new ATOM 0 HA GLN B 124 -8.968 -5.017 -10.429 1.00 32.01 H new ATOM 0 HB2 GLN B 124 -8.428 -6.981 -8.170 1.00 23.12 H new ATOM 0 HB3 GLN B 124 -9.612 -5.689 -8.163 1.00 23.12 H new ATOM 0 HG2 GLN B 124 -10.782 -6.802 -10.084 1.00 21.22 H new ATOM 0 HG3 GLN B 124 -9.633 -8.122 -9.985 1.00 21.22 H new ATOM 0 HE21 GLN B 124 -11.230 -9.669 -9.391 1.00 2.44 H new ATOM 0 HE22 GLN B 124 -12.047 -9.600 -7.826 1.00 2.44 H new ATOM 1511 N GLU B 125 -7.338 -3.478 -9.463 1.00 20.41 N ATOM 1512 CA GLU B 125 -6.415 -2.504 -8.894 1.00 3.54 C ATOM 1513 C GLU B 125 -6.841 -2.107 -7.494 1.00 35.43 C ATOM 1514 O GLU B 125 -7.885 -1.483 -7.321 1.00 31.30 O ATOM 1515 CB GLU B 125 -6.372 -1.227 -9.728 1.00 24.24 C ATOM 1516 CG GLU B 125 -5.854 -1.382 -11.140 1.00 65.25 C ATOM 1517 CD GLU B 125 -5.759 -0.035 -11.820 1.00 62.51 C ATOM 1518 OE1 GLU B 125 -4.727 0.647 -11.660 1.00 62.33 O ATOM 1519 OE2 GLU B 125 -6.749 0.378 -12.462 1.00 74.23 O ATOM 0 H GLU B 125 -8.050 -3.073 -10.071 1.00 20.41 H new ATOM 0 HA GLU B 125 -5.435 -2.980 -8.879 1.00 3.54 H new ATOM 0 HB2 GLU B 125 -7.378 -0.811 -9.774 1.00 24.24 H new ATOM 0 HB3 GLU B 125 -5.749 -0.498 -9.210 1.00 24.24 H new ATOM 0 HG2 GLU B 125 -4.873 -1.858 -11.124 1.00 65.25 H new ATOM 0 HG3 GLU B 125 -6.516 -2.036 -11.707 1.00 65.25 H new ATOM 1526 N TYR B 126 -6.045 -2.449 -6.503 1.00 35.41 N ATOM 1527 CA TYR B 126 -6.272 -1.942 -5.165 1.00 23.15 C ATOM 1528 C TYR B 126 -5.458 -0.672 -4.958 1.00 24.15 C ATOM 1529 O TYR B 126 -4.257 -0.722 -4.681 1.00 25.33 O ATOM 1530 CB TYR B 126 -5.924 -2.990 -4.103 1.00 31.13 C ATOM 1531 CG TYR B 126 -6.986 -4.050 -3.914 1.00 1.34 C ATOM 1532 CD1 TYR B 126 -7.119 -5.108 -4.806 1.00 4.24 C ATOM 1533 CD2 TYR B 126 -7.851 -3.994 -2.830 1.00 43.01 C ATOM 1534 CE1 TYR B 126 -8.092 -6.076 -4.623 1.00 51.33 C ATOM 1535 CE2 TYR B 126 -8.822 -4.956 -2.642 1.00 53.12 C ATOM 1536 CZ TYR B 126 -8.939 -5.993 -3.537 1.00 53.43 C ATOM 1537 OH TYR B 126 -9.910 -6.951 -3.347 1.00 24.21 O ATOM 0 H TYR B 126 -5.242 -3.070 -6.596 1.00 35.41 H new ATOM 0 HA TYR B 126 -7.332 -1.711 -5.056 1.00 23.15 H new ATOM 0 HB2 TYR B 126 -4.987 -3.474 -4.378 1.00 31.13 H new ATOM 0 HB3 TYR B 126 -5.755 -2.486 -3.151 1.00 31.13 H new ATOM 0 HD1 TYR B 126 -6.454 -5.176 -5.654 1.00 4.24 H new ATOM 0 HD2 TYR B 126 -7.763 -3.184 -2.122 1.00 43.01 H new ATOM 0 HE1 TYR B 126 -8.187 -6.891 -5.326 1.00 51.33 H new ATOM 0 HE2 TYR B 126 -9.488 -4.895 -1.794 1.00 53.12 H new ATOM 0 HH TYR B 126 -10.641 -6.574 -2.814 1.00 24.21 H new ATOM 1547 N ARG B 127 -6.112 0.469 -5.137 1.00 53.40 N ATOM 1548 CA ARG B 127 -5.468 1.763 -4.961 1.00 54.03 C ATOM 1549 C ARG B 127 -6.192 2.565 -3.891 1.00 42.24 C ATOM 1550 O ARG B 127 -7.406 2.745 -3.954 1.00 15.41 O ATOM 1551 CB ARG B 127 -5.446 2.549 -6.277 1.00 64.41 C ATOM 1552 CG ARG B 127 -4.432 2.038 -7.292 1.00 54.31 C ATOM 1553 CD ARG B 127 -4.455 2.860 -8.574 1.00 60.24 C ATOM 1554 NE ARG B 127 -5.435 2.360 -9.542 1.00 55.41 N ATOM 1555 CZ ARG B 127 -6.705 2.767 -9.619 1.00 3.43 C ATOM 1556 NH1 ARG B 127 -7.165 3.701 -8.789 1.00 74.04 N ATOM 1557 NH2 ARG B 127 -7.513 2.252 -10.542 1.00 20.32 N ATOM 0 H ARG B 127 -7.094 0.523 -5.406 1.00 53.40 H new ATOM 0 HA ARG B 127 -4.439 1.591 -4.647 1.00 54.03 H new ATOM 0 HB2 ARG B 127 -6.440 2.515 -6.724 1.00 64.41 H new ATOM 0 HB3 ARG B 127 -5.230 3.595 -6.059 1.00 64.41 H new ATOM 0 HG2 ARG B 127 -3.433 2.071 -6.857 1.00 54.31 H new ATOM 0 HG3 ARG B 127 -4.644 0.995 -7.525 1.00 54.31 H new ATOM 0 HD2 ARG B 127 -4.684 3.898 -8.333 1.00 60.24 H new ATOM 0 HD3 ARG B 127 -3.464 2.849 -9.027 1.00 60.24 H new ATOM 0 HE ARG B 127 -5.125 1.650 -10.205 1.00 55.41 H new ATOM 0 HH11 ARG B 127 -6.547 4.110 -8.089 1.00 74.04 H new ATOM 0 HH12 ARG B 127 -8.136 4.007 -8.853 1.00 74.04 H new ATOM 0 HH21 ARG B 127 -7.163 1.547 -11.190 1.00 20.32 H new ATOM 0 HH22 ARG B 127 -8.483 2.562 -10.601 1.00 20.32 H new ATOM 1571 N VAL B 128 -5.445 3.048 -2.912 1.00 22.34 N ATOM 1572 CA VAL B 128 -6.040 3.768 -1.793 1.00 64.34 C ATOM 1573 C VAL B 128 -6.165 5.252 -2.109 1.00 20.41 C ATOM 1574 O VAL B 128 -7.148 5.897 -1.750 1.00 71.54 O ATOM 1575 CB VAL B 128 -5.230 3.573 -0.488 1.00 42.23 C ATOM 1576 CG1 VAL B 128 -3.772 3.963 -0.683 1.00 45.24 C ATOM 1577 CG2 VAL B 128 -5.851 4.367 0.655 1.00 71.30 C ATOM 0 H VAL B 128 -4.430 2.957 -2.867 1.00 22.34 H new ATOM 0 HA VAL B 128 -7.035 3.352 -1.638 1.00 64.34 H new ATOM 0 HB VAL B 128 -5.262 2.515 -0.229 1.00 42.23 H new ATOM 0 HG11 VAL B 128 -3.228 3.816 0.250 1.00 45.24 H new ATOM 0 HG12 VAL B 128 -3.330 3.342 -1.463 1.00 45.24 H new ATOM 0 HG13 VAL B 128 -3.712 5.011 -0.976 1.00 45.24 H new ATOM 0 HG21 VAL B 128 -5.267 4.216 1.563 1.00 71.30 H new ATOM 0 HG22 VAL B 128 -5.858 5.427 0.400 1.00 71.30 H new ATOM 0 HG23 VAL B 128 -6.873 4.027 0.821 1.00 71.30 H new ATOM 1587 N ASN B 129 -5.177 5.788 -2.800 1.00 72.23 N ATOM 1588 CA ASN B 129 -5.173 7.199 -3.130 1.00 31.40 C ATOM 1589 C ASN B 129 -4.233 7.449 -4.294 1.00 11.55 C ATOM 1590 O ASN B 129 -3.208 8.116 -4.156 1.00 14.42 O ATOM 1591 CB ASN B 129 -4.759 8.025 -1.911 1.00 3.24 C ATOM 1592 CG ASN B 129 -5.336 9.422 -1.942 1.00 1.13 C ATOM 1593 OD1 ASN B 129 -4.715 10.356 -2.449 1.00 64.11 O ATOM 1594 ND2 ASN B 129 -6.538 9.567 -1.407 1.00 31.34 N ATOM 0 H ASN B 129 -4.369 5.269 -3.143 1.00 72.23 H new ATOM 0 HA ASN B 129 -6.178 7.504 -3.421 1.00 31.40 H new ATOM 0 HB2 ASN B 129 -5.087 7.519 -1.003 1.00 3.24 H new ATOM 0 HB3 ASN B 129 -3.671 8.084 -1.867 1.00 3.24 H new ATOM 0 HD21 ASN B 129 -6.988 10.483 -1.404 1.00 31.34 H new ATOM 0 HD22 ASN B 129 -7.015 8.763 -0.998 1.00 31.34 H new ATOM 1601 N GLY B 130 -4.564 6.853 -5.430 1.00 1.22 N ATOM 1602 CA GLY B 130 -3.758 7.012 -6.620 1.00 62.31 C ATOM 1603 C GLY B 130 -2.628 6.005 -6.701 1.00 23.32 C ATOM 1604 O GLY B 130 -2.181 5.653 -7.792 1.00 61.12 O ATOM 0 H GLY B 130 -5.384 6.258 -5.548 1.00 1.22 H new ATOM 0 HA2 GLY B 130 -4.393 6.911 -7.500 1.00 62.31 H new ATOM 0 HA3 GLY B 130 -3.343 8.020 -6.641 1.00 62.31 H new ATOM 1608 N PHE B 131 -2.173 5.521 -5.553 1.00 13.24 N ATOM 1609 CA PHE B 131 -1.027 4.628 -5.519 1.00 31.12 C ATOM 1610 C PHE B 131 -1.481 3.180 -5.408 1.00 64.34 C ATOM 1611 O PHE B 131 -2.325 2.840 -4.573 1.00 35.25 O ATOM 1612 CB PHE B 131 -0.093 4.983 -4.357 1.00 72.13 C ATOM 1613 CG PHE B 131 1.284 4.387 -4.495 1.00 2.13 C ATOM 1614 CD1 PHE B 131 2.240 5.003 -5.289 1.00 41.11 C ATOM 1615 CD2 PHE B 131 1.623 3.212 -3.841 1.00 4.22 C ATOM 1616 CE1 PHE B 131 3.505 4.462 -5.423 1.00 14.15 C ATOM 1617 CE2 PHE B 131 2.884 2.667 -3.975 1.00 40.44 C ATOM 1618 CZ PHE B 131 3.826 3.293 -4.766 1.00 30.21 C ATOM 0 H PHE B 131 -2.578 5.731 -4.640 1.00 13.24 H new ATOM 0 HA PHE B 131 -0.476 4.750 -6.451 1.00 31.12 H new ATOM 0 HB2 PHE B 131 -0.007 6.067 -4.288 1.00 72.13 H new ATOM 0 HB3 PHE B 131 -0.538 4.639 -3.424 1.00 72.13 H new ATOM 0 HD1 PHE B 131 1.993 5.917 -5.809 1.00 41.11 H new ATOM 0 HD2 PHE B 131 0.891 2.717 -3.219 1.00 4.22 H new ATOM 0 HE1 PHE B 131 4.241 4.954 -6.041 1.00 14.15 H new ATOM 0 HE2 PHE B 131 3.134 1.751 -3.461 1.00 40.44 H new ATOM 0 HZ PHE B 131 4.813 2.868 -4.870 1.00 30.21 H new ATOM 1628 N LEU B 132 -0.925 2.346 -6.272 1.00 12.50 N ATOM 1629 CA LEU B 132 -1.227 0.923 -6.292 1.00 61.03 C ATOM 1630 C LEU B 132 -0.469 0.222 -5.166 1.00 43.15 C ATOM 1631 O LEU B 132 0.760 0.246 -5.131 1.00 1.22 O ATOM 1632 CB LEU B 132 -0.835 0.350 -7.669 1.00 72.41 C ATOM 1633 CG LEU B 132 -1.290 -1.085 -7.986 1.00 33.02 C ATOM 1634 CD1 LEU B 132 -0.485 -2.113 -7.208 1.00 62.11 C ATOM 1635 CD2 LEU B 132 -2.776 -1.247 -7.707 1.00 21.43 C ATOM 0 H LEU B 132 -0.251 2.637 -6.980 1.00 12.50 H new ATOM 0 HA LEU B 132 -2.293 0.759 -6.134 1.00 61.03 H new ATOM 0 HB2 LEU B 132 -1.238 1.010 -8.437 1.00 72.41 H new ATOM 0 HB3 LEU B 132 0.251 0.387 -7.754 1.00 72.41 H new ATOM 0 HG LEU B 132 -1.111 -1.261 -9.047 1.00 33.02 H new ATOM 0 HD11 LEU B 132 -0.835 -3.114 -7.458 1.00 62.11 H new ATOM 0 HD12 LEU B 132 0.570 -2.022 -7.468 1.00 62.11 H new ATOM 0 HD13 LEU B 132 -0.611 -1.941 -6.139 1.00 62.11 H new ATOM 0 HD21 LEU B 132 -3.080 -2.268 -7.937 1.00 21.43 H new ATOM 0 HD22 LEU B 132 -2.974 -1.037 -6.656 1.00 21.43 H new ATOM 0 HD23 LEU B 132 -3.341 -0.552 -8.328 1.00 21.43 H new ATOM 1647 N TYR B 133 -1.199 -0.389 -4.239 1.00 61.24 N ATOM 1648 CA TYR B 133 -0.561 -1.117 -3.147 1.00 71.23 C ATOM 1649 C TYR B 133 -0.747 -2.625 -3.301 1.00 43.22 C ATOM 1650 O TYR B 133 0.033 -3.409 -2.760 1.00 72.34 O ATOM 1651 CB TYR B 133 -1.072 -0.642 -1.775 1.00 0.03 C ATOM 1652 CG TYR B 133 -2.562 -0.812 -1.548 1.00 45.42 C ATOM 1653 CD1 TYR B 133 -3.081 -2.002 -1.055 1.00 60.14 C ATOM 1654 CD2 TYR B 133 -3.447 0.227 -1.814 1.00 62.42 C ATOM 1655 CE1 TYR B 133 -4.438 -2.157 -0.843 1.00 3.32 C ATOM 1656 CE2 TYR B 133 -4.804 0.079 -1.603 1.00 53.14 C ATOM 1657 CZ TYR B 133 -5.294 -1.111 -1.117 1.00 71.04 C ATOM 1658 OH TYR B 133 -6.648 -1.260 -0.913 1.00 43.34 O ATOM 0 H TYR B 133 -2.219 -0.396 -4.220 1.00 61.24 H new ATOM 0 HA TYR B 133 0.506 -0.901 -3.198 1.00 71.23 H new ATOM 0 HB2 TYR B 133 -0.537 -1.187 -0.997 1.00 0.03 H new ATOM 0 HB3 TYR B 133 -0.820 0.412 -1.656 1.00 0.03 H new ATOM 0 HD1 TYR B 133 -2.413 -2.821 -0.833 1.00 60.14 H new ATOM 0 HD2 TYR B 133 -3.067 1.165 -2.192 1.00 62.42 H new ATOM 0 HE1 TYR B 133 -4.826 -3.092 -0.465 1.00 3.32 H new ATOM 0 HE2 TYR B 133 -5.478 0.895 -1.819 1.00 53.14 H new ATOM 0 HH TYR B 133 -6.801 -1.893 -0.180 1.00 43.34 H new ATOM 1668 N ALA B 134 -1.767 -3.033 -4.048 1.00 42.11 N ATOM 1669 CA ALA B 134 -2.026 -4.452 -4.267 1.00 34.34 C ATOM 1670 C ALA B 134 -2.813 -4.674 -5.550 1.00 44.02 C ATOM 1671 O ALA B 134 -3.616 -3.834 -5.952 1.00 5.11 O ATOM 1672 CB ALA B 134 -2.774 -5.049 -3.083 1.00 54.25 C ATOM 0 H ALA B 134 -2.425 -2.405 -4.510 1.00 42.11 H new ATOM 0 HA ALA B 134 -1.064 -4.955 -4.365 1.00 34.34 H new ATOM 0 HB1 ALA B 134 -2.958 -6.108 -3.265 1.00 54.25 H new ATOM 0 HB2 ALA B 134 -2.175 -4.935 -2.179 1.00 54.25 H new ATOM 0 HB3 ALA B 134 -3.725 -4.532 -2.956 1.00 54.25 H new ATOM 1678 N ILE B 135 -2.564 -5.798 -6.199 1.00 51.40 N ATOM 1679 CA ILE B 135 -3.303 -6.180 -7.391 1.00 14.11 C ATOM 1680 C ILE B 135 -3.897 -7.568 -7.204 1.00 1.05 C ATOM 1681 O ILE B 135 -3.201 -8.493 -6.783 1.00 51.31 O ATOM 1682 CB ILE B 135 -2.399 -6.192 -8.647 1.00 43.35 C ATOM 1683 CG1 ILE B 135 -1.830 -4.797 -8.916 1.00 35.35 C ATOM 1684 CG2 ILE B 135 -3.172 -6.692 -9.862 1.00 55.23 C ATOM 1685 CD1 ILE B 135 -0.885 -4.738 -10.098 1.00 51.53 C ATOM 0 H ILE B 135 -1.849 -6.468 -5.917 1.00 51.40 H new ATOM 0 HA ILE B 135 -4.091 -5.442 -7.538 1.00 14.11 H new ATOM 0 HB ILE B 135 -1.569 -6.874 -8.461 1.00 43.35 H new ATOM 0 HG12 ILE B 135 -2.655 -4.106 -9.088 1.00 35.35 H new ATOM 0 HG13 ILE B 135 -1.305 -4.451 -8.026 1.00 35.35 H new ATOM 0 HG21 ILE B 135 -2.518 -6.693 -10.734 1.00 55.23 H new ATOM 0 HG22 ILE B 135 -3.528 -7.705 -9.675 1.00 55.23 H new ATOM 0 HG23 ILE B 135 -4.023 -6.036 -10.047 1.00 55.23 H new ATOM 0 HD11 ILE B 135 -0.524 -3.717 -10.225 1.00 51.53 H new ATOM 0 HD12 ILE B 135 -0.039 -5.403 -9.921 1.00 51.53 H new ATOM 0 HD13 ILE B 135 -1.411 -5.051 -11.000 1.00 51.53 H new ATOM 1697 N LYS B 136 -5.180 -7.713 -7.491 1.00 1.24 N ATOM 1698 CA LYS B 136 -5.809 -9.020 -7.448 1.00 64.14 C ATOM 1699 C LYS B 136 -6.063 -9.504 -8.865 1.00 13.22 C ATOM 1700 O LYS B 136 -6.941 -8.989 -9.557 1.00 31.30 O ATOM 1701 CB LYS B 136 -7.129 -8.989 -6.673 1.00 63.13 C ATOM 1702 CG LYS B 136 -7.753 -10.368 -6.511 1.00 14.35 C ATOM 1703 CD LYS B 136 -9.196 -10.286 -6.048 1.00 34.34 C ATOM 1704 CE LYS B 136 -9.821 -11.667 -5.920 1.00 20.33 C ATOM 1705 NZ LYS B 136 -9.322 -12.403 -4.728 1.00 42.24 N ATOM 0 H LYS B 136 -5.801 -6.948 -7.754 1.00 1.24 H new ATOM 0 HA LYS B 136 -5.134 -9.702 -6.931 1.00 64.14 H new ATOM 0 HB2 LYS B 136 -6.956 -8.556 -5.688 1.00 63.13 H new ATOM 0 HB3 LYS B 136 -7.832 -8.336 -7.189 1.00 63.13 H new ATOM 0 HG2 LYS B 136 -7.706 -10.901 -7.460 1.00 14.35 H new ATOM 0 HG3 LYS B 136 -7.173 -10.946 -5.792 1.00 14.35 H new ATOM 0 HD2 LYS B 136 -9.242 -9.774 -5.087 1.00 34.34 H new ATOM 0 HD3 LYS B 136 -9.772 -9.689 -6.755 1.00 34.34 H new ATOM 0 HE2 LYS B 136 -10.905 -11.569 -5.856 1.00 20.33 H new ATOM 0 HE3 LYS B 136 -9.606 -12.246 -6.818 1.00 20.33 H new ATOM 0 HZ1 LYS B 136 -8.731 -13.202 -5.035 1.00 42.24 H new ATOM 0 HZ2 LYS B 136 -8.756 -11.762 -4.136 1.00 42.24 H new ATOM 0 HZ3 LYS B 136 -10.129 -12.761 -4.178 1.00 42.24 H new ATOM 1719 N VAL B 137 -5.280 -10.469 -9.304 1.00 11.44 N ATOM 1720 CA VAL B 137 -5.457 -11.025 -10.631 1.00 3.34 C ATOM 1721 C VAL B 137 -6.391 -12.210 -10.548 1.00 64.41 C ATOM 1722 O VAL B 137 -6.277 -13.026 -9.638 1.00 4.44 O ATOM 1723 CB VAL B 137 -4.130 -11.502 -11.263 1.00 70.34 C ATOM 1724 CG1 VAL B 137 -4.276 -11.654 -12.773 1.00 54.12 C ATOM 1725 CG2 VAL B 137 -2.989 -10.562 -10.927 1.00 60.40 C ATOM 0 H VAL B 137 -4.519 -10.883 -8.765 1.00 11.44 H new ATOM 0 HA VAL B 137 -5.863 -10.232 -11.259 1.00 3.34 H new ATOM 0 HB VAL B 137 -3.892 -12.478 -10.840 1.00 70.34 H new ATOM 0 HG11 VAL B 137 -3.330 -11.991 -13.198 1.00 54.12 H new ATOM 0 HG12 VAL B 137 -5.053 -12.386 -12.992 1.00 54.12 H new ATOM 0 HG13 VAL B 137 -4.549 -10.694 -13.211 1.00 54.12 H new ATOM 0 HG21 VAL B 137 -2.070 -10.926 -11.387 1.00 60.40 H new ATOM 0 HG22 VAL B 137 -3.215 -9.566 -11.307 1.00 60.40 H new ATOM 0 HG23 VAL B 137 -2.861 -10.517 -9.845 1.00 60.40 H new ATOM 1735 N VAL B 138 -7.324 -12.292 -11.476 1.00 34.14 N ATOM 1736 CA VAL B 138 -8.189 -13.452 -11.591 1.00 32.44 C ATOM 1737 C VAL B 138 -8.042 -14.061 -12.984 1.00 70.23 C ATOM 1738 O VAL B 138 -8.892 -13.861 -13.854 1.00 75.11 O ATOM 1739 CB VAL B 138 -9.671 -13.102 -11.326 1.00 32.50 C ATOM 1740 CG1 VAL B 138 -10.531 -14.359 -11.268 1.00 4.44 C ATOM 1741 CG2 VAL B 138 -9.818 -12.304 -10.039 1.00 13.30 C ATOM 0 H VAL B 138 -7.504 -11.563 -12.167 1.00 34.14 H new ATOM 0 HA VAL B 138 -7.883 -14.172 -10.832 1.00 32.44 H new ATOM 0 HB VAL B 138 -10.018 -12.488 -12.157 1.00 32.50 H new ATOM 0 HG11 VAL B 138 -11.568 -14.082 -11.080 1.00 4.44 H new ATOM 0 HG12 VAL B 138 -10.463 -14.890 -12.217 1.00 4.44 H new ATOM 0 HG13 VAL B 138 -10.177 -15.005 -10.465 1.00 4.44 H new ATOM 0 HG21 VAL B 138 -10.870 -12.070 -9.874 1.00 13.30 H new ATOM 0 HG22 VAL B 138 -9.442 -12.892 -9.202 1.00 13.30 H new ATOM 0 HG23 VAL B 138 -9.248 -11.378 -10.118 1.00 13.30 H new ATOM 1751 N PRO B 139 -6.912 -14.732 -13.247 1.00 3.32 N ATOM 1752 CA PRO B 139 -6.693 -15.415 -14.513 1.00 34.23 C ATOM 1753 C PRO B 139 -7.413 -16.754 -14.597 1.00 45.40 C ATOM 1754 O PRO B 139 -7.388 -17.550 -13.656 1.00 72.23 O ATOM 1755 CB PRO B 139 -5.176 -15.611 -14.561 1.00 22.42 C ATOM 1756 CG PRO B 139 -4.727 -15.618 -13.139 1.00 61.33 C ATOM 1757 CD PRO B 139 -5.741 -14.832 -12.353 1.00 61.44 C ATOM 0 HA PRO B 139 -7.086 -14.840 -15.351 1.00 34.23 H new ATOM 0 HB2 PRO B 139 -4.917 -16.546 -15.058 1.00 22.42 H new ATOM 0 HB3 PRO B 139 -4.695 -14.809 -15.120 1.00 22.42 H new ATOM 0 HG2 PRO B 139 -4.654 -16.638 -12.763 1.00 61.33 H new ATOM 0 HG3 PRO B 139 -3.737 -15.172 -13.045 1.00 61.33 H new ATOM 0 HD2 PRO B 139 -5.996 -15.336 -11.421 1.00 61.44 H new ATOM 0 HD3 PRO B 139 -5.359 -13.846 -12.088 1.00 61.44 H new ATOM 1765 N LYS B 140 -8.064 -16.990 -15.731 1.00 44.44 N ATOM 1766 CA LYS B 140 -8.692 -18.277 -15.999 1.00 55.43 C ATOM 1767 C LYS B 140 -7.630 -19.360 -16.047 1.00 11.45 C ATOM 1768 O LYS B 140 -7.872 -20.516 -15.706 1.00 71.43 O ATOM 1769 CB LYS B 140 -9.447 -18.240 -17.325 1.00 12.51 C ATOM 1770 CG LYS B 140 -10.607 -17.268 -17.333 1.00 71.22 C ATOM 1771 CD LYS B 140 -11.335 -17.306 -18.659 1.00 61.01 C ATOM 1772 CE LYS B 140 -12.144 -18.583 -18.831 1.00 1.02 C ATOM 1773 NZ LYS B 140 -13.272 -18.666 -17.865 1.00 51.51 N ATOM 0 H LYS B 140 -8.170 -16.305 -16.480 1.00 44.44 H new ATOM 0 HA LYS B 140 -9.401 -18.493 -15.200 1.00 55.43 H new ATOM 0 HB2 LYS B 140 -8.753 -17.972 -18.122 1.00 12.51 H new ATOM 0 HB3 LYS B 140 -9.819 -19.239 -17.550 1.00 12.51 H new ATOM 0 HG2 LYS B 140 -11.298 -17.514 -16.527 1.00 71.22 H new ATOM 0 HG3 LYS B 140 -10.242 -16.259 -17.143 1.00 71.22 H new ATOM 0 HD2 LYS B 140 -11.998 -16.444 -18.733 1.00 61.01 H new ATOM 0 HD3 LYS B 140 -10.613 -17.223 -19.471 1.00 61.01 H new ATOM 0 HE2 LYS B 140 -12.534 -18.630 -19.848 1.00 1.02 H new ATOM 0 HE3 LYS B 140 -11.491 -19.446 -18.700 1.00 1.02 H new ATOM 0 HZ1 LYS B 140 -13.938 -19.404 -18.171 1.00 51.51 H new ATOM 0 HZ2 LYS B 140 -12.904 -18.902 -16.921 1.00 51.51 H new ATOM 0 HZ3 LYS B 140 -13.764 -17.750 -17.826 1.00 51.51 H new ATOM 1787 N HIS B 141 -6.444 -18.963 -16.481 1.00 42.55 N ATOM 1788 CA HIS B 141 -5.302 -19.855 -16.528 1.00 75.12 C ATOM 1789 C HIS B 141 -4.258 -19.393 -15.521 1.00 1.41 C ATOM 1790 O HIS B 141 -3.403 -18.569 -15.836 1.00 31.04 O ATOM 1791 CB HIS B 141 -4.705 -19.886 -17.940 1.00 13.24 C ATOM 1792 CG HIS B 141 -5.709 -20.207 -19.004 1.00 43.03 C ATOM 1793 ND1 HIS B 141 -5.997 -21.490 -19.402 1.00 34.50 N ATOM 1794 CD2 HIS B 141 -6.512 -19.399 -19.737 1.00 65.43 C ATOM 1795 CE1 HIS B 141 -6.934 -21.460 -20.328 1.00 11.44 C ATOM 1796 NE2 HIS B 141 -7.265 -20.203 -20.551 1.00 23.42 N ATOM 0 H HIS B 141 -6.249 -18.017 -16.809 1.00 42.55 H new ATOM 0 HA HIS B 141 -5.625 -20.864 -16.273 1.00 75.12 H new ATOM 0 HB2 HIS B 141 -4.254 -18.918 -18.157 1.00 13.24 H new ATOM 0 HB3 HIS B 141 -3.904 -20.625 -17.972 1.00 13.24 H new ATOM 0 HD2 HIS B 141 -6.551 -18.321 -19.689 1.00 65.43 H new ATOM 0 HE1 HIS B 141 -7.360 -22.321 -20.822 1.00 11.44 H new ATOM 0 HE2 HIS B 141 -7.966 -19.883 -21.219 1.00 23.42 H new ATOM 1805 N GLY B 142 -4.358 -19.898 -14.300 1.00 62.02 N ATOM 1806 CA GLY B 142 -3.438 -19.494 -13.257 1.00 74.41 C ATOM 1807 C GLY B 142 -4.132 -19.286 -11.926 1.00 75.30 C ATOM 1808 O GLY B 142 -3.486 -19.331 -10.876 1.00 54.43 O ATOM 0 H GLY B 142 -5.060 -20.580 -14.013 1.00 62.02 H new ATOM 0 HA2 GLY B 142 -2.663 -20.252 -13.145 1.00 74.41 H new ATOM 0 HA3 GLY B 142 -2.940 -18.571 -13.553 1.00 74.41 H new ATOM 1812 N LYS B 143 -5.450 -19.056 -11.978 1.00 51.44 N ATOM 1813 CA LYS B 143 -6.283 -18.865 -10.779 1.00 11.20 C ATOM 1814 C LYS B 143 -5.969 -17.537 -10.082 1.00 22.43 C ATOM 1815 O LYS B 143 -4.849 -17.033 -10.160 1.00 1.43 O ATOM 1816 CB LYS B 143 -6.118 -20.041 -9.805 1.00 42.20 C ATOM 1817 CG LYS B 143 -6.528 -21.379 -10.399 1.00 65.32 C ATOM 1818 CD LYS B 143 -7.991 -21.381 -10.819 1.00 32.23 C ATOM 1819 CE LYS B 143 -8.391 -22.699 -11.459 1.00 54.24 C ATOM 1820 NZ LYS B 143 -8.074 -23.854 -10.584 1.00 44.12 N ATOM 0 H LYS B 143 -5.972 -18.997 -12.853 1.00 51.44 H new ATOM 0 HA LYS B 143 -7.323 -18.831 -11.104 1.00 11.20 H new ATOM 0 HB2 LYS B 143 -5.077 -20.097 -9.487 1.00 42.20 H new ATOM 0 HB3 LYS B 143 -6.714 -19.850 -8.912 1.00 42.20 H new ATOM 0 HG2 LYS B 143 -5.901 -21.602 -11.262 1.00 65.32 H new ATOM 0 HG3 LYS B 143 -6.358 -22.170 -9.668 1.00 65.32 H new ATOM 0 HD2 LYS B 143 -8.620 -21.194 -9.948 1.00 32.23 H new ATOM 0 HD3 LYS B 143 -8.169 -20.567 -11.521 1.00 32.23 H new ATOM 0 HE2 LYS B 143 -9.459 -22.689 -11.675 1.00 54.24 H new ATOM 0 HE3 LYS B 143 -7.874 -22.812 -12.412 1.00 54.24 H new ATOM 0 HZ1 LYS B 143 -8.552 -24.704 -10.945 1.00 44.12 H new ATOM 0 HZ2 LYS B 143 -7.046 -24.011 -10.576 1.00 44.12 H new ATOM 0 HZ3 LYS B 143 -8.402 -23.657 -9.617 1.00 44.12 H new ATOM 1834 N PRO B 144 -6.961 -16.944 -9.399 1.00 65.14 N ATOM 1835 CA PRO B 144 -6.799 -15.644 -8.741 1.00 13.43 C ATOM 1836 C PRO B 144 -5.698 -15.637 -7.679 1.00 12.44 C ATOM 1837 O PRO B 144 -5.530 -16.601 -6.926 1.00 73.32 O ATOM 1838 CB PRO B 144 -8.162 -15.379 -8.098 1.00 53.53 C ATOM 1839 CG PRO B 144 -8.847 -16.699 -8.053 1.00 75.54 C ATOM 1840 CD PRO B 144 -8.316 -17.488 -9.217 1.00 14.44 C ATOM 0 HA PRO B 144 -6.496 -14.881 -9.458 1.00 13.43 H new ATOM 0 HB2 PRO B 144 -8.049 -14.962 -7.097 1.00 53.53 H new ATOM 0 HB3 PRO B 144 -8.737 -14.659 -8.680 1.00 53.53 H new ATOM 0 HG2 PRO B 144 -8.645 -17.210 -7.112 1.00 75.54 H new ATOM 0 HG3 PRO B 144 -9.928 -16.579 -8.125 1.00 75.54 H new ATOM 0 HD2 PRO B 144 -8.296 -18.557 -9.004 1.00 14.44 H new ATOM 0 HD3 PRO B 144 -8.928 -17.352 -10.109 1.00 14.44 H new ATOM 1848 N TYR B 145 -4.945 -14.545 -7.631 1.00 74.31 N ATOM 1849 CA TYR B 145 -3.882 -14.382 -6.652 1.00 4.33 C ATOM 1850 C TYR B 145 -3.608 -12.902 -6.410 1.00 24.33 C ATOM 1851 O TYR B 145 -3.824 -12.070 -7.295 1.00 14.32 O ATOM 1852 CB TYR B 145 -2.597 -15.099 -7.101 1.00 23.01 C ATOM 1853 CG TYR B 145 -1.978 -14.556 -8.375 1.00 73.30 C ATOM 1854 CD1 TYR B 145 -2.468 -14.921 -9.624 1.00 13.30 C ATOM 1855 CD2 TYR B 145 -0.894 -13.687 -8.325 1.00 11.13 C ATOM 1856 CE1 TYR B 145 -1.896 -14.434 -10.785 1.00 22.23 C ATOM 1857 CE2 TYR B 145 -0.318 -13.197 -9.480 1.00 30.43 C ATOM 1858 CZ TYR B 145 -0.821 -13.572 -10.709 1.00 4.42 C ATOM 1859 OH TYR B 145 -0.245 -13.087 -11.863 1.00 1.30 O ATOM 0 H TYR B 145 -5.054 -13.754 -8.265 1.00 74.31 H new ATOM 0 HA TYR B 145 -4.211 -14.837 -5.718 1.00 4.33 H new ATOM 0 HB2 TYR B 145 -1.861 -15.033 -6.299 1.00 23.01 H new ATOM 0 HB3 TYR B 145 -2.819 -16.157 -7.243 1.00 23.01 H new ATOM 0 HD1 TYR B 145 -3.309 -15.596 -9.688 1.00 13.30 H new ATOM 0 HD2 TYR B 145 -0.496 -13.390 -7.366 1.00 11.13 H new ATOM 0 HE1 TYR B 145 -2.289 -14.727 -11.747 1.00 22.23 H new ATOM 0 HE2 TYR B 145 0.523 -12.522 -9.422 1.00 30.43 H new ATOM 0 HH TYR B 145 0.499 -12.492 -11.632 1.00 1.30 H new ATOM 1869 N PHE B 146 -3.151 -12.581 -5.208 1.00 5.02 N ATOM 1870 CA PHE B 146 -2.836 -11.203 -4.846 1.00 2.42 C ATOM 1871 C PHE B 146 -1.354 -10.907 -5.044 1.00 75.14 C ATOM 1872 O PHE B 146 -0.499 -11.742 -4.746 1.00 52.53 O ATOM 1873 CB PHE B 146 -3.201 -10.918 -3.385 1.00 23.44 C ATOM 1874 CG PHE B 146 -4.676 -10.876 -3.101 1.00 2.03 C ATOM 1875 CD1 PHE B 146 -5.390 -9.700 -3.266 1.00 34.33 C ATOM 1876 CD2 PHE B 146 -5.343 -12.004 -2.653 1.00 53.52 C ATOM 1877 CE1 PHE B 146 -6.744 -9.653 -2.995 1.00 42.24 C ATOM 1878 CE2 PHE B 146 -6.696 -11.962 -2.378 1.00 44.25 C ATOM 1879 CZ PHE B 146 -7.396 -10.784 -2.550 1.00 44.33 C ATOM 0 H PHE B 146 -2.989 -13.258 -4.463 1.00 5.02 H new ATOM 0 HA PHE B 146 -3.426 -10.561 -5.500 1.00 2.42 H new ATOM 0 HB2 PHE B 146 -2.746 -11.683 -2.756 1.00 23.44 H new ATOM 0 HB3 PHE B 146 -2.762 -9.963 -3.095 1.00 23.44 H new ATOM 0 HD1 PHE B 146 -4.883 -8.811 -3.610 1.00 34.33 H new ATOM 0 HD2 PHE B 146 -4.799 -12.927 -2.517 1.00 53.52 H new ATOM 0 HE1 PHE B 146 -7.291 -8.732 -3.131 1.00 42.24 H new ATOM 0 HE2 PHE B 146 -7.205 -12.848 -2.029 1.00 44.25 H new ATOM 0 HZ PHE B 146 -8.454 -10.748 -2.336 1.00 44.33 H new ATOM 1889 N LEU B 147 -1.071 -9.723 -5.563 1.00 25.41 N ATOM 1890 CA LEU B 147 0.287 -9.198 -5.628 1.00 40.22 C ATOM 1891 C LEU B 147 0.393 -7.943 -4.774 1.00 23.34 C ATOM 1892 O LEU B 147 -0.190 -6.910 -5.106 1.00 11.31 O ATOM 1893 CB LEU B 147 0.685 -8.872 -7.070 1.00 52.11 C ATOM 1894 CG LEU B 147 1.054 -10.074 -7.937 1.00 71.44 C ATOM 1895 CD1 LEU B 147 1.327 -9.631 -9.363 1.00 73.32 C ATOM 1896 CD2 LEU B 147 2.269 -10.788 -7.368 1.00 63.04 C ATOM 0 H LEU B 147 -1.776 -9.097 -5.952 1.00 25.41 H new ATOM 0 HA LEU B 147 0.966 -9.962 -5.249 1.00 40.22 H new ATOM 0 HB2 LEU B 147 -0.141 -8.343 -7.546 1.00 52.11 H new ATOM 0 HB3 LEU B 147 1.533 -8.187 -7.049 1.00 52.11 H new ATOM 0 HG LEU B 147 0.213 -10.768 -7.940 1.00 71.44 H new ATOM 0 HD11 LEU B 147 1.589 -10.498 -9.970 1.00 73.32 H new ATOM 0 HD12 LEU B 147 0.436 -9.157 -9.774 1.00 73.32 H new ATOM 0 HD13 LEU B 147 2.153 -8.920 -9.371 1.00 73.32 H new ATOM 0 HD21 LEU B 147 2.518 -11.642 -7.998 1.00 63.04 H new ATOM 0 HD22 LEU B 147 3.114 -10.100 -7.338 1.00 63.04 H new ATOM 0 HD23 LEU B 147 2.048 -11.135 -6.359 1.00 63.04 H new ATOM 1908 N VAL B 148 1.112 -8.039 -3.667 1.00 60.21 N ATOM 1909 CA VAL B 148 1.259 -6.911 -2.757 1.00 65.44 C ATOM 1910 C VAL B 148 2.541 -6.137 -3.050 1.00 40.53 C ATOM 1911 O VAL B 148 3.604 -6.732 -3.236 1.00 55.13 O ATOM 1912 CB VAL B 148 1.270 -7.380 -1.285 1.00 21.44 C ATOM 1913 CG1 VAL B 148 1.314 -6.190 -0.335 1.00 60.42 C ATOM 1914 CG2 VAL B 148 0.058 -8.253 -0.994 1.00 70.45 C ATOM 0 H VAL B 148 1.603 -8.884 -3.376 1.00 60.21 H new ATOM 0 HA VAL B 148 0.402 -6.256 -2.913 1.00 65.44 H new ATOM 0 HB VAL B 148 2.170 -7.974 -1.125 1.00 21.44 H new ATOM 0 HG11 VAL B 148 1.321 -6.547 0.695 1.00 60.42 H new ATOM 0 HG12 VAL B 148 2.216 -5.607 -0.523 1.00 60.42 H new ATOM 0 HG13 VAL B 148 0.437 -5.563 -0.496 1.00 60.42 H new ATOM 0 HG21 VAL B 148 0.082 -8.574 0.047 1.00 70.45 H new ATOM 0 HG22 VAL B 148 -0.853 -7.683 -1.177 1.00 70.45 H new ATOM 0 HG23 VAL B 148 0.075 -9.128 -1.644 1.00 70.45 H new ATOM 1924 N ARG B 149 2.428 -4.814 -3.121 1.00 12.03 N ATOM 1925 CA ARG B 149 3.582 -3.952 -3.306 1.00 72.24 C ATOM 1926 C ARG B 149 4.432 -3.944 -2.040 1.00 74.04 C ATOM 1927 O ARG B 149 3.989 -3.471 -0.991 1.00 11.24 O ATOM 1928 CB ARG B 149 3.116 -2.532 -3.647 1.00 55.01 C ATOM 1929 CG ARG B 149 4.231 -1.499 -3.718 1.00 60.34 C ATOM 1930 CD ARG B 149 5.237 -1.804 -4.820 1.00 10.23 C ATOM 1931 NE ARG B 149 4.613 -1.944 -6.141 1.00 33.20 N ATOM 1932 CZ ARG B 149 4.018 -0.947 -6.807 1.00 65.30 C ATOM 1933 NH1 ARG B 149 3.882 0.248 -6.251 1.00 4.44 N ATOM 1934 NH2 ARG B 149 3.549 -1.155 -8.035 1.00 32.02 N ATOM 0 H ARG B 149 1.540 -4.316 -3.052 1.00 12.03 H new ATOM 0 HA ARG B 149 4.188 -4.330 -4.129 1.00 72.24 H new ATOM 0 HB2 ARG B 149 2.598 -2.554 -4.606 1.00 55.01 H new ATOM 0 HB3 ARG B 149 2.390 -2.213 -2.899 1.00 55.01 H new ATOM 0 HG2 ARG B 149 3.799 -0.513 -3.888 1.00 60.34 H new ATOM 0 HG3 ARG B 149 4.748 -1.460 -2.759 1.00 60.34 H new ATOM 0 HD2 ARG B 149 5.980 -1.007 -4.857 1.00 10.23 H new ATOM 0 HD3 ARG B 149 5.768 -2.724 -4.575 1.00 10.23 H new ATOM 0 HE ARG B 149 4.634 -2.864 -6.582 1.00 33.20 H new ATOM 0 HH11 ARG B 149 4.232 0.414 -5.308 1.00 4.44 H new ATOM 0 HH12 ARG B 149 3.427 1.002 -6.766 1.00 4.44 H new ATOM 0 HH21 ARG B 149 3.643 -2.074 -8.468 1.00 32.02 H new ATOM 0 HH22 ARG B 149 3.095 -0.396 -8.543 1.00 32.02 H new ATOM 1948 N ALA B 150 5.638 -4.489 -2.143 1.00 73.35 N ATOM 1949 CA ALA B 150 6.544 -4.564 -1.007 1.00 13.42 C ATOM 1950 C ALA B 150 6.981 -3.175 -0.558 1.00 1.30 C ATOM 1951 O ALA B 150 6.979 -2.224 -1.348 1.00 74.24 O ATOM 1952 CB ALA B 150 7.758 -5.413 -1.350 1.00 43.15 C ATOM 0 H ALA B 150 6.011 -4.886 -3.005 1.00 73.35 H new ATOM 0 HA ALA B 150 6.008 -5.033 -0.182 1.00 13.42 H new ATOM 0 HB1 ALA B 150 8.425 -5.458 -0.489 1.00 43.15 H new ATOM 0 HB2 ALA B 150 7.435 -6.420 -1.612 1.00 43.15 H new ATOM 0 HB3 ALA B 150 8.285 -4.969 -2.195 1.00 43.15 H new ATOM 1958 N ASP B 151 7.363 -3.077 0.708 1.00 0.33 N ATOM 1959 CA ASP B 151 7.758 -1.807 1.310 1.00 54.55 C ATOM 1960 C ASP B 151 8.903 -1.145 0.554 1.00 60.34 C ATOM 1961 O ASP B 151 9.838 -1.805 0.093 1.00 72.00 O ATOM 1962 CB ASP B 151 8.151 -2.011 2.778 1.00 64.33 C ATOM 1963 CG ASP B 151 9.160 -3.128 2.978 1.00 45.41 C ATOM 1964 OD1 ASP B 151 8.740 -4.298 3.114 1.00 53.55 O ATOM 1965 OD2 ASP B 151 10.375 -2.844 3.014 1.00 33.42 O ATOM 0 H ASP B 151 7.408 -3.871 1.346 1.00 0.33 H new ATOM 0 HA ASP B 151 6.896 -1.142 1.253 1.00 54.55 H new ATOM 0 HB2 ASP B 151 8.565 -1.082 3.169 1.00 64.33 H new ATOM 0 HB3 ASP B 151 7.256 -2.230 3.360 1.00 64.33 H new ATOM 1970 N GLY B 152 8.794 0.168 0.400 1.00 35.01 N ATOM 1971 CA GLY B 152 9.843 0.933 -0.236 1.00 62.13 C ATOM 1972 C GLY B 152 9.609 1.122 -1.720 1.00 53.15 C ATOM 1973 O GLY B 152 10.293 1.922 -2.359 1.00 52.30 O ATOM 0 H GLY B 152 7.992 0.718 0.707 1.00 35.01 H new ATOM 0 HA2 GLY B 152 9.917 1.909 0.243 1.00 62.13 H new ATOM 0 HA3 GLY B 152 10.798 0.430 -0.084 1.00 62.13 H new ATOM 1977 N SER B 153 8.636 0.387 -2.265 1.00 21.40 N ATOM 1978 CA SER B 153 8.334 0.429 -3.695 1.00 1.53 C ATOM 1979 C SER B 153 9.587 0.056 -4.490 1.00 62.01 C ATOM 1980 O SER B 153 9.987 0.746 -5.429 1.00 22.51 O ATOM 1981 CB SER B 153 7.819 1.818 -4.095 1.00 44.25 C ATOM 1982 OG SER B 153 7.012 1.750 -5.258 1.00 33.02 O ATOM 0 H SER B 153 8.041 -0.248 -1.732 1.00 21.40 H new ATOM 0 HA SER B 153 7.548 -0.292 -3.920 1.00 1.53 H new ATOM 0 HB2 SER B 153 7.243 2.246 -3.274 1.00 44.25 H new ATOM 0 HB3 SER B 153 8.663 2.484 -4.273 1.00 44.25 H new ATOM 0 HG SER B 153 6.696 2.648 -5.490 1.00 33.02 H new ATOM 1988 N ASP B 154 10.186 -1.063 -4.097 1.00 1.14 N ATOM 1989 CA ASP B 154 11.452 -1.529 -4.661 1.00 72.41 C ATOM 1990 C ASP B 154 11.275 -2.088 -6.076 1.00 34.25 C ATOM 1991 O ASP B 154 12.249 -2.355 -6.778 1.00 72.45 O ATOM 1992 CB ASP B 154 12.040 -2.603 -3.734 1.00 13.53 C ATOM 1993 CG ASP B 154 13.369 -3.152 -4.209 1.00 3.44 C ATOM 1994 OD1 ASP B 154 14.396 -2.457 -4.057 1.00 62.44 O ATOM 1995 OD2 ASP B 154 13.402 -4.294 -4.708 1.00 63.50 O ATOM 0 H ASP B 154 9.807 -1.676 -3.375 1.00 1.14 H new ATOM 0 HA ASP B 154 12.133 -0.681 -4.736 1.00 72.41 H new ATOM 0 HB2 ASP B 154 12.166 -2.181 -2.737 1.00 13.53 H new ATOM 0 HB3 ASP B 154 11.328 -3.424 -3.645 1.00 13.53 H new ATOM 2000 N GLY B 155 10.031 -2.232 -6.505 1.00 10.43 N ATOM 2001 CA GLY B 155 9.761 -2.871 -7.778 1.00 31.55 C ATOM 2002 C GLY B 155 9.559 -4.357 -7.610 1.00 22.31 C ATOM 2003 O GLY B 155 9.649 -5.132 -8.564 1.00 33.12 O ATOM 0 H GLY B 155 9.204 -1.919 -5.997 1.00 10.43 H new ATOM 0 HA2 GLY B 155 8.872 -2.429 -8.229 1.00 31.55 H new ATOM 0 HA3 GLY B 155 10.590 -2.689 -8.462 1.00 31.55 H new ATOM 2007 N ASN B 156 9.284 -4.745 -6.379 1.00 35.34 N ATOM 2008 CA ASN B 156 9.095 -6.139 -6.028 1.00 5.01 C ATOM 2009 C ASN B 156 7.698 -6.350 -5.462 1.00 50.01 C ATOM 2010 O ASN B 156 7.207 -5.533 -4.676 1.00 23.25 O ATOM 2011 CB ASN B 156 10.154 -6.566 -5.007 1.00 73.40 C ATOM 2012 CG ASN B 156 9.997 -8.001 -4.548 1.00 2.20 C ATOM 2013 OD1 ASN B 156 10.349 -8.261 -3.300 1.00 41.42 O flip ATOM 2014 ND2 ASN B 156 9.569 -8.868 -5.304 1.00 54.11 N flip ATOM 0 H ASN B 156 9.185 -4.102 -5.594 1.00 35.34 H new ATOM 0 HA ASN B 156 9.203 -6.751 -6.924 1.00 5.01 H new ATOM 0 HB2 ASN B 156 11.144 -6.438 -5.445 1.00 73.40 H new ATOM 0 HB3 ASN B 156 10.101 -5.907 -4.141 1.00 73.40 H new ATOM 0 HD21 ASN B 156 9.308 -8.627 -6.260 1.00 54.11 H new ATOM 0 HD22 ASN B 156 9.474 -9.829 -4.976 1.00 54.11 H new ATOM 2021 N PHE B 157 7.059 -7.428 -5.876 1.00 52.24 N ATOM 2022 CA PHE B 157 5.740 -7.778 -5.379 1.00 12.01 C ATOM 2023 C PHE B 157 5.809 -9.060 -4.570 1.00 71.23 C ATOM 2024 O PHE B 157 6.760 -9.831 -4.689 1.00 34.15 O ATOM 2025 CB PHE B 157 4.742 -7.950 -6.532 1.00 61.24 C ATOM 2026 CG PHE B 157 4.191 -6.661 -7.070 1.00 75.44 C ATOM 2027 CD1 PHE B 157 4.886 -5.931 -8.018 1.00 1.02 C ATOM 2028 CD2 PHE B 157 2.962 -6.191 -6.639 1.00 42.32 C ATOM 2029 CE1 PHE B 157 4.370 -4.754 -8.523 1.00 72.13 C ATOM 2030 CE2 PHE B 157 2.437 -5.018 -7.142 1.00 21.34 C ATOM 2031 CZ PHE B 157 3.142 -4.298 -8.085 1.00 31.34 C ATOM 0 H PHE B 157 7.436 -8.082 -6.562 1.00 52.24 H new ATOM 0 HA PHE B 157 5.395 -6.964 -4.742 1.00 12.01 H new ATOM 0 HB2 PHE B 157 5.231 -8.489 -7.343 1.00 61.24 H new ATOM 0 HB3 PHE B 157 3.914 -8.571 -6.191 1.00 61.24 H new ATOM 0 HD1 PHE B 157 5.844 -6.286 -8.367 1.00 1.02 H new ATOM 0 HD2 PHE B 157 2.407 -6.750 -5.900 1.00 42.32 H new ATOM 0 HE1 PHE B 157 4.925 -4.191 -9.259 1.00 72.13 H new ATOM 0 HE2 PHE B 157 1.476 -4.664 -6.798 1.00 21.34 H new ATOM 0 HZ PHE B 157 2.734 -3.379 -8.480 1.00 31.34 H new ATOM 2041 N ILE B 158 4.811 -9.275 -3.736 1.00 72.22 N ATOM 2042 CA ILE B 158 4.705 -10.510 -2.985 1.00 75.31 C ATOM 2043 C ILE B 158 3.380 -11.185 -3.305 1.00 62.53 C ATOM 2044 O ILE B 158 2.312 -10.605 -3.102 1.00 10.22 O ATOM 2045 CB ILE B 158 4.815 -10.269 -1.459 1.00 70.54 C ATOM 2046 CG1 ILE B 158 6.188 -9.685 -1.101 1.00 44.32 C ATOM 2047 CG2 ILE B 158 4.573 -11.563 -0.691 1.00 14.11 C ATOM 2048 CD1 ILE B 158 7.356 -10.582 -1.468 1.00 55.30 C ATOM 0 H ILE B 158 4.059 -8.608 -3.561 1.00 72.22 H new ATOM 0 HA ILE B 158 5.535 -11.154 -3.278 1.00 75.31 H new ATOM 0 HB ILE B 158 4.048 -9.549 -1.173 1.00 70.54 H new ATOM 0 HG12 ILE B 158 6.307 -8.727 -1.606 1.00 44.32 H new ATOM 0 HG13 ILE B 158 6.219 -9.486 -0.030 1.00 44.32 H new ATOM 0 HG21 ILE B 158 4.655 -11.372 0.379 1.00 14.11 H new ATOM 0 HG22 ILE B 158 3.575 -11.939 -0.917 1.00 14.11 H new ATOM 0 HG23 ILE B 158 5.316 -12.305 -0.985 1.00 14.11 H new ATOM 0 HD11 ILE B 158 8.290 -10.098 -1.183 1.00 55.30 H new ATOM 0 HD12 ILE B 158 7.264 -11.532 -0.942 1.00 55.30 H new ATOM 0 HD13 ILE B 158 7.354 -10.761 -2.543 1.00 55.30 H new ATOM 2060 N ARG B 159 3.454 -12.393 -3.851 1.00 4.33 N ATOM 2061 CA ARG B 159 2.258 -13.168 -4.143 1.00 44.23 C ATOM 2062 C ARG B 159 1.626 -13.656 -2.854 1.00 34.34 C ATOM 2063 O ARG B 159 2.322 -14.072 -1.939 1.00 24.25 O ATOM 2064 CB ARG B 159 2.585 -14.389 -5.010 1.00 33.11 C ATOM 2065 CG ARG B 159 2.512 -14.158 -6.511 1.00 31.21 C ATOM 2066 CD ARG B 159 2.689 -15.471 -7.259 1.00 13.14 C ATOM 2067 NE ARG B 159 2.578 -15.324 -8.709 1.00 43.51 N ATOM 2068 CZ ARG B 159 1.983 -16.216 -9.503 1.00 43.24 C ATOM 2069 NH1 ARG B 159 1.454 -17.326 -8.994 1.00 24.33 N ATOM 2070 NH2 ARG B 159 1.948 -16.009 -10.811 1.00 20.22 N ATOM 0 H ARG B 159 4.329 -12.855 -4.099 1.00 4.33 H new ATOM 0 HA ARG B 159 1.570 -12.517 -4.682 1.00 44.23 H new ATOM 0 HB2 ARG B 159 3.589 -14.733 -4.760 1.00 33.11 H new ATOM 0 HB3 ARG B 159 1.898 -15.194 -4.749 1.00 33.11 H new ATOM 0 HG2 ARG B 159 1.552 -13.711 -6.770 1.00 31.21 H new ATOM 0 HG3 ARG B 159 3.285 -13.452 -6.815 1.00 31.21 H new ATOM 0 HD2 ARG B 159 3.665 -15.892 -7.016 1.00 13.14 H new ATOM 0 HD3 ARG B 159 1.940 -16.183 -6.913 1.00 13.14 H new ATOM 0 HE ARG B 159 2.979 -14.491 -9.139 1.00 43.51 H new ATOM 0 HH11 ARG B 159 1.502 -17.500 -7.990 1.00 24.33 H new ATOM 0 HH12 ARG B 159 1.001 -18.003 -9.608 1.00 24.33 H new ATOM 0 HH21 ARG B 159 2.375 -15.171 -11.206 1.00 20.22 H new ATOM 0 HH22 ARG B 159 1.494 -16.688 -11.423 1.00 20.22 H new ATOM 2084 N SER B 160 0.309 -13.625 -2.789 1.00 55.33 N ATOM 2085 CA SER B 160 -0.390 -14.273 -1.695 1.00 24.34 C ATOM 2086 C SER B 160 -0.489 -15.770 -1.997 1.00 34.34 C ATOM 2087 O SER B 160 -1.068 -16.549 -1.240 1.00 54.41 O ATOM 2088 CB SER B 160 -1.774 -13.654 -1.499 1.00 64.55 C ATOM 2089 OG SER B 160 -2.309 -13.999 -0.236 1.00 43.35 O ATOM 0 H SER B 160 -0.293 -13.164 -3.471 1.00 55.33 H new ATOM 0 HA SER B 160 0.161 -14.130 -0.766 1.00 24.34 H new ATOM 0 HB2 SER B 160 -1.707 -12.570 -1.586 1.00 64.55 H new ATOM 0 HB3 SER B 160 -2.444 -13.996 -2.288 1.00 64.55 H new ATOM 0 HG SER B 160 -1.594 -13.994 0.434 1.00 43.35 H new ATOM 2095 N ASP B 161 0.082 -16.142 -3.136 1.00 13.53 N ATOM 2096 CA ASP B 161 0.205 -17.532 -3.562 1.00 12.13 C ATOM 2097 C ASP B 161 1.606 -18.056 -3.232 1.00 55.31 C ATOM 2098 O ASP B 161 1.821 -19.257 -3.057 1.00 73.22 O ATOM 2099 CB ASP B 161 -0.088 -17.612 -5.070 1.00 62.21 C ATOM 2100 CG ASP B 161 0.655 -18.722 -5.788 1.00 65.20 C ATOM 2101 OD1 ASP B 161 0.246 -19.896 -5.673 1.00 45.02 O ATOM 2102 OD2 ASP B 161 1.641 -18.410 -6.494 1.00 71.13 O ATOM 0 H ASP B 161 0.479 -15.477 -3.800 1.00 13.53 H new ATOM 0 HA ASP B 161 -0.512 -18.158 -3.032 1.00 12.13 H new ATOM 0 HB2 ASP B 161 -1.159 -17.754 -5.214 1.00 62.21 H new ATOM 0 HB3 ASP B 161 0.172 -16.659 -5.531 1.00 62.21 H new ATOM 2107 N GLN B 162 2.542 -17.121 -3.104 1.00 22.22 N ATOM 2108 CA GLN B 162 3.935 -17.427 -2.792 1.00 72.13 C ATOM 2109 C GLN B 162 4.513 -16.328 -1.897 1.00 44.54 C ATOM 2110 O GLN B 162 5.374 -15.559 -2.327 1.00 22.53 O ATOM 2111 CB GLN B 162 4.764 -17.547 -4.079 1.00 21.43 C ATOM 2112 CG GLN B 162 4.594 -18.869 -4.814 1.00 62.02 C ATOM 2113 CD GLN B 162 5.143 -18.826 -6.230 1.00 61.11 C ATOM 2114 OE1 GLN B 162 6.331 -19.060 -6.462 1.00 14.34 O ATOM 2115 NE2 GLN B 162 4.272 -18.560 -7.191 1.00 10.22 N ATOM 0 H GLN B 162 2.355 -16.124 -3.214 1.00 22.22 H new ATOM 0 HA GLN B 162 3.976 -18.381 -2.267 1.00 72.13 H new ATOM 0 HB2 GLN B 162 4.490 -16.734 -4.751 1.00 21.43 H new ATOM 0 HB3 GLN B 162 5.817 -17.415 -3.832 1.00 21.43 H new ATOM 0 HG2 GLN B 162 5.099 -19.658 -4.256 1.00 62.02 H new ATOM 0 HG3 GLN B 162 3.536 -19.129 -4.846 1.00 62.02 H new ATOM 0 HE21 GLN B 162 3.297 -18.372 -6.958 1.00 10.22 H new ATOM 0 HE22 GLN B 162 4.576 -18.544 -8.165 1.00 10.22 H new ATOM 2124 N PRO B 163 4.024 -16.232 -0.647 1.00 23.33 N ATOM 2125 CA PRO B 163 4.384 -15.148 0.275 1.00 41.21 C ATOM 2126 C PRO B 163 5.782 -15.299 0.870 1.00 73.32 C ATOM 2127 O PRO B 163 6.312 -14.364 1.469 1.00 43.21 O ATOM 2128 CB PRO B 163 3.323 -15.234 1.386 1.00 43.33 C ATOM 2129 CG PRO B 163 2.355 -16.293 0.960 1.00 43.40 C ATOM 2130 CD PRO B 163 3.075 -17.160 -0.031 1.00 45.10 C ATOM 0 HA PRO B 163 4.405 -14.190 -0.244 1.00 41.21 H new ATOM 0 HB2 PRO B 163 3.781 -15.487 2.342 1.00 43.33 H new ATOM 0 HB3 PRO B 163 2.819 -14.276 1.518 1.00 43.33 H new ATOM 0 HG2 PRO B 163 2.021 -16.879 1.816 1.00 43.40 H new ATOM 0 HG3 PRO B 163 1.467 -15.848 0.512 1.00 43.40 H new ATOM 0 HD2 PRO B 163 3.582 -17.994 0.455 1.00 45.10 H new ATOM 0 HD3 PRO B 163 2.392 -17.587 -0.766 1.00 45.10 H new ATOM 2138 N ASP B 164 6.379 -16.474 0.712 1.00 64.34 N ATOM 2139 CA ASP B 164 7.728 -16.706 1.214 1.00 43.24 C ATOM 2140 C ASP B 164 8.741 -16.294 0.157 1.00 63.12 C ATOM 2141 O ASP B 164 9.936 -16.156 0.427 1.00 14.32 O ATOM 2142 CB ASP B 164 7.925 -18.177 1.600 1.00 65.44 C ATOM 2143 CG ASP B 164 9.303 -18.454 2.172 1.00 2.31 C ATOM 2144 OD1 ASP B 164 9.531 -18.153 3.364 1.00 65.52 O ATOM 2145 OD2 ASP B 164 10.170 -18.969 1.436 1.00 0.44 O ATOM 0 H ASP B 164 5.955 -17.275 0.244 1.00 64.34 H new ATOM 0 HA ASP B 164 7.877 -16.104 2.110 1.00 43.24 H new ATOM 0 HB2 ASP B 164 7.169 -18.460 2.332 1.00 65.44 H new ATOM 0 HB3 ASP B 164 7.769 -18.803 0.721 1.00 65.44 H new ATOM 2150 N LYS B 165 8.245 -16.071 -1.047 1.00 24.30 N ATOM 2151 CA LYS B 165 9.091 -15.718 -2.167 1.00 13.32 C ATOM 2152 C LYS B 165 8.966 -14.246 -2.515 1.00 20.21 C ATOM 2153 O LYS B 165 8.094 -13.546 -2.009 1.00 63.25 O ATOM 2154 CB LYS B 165 8.745 -16.553 -3.387 1.00 22.44 C ATOM 2155 CG LYS B 165 9.317 -17.952 -3.338 1.00 14.23 C ATOM 2156 CD LYS B 165 8.972 -18.715 -4.595 1.00 71.41 C ATOM 2157 CE LYS B 165 9.475 -18.008 -5.846 1.00 11.51 C ATOM 2158 NZ LYS B 165 9.070 -18.722 -7.087 1.00 32.51 N ATOM 0 H LYS B 165 7.252 -16.129 -1.272 1.00 24.30 H new ATOM 0 HA LYS B 165 10.120 -15.920 -1.869 1.00 13.32 H new ATOM 0 HB2 LYS B 165 7.661 -16.615 -3.481 1.00 22.44 H new ATOM 0 HB3 LYS B 165 9.114 -16.049 -4.280 1.00 22.44 H new ATOM 0 HG2 LYS B 165 10.400 -17.904 -3.222 1.00 14.23 H new ATOM 0 HG3 LYS B 165 8.926 -18.480 -2.468 1.00 14.23 H new ATOM 0 HD2 LYS B 165 9.406 -19.714 -4.544 1.00 71.41 H new ATOM 0 HD3 LYS B 165 7.891 -18.840 -4.659 1.00 71.41 H new ATOM 0 HE2 LYS B 165 9.086 -16.990 -5.869 1.00 11.51 H new ATOM 0 HE3 LYS B 165 10.562 -17.933 -5.809 1.00 11.51 H new ATOM 0 HZ1 LYS B 165 9.266 -18.121 -7.913 1.00 32.51 H new ATOM 0 HZ2 LYS B 165 9.608 -19.608 -7.169 1.00 32.51 H new ATOM 0 HZ3 LYS B 165 8.053 -18.936 -7.048 1.00 32.51 H new ATOM 2172 N LEU B 166 9.844 -13.799 -3.391 1.00 65.54 N ATOM 2173 CA LEU B 166 9.829 -12.430 -3.880 1.00 5.35 C ATOM 2174 C LEU B 166 9.578 -12.458 -5.378 1.00 61.41 C ATOM 2175 O LEU B 166 10.290 -13.140 -6.119 1.00 71.22 O ATOM 2176 CB LEU B 166 11.158 -11.740 -3.560 1.00 41.30 C ATOM 2177 CG LEU B 166 11.536 -11.732 -2.076 1.00 22.14 C ATOM 2178 CD1 LEU B 166 13.026 -11.493 -1.906 1.00 21.24 C ATOM 2179 CD2 LEU B 166 10.754 -10.676 -1.319 1.00 45.51 C ATOM 0 H LEU B 166 10.589 -14.373 -3.785 1.00 65.54 H new ATOM 0 HA LEU B 166 9.037 -11.864 -3.390 1.00 5.35 H new ATOM 0 HB2 LEU B 166 11.952 -12.234 -4.120 1.00 41.30 H new ATOM 0 HB3 LEU B 166 11.111 -10.710 -3.914 1.00 41.30 H new ATOM 0 HG LEU B 166 11.284 -12.709 -1.664 1.00 22.14 H new ATOM 0 HD11 LEU B 166 13.275 -11.491 -0.845 1.00 21.24 H new ATOM 0 HD12 LEU B 166 13.581 -12.286 -2.408 1.00 21.24 H new ATOM 0 HD13 LEU B 166 13.292 -10.531 -2.343 1.00 21.24 H new ATOM 0 HD21 LEU B 166 11.043 -10.693 -0.268 1.00 45.51 H new ATOM 0 HD22 LEU B 166 10.969 -9.693 -1.739 1.00 45.51 H new ATOM 0 HD23 LEU B 166 9.687 -10.882 -1.406 1.00 45.51 H new ATOM 2191 N ILE B 167 8.563 -11.739 -5.822 1.00 61.43 N ATOM 2192 CA ILE B 167 8.091 -11.857 -7.193 1.00 54.01 C ATOM 2193 C ILE B 167 8.950 -11.047 -8.161 1.00 15.13 C ATOM 2194 O ILE B 167 9.022 -9.818 -8.079 1.00 24.41 O ATOM 2195 CB ILE B 167 6.608 -11.440 -7.304 1.00 71.04 C ATOM 2196 CG1 ILE B 167 5.752 -12.358 -6.433 1.00 72.32 C ATOM 2197 CG2 ILE B 167 6.124 -11.473 -8.745 1.00 34.54 C ATOM 2198 CD1 ILE B 167 5.955 -13.831 -6.722 1.00 31.12 C ATOM 0 H ILE B 167 8.048 -11.066 -5.254 1.00 61.43 H new ATOM 0 HA ILE B 167 8.178 -12.906 -7.475 1.00 54.01 H new ATOM 0 HB ILE B 167 6.514 -10.413 -6.952 1.00 71.04 H new ATOM 0 HG12 ILE B 167 5.981 -12.167 -5.384 1.00 72.32 H new ATOM 0 HG13 ILE B 167 4.701 -12.109 -6.580 1.00 72.32 H new ATOM 0 HG21 ILE B 167 5.077 -11.174 -8.784 1.00 34.54 H new ATOM 0 HG22 ILE B 167 6.720 -10.786 -9.345 1.00 34.54 H new ATOM 0 HG23 ILE B 167 6.228 -12.483 -9.141 1.00 34.54 H new ATOM 0 HD11 ILE B 167 5.315 -14.422 -6.066 1.00 31.12 H new ATOM 0 HD12 ILE B 167 5.698 -14.037 -7.761 1.00 31.12 H new ATOM 0 HD13 ILE B 167 6.998 -14.096 -6.547 1.00 31.12 H new ATOM 2210 N PRO B 168 9.618 -11.753 -9.093 1.00 70.25 N ATOM 2211 CA PRO B 168 10.519 -11.146 -10.080 1.00 15.42 C ATOM 2212 C PRO B 168 9.780 -10.314 -11.120 1.00 24.32 C ATOM 2213 O PRO B 168 8.549 -10.226 -11.114 1.00 74.24 O ATOM 2214 CB PRO B 168 11.181 -12.350 -10.742 1.00 12.12 C ATOM 2215 CG PRO B 168 10.206 -13.457 -10.569 1.00 52.24 C ATOM 2216 CD PRO B 168 9.536 -13.215 -9.252 1.00 51.23 C ATOM 0 HA PRO B 168 11.219 -10.454 -9.612 1.00 15.42 H new ATOM 0 HB2 PRO B 168 11.383 -12.161 -11.796 1.00 12.12 H new ATOM 0 HB3 PRO B 168 12.136 -12.586 -10.272 1.00 12.12 H new ATOM 0 HG2 PRO B 168 9.479 -13.467 -11.381 1.00 52.24 H new ATOM 0 HG3 PRO B 168 10.708 -14.424 -10.579 1.00 52.24 H new ATOM 0 HD2 PRO B 168 8.503 -13.562 -9.257 1.00 51.23 H new ATOM 0 HD3 PRO B 168 10.043 -13.737 -8.441 1.00 51.23 H new ATOM 2224 N GLN B 169 10.529 -9.746 -12.048 1.00 11.02 N ATOM 2225 CA GLN B 169 9.977 -8.768 -12.966 1.00 41.15 C ATOM 2226 C GLN B 169 9.199 -9.440 -14.093 1.00 34.22 C ATOM 2227 O GLN B 169 8.211 -8.894 -14.582 1.00 33.04 O ATOM 2228 CB GLN B 169 11.082 -7.893 -13.542 1.00 31.24 C ATOM 2229 CG GLN B 169 10.580 -6.554 -14.046 1.00 52.41 C ATOM 2230 CD GLN B 169 11.604 -5.824 -14.889 1.00 10.53 C ATOM 2231 OE1 GLN B 169 12.441 -6.577 -15.588 1.00 40.32 O flip ATOM 2232 NE2 GLN B 169 11.646 -4.594 -14.914 1.00 13.33 N flip ATOM 0 H GLN B 169 11.520 -9.945 -12.185 1.00 11.02 H new ATOM 0 HA GLN B 169 9.285 -8.141 -12.404 1.00 41.15 H new ATOM 0 HB2 GLN B 169 11.840 -7.725 -12.777 1.00 31.24 H new ATOM 0 HB3 GLN B 169 11.568 -8.424 -14.361 1.00 31.24 H new ATOM 0 HG2 GLN B 169 9.675 -6.708 -14.634 1.00 52.41 H new ATOM 0 HG3 GLN B 169 10.305 -5.930 -13.195 1.00 52.41 H new ATOM 0 HE21 GLN B 169 10.984 -4.050 -14.361 1.00 13.33 H new ATOM 0 HE22 GLN B 169 12.343 -4.119 -15.487 1.00 13.33 H new ATOM 2241 N TRP B 170 9.629 -10.632 -14.497 1.00 73.14 N ATOM 2242 CA TRP B 170 8.920 -11.368 -15.543 1.00 44.21 C ATOM 2243 C TRP B 170 7.556 -11.824 -15.035 1.00 1.31 C ATOM 2244 O TRP B 170 6.673 -12.175 -15.815 1.00 13.24 O ATOM 2245 CB TRP B 170 9.738 -12.572 -16.038 1.00 13.10 C ATOM 2246 CG TRP B 170 10.002 -13.626 -14.999 1.00 52.12 C ATOM 2247 CD1 TRP B 170 9.106 -14.529 -14.500 1.00 4.12 C ATOM 2248 CD2 TRP B 170 11.252 -13.910 -14.362 1.00 12.02 C ATOM 2249 NE1 TRP B 170 9.715 -15.336 -13.573 1.00 1.10 N ATOM 2250 CE2 TRP B 170 11.034 -14.980 -13.473 1.00 53.53 C ATOM 2251 CE3 TRP B 170 12.533 -13.359 -14.451 1.00 3.31 C ATOM 2252 CZ2 TRP B 170 12.050 -15.508 -12.681 1.00 13.24 C ATOM 2253 CZ3 TRP B 170 13.541 -13.885 -13.664 1.00 43.22 C ATOM 2254 CH2 TRP B 170 13.294 -14.950 -12.788 1.00 62.12 C ATOM 0 H TRP B 170 10.452 -11.105 -14.124 1.00 73.14 H new ATOM 0 HA TRP B 170 8.777 -10.695 -16.388 1.00 44.21 H new ATOM 0 HB2 TRP B 170 9.212 -13.031 -16.875 1.00 13.10 H new ATOM 0 HB3 TRP B 170 10.693 -12.212 -16.420 1.00 13.10 H new ATOM 0 HD1 TRP B 170 8.069 -14.597 -14.793 1.00 4.12 H new ATOM 0 HE1 TRP B 170 9.260 -16.080 -13.044 1.00 1.10 H new ATOM 0 HE3 TRP B 170 12.732 -12.537 -15.123 1.00 3.31 H new ATOM 0 HZ2 TRP B 170 11.862 -16.330 -12.006 1.00 13.24 H new ATOM 0 HZ3 TRP B 170 14.535 -13.468 -13.726 1.00 43.22 H new ATOM 0 HH2 TRP B 170 14.102 -15.338 -12.185 1.00 62.12 H new ATOM 2265 N GLU B 171 7.401 -11.808 -13.719 1.00 1.23 N ATOM 2266 CA GLU B 171 6.161 -12.214 -13.081 1.00 22.01 C ATOM 2267 C GLU B 171 5.243 -11.008 -12.897 1.00 42.51 C ATOM 2268 O GLU B 171 4.048 -11.076 -13.177 1.00 44.23 O ATOM 2269 CB GLU B 171 6.472 -12.865 -11.734 1.00 22.01 C ATOM 2270 CG GLU B 171 5.904 -14.264 -11.570 1.00 33.40 C ATOM 2271 CD GLU B 171 4.390 -14.304 -11.604 1.00 62.13 C ATOM 2272 OE1 GLU B 171 3.753 -13.815 -10.647 1.00 4.10 O ATOM 2273 OE2 GLU B 171 3.830 -14.866 -12.570 1.00 15.41 O ATOM 0 H GLU B 171 8.129 -11.514 -13.067 1.00 1.23 H new ATOM 0 HA GLU B 171 5.648 -12.938 -13.714 1.00 22.01 H new ATOM 0 HB2 GLU B 171 7.554 -12.907 -11.605 1.00 22.01 H new ATOM 0 HB3 GLU B 171 6.081 -12.231 -10.938 1.00 22.01 H new ATOM 0 HG2 GLU B 171 6.295 -14.903 -12.362 1.00 33.40 H new ATOM 0 HG3 GLU B 171 6.250 -14.681 -10.624 1.00 33.40 H new ATOM 2280 N ILE B 172 5.820 -9.893 -12.451 1.00 35.55 N ATOM 2281 CA ILE B 172 5.049 -8.675 -12.221 1.00 25.11 C ATOM 2282 C ILE B 172 4.557 -8.081 -13.537 1.00 55.44 C ATOM 2283 O ILE B 172 3.551 -7.373 -13.572 1.00 33.25 O ATOM 2284 CB ILE B 172 5.865 -7.613 -11.443 1.00 3.12 C ATOM 2285 CG1 ILE B 172 7.091 -7.164 -12.238 1.00 5.53 C ATOM 2286 CG2 ILE B 172 6.286 -8.169 -10.090 1.00 30.24 C ATOM 2287 CD1 ILE B 172 7.860 -6.037 -11.581 1.00 24.32 C ATOM 0 H ILE B 172 6.815 -9.809 -12.243 1.00 35.55 H new ATOM 0 HA ILE B 172 4.189 -8.957 -11.613 1.00 25.11 H new ATOM 0 HB ILE B 172 5.229 -6.741 -11.289 1.00 3.12 H new ATOM 0 HG12 ILE B 172 7.757 -8.016 -12.375 1.00 5.53 H new ATOM 0 HG13 ILE B 172 6.773 -6.845 -13.231 1.00 5.53 H new ATOM 0 HG21 ILE B 172 6.859 -7.416 -9.550 1.00 30.24 H new ATOM 0 HG22 ILE B 172 5.400 -8.433 -9.513 1.00 30.24 H new ATOM 0 HG23 ILE B 172 6.901 -9.057 -10.237 1.00 30.24 H new ATOM 0 HD11 ILE B 172 8.716 -5.771 -12.201 1.00 24.32 H new ATOM 0 HD12 ILE B 172 7.210 -5.170 -11.469 1.00 24.32 H new ATOM 0 HD13 ILE B 172 8.209 -6.358 -10.599 1.00 24.32 H new ATOM 2299 N PHE B 173 5.268 -8.375 -14.619 1.00 30.42 N ATOM 2300 CA PHE B 173 4.860 -7.929 -15.942 1.00 53.02 C ATOM 2301 C PHE B 173 4.417 -9.113 -16.793 1.00 14.00 C ATOM 2302 O PHE B 173 4.517 -9.089 -18.020 1.00 32.44 O ATOM 2303 CB PHE B 173 5.993 -7.170 -16.635 1.00 43.10 C ATOM 2304 CG PHE B 173 6.305 -5.844 -16.000 1.00 43.23 C ATOM 2305 CD1 PHE B 173 5.302 -4.913 -15.780 1.00 72.34 C ATOM 2306 CD2 PHE B 173 7.598 -5.529 -15.620 1.00 33.45 C ATOM 2307 CE1 PHE B 173 5.584 -3.693 -15.197 1.00 45.43 C ATOM 2308 CE2 PHE B 173 7.887 -4.309 -15.033 1.00 42.40 C ATOM 2309 CZ PHE B 173 6.877 -3.392 -14.821 1.00 21.35 C ATOM 0 H PHE B 173 6.130 -8.920 -14.604 1.00 30.42 H new ATOM 0 HA PHE B 173 4.016 -7.250 -15.824 1.00 53.02 H new ATOM 0 HB2 PHE B 173 6.891 -7.788 -16.627 1.00 43.10 H new ATOM 0 HB3 PHE B 173 5.726 -7.009 -17.680 1.00 43.10 H new ATOM 0 HD1 PHE B 173 4.287 -5.144 -16.068 1.00 72.34 H new ATOM 0 HD2 PHE B 173 8.391 -6.244 -15.783 1.00 33.45 H new ATOM 0 HE1 PHE B 173 4.793 -2.975 -15.036 1.00 45.43 H new ATOM 0 HE2 PHE B 173 8.900 -4.075 -14.742 1.00 42.40 H new ATOM 0 HZ PHE B 173 7.099 -2.440 -14.361 1.00 21.35 H new ATOM 2319 N SER B 174 3.877 -10.131 -16.133 1.00 13.24 N ATOM 2320 CA SER B 174 3.377 -11.322 -16.814 1.00 54.31 C ATOM 2321 C SER B 174 1.994 -11.057 -17.422 1.00 2.35 C ATOM 2322 O SER B 174 1.220 -11.984 -17.672 1.00 33.10 O ATOM 2323 CB SER B 174 3.300 -12.485 -15.820 1.00 12.33 C ATOM 2324 OG SER B 174 2.949 -13.702 -16.459 1.00 73.04 O ATOM 0 H SER B 174 3.773 -10.156 -15.119 1.00 13.24 H new ATOM 0 HA SER B 174 4.062 -11.580 -17.622 1.00 54.31 H new ATOM 0 HB2 SER B 174 4.262 -12.601 -15.321 1.00 12.33 H new ATOM 0 HB3 SER B 174 2.566 -12.255 -15.048 1.00 12.33 H new ATOM 0 HG SER B 174 2.239 -13.535 -17.113 1.00 73.04 H new ATOM 2330 N TRP B 175 1.701 -9.784 -17.652 1.00 22.11 N ATOM 2331 CA TRP B 175 0.432 -9.357 -18.226 1.00 0.13 C ATOM 2332 C TRP B 175 0.244 -9.959 -19.613 1.00 54.34 C ATOM 2333 O TRP B 175 -0.453 -10.989 -19.721 1.00 37.72 O ATOM 2334 CB TRP B 175 0.375 -7.825 -18.302 1.00 44.24 C ATOM 2335 CG TRP B 175 0.430 -7.151 -16.959 1.00 65.43 C ATOM 2336 CD1 TRP B 175 1.356 -7.353 -15.976 1.00 3.50 C ATOM 2337 CD2 TRP B 175 -0.470 -6.156 -16.457 1.00 11.30 C ATOM 2338 NE1 TRP B 175 1.077 -6.564 -14.890 1.00 22.31 N ATOM 2339 CE2 TRP B 175 -0.035 -5.815 -15.161 1.00 73.32 C ATOM 2340 CE3 TRP B 175 -1.603 -5.523 -16.973 1.00 55.44 C ATOM 2341 CZ2 TRP B 175 -0.692 -4.871 -14.377 1.00 22.44 C ATOM 2342 CZ3 TRP B 175 -2.254 -4.584 -16.193 1.00 73.41 C ATOM 2343 CH2 TRP B 175 -1.796 -4.265 -14.908 1.00 21.34 C ATOM 2344 OXT TRP B 175 0.806 -9.415 -20.581 1.00 37.72 O ATOM 0 H TRP B 175 2.339 -9.016 -17.445 1.00 22.11 H new ATOM 0 HA TRP B 175 -0.375 -9.709 -17.583 1.00 0.13 H new ATOM 0 HB2 TRP B 175 1.206 -7.469 -18.912 1.00 44.24 H new ATOM 0 HB3 TRP B 175 -0.543 -7.529 -18.810 1.00 44.24 H new ATOM 0 HD1 TRP B 175 2.189 -8.037 -16.044 1.00 3.50 H new ATOM 0 HE1 TRP B 175 1.611 -6.540 -14.022 1.00 22.31 H new ATOM 0 HE3 TRP B 175 -1.964 -5.762 -17.962 1.00 55.44 H new ATOM 0 HZ2 TRP B 175 -0.342 -4.626 -13.385 1.00 22.44 H new ATOM 0 HZ3 TRP B 175 -3.131 -4.088 -16.582 1.00 73.41 H new ATOM 0 HH2 TRP B 175 -2.326 -3.526 -14.326 1.00 21.34 H new