USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1286 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 127 TYR OH : rot -28:sc= 0.864 USER MOD Set 1.2: A 154 CYS SG : rot -7:sc= -1.41! USER MOD Set 1.3: A 162 CYS SG : rot 180:sc= -0.223 USER MOD Set 2.1: A 60 HIS : no HE2:sc= -0.0375 X(o=0.16,f=-0.058) USER MOD Set 2.2: A 80 HIS : no HD1:sc= 1.36 K(o=0.16,f=-12!) USER MOD Set 2.3: A 83 THR OG1 : rot -170:sc= 0.196 USER MOD Set 2.4: A 96 HIS : no HE2:sc= -1.36! C(o=0.16!,f=-9.8!) USER MOD Set 3.1: A 58 THR OG1 : rot -140:sc= 0.472 USER MOD Set 3.2: A 85 SER OG : rot 121:sc= 0.519 USER MOD Single : A 5 THR OG1 : rot 26:sc= 0.109 USER MOD Single : A 10 THR OG1 : rot 63:sc= 1.13 USER MOD Single : A 11 GLN : amide:sc= 0.0578 X(o=0.058,f=0) USER MOD Single : A 13 GLN : amide:sc= -0.474 K(o=-0.47,f=-1.3) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 19 LYS NZ :NH3+ 178:sc= 0.477 (180deg=0.469) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 HIS : no HD1:sc= -0.23 K(o=-0.23,f=-4!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 26:sc= -0.148 USER MOD Single : A 43 SER OG : rot 122:sc= 0.145 USER MOD Single : A 44 TYR OH : rot 15:sc= -0.555 USER MOD Single : A 51 TYR OH : rot 15:sc= -0.269 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 44:sc= 0.35 USER MOD Single : A 65 SER OG : rot 40:sc= 0.185 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 136:sc= 1.83 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN :FLIP amide:sc=-0.00367 F(o=-0.79,f=-0.0037) USER MOD Single : A 105 SER OG : rot -42:sc= 0.434 USER MOD Single : A 107 THR OG1 : rot -75:sc= 0.0153 USER MOD Single : A 115 LYS NZ :NH3+ 148:sc= -0.212 (180deg=-1.61!) USER MOD Single : A 116 THR OG1 : rot 32:sc= 1.32 USER MOD Single : A 117 THR OG1 : rot 131:sc= -0.0469 USER MOD Single : A 119 GLN : amide:sc= -0.03 X(o=-0.03,f=0) USER MOD Single : A 120 GLN : amide:sc= -0.587 X(o=-0.59,f=-1.1) USER MOD Single : A 121 SER OG : rot -54:sc= 0.226 USER MOD Single : A 122 TYR OH : rot 180:sc= 0.189 USER MOD Single : A 128 MET CE :methyl -155:sc= -0.236 (180deg=-0.864) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.697 K(o=-0.7,f=-2.8!) USER MOD Single : A 150 TYR OH : rot 171:sc= 0.0791 USER MOD Single : A 151 SER OG : rot 38:sc= -0.015 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 1:sc= 0.221 USER MOD Single : A 159 THR OG1 : rot -85:sc= 0.201 USER MOD Single : A 161 SER OG : rot 173:sc= 0 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -0.761 K(o=-0.76,f=-4.5!) USER MOD Single : A 173 THR OG1 : rot -150:sc= 0 USER MOD Single : A 176 THR OG1 : rot 44:sc= 0.142 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -13.707 1.823 -16.865 1.00 14.52 N ATOM 60 CA THR A 5 -13.381 0.768 -15.880 1.00 2.25 C ATOM 61 C THR A 5 -11.985 0.162 -16.166 1.00 41.24 C ATOM 62 O THR A 5 -11.233 -0.144 -15.236 1.00 14.55 O ATOM 63 CB THR A 5 -14.479 -0.352 -15.884 1.00 25.34 C ATOM 64 OG1 THR A 5 -15.781 0.238 -15.686 1.00 21.45 O ATOM 65 CG2 THR A 5 -14.247 -1.427 -14.798 1.00 60.11 C ATOM 0 HA THR A 5 -13.359 1.224 -14.890 1.00 2.25 H new ATOM 0 HB THR A 5 -14.419 -0.844 -16.855 1.00 25.34 H new ATOM 0 HG1 THR A 5 -15.772 1.165 -16.004 1.00 21.45 H new ATOM 0 HG21 THR A 5 -15.039 -2.174 -14.851 1.00 60.11 H new ATOM 0 HG22 THR A 5 -13.283 -1.908 -14.962 1.00 60.11 H new ATOM 0 HG23 THR A 5 -14.256 -0.958 -13.814 1.00 60.11 H new ATOM 73 N GLU A 6 -11.634 0.036 -17.462 1.00 25.43 N ATOM 74 CA GLU A 6 -10.336 -0.532 -17.892 1.00 32.13 C ATOM 75 C GLU A 6 -9.158 0.426 -17.615 1.00 54.35 C ATOM 76 O GLU A 6 -8.017 -0.027 -17.546 1.00 14.20 O ATOM 77 CB GLU A 6 -10.383 -0.921 -19.390 1.00 3.44 C ATOM 78 CG GLU A 6 -10.582 0.256 -20.361 1.00 52.45 C ATOM 79 CD GLU A 6 -10.681 -0.183 -21.826 1.00 2.45 C ATOM 80 OE1 GLU A 6 -11.665 -0.873 -22.185 1.00 21.11 O ATOM 81 OE2 GLU A 6 -9.788 0.155 -22.629 1.00 72.41 O ATOM 0 H GLU A 6 -12.235 0.322 -18.235 1.00 25.43 H new ATOM 0 HA GLU A 6 -10.165 -1.430 -17.299 1.00 32.13 H new ATOM 0 HB2 GLU A 6 -9.455 -1.431 -19.647 1.00 3.44 H new ATOM 0 HB3 GLU A 6 -11.192 -1.636 -19.539 1.00 3.44 H new ATOM 0 HG2 GLU A 6 -11.489 0.795 -20.088 1.00 52.45 H new ATOM 0 HG3 GLU A 6 -9.751 0.953 -20.252 1.00 52.45 H new ATOM 88 N ASP A 7 -9.454 1.740 -17.438 1.00 74.33 N ATOM 89 CA ASP A 7 -8.437 2.776 -17.091 1.00 11.23 C ATOM 90 C ASP A 7 -7.782 2.454 -15.736 1.00 20.25 C ATOM 91 O ASP A 7 -6.588 2.705 -15.535 1.00 54.31 O ATOM 92 CB ASP A 7 -9.084 4.186 -17.064 1.00 0.53 C ATOM 93 CG ASP A 7 -8.139 5.297 -16.551 1.00 52.43 C ATOM 94 OD1 ASP A 7 -7.328 5.824 -17.340 1.00 33.43 O ATOM 95 OD2 ASP A 7 -8.201 5.647 -15.345 1.00 74.23 O ATOM 0 H ASP A 7 -10.399 2.113 -17.531 1.00 74.33 H new ATOM 0 HA ASP A 7 -7.662 2.770 -17.857 1.00 11.23 H new ATOM 0 HB2 ASP A 7 -9.418 4.442 -18.070 1.00 0.53 H new ATOM 0 HB3 ASP A 7 -9.971 4.156 -16.432 1.00 0.53 H new ATOM 100 N TRP A 8 -8.606 1.955 -14.805 1.00 54.15 N ATOM 101 CA TRP A 8 -8.143 1.357 -13.540 1.00 53.11 C ATOM 102 C TRP A 8 -7.033 0.308 -13.786 1.00 1.45 C ATOM 103 O TRP A 8 -5.980 0.369 -13.150 1.00 23.11 O ATOM 104 CB TRP A 8 -9.345 0.735 -12.779 1.00 64.42 C ATOM 105 CG TRP A 8 -8.968 -0.124 -11.579 1.00 74.44 C ATOM 106 CD1 TRP A 8 -8.662 0.296 -10.312 1.00 14.01 C ATOM 107 CD2 TRP A 8 -8.868 -1.560 -11.551 1.00 44.41 C ATOM 108 NE1 TRP A 8 -8.360 -0.785 -9.522 1.00 35.20 N ATOM 109 CE2 TRP A 8 -8.491 -1.931 -10.254 1.00 52.10 C ATOM 110 CE3 TRP A 8 -9.061 -2.561 -12.509 1.00 21.33 C ATOM 111 CZ2 TRP A 8 -8.304 -3.260 -9.885 1.00 61.24 C ATOM 112 CZ3 TRP A 8 -8.881 -3.879 -12.145 1.00 13.34 C ATOM 113 CH2 TRP A 8 -8.507 -4.217 -10.842 1.00 52.14 C ATOM 0 H TRP A 8 -9.621 1.954 -14.907 1.00 54.15 H new ATOM 0 HA TRP A 8 -7.709 2.144 -12.923 1.00 53.11 H new ATOM 0 HB2 TRP A 8 -9.998 1.540 -12.441 1.00 64.42 H new ATOM 0 HB3 TRP A 8 -9.922 0.127 -13.476 1.00 64.42 H new ATOM 0 HD1 TRP A 8 -8.659 1.325 -9.983 1.00 14.01 H new ATOM 0 HE1 TRP A 8 -8.081 -0.740 -8.542 1.00 35.20 H new ATOM 0 HE3 TRP A 8 -9.347 -2.305 -13.519 1.00 21.33 H new ATOM 0 HZ2 TRP A 8 -8.010 -3.526 -8.881 1.00 61.24 H new ATOM 0 HZ3 TRP A 8 -9.031 -4.659 -12.876 1.00 13.34 H new ATOM 0 HH2 TRP A 8 -8.375 -5.257 -10.584 1.00 52.14 H new ATOM 124 N GLU A 9 -7.273 -0.638 -14.717 1.00 11.44 N ATOM 125 CA GLU A 9 -6.297 -1.707 -15.024 1.00 11.30 C ATOM 126 C GLU A 9 -5.124 -1.174 -15.885 1.00 20.22 C ATOM 127 O GLU A 9 -4.035 -1.754 -15.880 1.00 33.21 O ATOM 128 CB GLU A 9 -6.989 -2.923 -15.699 1.00 54.24 C ATOM 129 CG GLU A 9 -6.090 -4.173 -15.789 1.00 54.43 C ATOM 130 CD GLU A 9 -6.787 -5.408 -16.374 1.00 72.52 C ATOM 131 OE1 GLU A 9 -7.424 -6.160 -15.604 1.00 70.22 O ATOM 132 OE2 GLU A 9 -6.691 -5.635 -17.600 1.00 12.15 O ATOM 0 H GLU A 9 -8.130 -0.685 -15.268 1.00 11.44 H new ATOM 0 HA GLU A 9 -5.877 -2.050 -14.079 1.00 11.30 H new ATOM 0 HB2 GLU A 9 -7.891 -3.174 -15.140 1.00 54.24 H new ATOM 0 HB3 GLU A 9 -7.305 -2.640 -16.703 1.00 54.24 H new ATOM 0 HG2 GLU A 9 -5.219 -3.937 -16.401 1.00 54.43 H new ATOM 0 HG3 GLU A 9 -5.723 -4.415 -14.792 1.00 54.43 H new ATOM 139 N THR A 10 -5.344 -0.045 -16.584 1.00 34.12 N ATOM 140 CA THR A 10 -4.319 0.605 -17.421 1.00 32.23 C ATOM 141 C THR A 10 -3.221 1.220 -16.523 1.00 43.00 C ATOM 142 O THR A 10 -2.026 0.990 -16.732 1.00 52.04 O ATOM 143 CB THR A 10 -4.960 1.711 -18.335 1.00 55.13 C ATOM 144 OG1 THR A 10 -6.041 1.155 -19.087 1.00 25.22 O ATOM 145 CG2 THR A 10 -3.949 2.333 -19.317 1.00 34.44 C ATOM 0 H THR A 10 -6.240 0.443 -16.584 1.00 34.12 H new ATOM 0 HA THR A 10 -3.871 -0.149 -18.068 1.00 32.23 H new ATOM 0 HB THR A 10 -5.312 2.499 -17.669 1.00 55.13 H new ATOM 0 HG1 THR A 10 -6.746 0.857 -18.475 1.00 25.22 H new ATOM 0 HG21 THR A 10 -4.448 3.090 -19.922 1.00 34.44 H new ATOM 0 HG22 THR A 10 -3.135 2.794 -18.758 1.00 34.44 H new ATOM 0 HG23 THR A 10 -3.548 1.556 -19.967 1.00 34.44 H new ATOM 153 N GLN A 11 -3.643 2.029 -15.538 1.00 72.52 N ATOM 154 CA GLN A 11 -2.737 2.581 -14.516 1.00 41.31 C ATOM 155 C GLN A 11 -2.189 1.473 -13.580 1.00 63.25 C ATOM 156 O GLN A 11 -1.050 1.576 -13.117 1.00 54.11 O ATOM 157 CB GLN A 11 -3.454 3.702 -13.711 1.00 51.11 C ATOM 158 CG GLN A 11 -4.624 3.230 -12.829 1.00 51.14 C ATOM 159 CD GLN A 11 -5.477 4.377 -12.281 1.00 43.22 C ATOM 160 OE1 GLN A 11 -5.201 4.921 -11.215 1.00 13.43 O ATOM 161 NE2 GLN A 11 -6.515 4.752 -13.019 1.00 23.21 N ATOM 0 H GLN A 11 -4.615 2.318 -15.427 1.00 72.52 H new ATOM 0 HA GLN A 11 -1.878 3.019 -15.024 1.00 41.31 H new ATOM 0 HB2 GLN A 11 -2.719 4.198 -13.077 1.00 51.11 H new ATOM 0 HB3 GLN A 11 -3.827 4.449 -14.412 1.00 51.11 H new ATOM 0 HG2 GLN A 11 -5.259 2.561 -13.409 1.00 51.14 H new ATOM 0 HG3 GLN A 11 -4.229 2.651 -11.994 1.00 51.14 H new ATOM 0 HE21 GLN A 11 -6.713 4.276 -13.899 1.00 23.21 H new ATOM 0 HE22 GLN A 11 -7.114 5.516 -12.706 1.00 23.21 H new ATOM 170 N LEU A 12 -3.000 0.413 -13.335 1.00 52.40 N ATOM 171 CA LEU A 12 -2.607 -0.729 -12.479 1.00 53.04 C ATOM 172 C LEU A 12 -1.394 -1.461 -13.062 1.00 5.13 C ATOM 173 O LEU A 12 -0.418 -1.691 -12.347 1.00 44.54 O ATOM 174 CB LEU A 12 -3.794 -1.724 -12.276 1.00 44.41 C ATOM 175 CG LEU A 12 -3.466 -3.115 -11.625 1.00 1.15 C ATOM 176 CD1 LEU A 12 -2.775 -2.965 -10.247 1.00 44.42 C ATOM 177 CD2 LEU A 12 -4.730 -4.010 -11.539 1.00 44.40 C ATOM 0 H LEU A 12 -3.939 0.328 -13.724 1.00 52.40 H new ATOM 0 HA LEU A 12 -2.332 -0.325 -11.504 1.00 53.04 H new ATOM 0 HB2 LEU A 12 -4.545 -1.231 -11.658 1.00 44.41 H new ATOM 0 HB3 LEU A 12 -4.251 -1.906 -13.249 1.00 44.41 H new ATOM 0 HG LEU A 12 -2.753 -3.616 -12.280 1.00 1.15 H new ATOM 0 HD11 LEU A 12 -2.567 -3.952 -9.835 1.00 44.42 H new ATOM 0 HD12 LEU A 12 -1.840 -2.418 -10.366 1.00 44.42 H new ATOM 0 HD13 LEU A 12 -3.431 -2.419 -9.569 1.00 44.42 H new ATOM 0 HD21 LEU A 12 -4.469 -4.965 -11.084 1.00 44.40 H new ATOM 0 HD22 LEU A 12 -5.487 -3.513 -10.932 1.00 44.40 H new ATOM 0 HD23 LEU A 12 -5.124 -4.181 -12.541 1.00 44.40 H new ATOM 189 N GLN A 13 -1.462 -1.824 -14.360 1.00 1.45 N ATOM 190 CA GLN A 13 -0.384 -2.585 -15.019 1.00 45.24 C ATOM 191 C GLN A 13 0.935 -1.788 -15.014 1.00 12.02 C ATOM 192 O GLN A 13 1.996 -2.350 -14.761 1.00 33.21 O ATOM 193 CB GLN A 13 -0.791 -3.033 -16.450 1.00 64.55 C ATOM 194 CG GLN A 13 -1.118 -1.900 -17.438 1.00 54.11 C ATOM 195 CD GLN A 13 -1.441 -2.359 -18.871 1.00 54.05 C ATOM 196 OE1 GLN A 13 -2.259 -1.750 -19.551 1.00 25.12 O ATOM 197 NE2 GLN A 13 -0.762 -3.398 -19.356 1.00 62.53 N ATOM 0 H GLN A 13 -2.250 -1.603 -14.969 1.00 1.45 H new ATOM 0 HA GLN A 13 -0.217 -3.495 -14.443 1.00 45.24 H new ATOM 0 HB2 GLN A 13 0.019 -3.631 -16.867 1.00 64.55 H new ATOM 0 HB3 GLN A 13 -1.661 -3.685 -16.373 1.00 64.55 H new ATOM 0 HG2 GLN A 13 -1.968 -1.337 -17.053 1.00 54.11 H new ATOM 0 HG3 GLN A 13 -0.271 -1.214 -17.474 1.00 54.11 H new ATOM 0 HE21 GLN A 13 -0.087 -3.886 -18.767 1.00 62.53 H new ATOM 0 HE22 GLN A 13 -0.917 -3.705 -20.316 1.00 62.53 H new ATOM 206 N ALA A 14 0.839 -0.465 -15.223 1.00 70.33 N ATOM 207 CA ALA A 14 2.004 0.435 -15.170 1.00 23.23 C ATOM 208 C ALA A 14 2.648 0.432 -13.764 1.00 20.03 C ATOM 209 O ALA A 14 3.866 0.292 -13.634 1.00 40.41 O ATOM 210 CB ALA A 14 1.594 1.854 -15.583 1.00 0.14 C ATOM 0 H ALA A 14 -0.040 0.008 -15.432 1.00 70.33 H new ATOM 0 HA ALA A 14 2.752 0.071 -15.874 1.00 23.23 H new ATOM 0 HB1 ALA A 14 2.463 2.511 -15.540 1.00 0.14 H new ATOM 0 HB2 ALA A 14 1.201 1.838 -16.600 1.00 0.14 H new ATOM 0 HB3 ALA A 14 0.826 2.223 -14.903 1.00 0.14 H new ATOM 216 N ASN A 15 1.794 0.580 -12.724 1.00 21.24 N ATOM 217 CA ASN A 15 2.208 0.543 -11.300 1.00 13.11 C ATOM 218 C ASN A 15 2.967 -0.754 -10.956 1.00 12.43 C ATOM 219 O ASN A 15 4.142 -0.723 -10.592 1.00 20.52 O ATOM 220 CB ASN A 15 0.968 0.699 -10.350 1.00 64.51 C ATOM 221 CG ASN A 15 0.354 2.107 -10.327 1.00 13.41 C ATOM 222 OD1 ASN A 15 1.055 3.109 -10.458 1.00 64.12 O ATOM 223 ND2 ASN A 15 -0.964 2.191 -10.154 1.00 11.42 N ATOM 0 H ASN A 15 0.793 0.729 -12.849 1.00 21.24 H new ATOM 0 HA ASN A 15 2.884 1.384 -11.146 1.00 13.11 H new ATOM 0 HB2 ASN A 15 0.201 -0.013 -10.655 1.00 64.51 H new ATOM 0 HB3 ASN A 15 1.267 0.430 -9.337 1.00 64.51 H new ATOM 0 HD21 ASN A 15 -1.418 3.104 -10.127 1.00 11.42 H new ATOM 0 HD22 ASN A 15 -1.520 1.342 -10.048 1.00 11.42 H new ATOM 230 N ARG A 16 2.280 -1.891 -11.100 1.00 25.32 N ATOM 231 CA ARG A 16 2.774 -3.197 -10.626 1.00 21.40 C ATOM 232 C ARG A 16 4.050 -3.657 -11.357 1.00 12.41 C ATOM 233 O ARG A 16 4.915 -4.278 -10.745 1.00 13.03 O ATOM 234 CB ARG A 16 1.661 -4.264 -10.746 1.00 25.43 C ATOM 235 CG ARG A 16 1.165 -4.517 -12.186 1.00 63.04 C ATOM 236 CD ARG A 16 0.033 -5.546 -12.255 1.00 13.05 C ATOM 237 NE ARG A 16 -0.504 -5.709 -13.614 1.00 70.40 N ATOM 238 CZ ARG A 16 -1.640 -6.352 -13.927 1.00 51.41 C ATOM 239 NH1 ARG A 16 -2.384 -6.918 -12.979 1.00 72.10 N ATOM 240 NH2 ARG A 16 -2.017 -6.443 -15.190 1.00 54.23 N ATOM 0 H ARG A 16 1.365 -1.937 -11.548 1.00 25.32 H new ATOM 0 HA ARG A 16 3.046 -3.074 -9.578 1.00 21.40 H new ATOM 0 HB2 ARG A 16 2.030 -5.203 -10.333 1.00 25.43 H new ATOM 0 HB3 ARG A 16 0.814 -3.957 -10.133 1.00 25.43 H new ATOM 0 HG2 ARG A 16 0.821 -3.577 -12.617 1.00 63.04 H new ATOM 0 HG3 ARG A 16 2.000 -4.861 -12.797 1.00 63.04 H new ATOM 0 HD2 ARG A 16 0.399 -6.508 -11.896 1.00 13.05 H new ATOM 0 HD3 ARG A 16 -0.771 -5.241 -11.585 1.00 13.05 H new ATOM 0 HE ARG A 16 0.030 -5.300 -14.381 1.00 70.40 H new ATOM 0 HH11 ARG A 16 -2.093 -6.866 -12.003 1.00 72.10 H new ATOM 0 HH12 ARG A 16 -3.245 -7.404 -13.229 1.00 72.10 H new ATOM 0 HH21 ARG A 16 -1.445 -6.025 -15.924 1.00 54.23 H new ATOM 0 HH22 ARG A 16 -2.880 -6.931 -15.431 1.00 54.23 H new ATOM 254 N ASP A 17 4.163 -3.334 -12.657 1.00 52.24 N ATOM 255 CA ASP A 17 5.334 -3.712 -13.470 1.00 1.52 C ATOM 256 C ASP A 17 6.582 -2.894 -13.098 1.00 32.14 C ATOM 257 O ASP A 17 7.701 -3.412 -13.207 1.00 60.31 O ATOM 258 CB ASP A 17 5.031 -3.601 -14.990 1.00 51.51 C ATOM 259 CG ASP A 17 4.183 -4.775 -15.523 1.00 22.30 C ATOM 260 OD1 ASP A 17 4.611 -5.941 -15.394 1.00 62.05 O ATOM 261 OD2 ASP A 17 3.091 -4.548 -16.074 1.00 74.41 O ATOM 0 H ASP A 17 3.454 -2.810 -13.170 1.00 52.24 H new ATOM 0 HA ASP A 17 5.550 -4.757 -13.245 1.00 1.52 H new ATOM 0 HB2 ASP A 17 4.507 -2.665 -15.183 1.00 51.51 H new ATOM 0 HB3 ASP A 17 5.971 -3.560 -15.540 1.00 51.51 H new ATOM 266 N GLU A 18 6.414 -1.623 -12.675 1.00 52.45 N ATOM 267 CA GLU A 18 7.563 -0.806 -12.206 1.00 2.12 C ATOM 268 C GLU A 18 7.905 -1.100 -10.727 1.00 60.14 C ATOM 269 O GLU A 18 9.032 -0.836 -10.276 1.00 62.11 O ATOM 270 CB GLU A 18 7.351 0.705 -12.466 1.00 3.31 C ATOM 271 CG GLU A 18 6.241 1.370 -11.655 1.00 43.23 C ATOM 272 CD GLU A 18 6.039 2.836 -12.046 1.00 14.10 C ATOM 273 OE1 GLU A 18 6.765 3.702 -11.517 1.00 32.53 O ATOM 274 OE2 GLU A 18 5.191 3.121 -12.918 1.00 33.10 O ATOM 0 H GLU A 18 5.514 -1.144 -12.647 1.00 52.45 H new ATOM 0 HA GLU A 18 8.428 -1.102 -12.799 1.00 2.12 H new ATOM 0 HB2 GLU A 18 8.287 1.225 -12.260 1.00 3.31 H new ATOM 0 HB3 GLU A 18 7.135 0.845 -13.525 1.00 3.31 H new ATOM 0 HG2 GLU A 18 5.309 0.825 -11.802 1.00 43.23 H new ATOM 0 HG3 GLU A 18 6.482 1.309 -10.594 1.00 43.23 H new ATOM 281 N LYS A 19 6.938 -1.666 -9.989 1.00 50.31 N ATOM 282 CA LYS A 19 7.184 -2.211 -8.636 1.00 63.22 C ATOM 283 C LYS A 19 7.926 -3.558 -8.747 1.00 1.21 C ATOM 284 O LYS A 19 8.752 -3.886 -7.897 1.00 53.23 O ATOM 285 CB LYS A 19 5.857 -2.390 -7.844 1.00 31.41 C ATOM 286 CG LYS A 19 5.073 -1.085 -7.581 1.00 75.53 C ATOM 287 CD LYS A 19 5.884 -0.049 -6.772 1.00 23.41 C ATOM 288 CE LYS A 19 5.176 1.311 -6.638 1.00 1.31 C ATOM 289 NZ LYS A 19 6.045 2.311 -5.958 1.00 60.23 N ATOM 0 H LYS A 19 5.973 -1.761 -10.304 1.00 50.31 H new ATOM 0 HA LYS A 19 7.801 -1.499 -8.088 1.00 63.22 H new ATOM 0 HB2 LYS A 19 5.214 -3.078 -8.393 1.00 31.41 H new ATOM 0 HB3 LYS A 19 6.083 -2.860 -6.887 1.00 31.41 H new ATOM 0 HG2 LYS A 19 4.780 -0.645 -8.534 1.00 75.53 H new ATOM 0 HG3 LYS A 19 4.155 -1.321 -7.043 1.00 75.53 H new ATOM 0 HD2 LYS A 19 6.079 -0.448 -5.777 1.00 23.41 H new ATOM 0 HD3 LYS A 19 6.852 0.099 -7.252 1.00 23.41 H new ATOM 0 HE2 LYS A 19 4.901 1.678 -7.627 1.00 1.31 H new ATOM 0 HE3 LYS A 19 4.251 1.188 -6.075 1.00 1.31 H new ATOM 0 HZ1 LYS A 19 5.552 3.226 -5.913 1.00 60.23 H new ATOM 0 HZ2 LYS A 19 6.259 1.986 -4.994 1.00 60.23 H new ATOM 0 HZ3 LYS A 19 6.931 2.421 -6.491 1.00 60.23 H new ATOM 303 N ASP A 20 7.619 -4.314 -9.819 1.00 12.52 N ATOM 304 CA ASP A 20 8.213 -5.639 -10.092 1.00 10.24 C ATOM 305 C ASP A 20 9.647 -5.491 -10.627 1.00 74.21 C ATOM 306 O ASP A 20 10.556 -6.240 -10.224 1.00 43.23 O ATOM 307 CB ASP A 20 7.325 -6.418 -11.100 1.00 53.22 C ATOM 308 CG ASP A 20 7.907 -7.783 -11.509 1.00 31.13 C ATOM 309 OD1 ASP A 20 7.799 -8.745 -10.727 1.00 10.11 O ATOM 310 OD2 ASP A 20 8.506 -7.888 -12.596 1.00 2.32 O ATOM 0 H ASP A 20 6.946 -4.020 -10.527 1.00 12.52 H new ATOM 0 HA ASP A 20 8.260 -6.203 -9.160 1.00 10.24 H new ATOM 0 HB2 ASP A 20 6.339 -6.570 -10.661 1.00 53.22 H new ATOM 0 HB3 ASP A 20 7.185 -5.810 -11.994 1.00 53.22 H new ATOM 315 N ARG A 21 9.843 -4.506 -11.533 1.00 53.32 N ATOM 316 CA ARG A 21 11.166 -4.240 -12.148 1.00 63.45 C ATOM 317 C ARG A 21 12.166 -3.802 -11.078 1.00 3.42 C ATOM 318 O ARG A 21 13.354 -4.032 -11.224 1.00 31.24 O ATOM 319 CB ARG A 21 11.123 -3.137 -13.257 1.00 62.02 C ATOM 320 CG ARG A 21 11.074 -1.673 -12.731 1.00 31.31 C ATOM 321 CD ARG A 21 11.379 -0.601 -13.789 1.00 51.41 C ATOM 322 NE ARG A 21 11.315 0.756 -13.203 1.00 20.15 N ATOM 323 CZ ARG A 21 10.668 1.811 -13.714 1.00 15.14 C ATOM 324 NH1 ARG A 21 9.977 1.708 -14.850 1.00 12.21 N ATOM 325 NH2 ARG A 21 10.708 2.966 -13.074 1.00 52.41 N ATOM 0 H ARG A 21 9.103 -3.882 -11.855 1.00 53.32 H new ATOM 0 HA ARG A 21 11.472 -5.176 -12.616 1.00 63.45 H new ATOM 0 HB2 ARG A 21 12.001 -3.249 -13.893 1.00 62.02 H new ATOM 0 HB3 ARG A 21 10.250 -3.310 -13.886 1.00 62.02 H new ATOM 0 HG2 ARG A 21 10.084 -1.483 -12.316 1.00 31.31 H new ATOM 0 HG3 ARG A 21 11.788 -1.571 -11.913 1.00 31.31 H new ATOM 0 HD2 ARG A 21 12.369 -0.773 -14.211 1.00 51.41 H new ATOM 0 HD3 ARG A 21 10.665 -0.681 -14.609 1.00 51.41 H new ATOM 0 HE ARG A 21 11.812 0.902 -12.324 1.00 20.15 H new ATOM 0 HH11 ARG A 21 9.936 0.816 -15.343 1.00 12.21 H new ATOM 0 HH12 ARG A 21 9.490 2.521 -15.226 1.00 12.21 H new ATOM 0 HH21 ARG A 21 11.228 3.047 -12.200 1.00 52.41 H new ATOM 0 HH22 ARG A 21 10.219 3.777 -13.454 1.00 52.41 H new ATOM 339 N PHE A 22 11.647 -3.127 -10.030 1.00 11.11 N ATOM 340 CA PHE A 22 12.450 -2.583 -8.924 1.00 10.11 C ATOM 341 C PHE A 22 13.257 -3.708 -8.258 1.00 44.54 C ATOM 342 O PHE A 22 14.429 -3.544 -7.943 1.00 63.43 O ATOM 343 CB PHE A 22 11.515 -1.871 -7.896 1.00 52.11 C ATOM 344 CG PHE A 22 12.239 -0.939 -6.915 1.00 35.52 C ATOM 345 CD1 PHE A 22 12.861 -1.435 -5.772 1.00 72.04 C ATOM 346 CD2 PHE A 22 12.298 0.433 -7.149 1.00 32.44 C ATOM 347 CE1 PHE A 22 13.515 -0.588 -4.900 1.00 13.34 C ATOM 348 CE2 PHE A 22 12.951 1.278 -6.275 1.00 12.42 C ATOM 349 CZ PHE A 22 13.559 0.769 -5.151 1.00 3.12 C ATOM 0 H PHE A 22 10.648 -2.945 -9.931 1.00 11.11 H new ATOM 0 HA PHE A 22 13.155 -1.848 -9.311 1.00 10.11 H new ATOM 0 HB2 PHE A 22 10.769 -1.294 -8.442 1.00 52.11 H new ATOM 0 HB3 PHE A 22 10.977 -2.630 -7.327 1.00 52.11 H new ATOM 0 HD1 PHE A 22 12.831 -2.495 -5.565 1.00 72.04 H new ATOM 0 HD2 PHE A 22 11.825 0.842 -8.029 1.00 32.44 H new ATOM 0 HE1 PHE A 22 13.994 -0.988 -4.019 1.00 13.34 H new ATOM 0 HE2 PHE A 22 12.985 2.339 -6.474 1.00 12.42 H new ATOM 0 HZ PHE A 22 14.070 1.430 -4.466 1.00 3.12 H new ATOM 359 N PHE A 23 12.600 -4.862 -8.100 1.00 24.42 N ATOM 360 CA PHE A 23 13.197 -6.065 -7.487 1.00 51.11 C ATOM 361 C PHE A 23 14.194 -6.744 -8.449 1.00 13.51 C ATOM 362 O PHE A 23 15.140 -7.403 -8.005 1.00 73.22 O ATOM 363 CB PHE A 23 12.084 -7.060 -7.073 1.00 44.00 C ATOM 364 CG PHE A 23 11.188 -6.607 -5.908 1.00 22.11 C ATOM 365 CD1 PHE A 23 10.594 -5.343 -5.897 1.00 50.44 C ATOM 366 CD2 PHE A 23 10.943 -7.447 -4.824 1.00 74.23 C ATOM 367 CE1 PHE A 23 9.790 -4.938 -4.848 1.00 4.15 C ATOM 368 CE2 PHE A 23 10.140 -7.042 -3.776 1.00 63.14 C ATOM 369 CZ PHE A 23 9.565 -5.791 -3.788 1.00 33.44 C ATOM 0 H PHE A 23 11.632 -4.994 -8.394 1.00 24.42 H new ATOM 0 HA PHE A 23 13.746 -5.757 -6.598 1.00 51.11 H new ATOM 0 HB2 PHE A 23 11.452 -7.252 -7.940 1.00 44.00 H new ATOM 0 HB3 PHE A 23 12.550 -8.007 -6.802 1.00 44.00 H new ATOM 0 HD1 PHE A 23 10.766 -4.669 -6.723 1.00 50.44 H new ATOM 0 HD2 PHE A 23 11.388 -8.431 -4.803 1.00 74.23 H new ATOM 0 HE1 PHE A 23 9.339 -3.957 -4.859 1.00 4.15 H new ATOM 0 HE2 PHE A 23 9.963 -7.708 -2.945 1.00 63.14 H new ATOM 0 HZ PHE A 23 8.937 -5.478 -2.967 1.00 33.44 H new ATOM 379 N SER A 24 13.955 -6.600 -9.762 1.00 34.33 N ATOM 380 CA SER A 24 14.812 -7.182 -10.809 1.00 42.11 C ATOM 381 C SER A 24 16.060 -6.318 -11.090 1.00 10.33 C ATOM 382 O SER A 24 17.139 -6.852 -11.347 1.00 51.15 O ATOM 383 CB SER A 24 14.003 -7.355 -12.118 1.00 61.33 C ATOM 384 OG SER A 24 14.712 -8.126 -13.083 1.00 11.52 O ATOM 0 H SER A 24 13.161 -6.076 -10.129 1.00 34.33 H new ATOM 0 HA SER A 24 15.152 -8.151 -10.445 1.00 42.11 H new ATOM 0 HB2 SER A 24 13.052 -7.838 -11.895 1.00 61.33 H new ATOM 0 HB3 SER A 24 13.773 -6.374 -12.535 1.00 61.33 H new ATOM 0 HG SER A 24 14.169 -8.214 -13.894 1.00 11.52 H new ATOM 390 N GLU A 25 15.902 -4.983 -11.056 1.00 13.34 N ATOM 391 CA GLU A 25 16.902 -4.020 -11.559 1.00 14.11 C ATOM 392 C GLU A 25 17.602 -3.308 -10.398 1.00 14.33 C ATOM 393 O GLU A 25 18.808 -3.460 -10.192 1.00 4.24 O ATOM 394 CB GLU A 25 16.190 -2.942 -12.446 1.00 23.34 C ATOM 395 CG GLU A 25 15.458 -3.486 -13.682 1.00 41.01 C ATOM 396 CD GLU A 25 16.404 -4.165 -14.676 1.00 71.44 C ATOM 397 OE1 GLU A 25 17.269 -3.465 -15.251 1.00 31.40 O ATOM 398 OE2 GLU A 25 16.304 -5.393 -14.878 1.00 5.34 O ATOM 0 H GLU A 25 15.068 -4.536 -10.675 1.00 13.34 H new ATOM 0 HA GLU A 25 17.641 -4.569 -12.143 1.00 14.11 H new ATOM 0 HB2 GLU A 25 15.472 -2.403 -11.827 1.00 23.34 H new ATOM 0 HB3 GLU A 25 16.935 -2.217 -12.775 1.00 23.34 H new ATOM 0 HG2 GLU A 25 14.698 -4.200 -13.364 1.00 41.01 H new ATOM 0 HG3 GLU A 25 14.939 -2.668 -14.181 1.00 41.01 H new ATOM 405 N HIS A 26 16.797 -2.556 -9.632 1.00 11.12 N ATOM 406 CA HIS A 26 17.285 -1.554 -8.674 1.00 35.21 C ATOM 407 C HIS A 26 17.849 -2.225 -7.412 1.00 51.43 C ATOM 408 O HIS A 26 19.025 -2.058 -7.069 1.00 2.44 O ATOM 409 CB HIS A 26 16.139 -0.571 -8.310 1.00 35.24 C ATOM 410 CG HIS A 26 16.547 0.551 -7.374 1.00 63.04 C ATOM 411 ND1 HIS A 26 16.678 0.347 -6.016 1.00 42.25 N ATOM 412 CD2 HIS A 26 16.846 1.845 -7.652 1.00 12.02 C ATOM 413 CE1 HIS A 26 17.049 1.508 -5.506 1.00 3.33 C ATOM 414 NE2 HIS A 26 17.163 2.440 -6.458 1.00 24.55 N ATOM 0 H HIS A 26 15.780 -2.628 -9.661 1.00 11.12 H new ATOM 0 HA HIS A 26 18.096 -0.994 -9.140 1.00 35.21 H new ATOM 0 HB2 HIS A 26 15.745 -0.136 -9.228 1.00 35.24 H new ATOM 0 HB3 HIS A 26 15.327 -1.134 -7.850 1.00 35.24 H new ATOM 0 HD2 HIS A 26 16.836 2.315 -8.624 1.00 12.02 H new ATOM 0 HE1 HIS A 26 17.236 1.682 -4.457 1.00 3.33 H new ATOM 0 HE2 HIS A 26 17.435 3.413 -6.321 1.00 24.55 H new ATOM 422 N ARG A 27 16.998 -3.012 -6.755 1.00 33.15 N ATOM 423 CA ARG A 27 17.249 -3.575 -5.428 1.00 71.52 C ATOM 424 C ARG A 27 17.002 -5.089 -5.510 1.00 4.21 C ATOM 425 O ARG A 27 16.020 -5.511 -6.103 1.00 51.33 O ATOM 426 CB ARG A 27 16.290 -2.879 -4.397 1.00 35.45 C ATOM 427 CG ARG A 27 16.759 -2.896 -2.920 1.00 72.31 C ATOM 428 CD ARG A 27 16.647 -4.253 -2.206 1.00 61.35 C ATOM 429 NE ARG A 27 17.430 -4.303 -0.958 1.00 2.41 N ATOM 430 CZ ARG A 27 17.472 -5.350 -0.120 1.00 50.44 C ATOM 431 NH1 ARG A 27 16.772 -6.450 -0.379 1.00 50.31 N ATOM 432 NH2 ARG A 27 18.255 -5.315 0.935 1.00 13.24 N ATOM 0 H ARG A 27 16.093 -3.283 -7.140 1.00 33.15 H new ATOM 0 HA ARG A 27 18.274 -3.404 -5.098 1.00 71.52 H new ATOM 0 HB2 ARG A 27 16.151 -1.842 -4.702 1.00 35.45 H new ATOM 0 HB3 ARG A 27 15.314 -3.362 -4.454 1.00 35.45 H new ATOM 0 HG2 ARG A 27 17.799 -2.570 -2.883 1.00 72.31 H new ATOM 0 HG3 ARG A 27 16.176 -2.163 -2.363 1.00 72.31 H new ATOM 0 HD2 ARG A 27 15.600 -4.456 -1.982 1.00 61.35 H new ATOM 0 HD3 ARG A 27 16.988 -5.042 -2.877 1.00 61.35 H new ATOM 0 HE ARG A 27 17.981 -3.480 -0.713 1.00 2.41 H new ATOM 0 HH11 ARG A 27 16.197 -6.503 -1.220 1.00 50.31 H new ATOM 0 HH12 ARG A 27 16.810 -7.241 0.263 1.00 50.31 H new ATOM 0 HH21 ARG A 27 18.830 -4.492 1.116 1.00 13.24 H new ATOM 0 HH22 ARG A 27 18.288 -6.111 1.573 1.00 13.24 H new ATOM 446 N GLN A 28 17.901 -5.882 -4.902 1.00 53.31 N ATOM 447 CA GLN A 28 17.809 -7.364 -4.863 1.00 45.53 C ATOM 448 C GLN A 28 16.498 -7.821 -4.167 1.00 73.14 C ATOM 449 O GLN A 28 16.130 -7.291 -3.111 1.00 15.32 O ATOM 450 CB GLN A 28 19.070 -7.929 -4.141 1.00 32.21 C ATOM 451 CG GLN A 28 19.298 -7.380 -2.716 1.00 52.21 C ATOM 452 CD GLN A 28 20.643 -7.787 -2.102 1.00 64.11 C ATOM 453 OE1 GLN A 28 20.755 -8.818 -1.447 1.00 63.13 O ATOM 454 NE2 GLN A 28 21.672 -6.981 -2.331 1.00 30.21 N ATOM 0 H GLN A 28 18.721 -5.516 -4.418 1.00 53.31 H new ATOM 0 HA GLN A 28 17.778 -7.756 -5.880 1.00 45.53 H new ATOM 0 HB2 GLN A 28 18.986 -9.014 -4.088 1.00 32.21 H new ATOM 0 HB3 GLN A 28 19.949 -7.706 -4.746 1.00 32.21 H new ATOM 0 HG2 GLN A 28 19.236 -6.292 -2.742 1.00 52.21 H new ATOM 0 HG3 GLN A 28 18.494 -7.730 -2.069 1.00 52.21 H new ATOM 0 HE21 GLN A 28 21.542 -6.131 -2.880 1.00 30.21 H new ATOM 0 HE22 GLN A 28 22.593 -7.211 -1.958 1.00 30.21 H new ATOM 463 N SER A 29 15.794 -8.785 -4.794 1.00 74.12 N ATOM 464 CA SER A 29 14.483 -9.265 -4.324 1.00 1.44 C ATOM 465 C SER A 29 14.592 -9.933 -2.925 1.00 32.34 C ATOM 466 O SER A 29 15.405 -10.838 -2.748 1.00 45.13 O ATOM 467 CB SER A 29 13.898 -10.249 -5.374 1.00 74.35 C ATOM 468 OG SER A 29 14.831 -11.270 -5.701 1.00 22.15 O ATOM 0 H SER A 29 16.120 -9.251 -5.640 1.00 74.12 H new ATOM 0 HA SER A 29 13.810 -8.415 -4.215 1.00 1.44 H new ATOM 0 HB2 SER A 29 12.985 -10.699 -4.985 1.00 74.35 H new ATOM 0 HB3 SER A 29 13.624 -9.701 -6.276 1.00 74.35 H new ATOM 0 HG SER A 29 15.444 -11.406 -4.949 1.00 22.15 H new ATOM 474 N PRO A 30 13.792 -9.470 -1.905 1.00 72.05 N ATOM 475 CA PRO A 30 13.713 -10.119 -0.574 1.00 52.22 C ATOM 476 C PRO A 30 13.089 -11.524 -0.649 1.00 3.01 C ATOM 477 O PRO A 30 13.414 -12.387 0.169 1.00 43.53 O ATOM 478 CB PRO A 30 12.800 -9.163 0.242 1.00 22.25 C ATOM 479 CG PRO A 30 11.996 -8.443 -0.788 1.00 75.32 C ATOM 480 CD PRO A 30 12.937 -8.253 -1.951 1.00 34.03 C ATOM 0 HA PRO A 30 14.699 -10.266 -0.132 1.00 52.22 H new ATOM 0 HB2 PRO A 30 12.160 -9.716 0.929 1.00 22.25 H new ATOM 0 HB3 PRO A 30 13.388 -8.469 0.843 1.00 22.25 H new ATOM 0 HG2 PRO A 30 11.119 -9.021 -1.080 1.00 75.32 H new ATOM 0 HG3 PRO A 30 11.636 -7.486 -0.410 1.00 75.32 H new ATOM 0 HD2 PRO A 30 12.398 -8.176 -2.895 1.00 34.03 H new ATOM 0 HD3 PRO A 30 13.527 -7.343 -1.846 1.00 34.03 H new ATOM 488 N ILE A 31 12.193 -11.713 -1.643 1.00 25.01 N ATOM 489 CA ILE A 31 11.430 -12.961 -1.830 1.00 31.23 C ATOM 490 C ILE A 31 12.409 -14.145 -2.062 1.00 51.51 C ATOM 491 O ILE A 31 13.047 -14.197 -3.123 1.00 73.44 O ATOM 492 CB ILE A 31 10.424 -12.856 -3.054 1.00 72.02 C ATOM 493 CG1 ILE A 31 9.652 -11.494 -3.059 1.00 24.51 C ATOM 494 CG2 ILE A 31 9.435 -14.052 -3.067 1.00 21.33 C ATOM 495 CD1 ILE A 31 8.716 -11.258 -1.876 1.00 33.11 C ATOM 0 H ILE A 31 11.980 -10.999 -2.340 1.00 25.01 H new ATOM 0 HA ILE A 31 10.845 -13.132 -0.927 1.00 31.23 H new ATOM 0 HB ILE A 31 11.020 -12.896 -3.966 1.00 72.02 H new ATOM 0 HG12 ILE A 31 10.381 -10.684 -3.089 1.00 24.51 H new ATOM 0 HG13 ILE A 31 9.069 -11.431 -3.978 1.00 24.51 H new ATOM 0 HG21 ILE A 31 8.758 -13.955 -3.915 1.00 21.33 H new ATOM 0 HG22 ILE A 31 9.993 -14.984 -3.153 1.00 21.33 H new ATOM 0 HG23 ILE A 31 8.859 -14.058 -2.142 1.00 21.33 H new ATOM 0 HD11 ILE A 31 8.234 -10.286 -1.982 1.00 33.11 H new ATOM 0 HD12 ILE A 31 7.956 -12.039 -1.852 1.00 33.11 H new ATOM 0 HD13 ILE A 31 9.289 -11.280 -0.949 1.00 33.11 H new ATOM 507 N PRO A 32 12.571 -15.086 -1.066 1.00 25.21 N ATOM 508 CA PRO A 32 13.556 -16.186 -1.167 1.00 71.22 C ATOM 509 C PRO A 32 13.177 -17.221 -2.259 1.00 31.34 C ATOM 510 O PRO A 32 11.993 -17.327 -2.616 1.00 22.00 O ATOM 511 CB PRO A 32 13.565 -16.801 0.263 1.00 1.31 C ATOM 512 CG PRO A 32 12.234 -16.460 0.849 1.00 44.53 C ATOM 513 CD PRO A 32 11.815 -15.144 0.222 1.00 74.02 C ATOM 0 HA PRO A 32 14.542 -15.838 -1.476 1.00 71.22 H new ATOM 0 HB2 PRO A 32 13.713 -17.880 0.226 1.00 1.31 H new ATOM 0 HB3 PRO A 32 14.376 -16.388 0.863 1.00 1.31 H new ATOM 0 HG2 PRO A 32 11.504 -17.241 0.636 1.00 44.53 H new ATOM 0 HG3 PRO A 32 12.298 -16.371 1.933 1.00 44.53 H new ATOM 0 HD2 PRO A 32 10.739 -15.110 0.052 1.00 74.02 H new ATOM 0 HD3 PRO A 32 12.063 -14.301 0.866 1.00 74.02 H new ATOM 521 N PRO A 33 14.180 -18.014 -2.785 1.00 71.32 N ATOM 522 CA PRO A 33 13.961 -18.996 -3.886 1.00 4.12 C ATOM 523 C PRO A 33 13.018 -20.157 -3.499 1.00 33.33 C ATOM 524 O PRO A 33 12.626 -20.949 -4.353 1.00 43.45 O ATOM 525 CB PRO A 33 15.396 -19.499 -4.204 1.00 62.42 C ATOM 526 CG PRO A 33 16.168 -19.280 -2.943 1.00 4.53 C ATOM 527 CD PRO A 33 15.615 -18.007 -2.357 1.00 45.23 C ATOM 0 HA PRO A 33 13.459 -18.542 -4.740 1.00 4.12 H new ATOM 0 HB2 PRO A 33 15.392 -20.552 -4.487 1.00 62.42 H new ATOM 0 HB3 PRO A 33 15.833 -18.947 -5.036 1.00 62.42 H new ATOM 0 HG2 PRO A 33 16.044 -20.116 -2.255 1.00 4.53 H new ATOM 0 HG3 PRO A 33 17.235 -19.189 -3.145 1.00 4.53 H new ATOM 0 HD2 PRO A 33 15.709 -17.992 -1.271 1.00 45.23 H new ATOM 0 HD3 PRO A 33 16.141 -17.130 -2.735 1.00 45.23 H new ATOM 535 N GLU A 34 12.669 -20.230 -2.206 1.00 64.24 N ATOM 536 CA GLU A 34 11.728 -21.214 -1.673 1.00 63.24 C ATOM 537 C GLU A 34 10.297 -20.757 -1.982 1.00 21.44 C ATOM 538 O GLU A 34 9.481 -21.535 -2.505 1.00 62.31 O ATOM 539 CB GLU A 34 11.943 -21.344 -0.140 1.00 63.24 C ATOM 540 CG GLU A 34 13.400 -21.637 0.259 1.00 43.13 C ATOM 541 CD GLU A 34 13.651 -21.573 1.772 1.00 24.11 C ATOM 542 OE1 GLU A 34 13.289 -22.528 2.487 1.00 42.01 O ATOM 543 OE2 GLU A 34 14.231 -20.569 2.252 1.00 30.44 O ATOM 0 H GLU A 34 13.039 -19.598 -1.496 1.00 64.24 H new ATOM 0 HA GLU A 34 11.894 -22.187 -2.135 1.00 63.24 H new ATOM 0 HB2 GLU A 34 11.623 -20.421 0.342 1.00 63.24 H new ATOM 0 HB3 GLU A 34 11.304 -22.141 0.241 1.00 63.24 H new ATOM 0 HG2 GLU A 34 13.675 -22.627 -0.104 1.00 43.13 H new ATOM 0 HG3 GLU A 34 14.055 -20.922 -0.239 1.00 43.13 H new ATOM 550 N GLU A 35 10.010 -19.483 -1.640 1.00 65.42 N ATOM 551 CA GLU A 35 8.706 -18.856 -1.908 1.00 51.31 C ATOM 552 C GLU A 35 8.419 -18.773 -3.405 1.00 71.01 C ATOM 553 O GLU A 35 7.554 -19.475 -3.897 1.00 72.24 O ATOM 554 CB GLU A 35 8.655 -17.423 -1.303 1.00 61.22 C ATOM 555 CG GLU A 35 8.820 -17.377 0.213 1.00 13.31 C ATOM 556 CD GLU A 35 7.766 -18.196 0.940 1.00 30.42 C ATOM 557 OE1 GLU A 35 6.582 -17.807 0.917 1.00 10.40 O ATOM 558 OE2 GLU A 35 8.111 -19.239 1.528 1.00 14.41 O ATOM 0 H GLU A 35 10.675 -18.866 -1.173 1.00 65.42 H new ATOM 0 HA GLU A 35 7.947 -19.483 -1.440 1.00 51.31 H new ATOM 0 HB2 GLU A 35 9.439 -16.820 -1.761 1.00 61.22 H new ATOM 0 HB3 GLU A 35 7.703 -16.963 -1.568 1.00 61.22 H new ATOM 0 HG2 GLU A 35 9.810 -17.748 0.479 1.00 13.31 H new ATOM 0 HG3 GLU A 35 8.766 -16.342 0.550 1.00 13.31 H new ATOM 565 N ARG A 36 9.242 -18.004 -4.132 1.00 24.23 N ATOM 566 CA ARG A 36 8.961 -17.602 -5.532 1.00 43.21 C ATOM 567 C ARG A 36 8.967 -18.769 -6.547 1.00 42.22 C ATOM 568 O ARG A 36 8.604 -18.567 -7.709 1.00 43.35 O ATOM 569 CB ARG A 36 9.983 -16.518 -5.952 1.00 34.23 C ATOM 570 CG ARG A 36 11.450 -16.984 -5.910 1.00 54.24 C ATOM 571 CD ARG A 36 12.444 -15.827 -6.061 1.00 13.51 C ATOM 572 NE ARG A 36 12.231 -15.049 -7.294 1.00 53.50 N ATOM 573 CZ ARG A 36 12.943 -13.970 -7.647 1.00 24.13 C ATOM 574 NH1 ARG A 36 13.929 -13.524 -6.875 1.00 72.54 N ATOM 575 NH2 ARG A 36 12.647 -13.325 -8.765 1.00 12.42 N ATOM 0 H ARG A 36 10.124 -17.639 -3.772 1.00 24.23 H new ATOM 0 HA ARG A 36 7.943 -17.214 -5.551 1.00 43.21 H new ATOM 0 HB2 ARG A 36 9.748 -16.185 -6.963 1.00 34.23 H new ATOM 0 HB3 ARG A 36 9.869 -15.654 -5.297 1.00 34.23 H new ATOM 0 HG2 ARG A 36 11.637 -17.497 -4.967 1.00 54.24 H new ATOM 0 HG3 ARG A 36 11.619 -17.709 -6.706 1.00 54.24 H new ATOM 0 HD2 ARG A 36 12.358 -15.165 -5.199 1.00 13.51 H new ATOM 0 HD3 ARG A 36 13.459 -16.223 -6.058 1.00 13.51 H new ATOM 0 HE ARG A 36 11.489 -15.353 -7.924 1.00 53.50 H new ATOM 0 HH11 ARG A 36 14.151 -14.004 -6.003 1.00 72.54 H new ATOM 0 HH12 ARG A 36 14.464 -12.702 -7.155 1.00 72.54 H new ATOM 0 HH21 ARG A 36 11.880 -13.650 -9.353 1.00 12.42 H new ATOM 0 HH22 ARG A 36 13.186 -12.503 -9.038 1.00 12.42 H new ATOM 589 N ASP A 37 9.363 -19.977 -6.114 1.00 15.42 N ATOM 590 CA ASP A 37 9.429 -21.154 -7.003 1.00 13.11 C ATOM 591 C ASP A 37 8.087 -21.926 -7.025 1.00 23.13 C ATOM 592 O ASP A 37 7.512 -22.137 -8.100 1.00 5.10 O ATOM 593 CB ASP A 37 10.606 -22.064 -6.582 1.00 50.22 C ATOM 594 CG ASP A 37 10.788 -23.289 -7.494 1.00 52.03 C ATOM 595 OD1 ASP A 37 11.187 -23.105 -8.665 1.00 33.22 O ATOM 596 OD2 ASP A 37 10.521 -24.429 -7.053 1.00 52.12 O ATOM 0 H ASP A 37 9.643 -20.167 -5.152 1.00 15.42 H new ATOM 0 HA ASP A 37 9.607 -20.810 -8.022 1.00 13.11 H new ATOM 0 HB2 ASP A 37 11.526 -21.479 -6.583 1.00 50.22 H new ATOM 0 HB3 ASP A 37 10.445 -22.403 -5.559 1.00 50.22 H new ATOM 601 N ASP A 38 7.574 -22.317 -5.841 1.00 4.22 N ATOM 602 CA ASP A 38 6.273 -23.040 -5.732 1.00 63.40 C ATOM 603 C ASP A 38 5.101 -22.056 -5.589 1.00 62.51 C ATOM 604 O ASP A 38 4.017 -22.273 -6.135 1.00 23.22 O ATOM 605 CB ASP A 38 6.291 -24.000 -4.520 1.00 32.30 C ATOM 606 CG ASP A 38 7.271 -25.173 -4.700 1.00 41.01 C ATOM 607 OD1 ASP A 38 6.868 -26.223 -5.258 1.00 50.31 O ATOM 608 OD2 ASP A 38 8.440 -25.057 -4.280 1.00 73.41 O ATOM 0 H ASP A 38 8.032 -22.149 -4.945 1.00 4.22 H new ATOM 0 HA ASP A 38 6.135 -23.614 -6.648 1.00 63.40 H new ATOM 0 HB2 ASP A 38 6.562 -23.441 -3.624 1.00 32.30 H new ATOM 0 HB3 ASP A 38 5.287 -24.393 -4.359 1.00 32.30 H new ATOM 613 N PHE A 39 5.350 -20.973 -4.854 1.00 22.44 N ATOM 614 CA PHE A 39 4.424 -19.836 -4.678 1.00 21.33 C ATOM 615 C PHE A 39 4.874 -18.729 -5.637 1.00 42.22 C ATOM 616 O PHE A 39 5.984 -18.790 -6.165 1.00 54.21 O ATOM 617 CB PHE A 39 4.426 -19.341 -3.200 1.00 13.12 C ATOM 618 CG PHE A 39 4.168 -20.464 -2.186 1.00 14.44 C ATOM 619 CD1 PHE A 39 2.871 -20.857 -1.865 1.00 63.52 C ATOM 620 CD2 PHE A 39 5.230 -21.141 -1.578 1.00 13.51 C ATOM 621 CE1 PHE A 39 2.642 -21.884 -0.966 1.00 43.14 C ATOM 622 CE2 PHE A 39 4.996 -22.168 -0.684 1.00 74.52 C ATOM 623 CZ PHE A 39 3.701 -22.538 -0.377 1.00 44.13 C ATOM 0 H PHE A 39 6.226 -20.851 -4.346 1.00 22.44 H new ATOM 0 HA PHE A 39 3.401 -20.136 -4.904 1.00 21.33 H new ATOM 0 HB2 PHE A 39 5.387 -18.876 -2.981 1.00 13.12 H new ATOM 0 HB3 PHE A 39 3.664 -18.570 -3.081 1.00 13.12 H new ATOM 0 HD1 PHE A 39 2.033 -20.354 -2.324 1.00 63.52 H new ATOM 0 HD2 PHE A 39 6.246 -20.857 -1.810 1.00 13.51 H new ATOM 0 HE1 PHE A 39 1.630 -22.173 -0.726 1.00 43.14 H new ATOM 0 HE2 PHE A 39 5.827 -22.682 -0.224 1.00 74.52 H new ATOM 0 HZ PHE A 39 3.519 -23.339 0.324 1.00 44.13 H new ATOM 633 N ASP A 40 4.010 -17.755 -5.919 1.00 14.32 N ATOM 634 CA ASP A 40 4.353 -16.667 -6.856 1.00 44.20 C ATOM 635 C ASP A 40 5.367 -15.686 -6.200 1.00 15.31 C ATOM 636 O ASP A 40 5.476 -15.629 -4.966 1.00 24.54 O ATOM 637 CB ASP A 40 3.061 -15.944 -7.312 1.00 21.12 C ATOM 638 CG ASP A 40 3.268 -15.042 -8.539 1.00 41.04 C ATOM 639 OD1 ASP A 40 3.297 -15.566 -9.671 1.00 32.42 O ATOM 640 OD2 ASP A 40 3.414 -13.820 -8.378 1.00 54.04 O ATOM 0 H ASP A 40 3.073 -17.690 -5.520 1.00 14.32 H new ATOM 0 HA ASP A 40 4.834 -17.085 -7.740 1.00 44.20 H new ATOM 0 HB2 ASP A 40 2.299 -16.688 -7.542 1.00 21.12 H new ATOM 0 HB3 ASP A 40 2.680 -15.342 -6.487 1.00 21.12 H new ATOM 645 N GLY A 41 6.117 -14.947 -7.047 1.00 33.34 N ATOM 646 CA GLY A 41 7.127 -13.961 -6.611 1.00 11.45 C ATOM 647 C GLY A 41 6.525 -12.731 -5.918 1.00 51.40 C ATOM 648 O GLY A 41 5.510 -12.849 -5.223 1.00 14.32 O ATOM 0 H GLY A 41 6.037 -15.020 -8.061 1.00 33.34 H new ATOM 0 HA2 GLY A 41 7.826 -14.446 -5.929 1.00 11.45 H new ATOM 0 HA3 GLY A 41 7.702 -13.634 -7.478 1.00 11.45 H new ATOM 652 N LEU A 42 7.194 -11.557 -6.029 1.00 63.55 N ATOM 653 CA LEU A 42 6.585 -10.264 -5.639 1.00 42.42 C ATOM 654 C LEU A 42 5.231 -10.141 -6.353 1.00 63.44 C ATOM 655 O LEU A 42 5.170 -10.139 -7.577 1.00 14.32 O ATOM 656 CB LEU A 42 7.543 -9.073 -5.987 1.00 52.24 C ATOM 657 CG LEU A 42 7.054 -7.582 -5.717 1.00 2.04 C ATOM 658 CD1 LEU A 42 6.178 -7.002 -6.869 1.00 54.42 C ATOM 659 CD2 LEU A 42 6.336 -7.446 -4.340 1.00 1.13 C ATOM 0 H LEU A 42 8.148 -11.480 -6.383 1.00 63.55 H new ATOM 0 HA LEU A 42 6.426 -10.227 -4.561 1.00 42.42 H new ATOM 0 HB2 LEU A 42 8.468 -9.222 -5.430 1.00 52.24 H new ATOM 0 HB3 LEU A 42 7.793 -9.150 -7.045 1.00 52.24 H new ATOM 0 HG LEU A 42 7.960 -6.977 -5.685 1.00 2.04 H new ATOM 0 HD11 LEU A 42 5.879 -5.984 -6.621 1.00 54.42 H new ATOM 0 HD12 LEU A 42 6.753 -6.996 -7.795 1.00 54.42 H new ATOM 0 HD13 LEU A 42 5.290 -7.620 -6.997 1.00 54.42 H new ATOM 0 HD21 LEU A 42 6.019 -6.413 -4.196 1.00 1.13 H new ATOM 0 HD22 LEU A 42 5.464 -8.100 -4.318 1.00 1.13 H new ATOM 0 HD23 LEU A 42 7.022 -7.729 -3.542 1.00 1.13 H new ATOM 671 N SER A 43 4.165 -10.048 -5.569 1.00 63.43 N ATOM 672 CA SER A 43 2.808 -10.241 -6.066 1.00 14.43 C ATOM 673 C SER A 43 1.838 -9.462 -5.192 1.00 1.53 C ATOM 674 O SER A 43 2.251 -8.631 -4.377 1.00 44.11 O ATOM 675 CB SER A 43 2.474 -11.765 -6.075 1.00 55.10 C ATOM 676 OG SER A 43 1.317 -12.054 -6.859 1.00 71.33 O ATOM 0 H SER A 43 4.216 -9.837 -4.572 1.00 63.43 H new ATOM 0 HA SER A 43 2.720 -9.869 -7.087 1.00 14.43 H new ATOM 0 HB2 SER A 43 3.326 -12.321 -6.467 1.00 55.10 H new ATOM 0 HB3 SER A 43 2.314 -12.107 -5.053 1.00 55.10 H new ATOM 0 HG SER A 43 1.552 -12.689 -7.567 1.00 71.33 H new ATOM 682 N TYR A 44 0.560 -9.723 -5.407 1.00 23.01 N ATOM 683 CA TYR A 44 -0.519 -9.214 -4.578 1.00 71.22 C ATOM 684 C TYR A 44 -1.757 -10.118 -4.732 1.00 73.01 C ATOM 685 O TYR A 44 -1.831 -10.915 -5.680 1.00 40.34 O ATOM 686 CB TYR A 44 -0.809 -7.713 -4.903 1.00 51.13 C ATOM 687 CG TYR A 44 -1.141 -7.350 -6.361 1.00 11.13 C ATOM 688 CD1 TYR A 44 -2.294 -7.824 -6.970 1.00 72.13 C ATOM 689 CD2 TYR A 44 -0.332 -6.483 -7.113 1.00 22.01 C ATOM 690 CE1 TYR A 44 -2.632 -7.473 -8.245 1.00 33.21 C ATOM 691 CE2 TYR A 44 -0.674 -6.133 -8.404 1.00 71.32 C ATOM 692 CZ TYR A 44 -1.827 -6.632 -8.961 1.00 25.54 C ATOM 693 OH TYR A 44 -2.195 -6.279 -10.229 1.00 71.54 O ATOM 0 H TYR A 44 0.237 -10.307 -6.179 1.00 23.01 H new ATOM 0 HA TYR A 44 -0.225 -9.242 -3.529 1.00 71.22 H new ATOM 0 HB2 TYR A 44 -1.642 -7.389 -4.278 1.00 51.13 H new ATOM 0 HB3 TYR A 44 0.061 -7.130 -4.602 1.00 51.13 H new ATOM 0 HD1 TYR A 44 -2.942 -8.490 -6.420 1.00 72.13 H new ATOM 0 HD2 TYR A 44 0.571 -6.084 -6.675 1.00 22.01 H new ATOM 0 HE1 TYR A 44 -3.537 -7.861 -8.689 1.00 33.21 H new ATOM 0 HE2 TYR A 44 -0.039 -5.471 -8.973 1.00 71.32 H new ATOM 0 HH TYR A 44 -3.137 -6.507 -10.372 1.00 71.54 H new ATOM 703 N PHE A 45 -2.692 -10.002 -3.777 1.00 35.23 N ATOM 704 CA PHE A 45 -4.003 -10.695 -3.818 1.00 64.14 C ATOM 705 C PHE A 45 -4.731 -10.408 -5.166 1.00 71.12 C ATOM 706 O PHE A 45 -4.664 -9.290 -5.664 1.00 12.35 O ATOM 707 CB PHE A 45 -4.872 -10.242 -2.611 1.00 71.31 C ATOM 708 CG PHE A 45 -4.179 -10.318 -1.247 1.00 54.12 C ATOM 709 CD1 PHE A 45 -4.115 -11.516 -0.548 1.00 23.13 C ATOM 710 CD2 PHE A 45 -3.599 -9.184 -0.669 1.00 1.01 C ATOM 711 CE1 PHE A 45 -3.492 -11.589 0.682 1.00 50.34 C ATOM 712 CE2 PHE A 45 -2.974 -9.256 0.562 1.00 21.45 C ATOM 713 CZ PHE A 45 -2.923 -10.461 1.239 1.00 2.12 C ATOM 0 H PHE A 45 -2.566 -9.423 -2.947 1.00 35.23 H new ATOM 0 HA PHE A 45 -3.841 -11.771 -3.749 1.00 64.14 H new ATOM 0 HB2 PHE A 45 -5.195 -9.215 -2.781 1.00 71.31 H new ATOM 0 HB3 PHE A 45 -5.771 -10.857 -2.579 1.00 71.31 H new ATOM 0 HD1 PHE A 45 -4.559 -12.404 -0.973 1.00 23.13 H new ATOM 0 HD2 PHE A 45 -3.640 -8.240 -1.191 1.00 1.01 H new ATOM 0 HE1 PHE A 45 -3.450 -12.530 1.210 1.00 50.34 H new ATOM 0 HE2 PHE A 45 -2.526 -8.373 0.994 1.00 21.45 H new ATOM 0 HZ PHE A 45 -2.439 -10.520 2.202 1.00 2.12 H new ATOM 723 N ASP A 46 -5.459 -11.395 -5.726 1.00 70.32 N ATOM 724 CA ASP A 46 -5.992 -11.310 -7.111 1.00 21.52 C ATOM 725 C ASP A 46 -7.012 -10.142 -7.230 1.00 11.11 C ATOM 726 O ASP A 46 -7.952 -10.100 -6.434 1.00 13.21 O ATOM 727 CB ASP A 46 -6.649 -12.661 -7.494 1.00 0.42 C ATOM 728 CG ASP A 46 -7.188 -12.703 -8.939 1.00 14.31 C ATOM 729 OD1 ASP A 46 -6.370 -12.686 -9.883 1.00 74.44 O ATOM 730 OD2 ASP A 46 -8.423 -12.755 -9.131 1.00 11.22 O ATOM 0 H ASP A 46 -5.694 -12.263 -5.244 1.00 70.32 H new ATOM 0 HA ASP A 46 -5.173 -11.108 -7.802 1.00 21.52 H new ATOM 0 HB2 ASP A 46 -5.918 -13.459 -7.365 1.00 0.42 H new ATOM 0 HB3 ASP A 46 -7.468 -12.865 -6.804 1.00 0.42 H new ATOM 735 N PRO A 47 -6.826 -9.178 -8.211 1.00 5.32 N ATOM 736 CA PRO A 47 -7.610 -7.910 -8.281 1.00 72.24 C ATOM 737 C PRO A 47 -9.144 -8.114 -8.256 1.00 62.32 C ATOM 738 O PRO A 47 -9.724 -8.601 -9.226 1.00 65.34 O ATOM 739 CB PRO A 47 -7.160 -7.291 -9.636 1.00 63.02 C ATOM 740 CG PRO A 47 -5.813 -7.873 -9.916 1.00 51.42 C ATOM 741 CD PRO A 47 -5.838 -9.267 -9.329 1.00 74.01 C ATOM 0 HA PRO A 47 -7.420 -7.281 -7.411 1.00 72.24 H new ATOM 0 HB2 PRO A 47 -7.865 -7.534 -10.431 1.00 63.02 H new ATOM 0 HB3 PRO A 47 -7.112 -6.204 -9.574 1.00 63.02 H new ATOM 0 HG2 PRO A 47 -5.615 -7.903 -10.987 1.00 51.42 H new ATOM 0 HG3 PRO A 47 -5.025 -7.272 -9.463 1.00 51.42 H new ATOM 0 HD2 PRO A 47 -6.142 -10.006 -10.071 1.00 74.01 H new ATOM 0 HD3 PRO A 47 -4.854 -9.564 -8.968 1.00 74.01 H new ATOM 749 N ASP A 48 -9.792 -7.759 -7.128 1.00 2.51 N ATOM 750 CA ASP A 48 -11.261 -7.883 -6.985 1.00 22.23 C ATOM 751 C ASP A 48 -11.906 -6.483 -6.928 1.00 12.35 C ATOM 752 O ASP A 48 -11.572 -5.693 -6.034 1.00 24.55 O ATOM 753 CB ASP A 48 -11.642 -8.684 -5.720 1.00 55.14 C ATOM 754 CG ASP A 48 -13.151 -8.983 -5.642 1.00 24.31 C ATOM 755 OD1 ASP A 48 -13.638 -9.834 -6.418 1.00 25.40 O ATOM 756 OD2 ASP A 48 -13.859 -8.353 -4.835 1.00 32.42 O ATOM 0 H ASP A 48 -9.324 -7.384 -6.303 1.00 2.51 H new ATOM 0 HA ASP A 48 -11.635 -8.424 -7.854 1.00 22.23 H new ATOM 0 HB2 ASP A 48 -11.088 -9.623 -5.708 1.00 55.14 H new ATOM 0 HB3 ASP A 48 -11.340 -8.124 -4.835 1.00 55.14 H new ATOM 761 N PRO A 49 -12.857 -6.172 -7.866 1.00 22.43 N ATOM 762 CA PRO A 49 -13.515 -4.849 -7.932 1.00 44.11 C ATOM 763 C PRO A 49 -14.569 -4.629 -6.820 1.00 53.34 C ATOM 764 O PRO A 49 -14.881 -3.484 -6.479 1.00 51.12 O ATOM 765 CB PRO A 49 -14.163 -4.867 -9.341 1.00 51.22 C ATOM 766 CG PRO A 49 -14.469 -6.306 -9.602 1.00 34.14 C ATOM 767 CD PRO A 49 -13.354 -7.084 -8.946 1.00 32.34 C ATOM 0 HA PRO A 49 -12.814 -4.029 -7.776 1.00 44.11 H new ATOM 0 HB2 PRO A 49 -15.067 -4.259 -9.368 1.00 51.22 H new ATOM 0 HB3 PRO A 49 -13.485 -4.464 -10.093 1.00 51.22 H new ATOM 0 HG2 PRO A 49 -15.438 -6.582 -9.185 1.00 34.14 H new ATOM 0 HG3 PRO A 49 -14.512 -6.510 -10.672 1.00 34.14 H new ATOM 0 HD2 PRO A 49 -13.714 -8.028 -8.536 1.00 32.34 H new ATOM 0 HD3 PRO A 49 -12.565 -7.326 -9.658 1.00 32.34 H new ATOM 775 N ASP A 50 -15.134 -5.726 -6.284 1.00 32.54 N ATOM 776 CA ASP A 50 -16.210 -5.673 -5.265 1.00 74.42 C ATOM 777 C ASP A 50 -15.664 -5.431 -3.850 1.00 74.50 C ATOM 778 O ASP A 50 -16.406 -4.966 -2.970 1.00 14.44 O ATOM 779 CB ASP A 50 -17.045 -6.980 -5.307 1.00 10.03 C ATOM 780 CG ASP A 50 -17.886 -7.119 -6.591 1.00 12.34 C ATOM 781 OD1 ASP A 50 -17.304 -7.364 -7.666 1.00 73.20 O ATOM 782 OD2 ASP A 50 -19.129 -6.948 -6.533 1.00 44.14 O ATOM 0 H ASP A 50 -14.862 -6.675 -6.541 1.00 32.54 H new ATOM 0 HA ASP A 50 -16.849 -4.825 -5.509 1.00 74.42 H new ATOM 0 HB2 ASP A 50 -16.374 -7.835 -5.225 1.00 10.03 H new ATOM 0 HB3 ASP A 50 -17.707 -7.009 -4.441 1.00 10.03 H new ATOM 787 N TYR A 51 -14.374 -5.753 -3.624 1.00 62.54 N ATOM 788 CA TYR A 51 -13.723 -5.509 -2.317 1.00 24.02 C ATOM 789 C TYR A 51 -13.103 -4.100 -2.293 1.00 34.34 C ATOM 790 O TYR A 51 -12.776 -3.565 -1.224 1.00 53.42 O ATOM 791 CB TYR A 51 -12.665 -6.596 -1.971 1.00 62.24 C ATOM 792 CG TYR A 51 -12.493 -6.776 -0.449 1.00 53.14 C ATOM 793 CD1 TYR A 51 -13.280 -7.690 0.253 1.00 53.34 C ATOM 794 CD2 TYR A 51 -11.591 -6.003 0.290 1.00 70.54 C ATOM 795 CE1 TYR A 51 -13.177 -7.825 1.620 1.00 50.02 C ATOM 796 CE2 TYR A 51 -11.482 -6.146 1.660 1.00 63.31 C ATOM 797 CZ TYR A 51 -12.276 -7.054 2.318 1.00 45.34 C ATOM 798 OH TYR A 51 -12.184 -7.181 3.687 1.00 40.53 O ATOM 0 H TYR A 51 -13.765 -6.179 -4.322 1.00 62.54 H new ATOM 0 HA TYR A 51 -14.491 -5.571 -1.546 1.00 24.02 H new ATOM 0 HB2 TYR A 51 -12.963 -7.545 -2.416 1.00 62.24 H new ATOM 0 HB3 TYR A 51 -11.707 -6.323 -2.414 1.00 62.24 H new ATOM 0 HD1 TYR A 51 -13.985 -8.305 -0.287 1.00 53.34 H new ATOM 0 HD2 TYR A 51 -10.969 -5.282 -0.219 1.00 70.54 H new ATOM 0 HE1 TYR A 51 -13.802 -8.534 2.143 1.00 50.02 H new ATOM 0 HE2 TYR A 51 -10.774 -5.545 2.212 1.00 63.31 H new ATOM 0 HH TYR A 51 -12.636 -8.003 3.970 1.00 40.53 H new ATOM 808 N ARG A 52 -12.941 -3.525 -3.497 1.00 31.51 N ATOM 809 CA ARG A 52 -12.524 -2.134 -3.678 1.00 55.04 C ATOM 810 C ARG A 52 -13.484 -1.164 -2.968 1.00 5.11 C ATOM 811 O ARG A 52 -14.708 -1.320 -3.039 1.00 63.03 O ATOM 812 CB ARG A 52 -12.453 -1.792 -5.190 1.00 31.13 C ATOM 813 CG ARG A 52 -12.323 -0.288 -5.511 1.00 10.42 C ATOM 814 CD ARG A 52 -12.058 -0.019 -6.992 1.00 43.11 C ATOM 815 NE ARG A 52 -13.095 -0.519 -7.899 1.00 62.13 N ATOM 816 CZ ARG A 52 -12.866 -1.289 -8.972 1.00 64.42 C ATOM 817 NH1 ARG A 52 -11.628 -1.700 -9.266 1.00 31.12 N ATOM 818 NH2 ARG A 52 -13.863 -1.609 -9.770 1.00 32.04 N ATOM 0 H ARG A 52 -13.098 -4.020 -4.375 1.00 31.51 H new ATOM 0 HA ARG A 52 -11.536 -2.020 -3.233 1.00 55.04 H new ATOM 0 HB2 ARG A 52 -11.603 -2.317 -5.627 1.00 31.13 H new ATOM 0 HB3 ARG A 52 -13.349 -2.176 -5.677 1.00 31.13 H new ATOM 0 HG2 ARG A 52 -13.238 0.223 -5.212 1.00 10.42 H new ATOM 0 HG3 ARG A 52 -11.512 0.137 -4.919 1.00 10.42 H new ATOM 0 HD2 ARG A 52 -11.953 1.056 -7.139 1.00 43.11 H new ATOM 0 HD3 ARG A 52 -11.105 -0.473 -7.265 1.00 43.11 H new ATOM 0 HE ARG A 52 -14.062 -0.262 -7.699 1.00 62.13 H new ATOM 0 HH11 ARG A 52 -10.846 -1.428 -8.671 1.00 31.12 H new ATOM 0 HH12 ARG A 52 -11.466 -2.286 -10.085 1.00 31.12 H new ATOM 0 HH21 ARG A 52 -14.805 -1.271 -9.570 1.00 32.04 H new ATOM 0 HH22 ARG A 52 -13.694 -2.195 -10.588 1.00 32.04 H new ATOM 832 N VAL A 53 -12.903 -0.171 -2.292 1.00 55.20 N ATOM 833 CA VAL A 53 -13.632 0.944 -1.694 1.00 21.45 C ATOM 834 C VAL A 53 -13.138 2.254 -2.338 1.00 5.24 C ATOM 835 O VAL A 53 -12.000 2.334 -2.837 1.00 51.34 O ATOM 836 CB VAL A 53 -13.439 0.995 -0.129 1.00 40.50 C ATOM 837 CG1 VAL A 53 -13.874 -0.336 0.539 1.00 34.13 C ATOM 838 CG2 VAL A 53 -11.987 1.357 0.249 1.00 24.44 C ATOM 0 H VAL A 53 -11.895 -0.120 -2.143 1.00 55.20 H new ATOM 0 HA VAL A 53 -14.698 0.810 -1.880 1.00 21.45 H new ATOM 0 HB VAL A 53 -14.087 1.784 0.252 1.00 40.50 H new ATOM 0 HG11 VAL A 53 -13.728 -0.267 1.617 1.00 34.13 H new ATOM 0 HG12 VAL A 53 -14.927 -0.523 0.327 1.00 34.13 H new ATOM 0 HG13 VAL A 53 -13.273 -1.155 0.143 1.00 34.13 H new ATOM 0 HG21 VAL A 53 -11.889 1.383 1.334 1.00 24.44 H new ATOM 0 HG22 VAL A 53 -11.308 0.608 -0.158 1.00 24.44 H new ATOM 0 HG23 VAL A 53 -11.737 2.335 -0.162 1.00 24.44 H new ATOM 848 N GLU A 54 -14.007 3.250 -2.355 1.00 34.13 N ATOM 849 CA GLU A 54 -13.655 4.622 -2.742 1.00 23.22 C ATOM 850 C GLU A 54 -13.355 5.414 -1.455 1.00 64.41 C ATOM 851 O GLU A 54 -14.062 5.248 -0.448 1.00 71.31 O ATOM 852 CB GLU A 54 -14.835 5.243 -3.542 1.00 70.54 C ATOM 853 CG GLU A 54 -16.186 5.228 -2.786 1.00 3.24 C ATOM 854 CD GLU A 54 -17.382 5.696 -3.626 1.00 15.53 C ATOM 855 OE1 GLU A 54 -17.525 6.912 -3.836 1.00 24.11 O ATOM 856 OE2 GLU A 54 -18.195 4.856 -4.067 1.00 62.33 O ATOM 0 H GLU A 54 -14.988 3.137 -2.100 1.00 34.13 H new ATOM 0 HA GLU A 54 -12.774 4.645 -3.383 1.00 23.22 H new ATOM 0 HB2 GLU A 54 -14.585 6.273 -3.798 1.00 70.54 H new ATOM 0 HB3 GLU A 54 -14.950 4.700 -4.480 1.00 70.54 H new ATOM 0 HG2 GLU A 54 -16.380 4.216 -2.431 1.00 3.24 H new ATOM 0 HG3 GLU A 54 -16.104 5.865 -1.905 1.00 3.24 H new ATOM 863 N ALA A 55 -12.322 6.269 -1.463 1.00 43.03 N ATOM 864 CA ALA A 55 -11.865 6.969 -0.244 1.00 20.21 C ATOM 865 C ALA A 55 -11.568 8.440 -0.549 1.00 44.55 C ATOM 866 O ALA A 55 -10.978 8.749 -1.575 1.00 1.44 O ATOM 867 CB ALA A 55 -10.630 6.267 0.331 1.00 35.04 C ATOM 0 H ALA A 55 -11.784 6.496 -2.299 1.00 43.03 H new ATOM 0 HA ALA A 55 -12.659 6.936 0.502 1.00 20.21 H new ATOM 0 HB1 ALA A 55 -10.300 6.789 1.229 1.00 35.04 H new ATOM 0 HB2 ALA A 55 -10.881 5.237 0.582 1.00 35.04 H new ATOM 0 HB3 ALA A 55 -9.829 6.275 -0.409 1.00 35.04 H new ATOM 873 N THR A 56 -11.988 9.336 0.353 1.00 22.32 N ATOM 874 CA THR A 56 -11.725 10.772 0.241 1.00 0.32 C ATOM 875 C THR A 56 -10.390 11.093 0.938 1.00 44.20 C ATOM 876 O THR A 56 -10.194 10.735 2.101 1.00 14.41 O ATOM 877 CB THR A 56 -12.887 11.594 0.887 1.00 64.12 C ATOM 878 OG1 THR A 56 -14.143 11.212 0.293 1.00 15.15 O ATOM 879 CG2 THR A 56 -12.688 13.117 0.727 1.00 21.23 C ATOM 0 H THR A 56 -12.522 9.082 1.184 1.00 22.32 H new ATOM 0 HA THR A 56 -11.662 11.047 -0.812 1.00 0.32 H new ATOM 0 HB THR A 56 -12.888 11.370 1.954 1.00 64.12 H new ATOM 0 HG1 THR A 56 -14.869 11.728 0.702 1.00 15.15 H new ATOM 0 HG21 THR A 56 -13.521 13.644 1.192 1.00 21.23 H new ATOM 0 HG22 THR A 56 -11.756 13.415 1.208 1.00 21.23 H new ATOM 0 HG23 THR A 56 -12.646 13.369 -0.333 1.00 21.23 H new ATOM 887 N VAL A 57 -9.489 11.766 0.215 1.00 45.03 N ATOM 888 CA VAL A 57 -8.166 12.152 0.718 1.00 1.32 C ATOM 889 C VAL A 57 -8.323 13.324 1.711 1.00 55.31 C ATOM 890 O VAL A 57 -8.951 14.334 1.390 1.00 64.34 O ATOM 891 CB VAL A 57 -7.216 12.570 -0.471 1.00 53.12 C ATOM 892 CG1 VAL A 57 -5.774 12.824 0.017 1.00 51.22 C ATOM 893 CG2 VAL A 57 -7.239 11.515 -1.600 1.00 0.25 C ATOM 0 H VAL A 57 -9.659 12.061 -0.746 1.00 45.03 H new ATOM 0 HA VAL A 57 -7.716 11.299 1.226 1.00 1.32 H new ATOM 0 HB VAL A 57 -7.596 13.507 -0.877 1.00 53.12 H new ATOM 0 HG11 VAL A 57 -5.149 13.110 -0.829 1.00 51.22 H new ATOM 0 HG12 VAL A 57 -5.776 13.627 0.755 1.00 51.22 H new ATOM 0 HG13 VAL A 57 -5.378 11.915 0.470 1.00 51.22 H new ATOM 0 HG21 VAL A 57 -6.575 11.830 -2.406 1.00 0.25 H new ATOM 0 HG22 VAL A 57 -6.904 10.555 -1.208 1.00 0.25 H new ATOM 0 HG23 VAL A 57 -8.254 11.415 -1.984 1.00 0.25 H new ATOM 903 N THR A 58 -7.768 13.145 2.919 1.00 44.42 N ATOM 904 CA THR A 58 -7.829 14.125 4.010 1.00 53.33 C ATOM 905 C THR A 58 -6.389 14.513 4.382 1.00 13.41 C ATOM 906 O THR A 58 -5.710 13.800 5.132 1.00 0.54 O ATOM 907 CB THR A 58 -8.583 13.525 5.247 1.00 63.23 C ATOM 908 OG1 THR A 58 -9.863 13.017 4.835 1.00 65.00 O ATOM 909 CG2 THR A 58 -8.780 14.554 6.378 1.00 2.12 C ATOM 0 H THR A 58 -7.255 12.299 3.168 1.00 44.42 H new ATOM 0 HA THR A 58 -8.381 15.009 3.691 1.00 53.33 H new ATOM 0 HB THR A 58 -7.962 12.721 5.642 1.00 63.23 H new ATOM 0 HG1 THR A 58 -10.535 13.232 5.515 1.00 65.00 H new ATOM 0 HG21 THR A 58 -9.307 14.085 7.209 1.00 2.12 H new ATOM 0 HG22 THR A 58 -7.808 14.910 6.719 1.00 2.12 H new ATOM 0 HG23 THR A 58 -9.364 15.396 6.006 1.00 2.12 H new ATOM 917 N VAL A 59 -5.921 15.637 3.833 1.00 21.33 N ATOM 918 CA VAL A 59 -4.518 16.065 3.963 1.00 51.11 C ATOM 919 C VAL A 59 -4.398 17.070 5.109 1.00 22.44 C ATOM 920 O VAL A 59 -5.186 18.012 5.216 1.00 72.54 O ATOM 921 CB VAL A 59 -3.954 16.666 2.624 1.00 51.15 C ATOM 922 CG1 VAL A 59 -2.523 17.232 2.793 1.00 1.12 C ATOM 923 CG2 VAL A 59 -3.979 15.599 1.515 1.00 70.32 C ATOM 0 H VAL A 59 -6.498 16.277 3.287 1.00 21.33 H new ATOM 0 HA VAL A 59 -3.913 15.186 4.186 1.00 51.11 H new ATOM 0 HB VAL A 59 -4.598 17.499 2.342 1.00 51.15 H new ATOM 0 HG11 VAL A 59 -2.177 17.636 1.842 1.00 1.12 H new ATOM 0 HG12 VAL A 59 -2.531 18.024 3.542 1.00 1.12 H new ATOM 0 HG13 VAL A 59 -1.852 16.435 3.115 1.00 1.12 H new ATOM 0 HG21 VAL A 59 -3.587 16.025 0.592 1.00 70.32 H new ATOM 0 HG22 VAL A 59 -3.364 14.750 1.813 1.00 70.32 H new ATOM 0 HG23 VAL A 59 -5.004 15.266 1.354 1.00 70.32 H new ATOM 933 N HIS A 60 -3.390 16.836 5.951 1.00 55.45 N ATOM 934 CA HIS A 60 -3.127 17.581 7.175 1.00 41.42 C ATOM 935 C HIS A 60 -2.127 18.682 6.866 1.00 72.44 C ATOM 936 O HIS A 60 -1.097 18.434 6.230 1.00 61.42 O ATOM 937 CB HIS A 60 -2.564 16.626 8.265 1.00 22.41 C ATOM 938 CG HIS A 60 -3.567 15.599 8.732 1.00 55.54 C ATOM 939 ND1 HIS A 60 -3.827 14.433 8.043 1.00 14.34 N ATOM 940 CD2 HIS A 60 -4.415 15.597 9.795 1.00 34.01 C ATOM 941 CE1 HIS A 60 -4.788 13.769 8.654 1.00 64.43 C ATOM 942 NE2 HIS A 60 -5.165 14.451 9.717 1.00 12.11 N ATOM 0 H HIS A 60 -2.710 16.093 5.789 1.00 55.45 H new ATOM 0 HA HIS A 60 -4.050 18.022 7.551 1.00 41.42 H new ATOM 0 HB2 HIS A 60 -1.686 16.114 7.872 1.00 22.41 H new ATOM 0 HB3 HIS A 60 -2.233 17.216 9.120 1.00 22.41 H new ATOM 0 HD1 HIS A 60 -3.350 14.131 7.193 1.00 14.34 H new ATOM 0 HD2 HIS A 60 -4.485 16.357 10.559 1.00 34.01 H new ATOM 0 HE1 HIS A 60 -5.199 12.822 8.336 1.00 64.43 H new ATOM 951 N GLU A 61 -2.445 19.888 7.327 1.00 25.23 N ATOM 952 CA GLU A 61 -1.568 21.052 7.199 1.00 43.42 C ATOM 953 C GLU A 61 -0.388 20.939 8.187 1.00 41.13 C ATOM 954 O GLU A 61 0.636 21.605 8.016 1.00 22.20 O ATOM 955 CB GLU A 61 -2.378 22.352 7.424 1.00 70.41 C ATOM 956 CG GLU A 61 -3.100 22.431 8.780 1.00 42.11 C ATOM 957 CD GLU A 61 -3.950 23.700 8.933 1.00 41.41 C ATOM 958 OE1 GLU A 61 -5.080 23.737 8.396 1.00 72.12 O ATOM 959 OE2 GLU A 61 -3.487 24.666 9.575 1.00 65.02 O ATOM 0 H GLU A 61 -3.324 20.089 7.804 1.00 25.23 H new ATOM 0 HA GLU A 61 -1.155 21.086 6.191 1.00 43.42 H new ATOM 0 HB2 GLU A 61 -1.704 23.204 7.336 1.00 70.41 H new ATOM 0 HB3 GLU A 61 -3.117 22.446 6.628 1.00 70.41 H new ATOM 0 HG2 GLU A 61 -3.739 21.556 8.897 1.00 42.11 H new ATOM 0 HG3 GLU A 61 -2.362 22.396 9.581 1.00 42.11 H new ATOM 966 N THR A 62 -0.548 20.073 9.215 1.00 14.43 N ATOM 967 CA THR A 62 0.484 19.783 10.211 1.00 33.44 C ATOM 968 C THR A 62 0.828 18.259 10.179 1.00 21.43 C ATOM 969 O THR A 62 0.132 17.447 10.810 1.00 55.41 O ATOM 970 CB THR A 62 -0.009 20.241 11.628 1.00 63.22 C ATOM 971 OG1 THR A 62 -1.291 19.660 11.904 1.00 2.34 O ATOM 972 CG2 THR A 62 -0.125 21.776 11.737 1.00 73.12 C ATOM 0 H THR A 62 -1.413 19.554 9.369 1.00 14.43 H new ATOM 0 HA THR A 62 1.395 20.336 9.981 1.00 33.44 H new ATOM 0 HB THR A 62 0.732 19.904 12.353 1.00 63.22 H new ATOM 0 HG1 THR A 62 -1.286 18.716 11.640 1.00 2.34 H new ATOM 0 HG21 THR A 62 -0.470 22.045 12.736 1.00 73.12 H new ATOM 0 HG22 THR A 62 0.850 22.228 11.556 1.00 73.12 H new ATOM 0 HG23 THR A 62 -0.837 22.141 10.997 1.00 73.12 H new ATOM 980 N PRO A 63 1.870 17.848 9.373 1.00 43.24 N ATOM 981 CA PRO A 63 2.282 16.427 9.239 1.00 64.35 C ATOM 982 C PRO A 63 3.248 15.959 10.369 1.00 34.14 C ATOM 983 O PRO A 63 4.195 16.671 10.720 1.00 61.04 O ATOM 984 CB PRO A 63 2.980 16.431 7.855 1.00 71.22 C ATOM 985 CG PRO A 63 3.613 17.784 7.744 1.00 13.44 C ATOM 986 CD PRO A 63 2.703 18.735 8.504 1.00 20.43 C ATOM 0 HA PRO A 63 1.446 15.732 9.321 1.00 64.35 H new ATOM 0 HB2 PRO A 63 3.726 15.639 7.787 1.00 71.22 H new ATOM 0 HB3 PRO A 63 2.263 16.263 7.051 1.00 71.22 H new ATOM 0 HG2 PRO A 63 4.617 17.781 8.169 1.00 13.44 H new ATOM 0 HG3 PRO A 63 3.709 18.086 6.701 1.00 13.44 H new ATOM 0 HD2 PRO A 63 3.279 19.444 9.098 1.00 20.43 H new ATOM 0 HD3 PRO A 63 2.083 19.319 7.824 1.00 20.43 H new ATOM 994 N GLU A 64 2.986 14.765 10.952 1.00 11.32 N ATOM 995 CA GLU A 64 3.837 14.169 12.021 1.00 71.15 C ATOM 996 C GLU A 64 4.887 13.194 11.446 1.00 33.42 C ATOM 997 O GLU A 64 4.766 12.750 10.309 1.00 0.51 O ATOM 998 CB GLU A 64 2.947 13.435 13.060 1.00 43.24 C ATOM 999 CG GLU A 64 2.104 12.284 12.479 1.00 15.40 C ATOM 1000 CD GLU A 64 1.300 11.512 13.529 1.00 32.31 C ATOM 1001 OE1 GLU A 64 0.196 11.966 13.908 1.00 75.02 O ATOM 1002 OE2 GLU A 64 1.767 10.447 13.983 1.00 54.42 O ATOM 0 H GLU A 64 2.184 14.187 10.699 1.00 11.32 H new ATOM 0 HA GLU A 64 4.374 14.984 12.507 1.00 71.15 H new ATOM 0 HB2 GLU A 64 3.585 13.039 13.850 1.00 43.24 H new ATOM 0 HB3 GLU A 64 2.278 14.160 13.524 1.00 43.24 H new ATOM 0 HG2 GLU A 64 1.417 12.689 11.736 1.00 15.40 H new ATOM 0 HG3 GLU A 64 2.764 11.590 11.959 1.00 15.40 H new ATOM 1009 N SER A 65 5.898 12.853 12.264 1.00 14.55 N ATOM 1010 CA SER A 65 6.996 11.951 11.867 1.00 31.12 C ATOM 1011 C SER A 65 6.677 10.495 12.267 1.00 1.20 C ATOM 1012 O SER A 65 6.520 10.187 13.454 1.00 12.33 O ATOM 1013 CB SER A 65 8.311 12.427 12.522 1.00 1.31 C ATOM 1014 OG SER A 65 8.187 12.552 13.935 1.00 61.23 O ATOM 0 H SER A 65 5.978 13.195 13.221 1.00 14.55 H new ATOM 0 HA SER A 65 7.109 11.978 10.783 1.00 31.12 H new ATOM 0 HB2 SER A 65 9.109 11.722 12.289 1.00 1.31 H new ATOM 0 HB3 SER A 65 8.601 13.388 12.097 1.00 1.31 H new ATOM 0 HG SER A 65 7.661 11.803 14.285 1.00 61.23 H new ATOM 1020 N VAL A 66 6.535 9.623 11.252 1.00 2.33 N ATOM 1021 CA VAL A 66 6.286 8.180 11.432 1.00 24.05 C ATOM 1022 C VAL A 66 7.391 7.410 10.685 1.00 4.34 C ATOM 1023 O VAL A 66 7.503 7.525 9.462 1.00 32.30 O ATOM 1024 CB VAL A 66 4.865 7.782 10.871 1.00 44.42 C ATOM 1025 CG1 VAL A 66 4.466 6.339 11.267 1.00 12.22 C ATOM 1026 CG2 VAL A 66 3.789 8.811 11.295 1.00 71.21 C ATOM 0 H VAL A 66 6.590 9.903 10.273 1.00 2.33 H new ATOM 0 HA VAL A 66 6.301 7.931 12.493 1.00 24.05 H new ATOM 0 HB VAL A 66 4.930 7.800 9.783 1.00 44.42 H new ATOM 0 HG11 VAL A 66 3.482 6.109 10.859 1.00 12.22 H new ATOM 0 HG12 VAL A 66 5.197 5.637 10.867 1.00 12.22 H new ATOM 0 HG13 VAL A 66 4.438 6.254 12.353 1.00 12.22 H new ATOM 0 HG21 VAL A 66 2.821 8.511 10.894 1.00 71.21 H new ATOM 0 HG22 VAL A 66 3.734 8.853 12.383 1.00 71.21 H new ATOM 0 HG23 VAL A 66 4.053 9.795 10.907 1.00 71.21 H new ATOM 1036 N ASP A 67 8.206 6.645 11.428 1.00 61.21 N ATOM 1037 CA ASP A 67 9.381 5.947 10.867 1.00 50.43 C ATOM 1038 C ASP A 67 8.946 4.644 10.195 1.00 4.24 C ATOM 1039 O ASP A 67 8.476 3.707 10.858 1.00 44.43 O ATOM 1040 CB ASP A 67 10.427 5.665 11.971 1.00 25.14 C ATOM 1041 CG ASP A 67 10.886 6.949 12.680 1.00 63.33 C ATOM 1042 OD1 ASP A 67 11.615 7.758 12.059 1.00 63.12 O ATOM 1043 OD2 ASP A 67 10.495 7.178 13.850 1.00 13.12 O ATOM 0 H ASP A 67 8.074 6.491 12.428 1.00 61.21 H new ATOM 0 HA ASP A 67 9.843 6.590 10.118 1.00 50.43 H new ATOM 0 HB2 ASP A 67 10.002 4.979 12.704 1.00 25.14 H new ATOM 0 HB3 ASP A 67 11.291 5.166 11.531 1.00 25.14 H new ATOM 1048 N LEU A 68 9.104 4.603 8.867 1.00 44.11 N ATOM 1049 CA LEU A 68 8.738 3.444 8.034 1.00 2.33 C ATOM 1050 C LEU A 68 9.998 2.982 7.284 1.00 62.20 C ATOM 1051 O LEU A 68 10.997 3.714 7.231 1.00 65.03 O ATOM 1052 CB LEU A 68 7.604 3.818 7.032 1.00 12.40 C ATOM 1053 CG LEU A 68 6.374 4.572 7.631 1.00 31.43 C ATOM 1054 CD1 LEU A 68 5.378 4.958 6.534 1.00 2.31 C ATOM 1055 CD2 LEU A 68 5.666 3.767 8.736 1.00 21.51 C ATOM 0 H LEU A 68 9.493 5.379 8.332 1.00 44.11 H new ATOM 0 HA LEU A 68 8.360 2.637 8.662 1.00 2.33 H new ATOM 0 HB2 LEU A 68 8.034 4.436 6.244 1.00 12.40 H new ATOM 0 HB3 LEU A 68 7.248 2.902 6.561 1.00 12.40 H new ATOM 0 HG LEU A 68 6.763 5.480 8.092 1.00 31.43 H new ATOM 0 HD11 LEU A 68 4.532 5.481 6.979 1.00 2.31 H new ATOM 0 HD12 LEU A 68 5.868 5.610 5.810 1.00 2.31 H new ATOM 0 HD13 LEU A 68 5.024 4.058 6.031 1.00 2.31 H new ATOM 0 HD21 LEU A 68 4.819 4.338 9.116 1.00 21.51 H new ATOM 0 HD22 LEU A 68 5.311 2.821 8.327 1.00 21.51 H new ATOM 0 HD23 LEU A 68 6.366 3.571 9.548 1.00 21.51 H new ATOM 1067 N GLU A 69 9.959 1.768 6.724 1.00 70.35 N ATOM 1068 CA GLU A 69 11.057 1.266 5.887 1.00 60.43 C ATOM 1069 C GLU A 69 11.007 1.903 4.498 1.00 21.34 C ATOM 1070 O GLU A 69 9.945 2.343 4.030 1.00 72.44 O ATOM 1071 CB GLU A 69 11.004 -0.279 5.734 1.00 35.10 C ATOM 1072 CG GLU A 69 9.693 -0.839 5.124 1.00 1.30 C ATOM 1073 CD GLU A 69 9.739 -2.355 4.862 1.00 52.12 C ATOM 1074 OE1 GLU A 69 9.826 -3.130 5.834 1.00 71.14 O ATOM 1075 OE2 GLU A 69 9.693 -2.775 3.682 1.00 43.14 O ATOM 0 H GLU A 69 9.182 1.116 6.834 1.00 70.35 H new ATOM 0 HA GLU A 69 11.987 1.536 6.387 1.00 60.43 H new ATOM 0 HB2 GLU A 69 11.840 -0.595 5.110 1.00 35.10 H new ATOM 0 HB3 GLU A 69 11.151 -0.730 6.715 1.00 35.10 H new ATOM 0 HG2 GLU A 69 8.865 -0.619 5.798 1.00 1.30 H new ATOM 0 HG3 GLU A 69 9.487 -0.322 4.187 1.00 1.30 H new ATOM 1082 N THR A 70 12.178 1.984 3.872 1.00 43.44 N ATOM 1083 CA THR A 70 12.286 2.126 2.426 1.00 31.15 C ATOM 1084 C THR A 70 12.563 0.733 1.836 1.00 10.51 C ATOM 1085 O THR A 70 12.984 -0.188 2.560 1.00 1.23 O ATOM 1086 CB THR A 70 13.396 3.151 2.001 1.00 42.10 C ATOM 1087 OG1 THR A 70 13.324 3.390 0.587 1.00 5.25 O ATOM 1088 CG2 THR A 70 14.821 2.692 2.373 1.00 51.51 C ATOM 0 H THR A 70 13.077 1.953 4.354 1.00 43.44 H new ATOM 0 HA THR A 70 11.351 2.529 2.037 1.00 31.15 H new ATOM 0 HB THR A 70 13.201 4.069 2.555 1.00 42.10 H new ATOM 0 HG1 THR A 70 14.018 4.032 0.328 1.00 5.25 H new ATOM 0 HG21 THR A 70 15.541 3.445 2.052 1.00 51.51 H new ATOM 0 HG22 THR A 70 14.891 2.560 3.453 1.00 51.51 H new ATOM 0 HG23 THR A 70 15.040 1.746 1.877 1.00 51.51 H new ATOM 1096 N SER A 71 12.353 0.603 0.527 1.00 34.25 N ATOM 1097 CA SER A 71 12.426 -0.679 -0.190 1.00 23.15 C ATOM 1098 C SER A 71 13.834 -1.332 -0.112 1.00 73.45 C ATOM 1099 O SER A 71 13.952 -2.564 -0.203 1.00 71.11 O ATOM 1100 CB SER A 71 11.976 -0.450 -1.650 1.00 71.02 C ATOM 1101 OG SER A 71 12.576 0.721 -2.191 1.00 74.01 O ATOM 0 H SER A 71 12.124 1.392 -0.077 1.00 34.25 H new ATOM 0 HA SER A 71 11.756 -1.390 0.293 1.00 23.15 H new ATOM 0 HB2 SER A 71 12.245 -1.314 -2.257 1.00 71.02 H new ATOM 0 HB3 SER A 71 10.891 -0.358 -1.690 1.00 71.02 H new ATOM 0 HG SER A 71 12.892 0.536 -3.100 1.00 74.01 H new ATOM 1107 N ASP A 72 14.896 -0.505 0.019 1.00 44.42 N ATOM 1108 CA ASP A 72 16.291 -0.974 0.224 1.00 62.43 C ATOM 1109 C ASP A 72 16.596 -1.336 1.707 1.00 42.25 C ATOM 1110 O ASP A 72 17.638 -0.950 2.250 1.00 52.44 O ATOM 1111 CB ASP A 72 17.258 0.132 -0.311 1.00 23.11 C ATOM 1112 CG ASP A 72 18.723 -0.333 -0.455 1.00 70.20 C ATOM 1113 OD1 ASP A 72 19.006 -1.127 -1.382 1.00 11.31 O ATOM 1114 OD2 ASP A 72 19.583 0.070 0.364 1.00 51.13 O ATOM 0 H ASP A 72 14.812 0.511 -0.014 1.00 44.42 H new ATOM 0 HA ASP A 72 16.437 -1.901 -0.330 1.00 62.43 H new ATOM 0 HB2 ASP A 72 16.899 0.476 -1.281 1.00 23.11 H new ATOM 0 HB3 ASP A 72 17.224 0.988 0.363 1.00 23.11 H new ATOM 1119 N ASP A 73 15.670 -2.076 2.367 1.00 42.24 N ATOM 1120 CA ASP A 73 15.903 -2.714 3.707 1.00 54.45 C ATOM 1121 C ASP A 73 16.105 -1.699 4.868 1.00 72.25 C ATOM 1122 O ASP A 73 16.122 -2.077 6.041 1.00 74.13 O ATOM 1123 CB ASP A 73 17.097 -3.719 3.607 1.00 71.42 C ATOM 1124 CG ASP A 73 17.336 -4.580 4.864 1.00 13.02 C ATOM 1125 OD1 ASP A 73 16.564 -5.523 5.091 1.00 23.33 O ATOM 1126 OD2 ASP A 73 18.307 -4.328 5.611 1.00 31.11 O ATOM 0 H ASP A 73 14.738 -2.253 1.993 1.00 42.24 H new ATOM 0 HA ASP A 73 14.991 -3.251 3.966 1.00 54.45 H new ATOM 0 HB2 ASP A 73 16.923 -4.382 2.759 1.00 71.42 H new ATOM 0 HB3 ASP A 73 18.006 -3.158 3.392 1.00 71.42 H new ATOM 1131 N ARG A 74 16.160 -0.409 4.532 1.00 30.34 N ATOM 1132 CA ARG A 74 16.676 0.651 5.415 1.00 4.42 C ATOM 1133 C ARG A 74 15.494 1.363 6.107 1.00 12.32 C ATOM 1134 O ARG A 74 14.333 1.011 5.870 1.00 64.23 O ATOM 1135 CB ARG A 74 17.553 1.626 4.545 1.00 71.45 C ATOM 1136 CG ARG A 74 18.780 2.230 5.261 1.00 34.12 C ATOM 1137 CD ARG A 74 19.666 3.073 4.311 1.00 60.11 C ATOM 1138 NE ARG A 74 20.201 2.289 3.170 1.00 4.34 N ATOM 1139 CZ ARG A 74 21.056 2.756 2.234 1.00 24.52 C ATOM 1140 NH1 ARG A 74 21.490 4.013 2.252 1.00 61.22 N ATOM 1141 NH2 ARG A 74 21.483 1.950 1.269 1.00 71.24 N ATOM 0 H ARG A 74 15.844 -0.061 3.627 1.00 30.34 H new ATOM 0 HA ARG A 74 17.305 0.245 6.207 1.00 4.42 H new ATOM 0 HB2 ARG A 74 17.897 1.088 3.662 1.00 71.45 H new ATOM 0 HB3 ARG A 74 16.920 2.441 4.194 1.00 71.45 H new ATOM 0 HG2 ARG A 74 18.443 2.855 6.088 1.00 34.12 H new ATOM 0 HG3 ARG A 74 19.377 1.426 5.692 1.00 34.12 H new ATOM 0 HD2 ARG A 74 19.084 3.911 3.928 1.00 60.11 H new ATOM 0 HD3 ARG A 74 20.497 3.495 4.877 1.00 60.11 H new ATOM 0 HE ARG A 74 19.899 1.319 3.086 1.00 4.34 H new ATOM 0 HH11 ARG A 74 21.177 4.650 2.985 1.00 61.22 H new ATOM 0 HH12 ARG A 74 22.135 4.340 1.533 1.00 61.22 H new ATOM 0 HH21 ARG A 74 21.165 0.981 1.236 1.00 71.24 H new ATOM 0 HH22 ARG A 74 22.129 2.300 0.561 1.00 71.24 H new ATOM 1155 N THR A 75 15.780 2.384 6.927 1.00 21.10 N ATOM 1156 CA THR A 75 14.756 3.097 7.715 1.00 31.42 C ATOM 1157 C THR A 75 14.856 4.587 7.403 1.00 62.20 C ATOM 1158 O THR A 75 15.958 5.145 7.347 1.00 2.12 O ATOM 1159 CB THR A 75 14.925 2.861 9.253 1.00 1.45 C ATOM 1160 OG1 THR A 75 14.858 1.452 9.537 1.00 22.22 O ATOM 1161 CG2 THR A 75 13.850 3.609 10.078 1.00 41.21 C ATOM 0 H THR A 75 16.725 2.741 7.065 1.00 21.10 H new ATOM 0 HA THR A 75 13.775 2.709 7.439 1.00 31.42 H new ATOM 0 HB THR A 75 15.899 3.257 9.542 1.00 1.45 H new ATOM 0 HG1 THR A 75 14.966 1.307 10.500 1.00 22.22 H new ATOM 0 HG21 THR A 75 14.006 3.416 11.139 1.00 41.21 H new ATOM 0 HG22 THR A 75 13.926 4.680 9.889 1.00 41.21 H new ATOM 0 HG23 THR A 75 12.860 3.259 9.788 1.00 41.21 H new ATOM 1169 N VAL A 76 13.697 5.215 7.204 1.00 75.54 N ATOM 1170 CA VAL A 76 13.583 6.630 6.836 1.00 34.31 C ATOM 1171 C VAL A 76 12.300 7.205 7.455 1.00 50.40 C ATOM 1172 O VAL A 76 11.289 6.503 7.592 1.00 61.52 O ATOM 1173 CB VAL A 76 13.588 6.848 5.266 1.00 34.02 C ATOM 1174 CG1 VAL A 76 15.015 6.736 4.670 1.00 52.31 C ATOM 1175 CG2 VAL A 76 12.627 5.858 4.567 1.00 41.20 C ATOM 0 H VAL A 76 12.795 4.748 7.295 1.00 75.54 H new ATOM 0 HA VAL A 76 14.456 7.154 7.225 1.00 34.31 H new ATOM 0 HB VAL A 76 13.235 7.863 5.082 1.00 34.02 H new ATOM 0 HG11 VAL A 76 14.972 6.892 3.592 1.00 52.31 H new ATOM 0 HG12 VAL A 76 15.658 7.492 5.121 1.00 52.31 H new ATOM 0 HG13 VAL A 76 15.419 5.745 4.878 1.00 52.31 H new ATOM 0 HG21 VAL A 76 12.649 6.028 3.491 1.00 41.20 H new ATOM 0 HG22 VAL A 76 12.940 4.836 4.779 1.00 41.20 H new ATOM 0 HG23 VAL A 76 11.614 6.011 4.938 1.00 41.20 H new ATOM 1185 N ARG A 77 12.374 8.476 7.852 1.00 21.41 N ATOM 1186 CA ARG A 77 11.238 9.207 8.413 1.00 11.10 C ATOM 1187 C ARG A 77 10.258 9.562 7.293 1.00 3.42 C ATOM 1188 O ARG A 77 10.663 10.083 6.248 1.00 3.30 O ATOM 1189 CB ARG A 77 11.758 10.477 9.143 1.00 64.13 C ATOM 1190 CG ARG A 77 10.686 11.411 9.788 1.00 63.13 C ATOM 1191 CD ARG A 77 10.130 12.507 8.840 1.00 32.31 C ATOM 1192 NE ARG A 77 11.205 13.375 8.302 1.00 31.30 N ATOM 1193 CZ ARG A 77 11.326 14.702 8.509 1.00 23.25 C ATOM 1194 NH1 ARG A 77 10.445 15.365 9.247 1.00 32.04 N ATOM 1195 NH2 ARG A 77 12.345 15.353 7.973 1.00 70.35 N ATOM 0 H ARG A 77 13.228 9.030 7.793 1.00 21.41 H new ATOM 0 HA ARG A 77 10.709 8.590 9.139 1.00 11.10 H new ATOM 0 HB2 ARG A 77 12.447 10.160 9.926 1.00 64.13 H new ATOM 0 HB3 ARG A 77 12.335 11.065 8.430 1.00 64.13 H new ATOM 0 HG2 ARG A 77 9.856 10.800 10.142 1.00 63.13 H new ATOM 0 HG3 ARG A 77 11.122 11.893 10.663 1.00 63.13 H new ATOM 0 HD2 ARG A 77 9.598 12.036 8.014 1.00 32.31 H new ATOM 0 HD3 ARG A 77 9.406 13.118 9.378 1.00 32.31 H new ATOM 0 HE ARG A 77 11.917 12.928 7.724 1.00 31.30 H new ATOM 0 HH11 ARG A 77 9.659 14.871 9.669 1.00 32.04 H new ATOM 0 HH12 ARG A 77 10.554 16.369 9.392 1.00 32.04 H new ATOM 0 HH21 ARG A 77 13.031 14.851 7.409 1.00 70.35 H new ATOM 0 HH22 ARG A 77 12.445 16.357 8.124 1.00 70.35 H new ATOM 1209 N TYR A 78 8.983 9.249 7.524 1.00 43.41 N ATOM 1210 CA TYR A 78 7.856 9.680 6.688 1.00 61.53 C ATOM 1211 C TYR A 78 7.055 10.751 7.421 1.00 65.13 C ATOM 1212 O TYR A 78 7.082 10.829 8.651 1.00 42.32 O ATOM 1213 CB TYR A 78 6.948 8.476 6.330 1.00 32.43 C ATOM 1214 CG TYR A 78 7.486 7.557 5.212 1.00 74.35 C ATOM 1215 CD1 TYR A 78 8.658 6.822 5.376 1.00 32.04 C ATOM 1216 CD2 TYR A 78 6.797 7.402 4.005 1.00 63.35 C ATOM 1217 CE1 TYR A 78 9.116 5.977 4.383 1.00 22.35 C ATOM 1218 CE2 TYR A 78 7.250 6.555 3.016 1.00 23.12 C ATOM 1219 CZ TYR A 78 8.409 5.843 3.206 1.00 51.45 C ATOM 1220 OH TYR A 78 8.860 4.984 2.223 1.00 10.54 O ATOM 0 H TYR A 78 8.695 8.675 8.316 1.00 43.41 H new ATOM 0 HA TYR A 78 8.245 10.097 5.759 1.00 61.53 H new ATOM 0 HB2 TYR A 78 6.794 7.877 7.228 1.00 32.43 H new ATOM 0 HB3 TYR A 78 5.971 8.855 6.029 1.00 32.43 H new ATOM 0 HD1 TYR A 78 9.218 6.914 6.295 1.00 32.04 H new ATOM 0 HD2 TYR A 78 5.887 7.960 3.843 1.00 63.35 H new ATOM 0 HE1 TYR A 78 10.030 5.420 4.529 1.00 22.35 H new ATOM 0 HE2 TYR A 78 6.695 6.452 2.095 1.00 23.12 H new ATOM 0 HH TYR A 78 8.245 5.008 1.460 1.00 10.54 H new ATOM 1230 N LEU A 79 6.360 11.586 6.648 1.00 60.31 N ATOM 1231 CA LEU A 79 5.425 12.585 7.175 1.00 35.43 C ATOM 1232 C LEU A 79 3.995 12.129 6.896 1.00 13.22 C ATOM 1233 O LEU A 79 3.653 11.803 5.748 1.00 11.25 O ATOM 1234 CB LEU A 79 5.693 13.984 6.554 1.00 1.35 C ATOM 1235 CG LEU A 79 7.005 14.695 7.021 1.00 51.12 C ATOM 1236 CD1 LEU A 79 7.182 16.064 6.325 1.00 71.43 C ATOM 1237 CD2 LEU A 79 7.041 14.843 8.565 1.00 3.04 C ATOM 0 H LEU A 79 6.429 11.589 5.630 1.00 60.31 H new ATOM 0 HA LEU A 79 5.570 12.676 8.252 1.00 35.43 H new ATOM 0 HB2 LEU A 79 5.725 13.879 5.470 1.00 1.35 H new ATOM 0 HB3 LEU A 79 4.848 14.632 6.787 1.00 1.35 H new ATOM 0 HG LEU A 79 7.844 14.065 6.726 1.00 51.12 H new ATOM 0 HD11 LEU A 79 8.103 16.532 6.672 1.00 71.43 H new ATOM 0 HD12 LEU A 79 7.232 15.920 5.246 1.00 71.43 H new ATOM 0 HD13 LEU A 79 6.335 16.707 6.566 1.00 71.43 H new ATOM 0 HD21 LEU A 79 7.964 15.341 8.861 1.00 3.04 H new ATOM 0 HD22 LEU A 79 6.188 15.436 8.894 1.00 3.04 H new ATOM 0 HD23 LEU A 79 6.996 13.856 9.026 1.00 3.04 H new ATOM 1249 N HIS A 80 3.170 12.073 7.963 1.00 10.10 N ATOM 1250 CA HIS A 80 1.742 11.796 7.837 1.00 4.34 C ATOM 1251 C HIS A 80 1.069 13.023 7.248 1.00 12.15 C ATOM 1252 O HIS A 80 0.756 13.991 7.955 1.00 21.01 O ATOM 1253 CB HIS A 80 1.123 11.426 9.208 1.00 10.44 C ATOM 1254 CG HIS A 80 -0.371 11.209 9.183 1.00 35.52 C ATOM 1255 ND1 HIS A 80 -1.187 11.740 10.150 1.00 1.45 N ATOM 1256 CD2 HIS A 80 -1.133 10.527 8.291 1.00 71.24 C ATOM 1257 CE1 HIS A 80 -2.410 11.376 9.828 1.00 1.21 C ATOM 1258 NE2 HIS A 80 -2.430 10.634 8.712 1.00 32.33 N ATOM 0 H HIS A 80 3.481 12.219 8.923 1.00 10.10 H new ATOM 0 HA HIS A 80 1.590 10.940 7.179 1.00 4.34 H new ATOM 0 HB2 HIS A 80 1.603 10.519 9.576 1.00 10.44 H new ATOM 0 HB3 HIS A 80 1.350 12.219 9.921 1.00 10.44 H new ATOM 0 HD2 HIS A 80 -0.782 10.000 7.416 1.00 71.24 H new ATOM 0 HE1 HIS A 80 -3.290 11.643 10.394 1.00 1.21 H new ATOM 0 HE2 HIS A 80 -3.252 10.228 8.264 1.00 32.33 H new ATOM 1266 N VAL A 81 0.852 12.962 5.945 1.00 2.23 N ATOM 1267 CA VAL A 81 0.211 14.030 5.202 1.00 54.12 C ATOM 1268 C VAL A 81 -1.276 13.703 5.050 1.00 43.25 C ATOM 1269 O VAL A 81 -2.112 14.397 5.596 1.00 51.21 O ATOM 1270 CB VAL A 81 0.932 14.283 3.822 1.00 52.54 C ATOM 1271 CG1 VAL A 81 2.359 14.850 4.053 1.00 32.31 C ATOM 1272 CG2 VAL A 81 0.994 13.005 2.962 1.00 2.44 C ATOM 0 H VAL A 81 1.118 12.163 5.370 1.00 2.23 H new ATOM 0 HA VAL A 81 0.297 14.968 5.751 1.00 54.12 H new ATOM 0 HB VAL A 81 0.341 15.017 3.274 1.00 52.54 H new ATOM 0 HG11 VAL A 81 2.843 15.019 3.091 1.00 32.31 H new ATOM 0 HG12 VAL A 81 2.292 15.792 4.597 1.00 32.31 H new ATOM 0 HG13 VAL A 81 2.944 14.137 4.634 1.00 32.31 H new ATOM 0 HG21 VAL A 81 1.498 13.224 2.021 1.00 2.44 H new ATOM 0 HG22 VAL A 81 1.545 12.232 3.498 1.00 2.44 H new ATOM 0 HG23 VAL A 81 -0.018 12.654 2.759 1.00 2.44 H new ATOM 1282 N ALA A 82 -1.607 12.563 4.433 1.00 33.21 N ATOM 1283 CA ALA A 82 -2.990 12.263 4.040 1.00 74.25 C ATOM 1284 C ALA A 82 -3.555 11.110 4.861 1.00 71.34 C ATOM 1285 O ALA A 82 -2.817 10.332 5.459 1.00 33.40 O ATOM 1286 CB ALA A 82 -3.062 11.969 2.534 1.00 12.02 C ATOM 0 H ALA A 82 -0.936 11.832 4.195 1.00 33.21 H new ATOM 0 HA ALA A 82 -3.607 13.138 4.245 1.00 74.25 H new ATOM 0 HB1 ALA A 82 -4.092 11.748 2.255 1.00 12.02 H new ATOM 0 HB2 ALA A 82 -2.714 12.838 1.976 1.00 12.02 H new ATOM 0 HB3 ALA A 82 -2.431 11.111 2.300 1.00 12.02 H new ATOM 1292 N THR A 83 -4.883 11.062 4.934 1.00 64.15 N ATOM 1293 CA THR A 83 -5.641 9.954 5.510 1.00 33.22 C ATOM 1294 C THR A 83 -6.836 9.699 4.584 1.00 54.31 C ATOM 1295 O THR A 83 -7.612 10.615 4.292 1.00 13.41 O ATOM 1296 CB THR A 83 -6.132 10.274 6.967 1.00 11.42 C ATOM 1297 OG1 THR A 83 -5.030 10.743 7.752 1.00 65.01 O ATOM 1298 CG2 THR A 83 -6.742 9.041 7.657 1.00 72.51 C ATOM 0 H THR A 83 -5.478 11.813 4.585 1.00 64.15 H new ATOM 0 HA THR A 83 -5.006 9.072 5.588 1.00 33.22 H new ATOM 0 HB THR A 83 -6.906 11.038 6.889 1.00 11.42 H new ATOM 0 HG1 THR A 83 -5.296 10.791 8.694 1.00 65.01 H new ATOM 0 HG21 THR A 83 -7.067 9.310 8.662 1.00 72.51 H new ATOM 0 HG22 THR A 83 -7.597 8.688 7.081 1.00 72.51 H new ATOM 0 HG23 THR A 83 -5.994 8.251 7.717 1.00 72.51 H new ATOM 1306 N LEU A 84 -6.959 8.462 4.106 1.00 54.53 N ATOM 1307 CA LEU A 84 -7.940 8.079 3.099 1.00 32.05 C ATOM 1308 C LEU A 84 -9.191 7.601 3.844 1.00 63.25 C ATOM 1309 O LEU A 84 -9.208 6.505 4.399 1.00 3.42 O ATOM 1310 CB LEU A 84 -7.331 6.995 2.159 1.00 24.51 C ATOM 1311 CG LEU A 84 -5.892 7.297 1.594 1.00 33.53 C ATOM 1312 CD1 LEU A 84 -5.447 6.216 0.581 1.00 31.33 C ATOM 1313 CD2 LEU A 84 -5.783 8.727 0.985 1.00 34.23 C ATOM 0 H LEU A 84 -6.370 7.688 4.414 1.00 54.53 H new ATOM 0 HA LEU A 84 -8.218 8.914 2.455 1.00 32.05 H new ATOM 0 HB2 LEU A 84 -7.295 6.051 2.702 1.00 24.51 H new ATOM 0 HB3 LEU A 84 -8.007 6.852 1.316 1.00 24.51 H new ATOM 0 HG LEU A 84 -5.207 7.263 2.441 1.00 33.53 H new ATOM 0 HD11 LEU A 84 -4.450 6.454 0.210 1.00 31.33 H new ATOM 0 HD12 LEU A 84 -5.429 5.243 1.072 1.00 31.33 H new ATOM 0 HD13 LEU A 84 -6.148 6.189 -0.253 1.00 31.33 H new ATOM 0 HD21 LEU A 84 -4.772 8.886 0.609 1.00 34.23 H new ATOM 0 HD22 LEU A 84 -6.495 8.829 0.166 1.00 34.23 H new ATOM 0 HD23 LEU A 84 -6.006 9.468 1.753 1.00 34.23 H new ATOM 1325 N SER A 85 -10.185 8.486 3.917 1.00 53.51 N ATOM 1326 CA SER A 85 -11.416 8.301 4.689 1.00 64.05 C ATOM 1327 C SER A 85 -12.459 7.492 3.897 1.00 24.12 C ATOM 1328 O SER A 85 -12.822 7.877 2.782 1.00 54.01 O ATOM 1329 CB SER A 85 -11.964 9.696 5.045 1.00 30.01 C ATOM 1330 OG SER A 85 -10.977 10.462 5.717 1.00 72.21 O ATOM 0 H SER A 85 -10.156 9.379 3.426 1.00 53.51 H new ATOM 0 HA SER A 85 -11.200 7.735 5.595 1.00 64.05 H new ATOM 0 HB2 SER A 85 -12.278 10.212 4.138 1.00 30.01 H new ATOM 0 HB3 SER A 85 -12.847 9.596 5.676 1.00 30.01 H new ATOM 0 HG SER A 85 -10.797 11.281 5.210 1.00 72.21 H new ATOM 1336 N PHE A 86 -12.945 6.390 4.486 1.00 75.43 N ATOM 1337 CA PHE A 86 -13.941 5.499 3.864 1.00 4.42 C ATOM 1338 C PHE A 86 -14.649 4.658 4.947 1.00 60.13 C ATOM 1339 O PHE A 86 -14.509 4.920 6.149 1.00 31.41 O ATOM 1340 CB PHE A 86 -13.270 4.600 2.772 1.00 1.21 C ATOM 1341 CG PHE A 86 -12.131 3.683 3.254 1.00 43.04 C ATOM 1342 CD1 PHE A 86 -10.816 4.139 3.287 1.00 45.34 C ATOM 1343 CD2 PHE A 86 -12.377 2.370 3.655 1.00 32.43 C ATOM 1344 CE1 PHE A 86 -9.787 3.323 3.708 1.00 11.22 C ATOM 1345 CE2 PHE A 86 -11.346 1.553 4.075 1.00 63.30 C ATOM 1346 CZ PHE A 86 -10.052 2.031 4.103 1.00 41.31 C ATOM 0 H PHE A 86 -12.656 6.087 5.416 1.00 75.43 H new ATOM 0 HA PHE A 86 -14.698 6.103 3.364 1.00 4.42 H new ATOM 0 HB2 PHE A 86 -14.042 3.978 2.318 1.00 1.21 H new ATOM 0 HB3 PHE A 86 -12.880 5.248 1.987 1.00 1.21 H new ATOM 0 HD1 PHE A 86 -10.598 5.150 2.977 1.00 45.34 H new ATOM 0 HD2 PHE A 86 -13.387 1.987 3.637 1.00 32.43 H new ATOM 0 HE1 PHE A 86 -8.774 3.697 3.728 1.00 11.22 H new ATOM 0 HE2 PHE A 86 -11.553 0.538 4.382 1.00 63.30 H new ATOM 0 HZ PHE A 86 -9.247 1.392 4.435 1.00 41.31 H new ATOM 1356 N ASP A 87 -15.450 3.685 4.512 1.00 55.12 N ATOM 1357 CA ASP A 87 -16.058 2.680 5.399 1.00 22.02 C ATOM 1358 C ASP A 87 -15.779 1.283 4.833 1.00 24.34 C ATOM 1359 O ASP A 87 -15.727 1.099 3.607 1.00 21.21 O ATOM 1360 CB ASP A 87 -17.583 2.933 5.573 1.00 62.43 C ATOM 1361 CG ASP A 87 -18.443 2.634 4.324 1.00 72.44 C ATOM 1362 OD1 ASP A 87 -18.249 3.301 3.288 1.00 1.34 O ATOM 1363 OD2 ASP A 87 -19.314 1.738 4.378 1.00 63.22 O ATOM 0 H ASP A 87 -15.700 3.567 3.530 1.00 55.12 H new ATOM 0 HA ASP A 87 -15.613 2.756 6.391 1.00 22.02 H new ATOM 0 HB2 ASP A 87 -17.945 2.322 6.399 1.00 62.43 H new ATOM 0 HB3 ASP A 87 -17.733 3.974 5.858 1.00 62.43 H new ATOM 1368 N LEU A 88 -15.576 0.315 5.733 1.00 13.14 N ATOM 1369 CA LEU A 88 -15.315 -1.089 5.371 1.00 4.45 C ATOM 1370 C LEU A 88 -15.890 -1.986 6.475 1.00 40.21 C ATOM 1371 O LEU A 88 -15.760 -1.651 7.661 1.00 11.14 O ATOM 1372 CB LEU A 88 -13.790 -1.347 5.190 1.00 35.23 C ATOM 1373 CG LEU A 88 -13.379 -2.792 4.759 1.00 40.14 C ATOM 1374 CD1 LEU A 88 -13.850 -3.119 3.319 1.00 73.33 C ATOM 1375 CD2 LEU A 88 -11.860 -3.003 4.918 1.00 14.42 C ATOM 0 H LEU A 88 -15.587 0.481 6.739 1.00 13.14 H new ATOM 0 HA LEU A 88 -15.794 -1.316 4.419 1.00 4.45 H new ATOM 0 HB2 LEU A 88 -13.410 -0.647 4.446 1.00 35.23 H new ATOM 0 HB3 LEU A 88 -13.290 -1.115 6.130 1.00 35.23 H new ATOM 0 HG LEU A 88 -13.886 -3.490 5.425 1.00 40.14 H new ATOM 0 HD11 LEU A 88 -13.545 -4.132 3.058 1.00 73.33 H new ATOM 0 HD12 LEU A 88 -14.936 -3.042 3.265 1.00 73.33 H new ATOM 0 HD13 LEU A 88 -13.401 -2.413 2.620 1.00 73.33 H new ATOM 0 HD21 LEU A 88 -11.599 -4.016 4.612 1.00 14.42 H new ATOM 0 HD22 LEU A 88 -11.326 -2.286 4.294 1.00 14.42 H new ATOM 0 HD23 LEU A 88 -11.579 -2.856 5.961 1.00 14.42 H new ATOM 1387 N ASP A 89 -16.553 -3.084 6.056 1.00 20.41 N ATOM 1388 CA ASP A 89 -17.127 -4.114 6.946 1.00 14.34 C ATOM 1389 C ASP A 89 -18.380 -3.595 7.687 1.00 12.01 C ATOM 1390 O ASP A 89 -19.506 -3.917 7.315 1.00 3.55 O ATOM 1391 CB ASP A 89 -16.066 -4.678 7.939 1.00 74.34 C ATOM 1392 CG ASP A 89 -16.615 -5.792 8.846 1.00 34.22 C ATOM 1393 OD1 ASP A 89 -16.763 -6.942 8.370 1.00 74.03 O ATOM 1394 OD2 ASP A 89 -16.887 -5.529 10.041 1.00 13.13 O ATOM 0 H ASP A 89 -16.707 -3.283 5.068 1.00 20.41 H new ATOM 0 HA ASP A 89 -17.446 -4.942 6.312 1.00 14.34 H new ATOM 0 HB2 ASP A 89 -15.218 -5.064 7.373 1.00 74.34 H new ATOM 0 HB3 ASP A 89 -15.691 -3.865 8.560 1.00 74.34 H new ATOM 1399 N GLY A 90 -18.149 -2.787 8.727 1.00 42.04 N ATOM 1400 CA GLY A 90 -19.206 -2.230 9.564 1.00 44.21 C ATOM 1401 C GLY A 90 -18.696 -1.078 10.421 1.00 52.04 C ATOM 1402 O GLY A 90 -19.280 -0.760 11.462 1.00 35.32 O ATOM 0 H GLY A 90 -17.212 -2.501 9.011 1.00 42.04 H new ATOM 0 HA2 GLY A 90 -20.024 -1.881 8.934 1.00 44.21 H new ATOM 0 HA3 GLY A 90 -19.611 -3.011 10.207 1.00 44.21 H new ATOM 1406 N GLU A 91 -17.592 -0.453 9.966 1.00 10.12 N ATOM 1407 CA GLU A 91 -16.897 0.624 10.698 1.00 14.20 C ATOM 1408 C GLU A 91 -16.307 1.670 9.726 1.00 2.24 C ATOM 1409 O GLU A 91 -16.027 1.368 8.556 1.00 44.24 O ATOM 1410 CB GLU A 91 -15.777 0.008 11.577 1.00 33.34 C ATOM 1411 CG GLU A 91 -14.743 -0.818 10.784 1.00 33.13 C ATOM 1412 CD GLU A 91 -13.617 -1.423 11.635 1.00 35.03 C ATOM 1413 OE1 GLU A 91 -12.889 -0.649 12.307 1.00 32.43 O ATOM 1414 OE2 GLU A 91 -13.415 -2.650 11.591 1.00 1.51 O ATOM 0 H GLU A 91 -17.155 -0.683 9.074 1.00 10.12 H new ATOM 0 HA GLU A 91 -17.618 1.137 11.334 1.00 14.20 H new ATOM 0 HB2 GLU A 91 -15.260 0.810 12.104 1.00 33.34 H new ATOM 0 HB3 GLU A 91 -16.233 -0.629 12.335 1.00 33.34 H new ATOM 0 HG2 GLU A 91 -15.262 -1.625 10.266 1.00 33.13 H new ATOM 0 HG3 GLU A 91 -14.300 -0.181 10.018 1.00 33.13 H new ATOM 1421 N SER A 92 -16.132 2.898 10.249 1.00 71.41 N ATOM 1422 CA SER A 92 -15.500 4.020 9.541 1.00 32.11 C ATOM 1423 C SER A 92 -13.984 3.775 9.447 1.00 24.11 C ATOM 1424 O SER A 92 -13.226 4.077 10.375 1.00 14.22 O ATOM 1425 CB SER A 92 -15.817 5.345 10.284 1.00 33.33 C ATOM 1426 OG SER A 92 -15.236 6.467 9.638 1.00 52.25 O ATOM 0 H SER A 92 -16.433 3.140 11.193 1.00 71.41 H new ATOM 0 HA SER A 92 -15.895 4.098 8.528 1.00 32.11 H new ATOM 0 HB2 SER A 92 -16.897 5.479 10.342 1.00 33.33 H new ATOM 0 HB3 SER A 92 -15.448 5.284 11.308 1.00 33.33 H new ATOM 0 HG SER A 92 -15.459 7.282 10.134 1.00 52.25 H new ATOM 1432 N ARG A 93 -13.561 3.151 8.336 1.00 3.52 N ATOM 1433 CA ARG A 93 -12.151 2.780 8.119 1.00 15.12 C ATOM 1434 C ARG A 93 -11.349 3.864 7.394 1.00 14.05 C ATOM 1435 O ARG A 93 -11.854 4.575 6.533 1.00 31.03 O ATOM 1436 CB ARG A 93 -12.036 1.409 7.399 1.00 44.23 C ATOM 1437 CG ARG A 93 -12.273 0.163 8.286 1.00 34.32 C ATOM 1438 CD ARG A 93 -11.177 -0.057 9.352 1.00 1.24 C ATOM 1439 NE ARG A 93 -11.186 0.962 10.417 1.00 15.44 N ATOM 1440 CZ ARG A 93 -10.166 1.818 10.709 1.00 44.41 C ATOM 1441 NH1 ARG A 93 -9.025 1.762 10.016 1.00 74.10 N ATOM 1442 NH2 ARG A 93 -10.320 2.746 11.642 1.00 62.22 N ATOM 0 H ARG A 93 -14.180 2.891 7.568 1.00 3.52 H new ATOM 0 HA ARG A 93 -11.702 2.684 9.108 1.00 15.12 H new ATOM 0 HB2 ARG A 93 -12.753 1.389 6.578 1.00 44.23 H new ATOM 0 HB3 ARG A 93 -11.043 1.334 6.957 1.00 44.23 H new ATOM 0 HG2 ARG A 93 -13.238 0.261 8.784 1.00 34.32 H new ATOM 0 HG3 ARG A 93 -12.331 -0.720 7.649 1.00 34.32 H new ATOM 0 HD2 ARG A 93 -11.308 -1.042 9.800 1.00 1.24 H new ATOM 0 HD3 ARG A 93 -10.201 -0.056 8.866 1.00 1.24 H new ATOM 0 HE ARG A 93 -12.030 1.033 10.986 1.00 15.44 H new ATOM 0 HH11 ARG A 93 -8.916 1.078 9.267 1.00 74.10 H new ATOM 0 HH12 ARG A 93 -8.263 2.403 10.236 1.00 74.10 H new ATOM 0 HH21 ARG A 93 -11.204 2.822 12.145 1.00 62.22 H new ATOM 0 HH22 ARG A 93 -9.554 3.385 11.857 1.00 62.22 H new ATOM 1456 N ASP A 94 -10.074 3.964 7.778 1.00 54.45 N ATOM 1457 CA ASP A 94 -9.128 4.930 7.200 1.00 61.35 C ATOM 1458 C ASP A 94 -7.722 4.326 7.103 1.00 31.25 C ATOM 1459 O ASP A 94 -7.323 3.507 7.943 1.00 5.23 O ATOM 1460 CB ASP A 94 -9.105 6.228 8.041 1.00 43.12 C ATOM 1461 CG ASP A 94 -8.664 5.989 9.496 1.00 31.11 C ATOM 1462 OD1 ASP A 94 -9.462 5.424 10.273 1.00 54.43 O ATOM 1463 OD2 ASP A 94 -7.540 6.374 9.872 1.00 32.23 O ATOM 0 H ASP A 94 -9.664 3.375 8.503 1.00 54.45 H new ATOM 0 HA ASP A 94 -9.461 5.174 6.191 1.00 61.35 H new ATOM 0 HB2 ASP A 94 -8.430 6.945 7.575 1.00 43.12 H new ATOM 0 HB3 ASP A 94 -10.099 6.676 8.036 1.00 43.12 H new ATOM 1468 N LEU A 95 -7.006 4.727 6.043 1.00 3.14 N ATOM 1469 CA LEU A 95 -5.602 4.342 5.798 1.00 14.32 C ATOM 1470 C LEU A 95 -4.735 5.599 5.715 1.00 45.43 C ATOM 1471 O LEU A 95 -5.052 6.527 4.979 1.00 52.43 O ATOM 1472 CB LEU A 95 -5.471 3.518 4.488 1.00 40.51 C ATOM 1473 CG LEU A 95 -6.193 2.138 4.468 1.00 22.20 C ATOM 1474 CD1 LEU A 95 -5.807 1.337 3.205 1.00 34.43 C ATOM 1475 CD2 LEU A 95 -5.910 1.332 5.759 1.00 35.31 C ATOM 0 H LEU A 95 -7.388 5.336 5.320 1.00 3.14 H new ATOM 0 HA LEU A 95 -5.263 3.718 6.625 1.00 14.32 H new ATOM 0 HB2 LEU A 95 -5.858 4.119 3.665 1.00 40.51 H new ATOM 0 HB3 LEU A 95 -4.412 3.353 4.292 1.00 40.51 H new ATOM 0 HG LEU A 95 -7.267 2.322 4.433 1.00 22.20 H new ATOM 0 HD11 LEU A 95 -6.323 0.377 3.212 1.00 34.43 H new ATOM 0 HD12 LEU A 95 -6.096 1.898 2.316 1.00 34.43 H new ATOM 0 HD13 LEU A 95 -4.730 1.170 3.195 1.00 34.43 H new ATOM 0 HD21 LEU A 95 -6.429 0.375 5.711 1.00 35.31 H new ATOM 0 HD22 LEU A 95 -4.838 1.159 5.852 1.00 35.31 H new ATOM 0 HD23 LEU A 95 -6.264 1.894 6.624 1.00 35.31 H new ATOM 1487 N HIS A 96 -3.619 5.617 6.438 1.00 35.40 N ATOM 1488 CA HIS A 96 -2.766 6.803 6.548 1.00 14.32 C ATOM 1489 C HIS A 96 -1.723 6.783 5.435 1.00 11.15 C ATOM 1490 O HIS A 96 -0.935 5.838 5.328 1.00 11.33 O ATOM 1491 CB HIS A 96 -2.102 6.839 7.940 1.00 23.22 C ATOM 1492 CG HIS A 96 -3.092 6.961 9.070 1.00 45.41 C ATOM 1493 ND1 HIS A 96 -3.173 8.094 9.830 1.00 52.43 N ATOM 1494 CD2 HIS A 96 -4.038 6.086 9.485 1.00 34.11 C ATOM 1495 CE1 HIS A 96 -4.161 7.888 10.676 1.00 54.20 C ATOM 1496 NE2 HIS A 96 -4.717 6.683 10.502 1.00 13.21 N ATOM 0 H HIS A 96 -3.278 4.813 6.965 1.00 35.40 H new ATOM 0 HA HIS A 96 -3.367 7.706 6.438 1.00 14.32 H new ATOM 0 HB2 HIS A 96 -1.514 5.932 8.078 1.00 23.22 H new ATOM 0 HB3 HIS A 96 -1.408 7.678 7.982 1.00 23.22 H new ATOM 0 HD1 HIS A 96 -2.589 8.927 9.757 1.00 52.43 H new ATOM 0 HD2 HIS A 96 -4.220 5.100 9.084 1.00 34.11 H new ATOM 0 HE1 HIS A 96 -4.483 8.603 11.419 1.00 54.20 H new ATOM 1504 N ALA A 97 -1.733 7.832 4.606 1.00 11.13 N ATOM 1505 CA ALA A 97 -0.867 7.968 3.437 1.00 53.23 C ATOM 1506 C ALA A 97 0.289 8.880 3.794 1.00 3.13 C ATOM 1507 O ALA A 97 0.085 10.049 4.155 1.00 21.34 O ATOM 1508 CB ALA A 97 -1.659 8.526 2.246 1.00 52.53 C ATOM 0 H ALA A 97 -2.359 8.627 4.735 1.00 11.13 H new ATOM 0 HA ALA A 97 -0.480 6.991 3.146 1.00 53.23 H new ATOM 0 HB1 ALA A 97 -1.000 8.621 1.383 1.00 52.53 H new ATOM 0 HB2 ALA A 97 -2.478 7.848 2.004 1.00 52.53 H new ATOM 0 HB3 ALA A 97 -2.063 9.505 2.504 1.00 52.53 H new ATOM 1514 N PHE A 98 1.497 8.331 3.719 1.00 31.44 N ATOM 1515 CA PHE A 98 2.718 9.022 4.103 1.00 42.11 C ATOM 1516 C PHE A 98 3.615 9.222 2.879 1.00 1.34 C ATOM 1517 O PHE A 98 3.405 8.606 1.824 1.00 70.20 O ATOM 1518 CB PHE A 98 3.502 8.204 5.160 1.00 22.30 C ATOM 1519 CG PHE A 98 2.700 7.661 6.338 1.00 45.25 C ATOM 1520 CD1 PHE A 98 2.482 8.438 7.457 1.00 73.51 C ATOM 1521 CD2 PHE A 98 2.191 6.362 6.332 1.00 3.34 C ATOM 1522 CE1 PHE A 98 1.782 7.950 8.535 1.00 42.30 C ATOM 1523 CE2 PHE A 98 1.492 5.874 7.414 1.00 4.24 C ATOM 1524 CZ PHE A 98 1.290 6.672 8.516 1.00 51.33 C ATOM 0 H PHE A 98 1.655 7.380 3.385 1.00 31.44 H new ATOM 0 HA PHE A 98 2.439 9.987 4.525 1.00 42.11 H new ATOM 0 HB2 PHE A 98 3.977 7.363 4.655 1.00 22.30 H new ATOM 0 HB3 PHE A 98 4.301 8.833 5.553 1.00 22.30 H new ATOM 0 HD1 PHE A 98 2.868 9.446 7.487 1.00 73.51 H new ATOM 0 HD2 PHE A 98 2.347 5.732 5.469 1.00 3.34 H new ATOM 0 HE1 PHE A 98 1.620 8.576 9.400 1.00 42.30 H new ATOM 0 HE2 PHE A 98 1.103 4.867 7.397 1.00 4.24 H new ATOM 0 HZ PHE A 98 0.744 6.291 9.366 1.00 51.33 H new ATOM 1534 N ARG A 99 4.625 10.075 3.069 1.00 42.04 N ATOM 1535 CA ARG A 99 5.720 10.296 2.119 1.00 73.22 C ATOM 1536 C ARG A 99 6.850 11.009 2.877 1.00 22.44 C ATOM 1537 O ARG A 99 6.563 11.872 3.714 1.00 33.24 O ATOM 1538 CB ARG A 99 5.232 11.087 0.885 1.00 73.41 C ATOM 1539 CG ARG A 99 4.622 12.488 1.167 1.00 55.33 C ATOM 1540 CD ARG A 99 3.320 12.754 0.377 1.00 31.11 C ATOM 1541 NE ARG A 99 3.465 12.693 -1.093 1.00 31.33 N ATOM 1542 CZ ARG A 99 2.609 13.250 -1.974 1.00 5.13 C ATOM 1543 NH1 ARG A 99 1.538 13.921 -1.558 1.00 60.43 N ATOM 1544 NH2 ARG A 99 2.824 13.130 -3.272 1.00 54.21 N ATOM 0 H ARG A 99 4.706 10.646 3.910 1.00 42.04 H new ATOM 0 HA ARG A 99 6.095 9.351 1.727 1.00 73.22 H new ATOM 0 HB2 ARG A 99 6.073 11.210 0.202 1.00 73.41 H new ATOM 0 HB3 ARG A 99 4.485 10.486 0.366 1.00 73.41 H new ATOM 0 HG2 ARG A 99 4.418 12.580 2.234 1.00 55.33 H new ATOM 0 HG3 ARG A 99 5.355 13.254 0.915 1.00 55.33 H new ATOM 0 HD2 ARG A 99 2.569 12.026 0.685 1.00 31.11 H new ATOM 0 HD3 ARG A 99 2.940 13.738 0.650 1.00 31.11 H new ATOM 0 HE ARG A 99 4.271 12.193 -1.468 1.00 31.33 H new ATOM 0 HH11 ARG A 99 1.354 14.020 -0.560 1.00 60.43 H new ATOM 0 HH12 ARG A 99 0.901 14.336 -2.238 1.00 60.43 H new ATOM 0 HH21 ARG A 99 3.638 12.616 -3.609 1.00 54.21 H new ATOM 0 HH22 ARG A 99 2.176 13.552 -3.937 1.00 54.21 H new ATOM 1558 N GLN A 100 8.113 10.631 2.575 1.00 75.01 N ATOM 1559 CA GLN A 100 9.293 10.906 3.433 1.00 44.42 C ATOM 1560 C GLN A 100 9.390 12.376 3.927 1.00 10.43 C ATOM 1561 O GLN A 100 9.170 12.642 5.120 1.00 4.22 O ATOM 1562 CB GLN A 100 10.601 10.452 2.735 1.00 0.31 C ATOM 1563 CG GLN A 100 10.672 8.928 2.458 1.00 14.31 C ATOM 1564 CD GLN A 100 12.044 8.429 1.977 1.00 74.01 C ATOM 1565 OE1 GLN A 100 13.122 9.019 2.481 1.00 44.43 O flip ATOM 1566 NE2 GLN A 100 12.140 7.480 1.200 1.00 20.42 N flip ATOM 0 H GLN A 100 8.346 10.122 1.722 1.00 75.01 H new ATOM 0 HA GLN A 100 9.152 10.311 4.335 1.00 44.42 H new ATOM 0 HB2 GLN A 100 10.702 10.988 1.791 1.00 0.31 H new ATOM 0 HB3 GLN A 100 11.450 10.738 3.356 1.00 0.31 H new ATOM 0 HG2 GLN A 100 10.405 8.393 3.369 1.00 14.31 H new ATOM 0 HG3 GLN A 100 9.924 8.673 1.708 1.00 14.31 H new ATOM 0 HE21 GLN A 100 11.299 7.041 0.825 1.00 20.42 H new ATOM 0 HE22 GLN A 100 13.060 7.132 0.931 1.00 20.42 H new ATOM 1575 N ALA A 101 9.719 13.316 3.023 1.00 23.24 N ATOM 1576 CA ALA A 101 9.753 14.756 3.353 1.00 51.24 C ATOM 1577 C ALA A 101 8.694 15.545 2.546 1.00 73.24 C ATOM 1578 O ALA A 101 7.620 15.866 3.061 1.00 75.04 O ATOM 1579 CB ALA A 101 11.175 15.310 3.115 1.00 33.15 C ATOM 0 H ALA A 101 9.966 13.106 2.056 1.00 23.24 H new ATOM 0 HA ALA A 101 9.503 14.880 4.407 1.00 51.24 H new ATOM 0 HB1 ALA A 101 11.197 16.372 3.359 1.00 33.15 H new ATOM 0 HB2 ALA A 101 11.884 14.777 3.749 1.00 33.15 H new ATOM 0 HB3 ALA A 101 11.449 15.172 2.069 1.00 33.15 H new ATOM 1585 N ALA A 102 8.991 15.807 1.261 1.00 1.33 N ATOM 1586 CA ALA A 102 8.195 16.706 0.400 1.00 62.41 C ATOM 1587 C ALA A 102 7.935 16.064 -0.977 1.00 23.22 C ATOM 1588 O ALA A 102 8.026 16.748 -2.010 1.00 32.22 O ATOM 1589 CB ALA A 102 8.918 18.066 0.279 1.00 52.30 C ATOM 0 H ALA A 102 9.796 15.399 0.785 1.00 1.33 H new ATOM 0 HA ALA A 102 7.218 16.875 0.853 1.00 62.41 H new ATOM 0 HB1 ALA A 102 8.334 18.733 -0.356 1.00 52.30 H new ATOM 0 HB2 ALA A 102 9.027 18.510 1.269 1.00 52.30 H new ATOM 0 HB3 ALA A 102 9.904 17.916 -0.162 1.00 52.30 H new ATOM 1595 N ASP A 103 7.629 14.746 -0.971 1.00 60.22 N ATOM 1596 CA ASP A 103 7.486 13.914 -2.198 1.00 13.41 C ATOM 1597 C ASP A 103 6.587 14.555 -3.267 1.00 10.50 C ATOM 1598 O ASP A 103 5.483 15.014 -2.966 1.00 12.03 O ATOM 1599 CB ASP A 103 6.923 12.518 -1.830 1.00 41.23 C ATOM 1600 CG ASP A 103 6.521 11.646 -3.039 1.00 61.14 C ATOM 1601 OD1 ASP A 103 7.407 10.986 -3.619 1.00 54.20 O ATOM 1602 OD2 ASP A 103 5.321 11.642 -3.423 1.00 65.33 O ATOM 0 H ASP A 103 7.472 14.222 -0.110 1.00 60.22 H new ATOM 0 HA ASP A 103 8.484 13.826 -2.626 1.00 13.41 H new ATOM 0 HB2 ASP A 103 7.671 11.982 -1.245 1.00 41.23 H new ATOM 0 HB3 ASP A 103 6.052 12.650 -1.189 1.00 41.23 H new ATOM 1607 N GLU A 104 7.101 14.559 -4.509 1.00 5.11 N ATOM 1608 CA GLU A 104 6.389 15.020 -5.714 1.00 11.03 C ATOM 1609 C GLU A 104 6.109 13.837 -6.675 1.00 51.33 C ATOM 1610 O GLU A 104 5.397 13.994 -7.677 1.00 11.33 O ATOM 1611 CB GLU A 104 7.241 16.121 -6.403 1.00 31.11 C ATOM 1612 CG GLU A 104 7.557 17.324 -5.491 1.00 54.21 C ATOM 1613 CD GLU A 104 8.356 18.428 -6.194 1.00 71.23 C ATOM 1614 OE1 GLU A 104 7.735 19.339 -6.790 1.00 70.53 O ATOM 1615 OE2 GLU A 104 9.605 18.388 -6.150 1.00 74.02 O ATOM 0 H GLU A 104 8.047 14.234 -4.708 1.00 5.11 H new ATOM 0 HA GLU A 104 5.422 15.438 -5.434 1.00 11.03 H new ATOM 0 HB2 GLU A 104 8.177 15.681 -6.746 1.00 31.11 H new ATOM 0 HB3 GLU A 104 6.712 16.476 -7.288 1.00 31.11 H new ATOM 0 HG2 GLU A 104 6.622 17.743 -5.118 1.00 54.21 H new ATOM 0 HG3 GLU A 104 8.118 16.976 -4.624 1.00 54.21 H new ATOM 1622 N SER A 105 6.637 12.641 -6.324 1.00 0.52 N ATOM 1623 CA SER A 105 6.558 11.412 -7.157 1.00 53.40 C ATOM 1624 C SER A 105 5.221 10.639 -6.959 1.00 64.40 C ATOM 1625 O SER A 105 5.112 9.460 -7.335 1.00 23.50 O ATOM 1626 CB SER A 105 7.779 10.515 -6.828 1.00 62.30 C ATOM 1627 OG SER A 105 7.909 9.436 -7.734 1.00 34.51 O ATOM 0 H SER A 105 7.136 12.498 -5.446 1.00 0.52 H new ATOM 0 HA SER A 105 6.579 11.702 -8.207 1.00 53.40 H new ATOM 0 HB2 SER A 105 8.687 11.118 -6.851 1.00 62.30 H new ATOM 0 HB3 SER A 105 7.680 10.126 -5.815 1.00 62.30 H new ATOM 0 HG SER A 105 7.026 9.049 -7.910 1.00 34.51 H new ATOM 1633 N ARG A 106 4.213 11.335 -6.367 1.00 55.51 N ATOM 1634 CA ARG A 106 2.801 10.857 -6.224 1.00 71.35 C ATOM 1635 C ARG A 106 2.714 9.638 -5.272 1.00 72.11 C ATOM 1636 O ARG A 106 1.668 9.001 -5.167 1.00 4.30 O ATOM 1637 CB ARG A 106 2.158 10.531 -7.626 1.00 10.24 C ATOM 1638 CG ARG A 106 2.423 11.594 -8.724 1.00 52.20 C ATOM 1639 CD ARG A 106 1.892 13.004 -8.389 1.00 22.21 C ATOM 1640 NE ARG A 106 2.661 14.052 -9.100 1.00 54.31 N ATOM 1641 CZ ARG A 106 2.473 14.457 -10.366 1.00 72.10 C ATOM 1642 NH1 ARG A 106 1.522 13.938 -11.122 1.00 44.22 N ATOM 1643 NH2 ARG A 106 3.267 15.379 -10.879 1.00 1.53 N ATOM 0 H ARG A 106 4.357 12.262 -5.967 1.00 55.51 H new ATOM 0 HA ARG A 106 2.225 11.668 -5.779 1.00 71.35 H new ATOM 0 HB2 ARG A 106 2.539 9.570 -7.971 1.00 10.24 H new ATOM 0 HB3 ARG A 106 1.081 10.420 -7.499 1.00 10.24 H new ATOM 0 HG2 ARG A 106 3.497 11.656 -8.901 1.00 52.20 H new ATOM 0 HG3 ARG A 106 1.966 11.259 -9.655 1.00 52.20 H new ATOM 0 HD2 ARG A 106 0.839 13.073 -8.663 1.00 22.21 H new ATOM 0 HD3 ARG A 106 1.953 13.172 -7.314 1.00 22.21 H new ATOM 0 HE ARG A 106 3.406 14.511 -8.576 1.00 54.31 H new ATOM 0 HH11 ARG A 106 0.911 13.213 -10.747 1.00 44.22 H new ATOM 0 HH12 ARG A 106 1.399 14.262 -12.081 1.00 44.22 H new ATOM 0 HH21 ARG A 106 4.017 15.778 -10.314 1.00 1.53 H new ATOM 0 HH22 ARG A 106 3.131 15.692 -11.840 1.00 1.53 H new ATOM 1657 N THR A 107 3.801 9.383 -4.530 1.00 13.04 N ATOM 1658 CA THR A 107 3.966 8.187 -3.713 1.00 12.34 C ATOM 1659 C THR A 107 3.247 8.356 -2.358 1.00 42.42 C ATOM 1660 O THR A 107 3.757 9.006 -1.435 1.00 10.52 O ATOM 1661 CB THR A 107 5.487 7.895 -3.519 1.00 11.43 C ATOM 1662 OG1 THR A 107 6.117 7.848 -4.816 1.00 5.23 O ATOM 1663 CG2 THR A 107 5.753 6.576 -2.764 1.00 70.22 C ATOM 0 H THR A 107 4.599 10.016 -4.485 1.00 13.04 H new ATOM 0 HA THR A 107 3.513 7.335 -4.220 1.00 12.34 H new ATOM 0 HB THR A 107 5.905 8.696 -2.909 1.00 11.43 H new ATOM 0 HG1 THR A 107 5.887 7.006 -5.261 1.00 5.23 H new ATOM 0 HG21 THR A 107 6.828 6.427 -2.660 1.00 70.22 H new ATOM 0 HG22 THR A 107 5.296 6.624 -1.776 1.00 70.22 H new ATOM 0 HG23 THR A 107 5.324 5.744 -3.323 1.00 70.22 H new ATOM 1671 N LEU A 108 2.013 7.836 -2.305 1.00 61.54 N ATOM 1672 CA LEU A 108 1.219 7.721 -1.078 1.00 15.31 C ATOM 1673 C LEU A 108 1.343 6.287 -0.556 1.00 13.41 C ATOM 1674 O LEU A 108 0.820 5.347 -1.161 1.00 41.33 O ATOM 1675 CB LEU A 108 -0.265 8.091 -1.357 1.00 51.12 C ATOM 1676 CG LEU A 108 -0.511 9.540 -1.886 1.00 22.31 C ATOM 1677 CD1 LEU A 108 -2.020 9.797 -2.107 1.00 3.42 C ATOM 1678 CD2 LEU A 108 0.112 10.598 -0.937 1.00 53.25 C ATOM 0 H LEU A 108 1.532 7.478 -3.130 1.00 61.54 H new ATOM 0 HA LEU A 108 1.590 8.414 -0.323 1.00 15.31 H new ATOM 0 HB2 LEU A 108 -0.666 7.385 -2.084 1.00 51.12 H new ATOM 0 HB3 LEU A 108 -0.833 7.958 -0.436 1.00 51.12 H new ATOM 0 HG LEU A 108 -0.013 9.635 -2.851 1.00 22.31 H new ATOM 0 HD11 LEU A 108 -2.166 10.812 -2.475 1.00 3.42 H new ATOM 0 HD12 LEU A 108 -2.407 9.087 -2.838 1.00 3.42 H new ATOM 0 HD13 LEU A 108 -2.552 9.673 -1.164 1.00 3.42 H new ATOM 0 HD21 LEU A 108 -0.076 11.596 -1.332 1.00 53.25 H new ATOM 0 HD22 LEU A 108 -0.337 10.509 0.052 1.00 53.25 H new ATOM 0 HD23 LEU A 108 1.187 10.433 -0.864 1.00 53.25 H new ATOM 1690 N PHE A 109 2.059 6.128 0.553 1.00 20.12 N ATOM 1691 CA PHE A 109 2.321 4.818 1.153 1.00 72.12 C ATOM 1692 C PHE A 109 1.311 4.606 2.290 1.00 72.00 C ATOM 1693 O PHE A 109 1.380 5.307 3.306 1.00 50.44 O ATOM 1694 CB PHE A 109 3.785 4.783 1.669 1.00 55.14 C ATOM 1695 CG PHE A 109 4.242 3.428 2.233 1.00 1.21 C ATOM 1696 CD1 PHE A 109 4.592 2.377 1.381 1.00 73.41 C ATOM 1697 CD2 PHE A 109 4.330 3.212 3.609 1.00 4.15 C ATOM 1698 CE1 PHE A 109 5.018 1.163 1.893 1.00 60.24 C ATOM 1699 CE2 PHE A 109 4.755 1.997 4.119 1.00 42.31 C ATOM 1700 CZ PHE A 109 5.097 0.972 3.259 1.00 45.13 C ATOM 0 H PHE A 109 2.477 6.905 1.065 1.00 20.12 H new ATOM 0 HA PHE A 109 2.205 4.014 0.426 1.00 72.12 H new ATOM 0 HB2 PHE A 109 4.449 5.062 0.851 1.00 55.14 H new ATOM 0 HB3 PHE A 109 3.899 5.540 2.445 1.00 55.14 H new ATOM 0 HD1 PHE A 109 4.530 2.513 0.311 1.00 73.41 H new ATOM 0 HD2 PHE A 109 4.062 4.007 4.289 1.00 4.15 H new ATOM 0 HE1 PHE A 109 5.290 0.362 1.222 1.00 60.24 H new ATOM 0 HE2 PHE A 109 4.819 1.851 5.187 1.00 42.31 H new ATOM 0 HZ PHE A 109 5.426 0.022 3.654 1.00 45.13 H new ATOM 1710 N VAL A 110 0.352 3.671 2.106 1.00 43.42 N ATOM 1711 CA VAL A 110 -0.660 3.356 3.137 1.00 21.35 C ATOM 1712 C VAL A 110 -0.452 1.916 3.666 1.00 73.32 C ATOM 1713 O VAL A 110 -0.858 0.940 3.028 1.00 60.21 O ATOM 1714 CB VAL A 110 -2.169 3.571 2.660 1.00 2.12 C ATOM 1715 CG1 VAL A 110 -2.458 5.043 2.350 1.00 30.34 C ATOM 1716 CG2 VAL A 110 -2.568 2.710 1.449 1.00 73.12 C ATOM 0 H VAL A 110 0.259 3.121 1.252 1.00 43.42 H new ATOM 0 HA VAL A 110 -0.505 4.073 3.943 1.00 21.35 H new ATOM 0 HB VAL A 110 -2.776 3.245 3.504 1.00 2.12 H new ATOM 0 HG11 VAL A 110 -3.494 5.151 2.029 1.00 30.34 H new ATOM 0 HG12 VAL A 110 -2.292 5.643 3.245 1.00 30.34 H new ATOM 0 HG13 VAL A 110 -1.794 5.385 1.556 1.00 30.34 H new ATOM 0 HG21 VAL A 110 -3.606 2.912 1.185 1.00 73.12 H new ATOM 0 HG22 VAL A 110 -1.925 2.952 0.603 1.00 73.12 H new ATOM 0 HG23 VAL A 110 -2.456 1.655 1.700 1.00 73.12 H new ATOM 1726 N PRO A 111 0.237 1.741 4.833 1.00 65.12 N ATOM 1727 CA PRO A 111 0.246 0.443 5.510 1.00 30.43 C ATOM 1728 C PRO A 111 -1.153 0.151 6.090 1.00 0.04 C ATOM 1729 O PRO A 111 -1.905 1.083 6.413 1.00 51.51 O ATOM 1730 CB PRO A 111 1.337 0.611 6.608 1.00 21.31 C ATOM 1731 CG PRO A 111 1.395 2.082 6.881 1.00 31.21 C ATOM 1732 CD PRO A 111 1.049 2.759 5.565 1.00 70.44 C ATOM 0 HA PRO A 111 0.469 -0.403 4.860 1.00 30.43 H new ATOM 0 HB2 PRO A 111 1.079 0.053 7.508 1.00 21.31 H new ATOM 0 HB3 PRO A 111 2.301 0.236 6.266 1.00 21.31 H new ATOM 0 HG2 PRO A 111 0.690 2.363 7.663 1.00 31.21 H new ATOM 0 HG3 PRO A 111 2.386 2.378 7.225 1.00 31.21 H new ATOM 0 HD2 PRO A 111 0.485 3.678 5.726 1.00 70.44 H new ATOM 0 HD3 PRO A 111 1.946 3.029 5.008 1.00 70.44 H new ATOM 1740 N PHE A 112 -1.516 -1.125 6.153 1.00 2.25 N ATOM 1741 CA PHE A 112 -2.739 -1.564 6.834 1.00 63.55 C ATOM 1742 C PHE A 112 -2.495 -2.942 7.429 1.00 74.41 C ATOM 1743 O PHE A 112 -1.725 -3.727 6.882 1.00 54.04 O ATOM 1744 CB PHE A 112 -3.982 -1.571 5.893 1.00 20.44 C ATOM 1745 CG PHE A 112 -4.112 -2.732 4.895 1.00 34.23 C ATOM 1746 CD1 PHE A 112 -3.513 -2.680 3.644 1.00 5.22 C ATOM 1747 CD2 PHE A 112 -4.873 -3.860 5.212 1.00 3.43 C ATOM 1748 CE1 PHE A 112 -3.669 -3.720 2.746 1.00 12.14 C ATOM 1749 CE2 PHE A 112 -5.024 -4.896 4.316 1.00 53.40 C ATOM 1750 CZ PHE A 112 -4.425 -4.828 3.083 1.00 31.05 C ATOM 0 H PHE A 112 -0.977 -1.885 5.737 1.00 2.25 H new ATOM 0 HA PHE A 112 -2.969 -0.850 7.624 1.00 63.55 H new ATOM 0 HB2 PHE A 112 -4.876 -1.563 6.517 1.00 20.44 H new ATOM 0 HB3 PHE A 112 -3.980 -0.640 5.327 1.00 20.44 H new ATOM 0 HD1 PHE A 112 -2.920 -1.820 3.370 1.00 5.22 H new ATOM 0 HD2 PHE A 112 -5.352 -3.921 6.178 1.00 3.43 H new ATOM 0 HE1 PHE A 112 -3.198 -3.667 1.776 1.00 12.14 H new ATOM 0 HE2 PHE A 112 -5.613 -5.761 4.584 1.00 53.40 H new ATOM 0 HZ PHE A 112 -4.544 -5.637 2.378 1.00 31.05 H new ATOM 1760 N ARG A 113 -3.155 -3.240 8.535 1.00 25.31 N ATOM 1761 CA ARG A 113 -3.059 -4.556 9.159 1.00 34.32 C ATOM 1762 C ARG A 113 -4.464 -5.031 9.513 1.00 0.30 C ATOM 1763 O ARG A 113 -5.233 -4.308 10.148 1.00 4.34 O ATOM 1764 CB ARG A 113 -2.156 -4.503 10.408 1.00 74.30 C ATOM 1765 CG ARG A 113 -1.860 -5.892 11.012 1.00 44.34 C ATOM 1766 CD ARG A 113 -1.234 -5.811 12.414 1.00 34.02 C ATOM 1767 NE ARG A 113 -1.003 -7.142 13.003 1.00 3.42 N ATOM 1768 CZ ARG A 113 -1.956 -8.032 13.349 1.00 3.14 C ATOM 1769 NH1 ARG A 113 -3.253 -7.779 13.170 1.00 71.42 N ATOM 1770 NH2 ARG A 113 -1.597 -9.180 13.897 1.00 35.21 N ATOM 0 H ARG A 113 -3.767 -2.587 9.024 1.00 25.31 H new ATOM 0 HA ARG A 113 -2.605 -5.262 8.464 1.00 34.32 H new ATOM 0 HB2 ARG A 113 -1.214 -4.021 10.146 1.00 74.30 H new ATOM 0 HB3 ARG A 113 -2.632 -3.880 11.165 1.00 74.30 H new ATOM 0 HG2 ARG A 113 -2.786 -6.465 11.065 1.00 44.34 H new ATOM 0 HG3 ARG A 113 -1.187 -6.435 10.349 1.00 44.34 H new ATOM 0 HD2 ARG A 113 -0.288 -5.273 12.356 1.00 34.02 H new ATOM 0 HD3 ARG A 113 -1.888 -5.235 13.069 1.00 34.02 H new ATOM 0 HE ARG A 113 -0.034 -7.415 13.164 1.00 3.42 H new ATOM 0 HH11 ARG A 113 -3.548 -6.892 12.761 1.00 71.42 H new ATOM 0 HH12 ARG A 113 -3.950 -8.472 13.442 1.00 71.42 H new ATOM 0 HH21 ARG A 113 -0.610 -9.384 14.053 1.00 35.21 H new ATOM 0 HH22 ARG A 113 -2.307 -9.862 14.163 1.00 35.21 H new ATOM 1784 N ASP A 114 -4.781 -6.254 9.106 1.00 70.05 N ATOM 1785 CA ASP A 114 -6.119 -6.842 9.224 1.00 14.52 C ATOM 1786 C ASP A 114 -6.056 -8.085 10.126 1.00 63.10 C ATOM 1787 O ASP A 114 -4.984 -8.431 10.661 1.00 75.45 O ATOM 1788 CB ASP A 114 -6.650 -7.174 7.804 1.00 21.04 C ATOM 1789 CG ASP A 114 -5.661 -8.022 6.991 1.00 2.23 C ATOM 1790 OD1 ASP A 114 -5.677 -9.256 7.121 1.00 12.01 O ATOM 1791 OD2 ASP A 114 -4.826 -7.457 6.263 1.00 2.13 O ATOM 0 H ASP A 114 -4.103 -6.882 8.674 1.00 70.05 H new ATOM 0 HA ASP A 114 -6.811 -6.138 9.687 1.00 14.52 H new ATOM 0 HB2 ASP A 114 -7.597 -7.707 7.889 1.00 21.04 H new ATOM 0 HB3 ASP A 114 -6.854 -6.246 7.269 1.00 21.04 H new ATOM 1796 N LYS A 115 -7.204 -8.755 10.290 1.00 44.43 N ATOM 1797 CA LYS A 115 -7.345 -9.877 11.243 1.00 54.12 C ATOM 1798 C LYS A 115 -6.978 -11.229 10.591 1.00 11.02 C ATOM 1799 O LYS A 115 -6.748 -12.212 11.299 1.00 2.54 O ATOM 1800 CB LYS A 115 -8.783 -9.910 11.831 1.00 22.44 C ATOM 1801 CG LYS A 115 -9.314 -8.535 12.302 1.00 73.21 C ATOM 1802 CD LYS A 115 -8.506 -7.850 13.436 1.00 35.05 C ATOM 1803 CE LYS A 115 -8.820 -8.393 14.846 1.00 4.43 C ATOM 1804 NZ LYS A 115 -8.318 -9.772 15.060 1.00 32.44 N ATOM 0 H LYS A 115 -8.057 -8.542 9.774 1.00 44.43 H new ATOM 0 HA LYS A 115 -6.642 -9.714 12.060 1.00 54.12 H new ATOM 0 HB2 LYS A 115 -9.462 -10.309 11.077 1.00 22.44 H new ATOM 0 HB3 LYS A 115 -8.802 -10.601 12.674 1.00 22.44 H new ATOM 0 HG2 LYS A 115 -9.340 -7.864 11.444 1.00 73.21 H new ATOM 0 HG3 LYS A 115 -10.343 -8.660 12.640 1.00 73.21 H new ATOM 0 HD2 LYS A 115 -7.442 -7.977 13.238 1.00 35.05 H new ATOM 0 HD3 LYS A 115 -8.708 -6.779 13.417 1.00 35.05 H new ATOM 0 HE2 LYS A 115 -8.378 -7.731 15.591 1.00 4.43 H new ATOM 0 HE3 LYS A 115 -9.898 -8.376 15.004 1.00 4.43 H new ATOM 0 HZ1 LYS A 115 -8.053 -9.894 16.058 1.00 32.44 H new ATOM 0 HZ2 LYS A 115 -9.063 -10.455 14.814 1.00 32.44 H new ATOM 0 HZ3 LYS A 115 -7.486 -9.936 14.458 1.00 32.44 H new ATOM 1818 N THR A 116 -6.923 -11.274 9.242 1.00 34.14 N ATOM 1819 CA THR A 116 -6.463 -12.464 8.501 1.00 73.11 C ATOM 1820 C THR A 116 -4.919 -12.456 8.350 1.00 11.40 C ATOM 1821 O THR A 116 -4.330 -13.485 8.006 1.00 14.13 O ATOM 1822 CB THR A 116 -7.174 -12.596 7.099 1.00 61.05 C ATOM 1823 OG1 THR A 116 -7.326 -11.314 6.489 1.00 24.23 O ATOM 1824 CG2 THR A 116 -8.559 -13.251 7.201 1.00 35.11 C ATOM 0 H THR A 116 -7.194 -10.494 8.643 1.00 34.14 H new ATOM 0 HA THR A 116 -6.743 -13.341 9.084 1.00 73.11 H new ATOM 0 HB THR A 116 -6.532 -13.234 6.492 1.00 61.05 H new ATOM 0 HG1 THR A 116 -6.581 -10.735 6.754 1.00 24.23 H new ATOM 0 HG21 THR A 116 -9.004 -13.317 6.208 1.00 35.11 H new ATOM 0 HG22 THR A 116 -8.458 -14.252 7.621 1.00 35.11 H new ATOM 0 HG23 THR A 116 -9.199 -12.649 7.846 1.00 35.11 H new ATOM 1832 N THR A 117 -4.277 -11.291 8.601 1.00 21.34 N ATOM 1833 CA THR A 117 -2.809 -11.185 8.698 1.00 62.22 C ATOM 1834 C THR A 117 -2.322 -11.949 9.949 1.00 2.12 C ATOM 1835 O THR A 117 -2.898 -11.809 11.029 1.00 64.35 O ATOM 1836 CB THR A 117 -2.327 -9.683 8.733 1.00 5.44 C ATOM 1837 OG1 THR A 117 -2.519 -9.087 7.443 1.00 50.14 O ATOM 1838 CG2 THR A 117 -0.839 -9.531 9.129 1.00 63.41 C ATOM 0 H THR A 117 -4.762 -10.405 8.741 1.00 21.34 H new ATOM 0 HA THR A 117 -2.373 -11.634 7.806 1.00 62.22 H new ATOM 0 HB THR A 117 -2.924 -9.182 9.495 1.00 5.44 H new ATOM 0 HG1 THR A 117 -2.979 -8.228 7.545 1.00 50.14 H new ATOM 0 HG21 THR A 117 -0.570 -8.475 9.135 1.00 63.41 H new ATOM 0 HG22 THR A 117 -0.682 -9.951 10.123 1.00 63.41 H new ATOM 0 HG23 THR A 117 -0.215 -10.061 8.409 1.00 63.41 H new ATOM 1846 N GLY A 118 -1.278 -12.784 9.769 1.00 41.11 N ATOM 1847 CA GLY A 118 -0.709 -13.599 10.848 1.00 14.30 C ATOM 1848 C GLY A 118 -1.523 -14.835 11.204 1.00 72.11 C ATOM 1849 O GLY A 118 -1.091 -15.641 12.029 1.00 53.43 O ATOM 0 H GLY A 118 -0.810 -12.908 8.871 1.00 41.11 H new ATOM 0 HA2 GLY A 118 0.295 -13.912 10.559 1.00 14.30 H new ATOM 0 HA3 GLY A 118 -0.606 -12.979 11.738 1.00 14.30 H new ATOM 1853 N GLN A 119 -2.702 -14.987 10.581 1.00 63.33 N ATOM 1854 CA GLN A 119 -3.659 -16.065 10.896 1.00 3.14 C ATOM 1855 C GLN A 119 -3.879 -16.922 9.637 1.00 14.30 C ATOM 1856 O GLN A 119 -3.478 -18.090 9.582 1.00 73.14 O ATOM 1857 CB GLN A 119 -5.002 -15.451 11.404 1.00 61.52 C ATOM 1858 CG GLN A 119 -4.892 -14.558 12.665 1.00 53.52 C ATOM 1859 CD GLN A 119 -4.450 -15.314 13.927 1.00 73.42 C ATOM 1860 OE1 GLN A 119 -5.283 -15.845 14.660 1.00 0.22 O ATOM 1861 NE2 GLN A 119 -3.155 -15.332 14.205 1.00 22.21 N ATOM 0 H GLN A 119 -3.022 -14.363 9.840 1.00 63.33 H new ATOM 0 HA GLN A 119 -3.262 -16.700 11.688 1.00 3.14 H new ATOM 0 HB2 GLN A 119 -5.439 -14.860 10.599 1.00 61.52 H new ATOM 0 HB3 GLN A 119 -5.696 -16.264 11.615 1.00 61.52 H new ATOM 0 HG2 GLN A 119 -4.183 -13.754 12.468 1.00 53.52 H new ATOM 0 HG3 GLN A 119 -5.859 -14.091 12.853 1.00 53.52 H new ATOM 0 HE21 GLN A 119 -2.492 -14.881 13.575 1.00 22.21 H new ATOM 0 HE22 GLN A 119 -2.821 -15.797 15.049 1.00 22.21 H new ATOM 1870 N GLN A 120 -4.503 -16.307 8.620 1.00 64.23 N ATOM 1871 CA GLN A 120 -4.766 -16.935 7.305 1.00 42.51 C ATOM 1872 C GLN A 120 -3.746 -16.457 6.244 1.00 61.04 C ATOM 1873 O GLN A 120 -3.966 -16.625 5.038 1.00 51.53 O ATOM 1874 CB GLN A 120 -6.217 -16.601 6.869 1.00 42.44 C ATOM 1875 CG GLN A 120 -7.306 -17.150 7.820 1.00 4.13 C ATOM 1876 CD GLN A 120 -8.732 -16.849 7.360 1.00 53.32 C ATOM 1877 OE1 GLN A 120 -9.007 -16.729 6.164 1.00 21.35 O ATOM 1878 NE2 GLN A 120 -9.649 -16.741 8.301 1.00 14.13 N ATOM 0 H GLN A 120 -4.845 -15.348 8.683 1.00 64.23 H new ATOM 0 HA GLN A 120 -4.654 -18.015 7.395 1.00 42.51 H new ATOM 0 HB2 GLN A 120 -6.324 -15.518 6.799 1.00 42.44 H new ATOM 0 HB3 GLN A 120 -6.386 -17.003 5.870 1.00 42.44 H new ATOM 0 HG2 GLN A 120 -7.184 -18.229 7.913 1.00 4.13 H new ATOM 0 HG3 GLN A 120 -7.157 -16.725 8.813 1.00 4.13 H new ATOM 0 HE21 GLN A 120 -9.388 -16.846 9.282 1.00 14.13 H new ATOM 0 HE22 GLN A 120 -10.619 -16.553 8.048 1.00 14.13 H new ATOM 1887 N SER A 121 -2.623 -15.905 6.729 1.00 40.31 N ATOM 1888 CA SER A 121 -1.520 -15.389 5.897 1.00 11.43 C ATOM 1889 C SER A 121 -0.323 -15.054 6.805 1.00 42.34 C ATOM 1890 O SER A 121 -0.410 -15.200 8.031 1.00 73.52 O ATOM 1891 CB SER A 121 -1.964 -14.140 5.080 1.00 42.02 C ATOM 1892 OG SER A 121 -2.315 -13.062 5.928 1.00 73.44 O ATOM 0 H SER A 121 -2.451 -15.802 7.729 1.00 40.31 H new ATOM 0 HA SER A 121 -1.228 -16.154 5.178 1.00 11.43 H new ATOM 0 HB2 SER A 121 -1.156 -13.833 4.415 1.00 42.02 H new ATOM 0 HB3 SER A 121 -2.814 -14.400 4.450 1.00 42.02 H new ATOM 0 HG SER A 121 -2.986 -13.361 6.576 1.00 73.44 H new ATOM 1898 N TYR A 122 0.792 -14.625 6.186 1.00 52.43 N ATOM 1899 CA TYR A 122 1.998 -14.151 6.901 1.00 52.33 C ATOM 1900 C TYR A 122 1.688 -13.002 7.884 1.00 12.43 C ATOM 1901 O TYR A 122 0.743 -12.233 7.692 1.00 51.24 O ATOM 1902 CB TYR A 122 3.077 -13.688 5.884 1.00 20.42 C ATOM 1903 CG TYR A 122 3.968 -14.807 5.332 1.00 52.32 C ATOM 1904 CD1 TYR A 122 4.956 -15.374 6.138 1.00 13.43 C ATOM 1905 CD2 TYR A 122 3.842 -15.281 4.023 1.00 4.52 C ATOM 1906 CE1 TYR A 122 5.777 -16.366 5.666 1.00 24.44 C ATOM 1907 CE2 TYR A 122 4.669 -16.283 3.547 1.00 13.15 C ATOM 1908 CZ TYR A 122 5.633 -16.819 4.380 1.00 72.24 C ATOM 1909 OH TYR A 122 6.459 -17.820 3.929 1.00 14.34 O ATOM 0 H TYR A 122 0.885 -14.596 5.171 1.00 52.43 H new ATOM 0 HA TYR A 122 2.372 -14.992 7.485 1.00 52.33 H new ATOM 0 HB2 TYR A 122 2.580 -13.194 5.049 1.00 20.42 H new ATOM 0 HB3 TYR A 122 3.711 -12.942 6.364 1.00 20.42 H new ATOM 0 HD1 TYR A 122 5.076 -15.025 7.153 1.00 13.43 H new ATOM 0 HD2 TYR A 122 3.089 -14.859 3.374 1.00 4.52 H new ATOM 0 HE1 TYR A 122 6.536 -16.790 6.307 1.00 24.44 H new ATOM 0 HE2 TYR A 122 4.562 -16.643 2.534 1.00 13.15 H new ATOM 0 HH TYR A 122 6.236 -18.034 2.999 1.00 14.34 H new ATOM 1919 N ASP A 123 2.505 -12.908 8.935 1.00 74.33 N ATOM 1920 CA ASP A 123 2.416 -11.845 9.959 1.00 11.42 C ATOM 1921 C ASP A 123 3.251 -10.608 9.559 1.00 3.41 C ATOM 1922 O ASP A 123 3.665 -10.475 8.397 1.00 32.41 O ATOM 1923 CB ASP A 123 2.858 -12.412 11.335 1.00 3.31 C ATOM 1924 CG ASP A 123 4.330 -12.867 11.367 1.00 45.12 C ATOM 1925 OD1 ASP A 123 4.657 -13.890 10.732 1.00 40.24 O ATOM 1926 OD2 ASP A 123 5.157 -12.221 12.045 1.00 53.04 O ATOM 0 H ASP A 123 3.259 -13.572 9.108 1.00 74.33 H new ATOM 0 HA ASP A 123 1.380 -11.513 10.035 1.00 11.42 H new ATOM 0 HB2 ASP A 123 2.705 -11.650 12.099 1.00 3.31 H new ATOM 0 HB3 ASP A 123 2.219 -13.256 11.594 1.00 3.31 H new ATOM 1931 N GLY A 124 3.450 -9.678 10.517 1.00 75.50 N ATOM 1932 CA GLY A 124 4.169 -8.424 10.272 1.00 10.11 C ATOM 1933 C GLY A 124 3.224 -7.273 9.954 1.00 30.10 C ATOM 1934 O GLY A 124 3.364 -6.162 10.485 1.00 61.54 O ATOM 0 H GLY A 124 3.116 -9.781 11.475 1.00 75.50 H new ATOM 0 HA2 GLY A 124 4.765 -8.171 11.149 1.00 10.11 H new ATOM 0 HA3 GLY A 124 4.864 -8.561 9.443 1.00 10.11 H new ATOM 1938 N GLY A 125 2.259 -7.555 9.067 1.00 5.33 N ATOM 1939 CA GLY A 125 1.300 -6.565 8.577 1.00 44.10 C ATOM 1940 C GLY A 125 1.318 -6.517 7.064 1.00 22.10 C ATOM 1941 O GLY A 125 2.172 -7.155 6.430 1.00 1.31 O ATOM 0 H GLY A 125 2.124 -8.484 8.669 1.00 5.33 H new ATOM 0 HA2 GLY A 125 0.299 -6.815 8.927 1.00 44.10 H new ATOM 0 HA3 GLY A 125 1.543 -5.582 8.981 1.00 44.10 H new ATOM 1945 N ARG A 126 0.380 -5.768 6.476 1.00 73.42 N ATOM 1946 CA ARG A 126 0.326 -5.536 5.017 1.00 4.03 C ATOM 1947 C ARG A 126 0.704 -4.073 4.758 1.00 41.21 C ATOM 1948 O ARG A 126 0.674 -3.243 5.681 1.00 52.32 O ATOM 1949 CB ARG A 126 -1.100 -5.816 4.447 1.00 74.25 C ATOM 1950 CG ARG A 126 -1.702 -7.221 4.705 1.00 51.03 C ATOM 1951 CD ARG A 126 -0.920 -8.381 4.048 1.00 31.25 C ATOM 1952 NE ARG A 126 0.303 -8.722 4.798 1.00 74.32 N ATOM 1953 CZ ARG A 126 0.494 -9.848 5.508 1.00 74.24 C ATOM 1954 NH1 ARG A 126 -0.458 -10.778 5.582 1.00 35.45 N ATOM 1955 NH2 ARG A 126 1.617 -10.007 6.187 1.00 41.22 N ATOM 0 H ARG A 126 -0.366 -5.302 6.992 1.00 73.42 H new ATOM 0 HA ARG A 126 1.019 -6.215 4.520 1.00 4.03 H new ATOM 0 HB2 ARG A 126 -1.782 -5.075 4.863 1.00 74.25 H new ATOM 0 HB3 ARG A 126 -1.071 -5.653 3.370 1.00 74.25 H new ATOM 0 HG2 ARG A 126 -1.746 -7.392 5.781 1.00 51.03 H new ATOM 0 HG3 ARG A 126 -2.728 -7.236 4.337 1.00 51.03 H new ATOM 0 HD2 ARG A 126 -1.562 -9.260 3.984 1.00 31.25 H new ATOM 0 HD3 ARG A 126 -0.654 -8.106 3.028 1.00 31.25 H new ATOM 0 HE ARG A 126 1.068 -8.048 4.776 1.00 74.32 H new ATOM 0 HH11 ARG A 126 -1.344 -10.640 5.097 1.00 35.45 H new ATOM 0 HH12 ARG A 126 -0.300 -11.628 6.124 1.00 35.45 H new ATOM 0 HH21 ARG A 126 2.331 -9.279 6.170 1.00 41.22 H new ATOM 0 HH22 ARG A 126 1.770 -10.858 6.728 1.00 41.22 H new ATOM 1969 N TYR A 127 1.095 -3.754 3.517 1.00 3.22 N ATOM 1970 CA TYR A 127 1.200 -2.359 3.079 1.00 52.24 C ATOM 1971 C TYR A 127 0.862 -2.203 1.590 1.00 75.11 C ATOM 1972 O TYR A 127 1.372 -2.917 0.719 1.00 64.12 O ATOM 1973 CB TYR A 127 2.565 -1.684 3.464 1.00 75.34 C ATOM 1974 CG TYR A 127 3.820 -2.574 3.564 1.00 45.52 C ATOM 1975 CD1 TYR A 127 4.096 -3.293 4.735 1.00 42.41 C ATOM 1976 CD2 TYR A 127 4.761 -2.639 2.536 1.00 1.23 C ATOM 1977 CE1 TYR A 127 5.245 -4.043 4.865 1.00 31.45 C ATOM 1978 CE2 TYR A 127 5.914 -3.382 2.672 1.00 11.23 C ATOM 1979 CZ TYR A 127 6.151 -4.081 3.838 1.00 21.44 C ATOM 1980 OH TYR A 127 7.302 -4.820 3.973 1.00 53.51 O ATOM 0 H TYR A 127 1.342 -4.440 2.804 1.00 3.22 H new ATOM 0 HA TYR A 127 0.443 -1.808 3.638 1.00 52.24 H new ATOM 0 HB2 TYR A 127 2.769 -0.904 2.730 1.00 75.34 H new ATOM 0 HB3 TYR A 127 2.431 -1.189 4.426 1.00 75.34 H new ATOM 0 HD1 TYR A 127 3.393 -3.259 5.554 1.00 42.41 H new ATOM 0 HD2 TYR A 127 4.583 -2.098 1.618 1.00 1.23 H new ATOM 0 HE1 TYR A 127 5.430 -4.598 5.773 1.00 31.45 H new ATOM 0 HE2 TYR A 127 6.632 -3.417 1.866 1.00 11.23 H new ATOM 0 HH TYR A 127 7.547 -4.873 4.920 1.00 53.51 H new ATOM 1990 N MET A 128 -0.050 -1.258 1.362 1.00 64.12 N ATOM 1991 CA MET A 128 -0.487 -0.778 0.055 1.00 32.42 C ATOM 1992 C MET A 128 0.329 0.478 -0.302 1.00 62.43 C ATOM 1993 O MET A 128 0.801 1.198 0.589 1.00 24.30 O ATOM 1994 CB MET A 128 -2.009 -0.438 0.142 1.00 50.54 C ATOM 1995 CG MET A 128 -2.984 -1.606 -0.080 1.00 11.43 C ATOM 1996 SD MET A 128 -3.368 -1.880 -1.820 1.00 75.15 S ATOM 1997 CE MET A 128 -4.260 -0.373 -2.223 1.00 2.43 C ATOM 0 H MET A 128 -0.528 -0.782 2.127 1.00 64.12 H new ATOM 0 HA MET A 128 -0.332 -1.533 -0.716 1.00 32.42 H new ATOM 0 HB2 MET A 128 -2.208 -0.009 1.124 1.00 50.54 H new ATOM 0 HB3 MET A 128 -2.229 0.335 -0.594 1.00 50.54 H new ATOM 0 HG2 MET A 128 -2.554 -2.516 0.339 1.00 11.43 H new ATOM 0 HG3 MET A 128 -3.908 -1.410 0.464 1.00 11.43 H new ATOM 0 HE1 MET A 128 -4.925 -0.558 -3.067 1.00 2.43 H new ATOM 0 HE2 MET A 128 -4.847 -0.056 -1.361 1.00 2.43 H new ATOM 0 HE3 MET A 128 -3.550 0.411 -2.486 1.00 2.43 H new ATOM 2007 N GLU A 129 0.502 0.731 -1.602 1.00 2.12 N ATOM 2008 CA GLU A 129 1.213 1.917 -2.103 1.00 23.41 C ATOM 2009 C GLU A 129 0.563 2.379 -3.421 1.00 12.51 C ATOM 2010 O GLU A 129 0.550 1.640 -4.416 1.00 0.41 O ATOM 2011 CB GLU A 129 2.718 1.576 -2.283 1.00 54.32 C ATOM 2012 CG GLU A 129 3.593 2.730 -2.812 1.00 33.31 C ATOM 2013 CD GLU A 129 5.090 2.371 -2.897 1.00 30.01 C ATOM 2014 OE1 GLU A 129 5.424 1.228 -3.289 1.00 32.20 O ATOM 2015 OE2 GLU A 129 5.938 3.227 -2.596 1.00 34.14 O ATOM 0 H GLU A 129 0.153 0.120 -2.341 1.00 2.12 H new ATOM 0 HA GLU A 129 1.141 2.738 -1.390 1.00 23.41 H new ATOM 0 HB2 GLU A 129 3.117 1.249 -1.323 1.00 54.32 H new ATOM 0 HB3 GLU A 129 2.804 0.733 -2.968 1.00 54.32 H new ATOM 0 HG2 GLU A 129 3.240 3.021 -3.801 1.00 33.31 H new ATOM 0 HG3 GLU A 129 3.471 3.597 -2.162 1.00 33.31 H new ATOM 2022 N LEU A 130 0.010 3.606 -3.402 1.00 41.42 N ATOM 2023 CA LEU A 130 -0.728 4.195 -4.533 1.00 21.21 C ATOM 2024 C LEU A 130 0.099 5.340 -5.122 1.00 43.44 C ATOM 2025 O LEU A 130 0.741 6.096 -4.383 1.00 21.35 O ATOM 2026 CB LEU A 130 -2.141 4.731 -4.100 1.00 23.15 C ATOM 2027 CG LEU A 130 -2.892 3.917 -2.987 1.00 31.11 C ATOM 2028 CD1 LEU A 130 -2.445 4.365 -1.581 1.00 14.43 C ATOM 2029 CD2 LEU A 130 -4.421 4.015 -3.133 1.00 52.14 C ATOM 0 H LEU A 130 0.064 4.223 -2.591 1.00 41.42 H new ATOM 0 HA LEU A 130 -0.889 3.415 -5.277 1.00 21.21 H new ATOM 0 HB2 LEU A 130 -2.024 5.757 -3.751 1.00 23.15 H new ATOM 0 HB3 LEU A 130 -2.777 4.766 -4.984 1.00 23.15 H new ATOM 0 HG LEU A 130 -2.622 2.869 -3.117 1.00 31.11 H new ATOM 0 HD11 LEU A 130 -2.980 3.786 -0.828 1.00 14.43 H new ATOM 0 HD12 LEU A 130 -1.373 4.202 -1.471 1.00 14.43 H new ATOM 0 HD13 LEU A 130 -2.666 5.424 -1.449 1.00 14.43 H new ATOM 0 HD21 LEU A 130 -4.900 3.437 -2.342 1.00 52.14 H new ATOM 0 HD22 LEU A 130 -4.728 5.058 -3.057 1.00 52.14 H new ATOM 0 HD23 LEU A 130 -4.720 3.619 -4.104 1.00 52.14 H new ATOM 2041 N GLU A 131 0.063 5.462 -6.452 1.00 41.52 N ATOM 2042 CA GLU A 131 0.699 6.564 -7.190 1.00 43.21 C ATOM 2043 C GLU A 131 -0.306 7.086 -8.245 1.00 53.53 C ATOM 2044 O GLU A 131 -0.348 6.572 -9.368 1.00 71.42 O ATOM 2045 CB GLU A 131 2.058 6.118 -7.821 1.00 41.14 C ATOM 2046 CG GLU A 131 3.175 5.835 -6.778 1.00 1.10 C ATOM 2047 CD GLU A 131 4.550 5.466 -7.356 1.00 45.53 C ATOM 2048 OE1 GLU A 131 4.746 5.511 -8.590 1.00 75.32 O ATOM 2049 OE2 GLU A 131 5.457 5.125 -6.565 1.00 54.44 O ATOM 0 H GLU A 131 -0.413 4.792 -7.056 1.00 41.52 H new ATOM 0 HA GLU A 131 0.947 7.378 -6.509 1.00 43.21 H new ATOM 0 HB2 GLU A 131 1.894 5.219 -8.415 1.00 41.14 H new ATOM 0 HB3 GLU A 131 2.402 6.894 -8.505 1.00 41.14 H new ATOM 0 HG2 GLU A 131 3.291 6.718 -6.149 1.00 1.10 H new ATOM 0 HG3 GLU A 131 2.844 5.023 -6.130 1.00 1.10 H new ATOM 2056 N PRO A 132 -1.196 8.073 -7.840 1.00 54.53 N ATOM 2057 CA PRO A 132 -2.226 8.689 -8.737 1.00 31.53 C ATOM 2058 C PRO A 132 -1.619 9.454 -9.933 1.00 53.12 C ATOM 2059 O PRO A 132 -0.409 9.693 -9.976 1.00 34.43 O ATOM 2060 CB PRO A 132 -2.978 9.667 -7.785 1.00 1.42 C ATOM 2061 CG PRO A 132 -1.997 9.952 -6.690 1.00 1.52 C ATOM 2062 CD PRO A 132 -1.281 8.652 -6.465 1.00 4.22 C ATOM 0 HA PRO A 132 -2.861 7.933 -9.199 1.00 31.53 H new ATOM 0 HB2 PRO A 132 -3.270 10.580 -8.304 1.00 1.42 H new ATOM 0 HB3 PRO A 132 -3.890 9.217 -7.394 1.00 1.42 H new ATOM 0 HG2 PRO A 132 -1.302 10.741 -6.978 1.00 1.52 H new ATOM 0 HG3 PRO A 132 -2.502 10.287 -5.784 1.00 1.52 H new ATOM 0 HD2 PRO A 132 -0.293 8.805 -6.030 1.00 4.22 H new ATOM 0 HD3 PRO A 132 -1.831 8.000 -5.786 1.00 4.22 H new ATOM 2070 N ASP A 133 -2.501 9.861 -10.874 1.00 45.23 N ATOM 2071 CA ASP A 133 -2.124 10.627 -12.084 1.00 13.51 C ATOM 2072 C ASP A 133 -1.516 11.971 -11.672 1.00 62.11 C ATOM 2073 O ASP A 133 -0.391 12.298 -12.050 1.00 2.32 O ATOM 2074 CB ASP A 133 -3.371 10.847 -12.990 1.00 71.23 C ATOM 2075 CG ASP A 133 -3.102 11.760 -14.208 1.00 10.42 C ATOM 2076 OD1 ASP A 133 -2.515 11.288 -15.206 1.00 11.32 O ATOM 2077 OD2 ASP A 133 -3.459 12.959 -14.161 1.00 34.03 O ATOM 0 H ASP A 133 -3.500 9.666 -10.815 1.00 45.23 H new ATOM 0 HA ASP A 133 -1.383 10.063 -12.651 1.00 13.51 H new ATOM 0 HB2 ASP A 133 -3.727 9.879 -13.344 1.00 71.23 H new ATOM 0 HB3 ASP A 133 -4.172 11.281 -12.391 1.00 71.23 H new ATOM 2082 N ARG A 134 -2.280 12.734 -10.884 1.00 22.44 N ATOM 2083 CA ARG A 134 -1.828 14.009 -10.304 1.00 1.42 C ATOM 2084 C ARG A 134 -1.757 13.879 -8.770 1.00 63.30 C ATOM 2085 O ARG A 134 -2.101 12.826 -8.221 1.00 52.41 O ATOM 2086 CB ARG A 134 -2.773 15.158 -10.772 1.00 4.02 C ATOM 2087 CG ARG A 134 -4.279 15.007 -10.374 1.00 12.53 C ATOM 2088 CD ARG A 134 -4.670 15.830 -9.127 1.00 43.22 C ATOM 2089 NE ARG A 134 -6.087 15.681 -8.737 1.00 5.52 N ATOM 2090 CZ ARG A 134 -7.138 16.277 -9.330 1.00 62.43 C ATOM 2091 NH1 ARG A 134 -6.982 17.083 -10.377 1.00 72.23 N ATOM 2092 NH2 ARG A 134 -8.350 16.081 -8.839 1.00 11.03 N ATOM 0 H ARG A 134 -3.235 12.486 -10.627 1.00 22.44 H new ATOM 0 HA ARG A 134 -0.825 14.256 -10.652 1.00 1.42 H new ATOM 0 HB2 ARG A 134 -2.401 16.098 -10.363 1.00 4.02 H new ATOM 0 HB3 ARG A 134 -2.710 15.235 -11.857 1.00 4.02 H new ATOM 0 HG2 ARG A 134 -4.902 15.316 -11.214 1.00 12.53 H new ATOM 0 HG3 ARG A 134 -4.494 13.955 -10.188 1.00 12.53 H new ATOM 0 HD2 ARG A 134 -4.039 15.528 -8.291 1.00 43.22 H new ATOM 0 HD3 ARG A 134 -4.464 16.883 -9.318 1.00 43.22 H new ATOM 0 HE ARG A 134 -6.287 15.070 -7.945 1.00 5.52 H new ATOM 0 HH11 ARG A 134 -6.049 17.262 -10.749 1.00 72.23 H new ATOM 0 HH12 ARG A 134 -7.795 17.522 -10.808 1.00 72.23 H new ATOM 0 HH21 ARG A 134 -8.479 15.485 -8.021 1.00 11.03 H new ATOM 0 HH22 ARG A 134 -9.156 16.526 -9.278 1.00 11.03 H new ATOM 2106 N ASP A 135 -1.330 14.952 -8.085 1.00 2.24 N ATOM 2107 CA ASP A 135 -1.130 14.946 -6.616 1.00 14.14 C ATOM 2108 C ASP A 135 -2.463 15.215 -5.903 1.00 62.01 C ATOM 2109 O ASP A 135 -3.241 16.051 -6.349 1.00 14.45 O ATOM 2110 CB ASP A 135 -0.081 16.005 -6.201 1.00 52.23 C ATOM 2111 CG ASP A 135 0.124 16.089 -4.674 1.00 31.43 C ATOM 2112 OD1 ASP A 135 0.393 15.043 -4.036 1.00 33.11 O ATOM 2113 OD2 ASP A 135 0.023 17.200 -4.116 1.00 52.40 O ATOM 0 H ASP A 135 -1.113 15.846 -8.525 1.00 2.24 H new ATOM 0 HA ASP A 135 -0.760 13.964 -6.322 1.00 14.14 H new ATOM 0 HB2 ASP A 135 0.871 15.770 -6.677 1.00 52.23 H new ATOM 0 HB3 ASP A 135 -0.392 16.981 -6.574 1.00 52.23 H new ATOM 2118 N LEU A 136 -2.696 14.533 -4.772 1.00 73.30 N ATOM 2119 CA LEU A 136 -3.994 14.553 -4.072 1.00 70.23 C ATOM 2120 C LEU A 136 -3.936 15.454 -2.832 1.00 45.42 C ATOM 2121 O LEU A 136 -2.950 15.459 -2.096 1.00 3.41 O ATOM 2122 CB LEU A 136 -4.406 13.115 -3.686 1.00 62.14 C ATOM 2123 CG LEU A 136 -4.522 12.107 -4.873 1.00 52.03 C ATOM 2124 CD1 LEU A 136 -4.893 10.700 -4.366 1.00 4.42 C ATOM 2125 CD2 LEU A 136 -5.521 12.595 -5.955 1.00 34.54 C ATOM 0 H LEU A 136 -1.993 13.952 -4.315 1.00 73.30 H new ATOM 0 HA LEU A 136 -4.745 14.965 -4.746 1.00 70.23 H new ATOM 0 HB2 LEU A 136 -3.679 12.727 -2.972 1.00 62.14 H new ATOM 0 HB3 LEU A 136 -5.366 13.156 -3.172 1.00 62.14 H new ATOM 0 HG LEU A 136 -3.542 12.050 -5.347 1.00 52.03 H new ATOM 0 HD11 LEU A 136 -4.968 10.016 -5.212 1.00 4.42 H new ATOM 0 HD12 LEU A 136 -4.123 10.346 -3.680 1.00 4.42 H new ATOM 0 HD13 LEU A 136 -5.851 10.741 -3.847 1.00 4.42 H new ATOM 0 HD21 LEU A 136 -5.570 11.863 -6.761 1.00 34.54 H new ATOM 0 HD22 LEU A 136 -6.510 12.712 -5.511 1.00 34.54 H new ATOM 0 HD23 LEU A 136 -5.186 13.553 -6.354 1.00 34.54 H new ATOM 2137 N SER A 137 -5.041 16.170 -2.600 1.00 51.24 N ATOM 2138 CA SER A 137 -5.198 17.158 -1.515 1.00 71.53 C ATOM 2139 C SER A 137 -6.477 16.835 -0.718 1.00 3.35 C ATOM 2140 O SER A 137 -7.208 15.895 -1.056 1.00 24.53 O ATOM 2141 CB SER A 137 -5.264 18.585 -2.110 1.00 32.43 C ATOM 2142 OG SER A 137 -4.083 18.877 -2.827 1.00 33.11 O ATOM 0 H SER A 137 -5.878 16.079 -3.176 1.00 51.24 H new ATOM 0 HA SER A 137 -4.342 17.110 -0.842 1.00 71.53 H new ATOM 0 HB2 SER A 137 -6.128 18.671 -2.770 1.00 32.43 H new ATOM 0 HB3 SER A 137 -5.400 19.313 -1.310 1.00 32.43 H new ATOM 0 HG SER A 137 -4.141 19.782 -3.198 1.00 33.11 H new ATOM 2148 N ASP A 138 -6.722 17.599 0.361 1.00 33.23 N ATOM 2149 CA ASP A 138 -7.953 17.478 1.168 1.00 13.20 C ATOM 2150 C ASP A 138 -9.177 17.880 0.321 1.00 53.01 C ATOM 2151 O ASP A 138 -9.439 19.061 0.101 1.00 53.24 O ATOM 2152 CB ASP A 138 -7.844 18.316 2.483 1.00 30.03 C ATOM 2153 CG ASP A 138 -7.451 19.786 2.256 1.00 40.05 C ATOM 2154 OD1 ASP A 138 -6.248 20.054 2.032 1.00 43.15 O ATOM 2155 OD2 ASP A 138 -8.329 20.680 2.334 1.00 24.21 O ATOM 0 H ASP A 138 -6.078 18.314 0.698 1.00 33.23 H new ATOM 0 HA ASP A 138 -8.082 16.438 1.469 1.00 13.20 H new ATOM 0 HB2 ASP A 138 -8.801 18.282 3.004 1.00 30.03 H new ATOM 0 HB3 ASP A 138 -7.108 17.851 3.139 1.00 30.03 H new ATOM 2160 N GLY A 139 -9.877 16.872 -0.213 1.00 1.31 N ATOM 2161 CA GLY A 139 -11.049 17.092 -1.070 1.00 34.43 C ATOM 2162 C GLY A 139 -11.010 16.247 -2.329 1.00 63.41 C ATOM 2163 O GLY A 139 -12.036 16.075 -2.998 1.00 21.01 O ATOM 0 H GLY A 139 -9.650 15.889 -0.065 1.00 1.31 H new ATOM 0 HA2 GLY A 139 -11.955 16.862 -0.509 1.00 34.43 H new ATOM 0 HA3 GLY A 139 -11.103 18.146 -1.344 1.00 34.43 H new ATOM 2167 N ASP A 140 -9.815 15.747 -2.668 1.00 10.41 N ATOM 2168 CA ASP A 140 -9.634 14.731 -3.723 1.00 65.25 C ATOM 2169 C ASP A 140 -10.166 13.383 -3.248 1.00 34.51 C ATOM 2170 O ASP A 140 -10.413 13.192 -2.057 1.00 42.43 O ATOM 2171 CB ASP A 140 -8.139 14.593 -4.111 1.00 43.20 C ATOM 2172 CG ASP A 140 -7.597 15.805 -4.875 1.00 61.44 C ATOM 2173 OD1 ASP A 140 -7.450 16.885 -4.266 1.00 65.45 O ATOM 2174 OD2 ASP A 140 -7.306 15.693 -6.079 1.00 44.02 O ATOM 0 H ASP A 140 -8.944 16.033 -2.221 1.00 10.41 H new ATOM 0 HA ASP A 140 -10.192 15.053 -4.602 1.00 65.25 H new ATOM 0 HB2 ASP A 140 -7.548 14.448 -3.207 1.00 43.20 H new ATOM 0 HB3 ASP A 140 -8.010 13.700 -4.722 1.00 43.20 H new ATOM 2179 N GLU A 141 -10.385 12.467 -4.193 1.00 13.43 N ATOM 2180 CA GLU A 141 -10.714 11.060 -3.897 1.00 71.22 C ATOM 2181 C GLU A 141 -9.669 10.132 -4.537 1.00 40.22 C ATOM 2182 O GLU A 141 -8.897 10.557 -5.408 1.00 34.41 O ATOM 2183 CB GLU A 141 -12.148 10.744 -4.395 1.00 44.44 C ATOM 2184 CG GLU A 141 -13.256 11.467 -3.593 1.00 1.23 C ATOM 2185 CD GLU A 141 -14.631 11.433 -4.271 1.00 21.25 C ATOM 2186 OE1 GLU A 141 -15.201 10.336 -4.423 1.00 75.10 O ATOM 2187 OE2 GLU A 141 -15.135 12.504 -4.679 1.00 61.41 O ATOM 0 H GLU A 141 -10.340 12.675 -5.191 1.00 13.43 H new ATOM 0 HA GLU A 141 -10.689 10.892 -2.820 1.00 71.22 H new ATOM 0 HB2 GLU A 141 -12.229 11.025 -5.445 1.00 44.44 H new ATOM 0 HB3 GLU A 141 -12.314 9.668 -4.339 1.00 44.44 H new ATOM 0 HG2 GLU A 141 -13.336 11.009 -2.607 1.00 1.23 H new ATOM 0 HG3 GLU A 141 -12.962 12.505 -3.440 1.00 1.23 H new ATOM 2194 N ILE A 142 -9.663 8.862 -4.101 1.00 13.12 N ATOM 2195 CA ILE A 142 -8.651 7.871 -4.490 1.00 60.33 C ATOM 2196 C ILE A 142 -9.260 6.448 -4.400 1.00 64.35 C ATOM 2197 O ILE A 142 -10.156 6.188 -3.582 1.00 15.15 O ATOM 2198 CB ILE A 142 -7.361 8.016 -3.593 1.00 50.52 C ATOM 2199 CG1 ILE A 142 -6.234 7.013 -4.016 1.00 34.41 C ATOM 2200 CG2 ILE A 142 -7.704 7.890 -2.086 1.00 13.40 C ATOM 2201 CD1 ILE A 142 -5.706 7.173 -5.448 1.00 3.12 C ATOM 0 H ILE A 142 -10.368 8.493 -3.463 1.00 13.12 H new ATOM 0 HA ILE A 142 -8.345 8.046 -5.521 1.00 60.33 H new ATOM 0 HB ILE A 142 -6.967 9.019 -3.757 1.00 50.52 H new ATOM 0 HG12 ILE A 142 -5.398 7.122 -3.325 1.00 34.41 H new ATOM 0 HG13 ILE A 142 -6.614 5.998 -3.899 1.00 34.41 H new ATOM 0 HG21 ILE A 142 -6.794 7.994 -1.496 1.00 13.40 H new ATOM 0 HG22 ILE A 142 -8.409 8.673 -1.807 1.00 13.40 H new ATOM 0 HG23 ILE A 142 -8.150 6.914 -1.895 1.00 13.40 H new ATOM 0 HD11 ILE A 142 -4.931 6.430 -5.635 1.00 3.12 H new ATOM 0 HD12 ILE A 142 -6.523 7.031 -6.155 1.00 3.12 H new ATOM 0 HD13 ILE A 142 -5.289 8.172 -5.572 1.00 3.12 H new ATOM 2213 N THR A 143 -8.768 5.556 -5.266 1.00 54.30 N ATOM 2214 CA THR A 143 -9.255 4.183 -5.421 1.00 42.54 C ATOM 2215 C THR A 143 -8.426 3.213 -4.551 1.00 3.22 C ATOM 2216 O THR A 143 -7.193 3.241 -4.622 1.00 22.40 O ATOM 2217 CB THR A 143 -9.131 3.798 -6.928 1.00 52.10 C ATOM 2218 OG1 THR A 143 -9.714 4.835 -7.733 1.00 32.42 O ATOM 2219 CG2 THR A 143 -9.831 2.488 -7.245 1.00 44.52 C ATOM 0 H THR A 143 -7.997 5.777 -5.897 1.00 54.30 H new ATOM 0 HA THR A 143 -10.293 4.115 -5.096 1.00 42.54 H new ATOM 0 HB THR A 143 -8.070 3.679 -7.148 1.00 52.10 H new ATOM 0 HG1 THR A 143 -9.636 4.597 -8.680 1.00 32.42 H new ATOM 0 HG21 THR A 143 -9.717 2.262 -8.305 1.00 44.52 H new ATOM 0 HG22 THR A 143 -9.388 1.687 -6.654 1.00 44.52 H new ATOM 0 HG23 THR A 143 -10.891 2.574 -7.004 1.00 44.52 H new ATOM 2227 N LEU A 144 -9.102 2.358 -3.739 1.00 53.40 N ATOM 2228 CA LEU A 144 -8.446 1.470 -2.742 1.00 54.10 C ATOM 2229 C LEU A 144 -8.914 0.015 -2.966 1.00 43.12 C ATOM 2230 O LEU A 144 -9.954 -0.402 -2.448 1.00 60.11 O ATOM 2231 CB LEU A 144 -8.793 1.902 -1.266 1.00 42.14 C ATOM 2232 CG LEU A 144 -7.911 3.003 -0.588 1.00 72.24 C ATOM 2233 CD1 LEU A 144 -6.448 2.525 -0.419 1.00 0.33 C ATOM 2234 CD2 LEU A 144 -7.994 4.350 -1.335 1.00 32.04 C ATOM 0 H LEU A 144 -10.118 2.265 -3.757 1.00 53.40 H new ATOM 0 HA LEU A 144 -7.367 1.549 -2.877 1.00 54.10 H new ATOM 0 HB2 LEU A 144 -9.826 2.250 -1.256 1.00 42.14 H new ATOM 0 HB3 LEU A 144 -8.751 1.011 -0.640 1.00 42.14 H new ATOM 0 HG LEU A 144 -8.315 3.174 0.410 1.00 72.24 H new ATOM 0 HD11 LEU A 144 -5.861 3.312 0.055 1.00 0.33 H new ATOM 0 HD12 LEU A 144 -6.427 1.631 0.204 1.00 0.33 H new ATOM 0 HD13 LEU A 144 -6.025 2.295 -1.397 1.00 0.33 H new ATOM 0 HD21 LEU A 144 -7.367 5.085 -0.830 1.00 32.04 H new ATOM 0 HD22 LEU A 144 -7.647 4.220 -2.360 1.00 32.04 H new ATOM 0 HD23 LEU A 144 -9.027 4.699 -1.343 1.00 32.04 H new ATOM 2246 N ASP A 145 -8.152 -0.736 -3.762 1.00 55.42 N ATOM 2247 CA ASP A 145 -8.321 -2.193 -3.875 1.00 3.32 C ATOM 2248 C ASP A 145 -7.290 -2.836 -2.948 1.00 13.35 C ATOM 2249 O ASP A 145 -6.097 -2.814 -3.249 1.00 42.45 O ATOM 2250 CB ASP A 145 -8.094 -2.698 -5.323 1.00 43.24 C ATOM 2251 CG ASP A 145 -8.953 -2.007 -6.387 1.00 32.01 C ATOM 2252 OD1 ASP A 145 -8.763 -0.788 -6.606 1.00 12.55 O ATOM 2253 OD2 ASP A 145 -9.806 -2.668 -7.022 1.00 50.13 O ATOM 0 H ASP A 145 -7.404 -0.359 -4.344 1.00 55.42 H new ATOM 0 HA ASP A 145 -9.342 -2.459 -3.602 1.00 3.32 H new ATOM 0 HB2 ASP A 145 -7.043 -2.562 -5.580 1.00 43.24 H new ATOM 0 HB3 ASP A 145 -8.294 -3.769 -5.355 1.00 43.24 H new ATOM 2258 N PHE A 146 -7.749 -3.371 -1.805 1.00 42.32 N ATOM 2259 CA PHE A 146 -6.863 -4.025 -0.792 1.00 3.22 C ATOM 2260 C PHE A 146 -6.255 -5.338 -1.311 1.00 53.23 C ATOM 2261 O PHE A 146 -5.374 -5.926 -0.674 1.00 15.35 O ATOM 2262 CB PHE A 146 -7.644 -4.257 0.529 1.00 45.32 C ATOM 2263 CG PHE A 146 -8.329 -2.988 1.037 1.00 32.33 C ATOM 2264 CD1 PHE A 146 -7.619 -1.789 1.127 1.00 1.42 C ATOM 2265 CD2 PHE A 146 -9.676 -2.982 1.375 1.00 51.50 C ATOM 2266 CE1 PHE A 146 -8.238 -0.635 1.546 1.00 51.14 C ATOM 2267 CE2 PHE A 146 -10.297 -1.822 1.790 1.00 11.13 C ATOM 2268 CZ PHE A 146 -9.577 -0.651 1.876 1.00 25.30 C ATOM 0 H PHE A 146 -8.735 -3.370 -1.546 1.00 42.32 H new ATOM 0 HA PHE A 146 -6.029 -3.350 -0.597 1.00 3.22 H new ATOM 0 HB2 PHE A 146 -8.394 -5.032 0.372 1.00 45.32 H new ATOM 0 HB3 PHE A 146 -6.959 -4.626 1.292 1.00 45.32 H new ATOM 0 HD1 PHE A 146 -6.572 -1.768 0.864 1.00 1.42 H new ATOM 0 HD2 PHE A 146 -10.245 -3.898 1.312 1.00 51.50 H new ATOM 0 HE1 PHE A 146 -7.676 0.284 1.617 1.00 51.14 H new ATOM 0 HE2 PHE A 146 -11.346 -1.832 2.047 1.00 11.13 H new ATOM 0 HZ PHE A 146 -10.062 0.257 2.203 1.00 25.30 H new ATOM 2278 N ASN A 147 -6.749 -5.778 -2.472 1.00 2.25 N ATOM 2279 CA ASN A 147 -6.194 -6.911 -3.205 1.00 12.42 C ATOM 2280 C ASN A 147 -4.841 -6.534 -3.841 1.00 60.13 C ATOM 2281 O ASN A 147 -3.949 -7.365 -3.930 1.00 31.20 O ATOM 2282 CB ASN A 147 -7.195 -7.425 -4.273 1.00 13.21 C ATOM 2283 CG ASN A 147 -8.546 -7.846 -3.677 1.00 30.31 C ATOM 2284 OD1 ASN A 147 -9.185 -7.083 -2.951 1.00 1.24 O ATOM 2285 ND2 ASN A 147 -8.983 -9.070 -3.947 1.00 25.30 N ATOM 0 H ASN A 147 -7.554 -5.351 -2.931 1.00 2.25 H new ATOM 0 HA ASN A 147 -6.020 -7.724 -2.500 1.00 12.42 H new ATOM 0 HB2 ASN A 147 -7.359 -6.643 -5.015 1.00 13.21 H new ATOM 0 HB3 ASN A 147 -6.755 -8.274 -4.797 1.00 13.21 H new ATOM 0 HD21 ASN A 147 -9.865 -9.396 -3.551 1.00 25.30 H new ATOM 0 HD22 ASN A 147 -8.437 -9.685 -4.551 1.00 25.30 H new ATOM 2292 N LEU A 148 -4.665 -5.248 -4.199 1.00 64.03 N ATOM 2293 CA LEU A 148 -3.417 -4.745 -4.826 1.00 50.41 C ATOM 2294 C LEU A 148 -2.285 -4.542 -3.775 1.00 45.23 C ATOM 2295 O LEU A 148 -1.237 -3.972 -4.092 1.00 52.43 O ATOM 2296 CB LEU A 148 -3.699 -3.419 -5.599 1.00 20.00 C ATOM 2297 CG LEU A 148 -4.874 -3.456 -6.638 1.00 41.43 C ATOM 2298 CD1 LEU A 148 -5.013 -2.108 -7.396 1.00 4.22 C ATOM 2299 CD2 LEU A 148 -4.767 -4.651 -7.611 1.00 74.03 C ATOM 0 H LEU A 148 -5.376 -4.529 -4.065 1.00 64.03 H new ATOM 0 HA LEU A 148 -3.070 -5.499 -5.533 1.00 50.41 H new ATOM 0 HB2 LEU A 148 -3.911 -2.637 -4.870 1.00 20.00 H new ATOM 0 HB3 LEU A 148 -2.788 -3.128 -6.123 1.00 20.00 H new ATOM 0 HG LEU A 148 -5.789 -3.604 -6.065 1.00 41.43 H new ATOM 0 HD11 LEU A 148 -5.837 -2.173 -8.106 1.00 4.22 H new ATOM 0 HD12 LEU A 148 -5.211 -1.308 -6.683 1.00 4.22 H new ATOM 0 HD13 LEU A 148 -4.088 -1.895 -7.932 1.00 4.22 H new ATOM 0 HD21 LEU A 148 -5.605 -4.629 -8.308 1.00 74.03 H new ATOM 0 HD22 LEU A 148 -3.831 -4.586 -8.166 1.00 74.03 H new ATOM 0 HD23 LEU A 148 -4.790 -5.583 -7.046 1.00 74.03 H new ATOM 2311 N ALA A 149 -2.512 -5.027 -2.533 1.00 40.32 N ATOM 2312 CA ALA A 149 -1.521 -4.976 -1.444 1.00 44.05 C ATOM 2313 C ALA A 149 -0.345 -5.927 -1.725 1.00 35.02 C ATOM 2314 O ALA A 149 -0.524 -7.148 -1.791 1.00 20.53 O ATOM 2315 CB ALA A 149 -2.186 -5.322 -0.099 1.00 45.12 C ATOM 0 H ALA A 149 -3.392 -5.465 -2.261 1.00 40.32 H new ATOM 0 HA ALA A 149 -1.128 -3.961 -1.388 1.00 44.05 H new ATOM 0 HB1 ALA A 149 -1.442 -5.280 0.696 1.00 45.12 H new ATOM 0 HB2 ALA A 149 -2.980 -4.605 0.109 1.00 45.12 H new ATOM 0 HB3 ALA A 149 -2.608 -6.326 -0.149 1.00 45.12 H new ATOM 2321 N TYR A 150 0.861 -5.347 -1.789 1.00 42.52 N ATOM 2322 CA TYR A 150 2.060 -6.029 -2.299 1.00 11.24 C ATOM 2323 C TYR A 150 2.632 -6.936 -1.207 1.00 21.34 C ATOM 2324 O TYR A 150 2.616 -6.553 -0.029 1.00 12.50 O ATOM 2325 CB TYR A 150 3.109 -4.980 -2.760 1.00 24.30 C ATOM 2326 CG TYR A 150 2.515 -3.909 -3.690 1.00 55.42 C ATOM 2327 CD1 TYR A 150 2.011 -4.252 -4.947 1.00 51.34 C ATOM 2328 CD2 TYR A 150 2.423 -2.569 -3.299 1.00 33.10 C ATOM 2329 CE1 TYR A 150 1.448 -3.301 -5.775 1.00 35.22 C ATOM 2330 CE2 TYR A 150 1.862 -1.614 -4.129 1.00 21.55 C ATOM 2331 CZ TYR A 150 1.375 -1.983 -5.367 1.00 52.45 C ATOM 2332 OH TYR A 150 0.807 -1.034 -6.198 1.00 32.44 O ATOM 0 H TYR A 150 1.034 -4.388 -1.488 1.00 42.52 H new ATOM 0 HA TYR A 150 1.797 -6.645 -3.159 1.00 11.24 H new ATOM 0 HB2 TYR A 150 3.540 -4.495 -1.884 1.00 24.30 H new ATOM 0 HB3 TYR A 150 3.923 -5.490 -3.275 1.00 24.30 H new ATOM 0 HD1 TYR A 150 2.063 -5.279 -5.277 1.00 51.34 H new ATOM 0 HD2 TYR A 150 2.797 -2.274 -2.330 1.00 33.10 H new ATOM 0 HE1 TYR A 150 1.064 -3.588 -6.743 1.00 35.22 H new ATOM 0 HE2 TYR A 150 1.805 -0.584 -3.809 1.00 21.55 H new ATOM 0 HH TYR A 150 0.701 -0.192 -5.708 1.00 32.44 H new ATOM 2342 N SER A 151 3.073 -8.151 -1.616 1.00 34.01 N ATOM 2343 CA SER A 151 3.693 -9.155 -0.736 1.00 70.55 C ATOM 2344 C SER A 151 4.805 -8.522 0.147 1.00 75.32 C ATOM 2345 O SER A 151 5.885 -8.177 -0.363 1.00 13.53 O ATOM 2346 CB SER A 151 4.231 -10.331 -1.602 1.00 54.04 C ATOM 2347 OG SER A 151 5.085 -9.876 -2.630 1.00 72.22 O ATOM 0 H SER A 151 3.003 -8.460 -2.586 1.00 34.01 H new ATOM 0 HA SER A 151 2.943 -9.546 -0.049 1.00 70.55 H new ATOM 0 HB2 SER A 151 4.769 -11.034 -0.966 1.00 54.04 H new ATOM 0 HB3 SER A 151 3.393 -10.874 -2.039 1.00 54.04 H new ATOM 0 HG SER A 151 5.636 -9.139 -2.295 1.00 72.22 H new ATOM 2353 N PRO A 152 4.510 -8.315 1.485 1.00 52.22 N ATOM 2354 CA PRO A 152 5.326 -7.451 2.364 1.00 14.30 C ATOM 2355 C PRO A 152 6.764 -7.975 2.563 1.00 13.43 C ATOM 2356 O PRO A 152 6.957 -9.128 2.959 1.00 51.32 O ATOM 2357 CB PRO A 152 4.531 -7.443 3.702 1.00 62.13 C ATOM 2358 CG PRO A 152 3.701 -8.683 3.677 1.00 13.25 C ATOM 2359 CD PRO A 152 3.365 -8.927 2.226 1.00 12.14 C ATOM 0 HA PRO A 152 5.468 -6.458 1.938 1.00 14.30 H new ATOM 0 HB2 PRO A 152 5.204 -7.438 4.559 1.00 62.13 H new ATOM 0 HB3 PRO A 152 3.906 -6.553 3.782 1.00 62.13 H new ATOM 0 HG2 PRO A 152 4.247 -9.527 4.099 1.00 13.25 H new ATOM 0 HG3 PRO A 152 2.796 -8.559 4.272 1.00 13.25 H new ATOM 0 HD2 PRO A 152 3.273 -9.992 2.011 1.00 12.14 H new ATOM 0 HD3 PRO A 152 2.418 -8.463 1.952 1.00 12.14 H new ATOM 2367 N PHE A 153 7.752 -7.104 2.255 1.00 10.03 N ATOM 2368 CA PHE A 153 9.200 -7.335 2.486 1.00 72.34 C ATOM 2369 C PHE A 153 9.497 -7.986 3.857 1.00 3.21 C ATOM 2370 O PHE A 153 10.291 -8.923 3.934 1.00 12.35 O ATOM 2371 CB PHE A 153 9.977 -5.987 2.413 1.00 23.55 C ATOM 2372 CG PHE A 153 9.865 -5.162 1.116 1.00 41.25 C ATOM 2373 CD1 PHE A 153 8.750 -4.369 0.863 1.00 34.42 C ATOM 2374 CD2 PHE A 153 10.906 -5.131 0.190 1.00 34.11 C ATOM 2375 CE1 PHE A 153 8.673 -3.577 -0.268 1.00 1.23 C ATOM 2376 CE2 PHE A 153 10.831 -4.347 -0.944 1.00 40.54 C ATOM 2377 CZ PHE A 153 9.716 -3.567 -1.172 1.00 74.44 C ATOM 0 H PHE A 153 7.561 -6.197 1.828 1.00 10.03 H new ATOM 0 HA PHE A 153 9.525 -8.021 1.704 1.00 72.34 H new ATOM 0 HB2 PHE A 153 9.639 -5.361 3.239 1.00 23.55 H new ATOM 0 HB3 PHE A 153 11.032 -6.199 2.585 1.00 23.55 H new ATOM 0 HD1 PHE A 153 7.928 -4.372 1.564 1.00 34.42 H new ATOM 0 HD2 PHE A 153 11.787 -5.731 0.363 1.00 34.11 H new ATOM 0 HE1 PHE A 153 7.799 -2.968 -0.444 1.00 1.23 H new ATOM 0 HE2 PHE A 153 11.646 -4.344 -1.653 1.00 40.54 H new ATOM 0 HZ PHE A 153 9.659 -2.950 -2.056 1.00 74.44 H new ATOM 2387 N CYS A 154 8.846 -7.461 4.913 1.00 23.31 N ATOM 2388 CA CYS A 154 9.008 -7.928 6.303 1.00 4.11 C ATOM 2389 C CYS A 154 8.703 -9.431 6.441 1.00 33.02 C ATOM 2390 O CYS A 154 9.496 -10.193 7.000 1.00 63.34 O ATOM 2391 CB CYS A 154 8.071 -7.130 7.235 1.00 11.50 C ATOM 2392 SG CYS A 154 8.219 -5.344 7.086 1.00 42.30 S ATOM 0 H CYS A 154 8.184 -6.690 4.823 1.00 23.31 H new ATOM 0 HA CYS A 154 10.048 -7.766 6.586 1.00 4.11 H new ATOM 0 HB2 CYS A 154 7.040 -7.416 7.025 1.00 11.50 H new ATOM 0 HB3 CYS A 154 8.277 -7.414 8.267 1.00 11.50 H new ATOM 0 HG CYS A 154 9.218 -5.055 6.306 1.00 42.30 H new ATOM 2398 N ALA A 155 7.549 -9.834 5.906 1.00 33.12 N ATOM 2399 CA ALA A 155 7.034 -11.210 6.024 1.00 10.31 C ATOM 2400 C ALA A 155 7.885 -12.237 5.254 1.00 54.34 C ATOM 2401 O ALA A 155 7.896 -13.424 5.589 1.00 11.32 O ATOM 2402 CB ALA A 155 5.592 -11.239 5.530 1.00 31.53 C ATOM 0 H ALA A 155 6.937 -9.215 5.374 1.00 33.12 H new ATOM 0 HA ALA A 155 7.085 -11.498 7.074 1.00 10.31 H new ATOM 0 HB1 ALA A 155 5.200 -12.253 5.612 1.00 31.53 H new ATOM 0 HB2 ALA A 155 4.986 -10.565 6.136 1.00 31.53 H new ATOM 0 HB3 ALA A 155 5.558 -10.920 4.488 1.00 31.53 H new ATOM 2408 N TYR A 156 8.570 -11.766 4.207 1.00 55.33 N ATOM 2409 CA TYR A 156 9.397 -12.623 3.331 1.00 13.25 C ATOM 2410 C TYR A 156 10.889 -12.526 3.679 1.00 65.32 C ATOM 2411 O TYR A 156 11.678 -13.372 3.248 1.00 63.54 O ATOM 2412 CB TYR A 156 9.119 -12.281 1.845 1.00 21.15 C ATOM 2413 CG TYR A 156 7.723 -12.737 1.385 1.00 25.12 C ATOM 2414 CD1 TYR A 156 6.600 -11.925 1.539 1.00 75.03 C ATOM 2415 CD2 TYR A 156 7.529 -14.003 0.832 1.00 72.12 C ATOM 2416 CE1 TYR A 156 5.344 -12.358 1.162 1.00 64.23 C ATOM 2417 CE2 TYR A 156 6.276 -14.436 0.445 1.00 24.34 C ATOM 2418 CZ TYR A 156 5.187 -13.611 0.614 1.00 70.22 C ATOM 2419 OH TYR A 156 3.933 -14.050 0.244 1.00 24.11 O ATOM 0 H TYR A 156 8.571 -10.782 3.938 1.00 55.33 H new ATOM 0 HA TYR A 156 9.116 -13.663 3.499 1.00 13.25 H new ATOM 0 HB2 TYR A 156 9.212 -11.205 1.700 1.00 21.15 H new ATOM 0 HB3 TYR A 156 9.876 -12.753 1.219 1.00 21.15 H new ATOM 0 HD1 TYR A 156 6.715 -10.938 1.962 1.00 75.03 H new ATOM 0 HD2 TYR A 156 8.377 -14.659 0.704 1.00 72.12 H new ATOM 0 HE1 TYR A 156 4.487 -11.715 1.297 1.00 64.23 H new ATOM 0 HE2 TYR A 156 6.151 -15.417 0.012 1.00 24.34 H new ATOM 0 HH TYR A 156 3.999 -14.955 -0.126 1.00 24.11 H new ATOM 2429 N SER A 157 11.265 -11.496 4.456 1.00 31.44 N ATOM 2430 CA SER A 157 12.630 -11.296 4.966 1.00 64.52 C ATOM 2431 C SER A 157 12.561 -10.498 6.279 1.00 31.34 C ATOM 2432 O SER A 157 12.214 -9.305 6.277 1.00 44.51 O ATOM 2433 CB SER A 157 13.493 -10.543 3.937 1.00 52.13 C ATOM 2434 OG SER A 157 13.641 -11.269 2.731 1.00 24.32 O ATOM 0 H SER A 157 10.616 -10.767 4.752 1.00 31.44 H new ATOM 0 HA SER A 157 13.090 -12.268 5.146 1.00 64.52 H new ATOM 0 HB2 SER A 157 13.039 -9.575 3.723 1.00 52.13 H new ATOM 0 HB3 SER A 157 14.476 -10.347 4.364 1.00 52.13 H new ATOM 0 HG SER A 157 13.145 -12.112 2.794 1.00 24.32 H new ATOM 2440 N ASP A 158 12.919 -11.159 7.392 1.00 12.42 N ATOM 2441 CA ASP A 158 12.822 -10.594 8.762 1.00 72.31 C ATOM 2442 C ASP A 158 13.865 -9.486 9.014 1.00 64.15 C ATOM 2443 O ASP A 158 13.804 -8.790 10.030 1.00 53.51 O ATOM 2444 CB ASP A 158 12.979 -11.722 9.816 1.00 73.23 C ATOM 2445 CG ASP A 158 11.941 -12.844 9.649 1.00 13.02 C ATOM 2446 OD1 ASP A 158 10.768 -12.649 10.035 1.00 41.32 O ATOM 2447 OD2 ASP A 158 12.292 -13.919 9.109 1.00 2.31 O ATOM 0 H ASP A 158 13.288 -12.110 7.374 1.00 12.42 H new ATOM 0 HA ASP A 158 11.836 -10.139 8.855 1.00 72.31 H new ATOM 0 HB2 ASP A 158 13.980 -12.146 9.741 1.00 73.23 H new ATOM 0 HB3 ASP A 158 12.888 -11.295 10.815 1.00 73.23 H new ATOM 2452 N THR A 159 14.820 -9.350 8.079 1.00 34.14 N ATOM 2453 CA THR A 159 15.853 -8.296 8.105 1.00 71.10 C ATOM 2454 C THR A 159 15.249 -6.888 7.869 1.00 5.10 C ATOM 2455 O THR A 159 15.822 -5.891 8.314 1.00 35.03 O ATOM 2456 CB THR A 159 16.991 -8.588 7.056 1.00 50.11 C ATOM 2457 OG1 THR A 159 17.960 -7.522 7.033 1.00 74.11 O ATOM 2458 CG2 THR A 159 16.434 -8.807 5.639 1.00 40.54 C ATOM 0 H THR A 159 14.899 -9.973 7.276 1.00 34.14 H new ATOM 0 HA THR A 159 16.291 -8.307 9.103 1.00 71.10 H new ATOM 0 HB THR A 159 17.476 -9.510 7.375 1.00 50.11 H new ATOM 0 HG1 THR A 159 17.651 -6.812 6.432 1.00 74.11 H new ATOM 0 HG21 THR A 159 17.256 -9.005 4.951 1.00 40.54 H new ATOM 0 HG22 THR A 159 15.752 -9.657 5.643 1.00 40.54 H new ATOM 0 HG23 THR A 159 15.898 -7.914 5.317 1.00 40.54 H new ATOM 2466 N PHE A 160 14.061 -6.817 7.234 1.00 71.21 N ATOM 2467 CA PHE A 160 13.428 -5.536 6.867 1.00 30.42 C ATOM 2468 C PHE A 160 12.772 -4.914 8.101 1.00 34.40 C ATOM 2469 O PHE A 160 12.003 -5.578 8.802 1.00 14.53 O ATOM 2470 CB PHE A 160 12.398 -5.732 5.724 1.00 35.05 C ATOM 2471 CG PHE A 160 13.049 -5.832 4.342 1.00 33.04 C ATOM 2472 CD1 PHE A 160 13.710 -6.985 3.945 1.00 73.33 C ATOM 2473 CD2 PHE A 160 13.023 -4.753 3.456 1.00 42.51 C ATOM 2474 CE1 PHE A 160 14.320 -7.066 2.708 1.00 25.31 C ATOM 2475 CE2 PHE A 160 13.634 -4.835 2.220 1.00 44.30 C ATOM 2476 CZ PHE A 160 14.282 -5.992 1.844 1.00 53.41 C ATOM 0 H PHE A 160 13.519 -7.638 6.964 1.00 71.21 H new ATOM 0 HA PHE A 160 14.196 -4.856 6.499 1.00 30.42 H new ATOM 0 HB2 PHE A 160 11.821 -6.637 5.914 1.00 35.05 H new ATOM 0 HB3 PHE A 160 11.695 -4.899 5.729 1.00 35.05 H new ATOM 0 HD1 PHE A 160 13.748 -7.833 4.613 1.00 73.33 H new ATOM 0 HD2 PHE A 160 12.518 -3.842 3.741 1.00 42.51 H new ATOM 0 HE1 PHE A 160 14.828 -7.973 2.417 1.00 25.31 H new ATOM 0 HE2 PHE A 160 13.604 -3.991 1.547 1.00 44.30 H new ATOM 0 HZ PHE A 160 14.758 -6.057 0.877 1.00 53.41 H new ATOM 2486 N SER A 161 13.113 -3.641 8.351 1.00 10.31 N ATOM 2487 CA SER A 161 12.628 -2.874 9.497 1.00 1.11 C ATOM 2488 C SER A 161 11.148 -2.544 9.282 1.00 74.34 C ATOM 2489 O SER A 161 10.842 -1.654 8.493 1.00 14.34 O ATOM 2490 CB SER A 161 13.475 -1.580 9.629 1.00 71.10 C ATOM 2491 OG SER A 161 14.861 -1.875 9.621 1.00 22.14 O ATOM 0 H SER A 161 13.744 -3.111 7.750 1.00 10.31 H new ATOM 0 HA SER A 161 12.726 -3.449 10.418 1.00 1.11 H new ATOM 0 HB2 SER A 161 13.239 -0.902 8.809 1.00 71.10 H new ATOM 0 HB3 SER A 161 13.215 -1.064 10.553 1.00 71.10 H new ATOM 0 HG SER A 161 15.373 -1.040 9.592 1.00 22.14 H new ATOM 2497 N CYS A 162 10.239 -3.248 9.985 1.00 54.33 N ATOM 2498 CA CYS A 162 8.790 -3.189 9.704 1.00 34.20 C ATOM 2499 C CYS A 162 8.245 -1.763 9.879 1.00 12.13 C ATOM 2500 O CYS A 162 8.549 -1.126 10.900 1.00 23.50 O ATOM 2501 CB CYS A 162 8.034 -4.158 10.637 1.00 62.11 C ATOM 2502 SG CYS A 162 6.253 -4.230 10.340 1.00 5.33 S ATOM 0 H CYS A 162 10.485 -3.868 10.757 1.00 54.33 H new ATOM 0 HA CYS A 162 8.634 -3.486 8.667 1.00 34.20 H new ATOM 0 HB2 CYS A 162 8.452 -5.158 10.520 1.00 62.11 H new ATOM 0 HB3 CYS A 162 8.207 -3.859 11.671 1.00 62.11 H new ATOM 0 HG CYS A 162 5.708 -5.070 11.169 1.00 5.33 H new ATOM 2508 N PRO A 163 7.464 -1.218 8.884 1.00 1.51 N ATOM 2509 CA PRO A 163 6.976 0.169 8.964 1.00 12.01 C ATOM 2510 C PRO A 163 5.996 0.342 10.145 1.00 0.14 C ATOM 2511 O PRO A 163 4.984 -0.364 10.202 1.00 75.35 O ATOM 2512 CB PRO A 163 6.297 0.387 7.579 1.00 34.23 C ATOM 2513 CG PRO A 163 5.920 -0.973 7.096 1.00 74.32 C ATOM 2514 CD PRO A 163 6.976 -1.909 7.647 1.00 61.42 C ATOM 0 HA PRO A 163 7.761 0.901 9.154 1.00 12.01 H new ATOM 0 HB2 PRO A 163 5.420 1.028 7.670 1.00 34.23 H new ATOM 0 HB3 PRO A 163 6.978 0.875 6.882 1.00 34.23 H new ATOM 0 HG2 PRO A 163 4.927 -1.252 7.448 1.00 74.32 H new ATOM 0 HG3 PRO A 163 5.894 -1.009 6.007 1.00 74.32 H new ATOM 0 HD2 PRO A 163 6.560 -2.890 7.876 1.00 61.42 H new ATOM 0 HD3 PRO A 163 7.784 -2.065 6.932 1.00 61.42 H new ATOM 2522 N LEU A 164 6.354 1.241 11.099 1.00 32.21 N ATOM 2523 CA LEU A 164 5.525 1.562 12.283 1.00 51.00 C ATOM 2524 C LEU A 164 4.089 1.946 11.852 1.00 3.31 C ATOM 2525 O LEU A 164 3.893 3.014 11.270 1.00 13.43 O ATOM 2526 CB LEU A 164 6.220 2.713 13.093 1.00 21.31 C ATOM 2527 CG LEU A 164 5.735 2.992 14.570 1.00 73.30 C ATOM 2528 CD1 LEU A 164 4.348 3.697 14.644 1.00 24.34 C ATOM 2529 CD2 LEU A 164 5.736 1.679 15.403 1.00 71.51 C ATOM 0 H LEU A 164 7.229 1.763 11.065 1.00 32.21 H new ATOM 0 HA LEU A 164 5.439 0.687 12.927 1.00 51.00 H new ATOM 0 HB2 LEU A 164 7.287 2.495 13.130 1.00 21.31 H new ATOM 0 HB3 LEU A 164 6.103 3.636 12.525 1.00 21.31 H new ATOM 0 HG LEU A 164 6.451 3.691 15.003 1.00 73.30 H new ATOM 0 HD11 LEU A 164 4.077 3.858 15.687 1.00 24.34 H new ATOM 0 HD12 LEU A 164 4.400 4.657 14.130 1.00 24.34 H new ATOM 0 HD13 LEU A 164 3.595 3.070 14.166 1.00 24.34 H new ATOM 0 HD21 LEU A 164 5.399 1.892 16.418 1.00 71.51 H new ATOM 0 HD22 LEU A 164 5.064 0.955 14.942 1.00 71.51 H new ATOM 0 HD23 LEU A 164 6.745 1.269 15.434 1.00 71.51 H new ATOM 2541 N PRO A 165 3.063 1.073 12.107 1.00 50.14 N ATOM 2542 CA PRO A 165 1.686 1.363 11.709 1.00 12.40 C ATOM 2543 C PRO A 165 0.918 2.123 12.829 1.00 53.12 C ATOM 2544 O PRO A 165 0.813 1.622 13.953 1.00 71.05 O ATOM 2545 CB PRO A 165 1.125 -0.062 11.454 1.00 52.12 C ATOM 2546 CG PRO A 165 1.875 -0.975 12.397 1.00 22.33 C ATOM 2547 CD PRO A 165 3.159 -0.251 12.794 1.00 73.12 C ATOM 0 HA PRO A 165 1.595 2.019 10.844 1.00 12.40 H new ATOM 0 HB2 PRO A 165 0.052 -0.100 11.644 1.00 52.12 H new ATOM 0 HB3 PRO A 165 1.276 -0.362 10.417 1.00 52.12 H new ATOM 0 HG2 PRO A 165 1.272 -1.200 13.277 1.00 22.33 H new ATOM 0 HG3 PRO A 165 2.102 -1.926 11.914 1.00 22.33 H new ATOM 0 HD2 PRO A 165 3.232 -0.134 13.875 1.00 73.12 H new ATOM 0 HD3 PRO A 165 4.043 -0.803 12.473 1.00 73.12 H new ATOM 2555 N PRO A 166 0.377 3.356 12.541 1.00 25.43 N ATOM 2556 CA PRO A 166 -0.504 4.083 13.489 1.00 14.42 C ATOM 2557 C PRO A 166 -1.818 3.302 13.662 1.00 64.13 C ATOM 2558 O PRO A 166 -2.444 2.987 12.670 1.00 21.41 O ATOM 2559 CB PRO A 166 -0.744 5.449 12.792 1.00 62.11 C ATOM 2560 CG PRO A 166 -0.501 5.181 11.342 1.00 24.15 C ATOM 2561 CD PRO A 166 0.596 4.139 11.294 1.00 14.34 C ATOM 0 HA PRO A 166 -0.080 4.203 14.486 1.00 14.42 H new ATOM 0 HB2 PRO A 166 -1.758 5.809 12.964 1.00 62.11 H new ATOM 0 HB3 PRO A 166 -0.066 6.213 13.173 1.00 62.11 H new ATOM 0 HG2 PRO A 166 -1.406 4.819 10.854 1.00 24.15 H new ATOM 0 HG3 PRO A 166 -0.200 6.090 10.821 1.00 24.15 H new ATOM 0 HD2 PRO A 166 0.517 3.512 10.406 1.00 14.34 H new ATOM 0 HD3 PRO A 166 1.585 4.596 11.274 1.00 14.34 H new ATOM 2569 N GLU A 167 -2.227 3.027 14.913 1.00 11.52 N ATOM 2570 CA GLU A 167 -3.322 2.062 15.240 1.00 13.41 C ATOM 2571 C GLU A 167 -4.649 2.296 14.455 1.00 45.20 C ATOM 2572 O GLU A 167 -5.455 1.377 14.311 1.00 25.12 O ATOM 2573 CB GLU A 167 -3.586 2.073 16.769 1.00 64.22 C ATOM 2574 CG GLU A 167 -2.340 1.796 17.629 1.00 13.25 C ATOM 2575 CD GLU A 167 -2.673 1.641 19.118 1.00 35.14 C ATOM 2576 OE1 GLU A 167 -2.728 2.664 19.838 1.00 32.24 O ATOM 2577 OE2 GLU A 167 -2.903 0.502 19.569 1.00 54.45 O ATOM 0 H GLU A 167 -1.814 3.463 15.737 1.00 11.52 H new ATOM 0 HA GLU A 167 -2.969 1.082 14.918 1.00 13.41 H new ATOM 0 HB2 GLU A 167 -3.997 3.043 17.048 1.00 64.22 H new ATOM 0 HB3 GLU A 167 -4.346 1.326 17.000 1.00 64.22 H new ATOM 0 HG2 GLU A 167 -1.852 0.888 17.273 1.00 13.25 H new ATOM 0 HG3 GLU A 167 -1.628 2.611 17.503 1.00 13.25 H new ATOM 2584 N SER A 168 -4.826 3.512 13.923 1.00 1.15 N ATOM 2585 CA SER A 168 -6.026 3.920 13.156 1.00 2.04 C ATOM 2586 C SER A 168 -6.032 3.385 11.693 1.00 63.11 C ATOM 2587 O SER A 168 -7.052 3.481 11.009 1.00 32.22 O ATOM 2588 CB SER A 168 -6.100 5.461 13.164 1.00 44.32 C ATOM 2589 OG SER A 168 -5.975 5.979 14.484 1.00 71.13 O ATOM 0 H SER A 168 -4.134 4.256 14.011 1.00 1.15 H new ATOM 0 HA SER A 168 -6.901 3.482 13.636 1.00 2.04 H new ATOM 0 HB2 SER A 168 -5.308 5.868 12.535 1.00 44.32 H new ATOM 0 HB3 SER A 168 -7.048 5.784 12.733 1.00 44.32 H new ATOM 0 HG SER A 168 -6.024 6.957 14.457 1.00 71.13 H new ATOM 2595 N ASN A 169 -4.897 2.815 11.233 1.00 13.35 N ATOM 2596 CA ASN A 169 -4.758 2.244 9.862 1.00 70.14 C ATOM 2597 C ASN A 169 -5.100 0.744 9.864 1.00 1.30 C ATOM 2598 O ASN A 169 -5.191 0.110 8.804 1.00 0.24 O ATOM 2599 CB ASN A 169 -3.313 2.460 9.287 1.00 22.21 C ATOM 2600 CG ASN A 169 -2.216 1.525 9.865 1.00 13.22 C ATOM 2601 OD1 ASN A 169 -2.298 1.056 10.988 1.00 10.32 O ATOM 2602 ND2 ASN A 169 -1.175 1.253 9.098 1.00 34.14 N ATOM 0 H ASN A 169 -4.049 2.734 11.795 1.00 13.35 H new ATOM 0 HA ASN A 169 -5.461 2.772 9.218 1.00 70.14 H new ATOM 0 HB2 ASN A 169 -3.347 2.326 8.206 1.00 22.21 H new ATOM 0 HB3 ASN A 169 -3.019 3.493 9.471 1.00 22.21 H new ATOM 0 HD21 ASN A 169 -0.431 0.646 9.444 1.00 34.14 H new ATOM 0 HD22 ASN A 169 -1.115 1.650 8.160 1.00 34.14 H new ATOM 2609 N TRP A 170 -5.283 0.186 11.077 1.00 4.50 N ATOM 2610 CA TRP A 170 -5.592 -1.231 11.258 1.00 62.43 C ATOM 2611 C TRP A 170 -7.057 -1.470 10.883 1.00 5.13 C ATOM 2612 O TRP A 170 -7.955 -0.842 11.456 1.00 50.10 O ATOM 2613 CB TRP A 170 -5.338 -1.691 12.724 1.00 15.15 C ATOM 2614 CG TRP A 170 -3.894 -1.633 13.189 1.00 24.35 C ATOM 2615 CD1 TRP A 170 -2.770 -1.540 12.419 1.00 1.43 C ATOM 2616 CD2 TRP A 170 -3.431 -1.705 14.549 1.00 33.52 C ATOM 2617 NE1 TRP A 170 -1.653 -1.513 13.213 1.00 13.23 N ATOM 2618 CE2 TRP A 170 -2.031 -1.621 14.521 1.00 73.22 C ATOM 2619 CE3 TRP A 170 -4.071 -1.826 15.786 1.00 24.34 C ATOM 2620 CZ2 TRP A 170 -1.258 -1.646 15.681 1.00 14.43 C ATOM 2621 CZ3 TRP A 170 -3.303 -1.858 16.935 1.00 32.12 C ATOM 2622 CH2 TRP A 170 -1.908 -1.769 16.876 1.00 43.11 C ATOM 0 H TRP A 170 -5.219 0.709 11.950 1.00 4.50 H new ATOM 0 HA TRP A 170 -4.936 -1.815 10.613 1.00 62.43 H new ATOM 0 HB2 TRP A 170 -5.940 -1.072 13.389 1.00 15.15 H new ATOM 0 HB3 TRP A 170 -5.695 -2.715 12.831 1.00 15.15 H new ATOM 0 HD1 TRP A 170 -2.762 -1.494 11.340 1.00 1.43 H new ATOM 0 HE1 TRP A 170 -0.693 -1.426 12.880 1.00 13.23 H new ATOM 0 HE3 TRP A 170 -5.147 -1.893 15.843 1.00 24.34 H new ATOM 0 HZ2 TRP A 170 -0.182 -1.571 15.636 1.00 14.43 H new ATOM 0 HZ3 TRP A 170 -3.788 -1.953 17.895 1.00 32.12 H new ATOM 0 HH2 TRP A 170 -1.335 -1.798 17.791 1.00 43.11 H new ATOM 2633 N LEU A 171 -7.286 -2.350 9.905 1.00 1.23 N ATOM 2634 CA LEU A 171 -8.632 -2.783 9.548 1.00 45.50 C ATOM 2635 C LEU A 171 -9.047 -3.841 10.576 1.00 54.50 C ATOM 2636 O LEU A 171 -8.457 -4.932 10.617 1.00 43.14 O ATOM 2637 CB LEU A 171 -8.673 -3.350 8.093 1.00 43.00 C ATOM 2638 CG LEU A 171 -8.056 -2.448 6.965 1.00 50.30 C ATOM 2639 CD1 LEU A 171 -8.243 -3.091 5.568 1.00 73.10 C ATOM 2640 CD2 LEU A 171 -8.617 -1.008 6.990 1.00 34.55 C ATOM 0 H LEU A 171 -6.548 -2.777 9.345 1.00 1.23 H new ATOM 0 HA LEU A 171 -9.327 -1.943 9.566 1.00 45.50 H new ATOM 0 HB2 LEU A 171 -8.151 -4.307 8.086 1.00 43.00 H new ATOM 0 HB3 LEU A 171 -9.713 -3.552 7.836 1.00 43.00 H new ATOM 0 HG LEU A 171 -6.988 -2.378 7.169 1.00 50.30 H new ATOM 0 HD11 LEU A 171 -7.806 -2.443 4.808 1.00 73.10 H new ATOM 0 HD12 LEU A 171 -7.749 -4.062 5.545 1.00 73.10 H new ATOM 0 HD13 LEU A 171 -9.306 -3.220 5.366 1.00 73.10 H new ATOM 0 HD21 LEU A 171 -8.159 -0.425 6.191 1.00 34.55 H new ATOM 0 HD22 LEU A 171 -9.697 -1.036 6.846 1.00 34.55 H new ATOM 0 HD23 LEU A 171 -8.391 -0.546 7.951 1.00 34.55 H new ATOM 2652 N GLU A 172 -10.034 -3.518 11.438 1.00 60.43 N ATOM 2653 CA GLU A 172 -10.472 -4.421 12.526 1.00 2.20 C ATOM 2654 C GLU A 172 -11.552 -5.385 11.985 1.00 42.21 C ATOM 2655 O GLU A 172 -12.647 -5.541 12.537 1.00 55.31 O ATOM 2656 CB GLU A 172 -10.960 -3.575 13.737 1.00 50.35 C ATOM 2657 CG GLU A 172 -11.183 -4.368 15.044 1.00 62.31 C ATOM 2658 CD GLU A 172 -11.477 -3.453 16.240 1.00 2.01 C ATOM 2659 OE1 GLU A 172 -10.537 -2.787 16.734 1.00 52.11 O ATOM 2660 OE2 GLU A 172 -12.645 -3.370 16.682 1.00 41.41 O ATOM 0 H GLU A 172 -10.545 -2.636 11.402 1.00 60.43 H new ATOM 0 HA GLU A 172 -9.643 -5.034 12.881 1.00 2.20 H new ATOM 0 HB2 GLU A 172 -10.230 -2.788 13.928 1.00 50.35 H new ATOM 0 HB3 GLU A 172 -11.894 -3.084 13.464 1.00 50.35 H new ATOM 0 HG2 GLU A 172 -12.013 -5.062 14.908 1.00 62.31 H new ATOM 0 HG3 GLU A 172 -10.298 -4.968 15.258 1.00 62.31 H new ATOM 2667 N THR A 173 -11.189 -6.041 10.883 1.00 24.15 N ATOM 2668 CA THR A 173 -12.021 -6.988 10.164 1.00 0.42 C ATOM 2669 C THR A 173 -11.116 -7.971 9.416 1.00 33.01 C ATOM 2670 O THR A 173 -9.957 -7.645 9.089 1.00 10.24 O ATOM 2671 CB THR A 173 -12.970 -6.269 9.160 1.00 61.30 C ATOM 2672 OG1 THR A 173 -13.764 -7.236 8.462 1.00 21.32 O ATOM 2673 CG2 THR A 173 -12.219 -5.390 8.137 1.00 32.23 C ATOM 0 H THR A 173 -10.271 -5.918 10.456 1.00 24.15 H new ATOM 0 HA THR A 173 -12.646 -7.520 10.882 1.00 0.42 H new ATOM 0 HB THR A 173 -13.603 -5.606 9.750 1.00 61.30 H new ATOM 0 HG1 THR A 173 -13.981 -6.898 7.568 1.00 21.32 H new ATOM 0 HG21 THR A 173 -12.937 -4.917 7.467 1.00 32.23 H new ATOM 0 HG22 THR A 173 -11.654 -4.621 8.664 1.00 32.23 H new ATOM 0 HG23 THR A 173 -11.535 -6.010 7.557 1.00 32.23 H new ATOM 2681 N ALA A 174 -11.634 -9.175 9.178 1.00 15.40 N ATOM 2682 CA ALA A 174 -10.930 -10.210 8.425 1.00 55.03 C ATOM 2683 C ALA A 174 -11.015 -9.871 6.930 1.00 20.22 C ATOM 2684 O ALA A 174 -12.119 -9.726 6.407 1.00 4.24 O ATOM 2685 CB ALA A 174 -11.563 -11.578 8.723 1.00 15.43 C ATOM 0 H ALA A 174 -12.558 -9.460 9.504 1.00 15.40 H new ATOM 0 HA ALA A 174 -9.881 -10.253 8.717 1.00 55.03 H new ATOM 0 HB1 ALA A 174 -11.039 -12.351 8.162 1.00 15.43 H new ATOM 0 HB2 ALA A 174 -11.487 -11.789 9.790 1.00 15.43 H new ATOM 0 HB3 ALA A 174 -12.613 -11.565 8.429 1.00 15.43 H new ATOM 2691 N VAL A 175 -9.855 -9.706 6.261 1.00 61.52 N ATOM 2692 CA VAL A 175 -9.799 -9.391 4.822 1.00 33.31 C ATOM 2693 C VAL A 175 -9.506 -10.687 4.042 1.00 2.11 C ATOM 2694 O VAL A 175 -8.352 -11.078 3.843 1.00 61.41 O ATOM 2695 CB VAL A 175 -8.740 -8.242 4.507 1.00 44.42 C ATOM 2696 CG1 VAL A 175 -8.570 -8.003 2.982 1.00 61.24 C ATOM 2697 CG2 VAL A 175 -9.144 -6.928 5.232 1.00 42.14 C ATOM 0 H VAL A 175 -8.938 -9.787 6.701 1.00 61.52 H new ATOM 0 HA VAL A 175 -10.763 -8.997 4.501 1.00 33.31 H new ATOM 0 HB VAL A 175 -7.772 -8.573 4.884 1.00 44.42 H new ATOM 0 HG11 VAL A 175 -7.839 -7.212 2.817 1.00 61.24 H new ATOM 0 HG12 VAL A 175 -8.225 -8.921 2.506 1.00 61.24 H new ATOM 0 HG13 VAL A 175 -9.527 -7.709 2.551 1.00 61.24 H new ATOM 0 HG21 VAL A 175 -8.413 -6.150 5.010 1.00 42.14 H new ATOM 0 HG22 VAL A 175 -10.128 -6.610 4.888 1.00 42.14 H new ATOM 0 HG23 VAL A 175 -9.174 -7.100 6.308 1.00 42.14 H new ATOM 2707 N THR A 176 -10.589 -11.384 3.665 1.00 4.44 N ATOM 2708 CA THR A 176 -10.541 -12.531 2.761 1.00 20.14 C ATOM 2709 C THR A 176 -10.905 -12.044 1.353 1.00 62.33 C ATOM 2710 O THR A 176 -12.085 -11.898 1.012 1.00 50.10 O ATOM 2711 CB THR A 176 -11.502 -13.676 3.242 1.00 13.35 C ATOM 2712 OG1 THR A 176 -12.802 -13.141 3.564 1.00 64.51 O ATOM 2713 CG2 THR A 176 -10.935 -14.411 4.475 1.00 34.01 C ATOM 0 H THR A 176 -11.531 -11.160 3.986 1.00 4.44 H new ATOM 0 HA THR A 176 -9.537 -12.956 2.753 1.00 20.14 H new ATOM 0 HB THR A 176 -11.591 -14.390 2.423 1.00 13.35 H new ATOM 0 HG1 THR A 176 -13.077 -12.509 2.868 1.00 64.51 H new ATOM 0 HG21 THR A 176 -11.626 -15.197 4.780 1.00 34.01 H new ATOM 0 HG22 THR A 176 -9.971 -14.853 4.223 1.00 34.01 H new ATOM 0 HG23 THR A 176 -10.807 -13.703 5.294 1.00 34.01 H new ATOM 2721 N ALA A 177 -9.861 -11.729 0.581 1.00 53.35 N ATOM 2722 CA ALA A 177 -9.963 -11.205 -0.781 1.00 55.50 C ATOM 2723 C ALA A 177 -8.668 -11.543 -1.518 1.00 62.11 C ATOM 2724 O ALA A 177 -7.584 -11.452 -0.926 1.00 33.21 O ATOM 2725 CB ALA A 177 -10.209 -9.687 -0.761 1.00 64.45 C ATOM 0 H ALA A 177 -8.897 -11.835 0.896 1.00 53.35 H new ATOM 0 HA ALA A 177 -10.809 -11.660 -1.297 1.00 55.50 H new ATOM 0 HB1 ALA A 177 -10.282 -9.317 -1.784 1.00 64.45 H new ATOM 0 HB2 ALA A 177 -11.138 -9.476 -0.232 1.00 64.45 H new ATOM 0 HB3 ALA A 177 -9.382 -9.191 -0.254 1.00 64.45 H new ATOM 2731 N GLY A 178 -8.789 -11.889 -2.813 1.00 22.51 N ATOM 2732 CA GLY A 178 -7.668 -12.397 -3.588 1.00 15.14 C ATOM 2733 C GLY A 178 -7.052 -13.669 -3.018 1.00 25.01 C ATOM 2734 O GLY A 178 -7.779 -14.510 -2.494 1.00 65.52 O ATOM 0 H GLY A 178 -9.662 -11.821 -3.337 1.00 22.51 H new ATOM 0 HA2 GLY A 178 -8.002 -12.591 -4.607 1.00 15.14 H new ATOM 0 HA3 GLY A 178 -6.899 -11.626 -3.646 1.00 15.14 H new ATOM 2738 N GLU A 179 -5.713 -13.796 -3.159 1.00 43.14 N ATOM 2739 CA GLU A 179 -4.927 -14.967 -2.703 1.00 42.42 C ATOM 2740 C GLU A 179 -5.246 -15.354 -1.239 1.00 73.11 C ATOM 2741 O GLU A 179 -5.059 -14.557 -0.315 1.00 33.20 O ATOM 2742 CB GLU A 179 -3.405 -14.677 -2.869 1.00 64.33 C ATOM 2743 CG GLU A 179 -2.985 -14.240 -4.290 1.00 34.31 C ATOM 2744 CD GLU A 179 -3.377 -15.245 -5.387 1.00 71.10 C ATOM 2745 OE1 GLU A 179 -2.695 -16.284 -5.526 1.00 75.42 O ATOM 2746 OE2 GLU A 179 -4.381 -15.014 -6.102 1.00 13.11 O ATOM 0 H GLU A 179 -5.139 -13.077 -3.599 1.00 43.14 H new ATOM 0 HA GLU A 179 -5.208 -15.817 -3.325 1.00 42.42 H new ATOM 0 HB2 GLU A 179 -3.118 -13.897 -2.164 1.00 64.33 H new ATOM 0 HB3 GLU A 179 -2.846 -15.573 -2.599 1.00 64.33 H new ATOM 0 HG2 GLU A 179 -3.441 -13.275 -4.514 1.00 34.31 H new ATOM 0 HG3 GLU A 179 -1.905 -14.095 -4.312 1.00 34.31 H new ATOM 2753 N ARG A 180 -5.748 -16.585 -1.076 1.00 11.43 N ATOM 2754 CA ARG A 180 -6.228 -17.130 0.205 1.00 72.12 C ATOM 2755 C ARG A 180 -5.064 -17.721 1.025 1.00 42.25 C ATOM 2756 O ARG A 180 -3.886 -17.446 0.755 1.00 64.03 O ATOM 2757 CB ARG A 180 -7.316 -18.234 -0.055 1.00 0.32 C ATOM 2758 CG ARG A 180 -8.583 -17.766 -0.816 1.00 44.10 C ATOM 2759 CD ARG A 180 -8.370 -17.619 -2.336 1.00 62.14 C ATOM 2760 NE ARG A 180 -9.537 -17.048 -3.024 1.00 73.32 N ATOM 2761 CZ ARG A 180 -9.528 -16.527 -4.265 1.00 2.32 C ATOM 2762 NH1 ARG A 180 -8.400 -16.487 -4.986 1.00 70.51 N ATOM 2763 NH2 ARG A 180 -10.642 -16.040 -4.769 1.00 51.34 N ATOM 0 H ARG A 180 -5.835 -17.246 -1.848 1.00 11.43 H new ATOM 0 HA ARG A 180 -6.671 -16.315 0.778 1.00 72.12 H new ATOM 0 HB2 ARG A 180 -6.856 -19.046 -0.619 1.00 0.32 H new ATOM 0 HB3 ARG A 180 -7.624 -18.647 0.905 1.00 0.32 H new ATOM 0 HG2 ARG A 180 -9.388 -18.479 -0.637 1.00 44.10 H new ATOM 0 HG3 ARG A 180 -8.909 -16.809 -0.409 1.00 44.10 H new ATOM 0 HD2 ARG A 180 -7.502 -16.985 -2.517 1.00 62.14 H new ATOM 0 HD3 ARG A 180 -8.145 -18.597 -2.763 1.00 62.14 H new ATOM 0 HE ARG A 180 -10.424 -17.047 -2.521 1.00 73.32 H new ATOM 0 HH11 ARG A 180 -7.532 -16.854 -4.596 1.00 70.51 H new ATOM 0 HH12 ARG A 180 -8.409 -16.089 -5.925 1.00 70.51 H new ATOM 0 HH21 ARG A 180 -11.501 -16.060 -4.220 1.00 51.34 H new ATOM 0 HH22 ARG A 180 -10.646 -15.643 -5.709 1.00 51.34 H new