USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=42 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 -49:sc= 0.06 USER MOD Set 1.2: A 154 CYS SG : rot 159:sc= -0.0723 USER MOD Set 1.3: A 162 CYS SG : rot 180:sc=-0.00355 USER MOD Set 2.1: A 75 THR OG1 : rot 160:sc= 0 USER MOD Set 2.2: A 161 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 116 THR OG1 : rot -76:sc= 1.31 USER MOD Set 3.2: A 121 SER OG : rot 140:sc= 0.513 USER MOD Set 4.1: A 70 THR OG1 : rot 88:sc= 0.361 USER MOD Set 4.2: A 71 SER OG : rot 80:sc= 0.311 USER MOD Set 4.3: A 100 GLN : amide:sc= -0.266 X(o=0.41,f=0.16) USER MOD Set 5.1: A 60 HIS : no HD1:sc= -0.212 X(o=-0.57,f=-0.87) USER MOD Set 5.2: A 80 HIS : no HE2:sc= -0.0845! C(o=-0.57!,f=-8.5!) USER MOD Set 5.3: A 83 THR OG1 : rot -93:sc= 0.412 USER MOD Set 5.4: A 96 HIS : no HE2:sc= -0.689! C(o=-0.57!,f=-13!) USER MOD Single : A 5 THR OG1 : rot 34:sc= 0.144 USER MOD Single : A 10 THR OG1 : rot 81:sc= 1.19 USER MOD Single : A 11 GLN : amide:sc= 0.0245 X(o=0.024,f=0) USER MOD Single : A 13 GLN : amide:sc= -1.07 K(o=-1.1,f=-0.086) USER MOD Single : A 15 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 19 LYS NZ :NH3+ 143:sc= 0.805 (180deg=0.2) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 HIS : no HD1:sc= -0.688 K(o=-0.69,f=-1.5) USER MOD Single : A 28 GLN : amide:sc= -0.209 K(o=-0.21,f=-0.92) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 30:sc= 0 USER MOD Single : A 51 TYR OH : rot 50:sc= -1.33 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 40:sc= 0.5 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 47:sc= 0.443 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 100:sc= 0.0727 USER MOD Single : A 107 THR OG1 : rot -40:sc= 0.0522 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 62:sc= 0.0413 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 120 GLN : amide:sc= -0.471 K(o=-0.47,f=-3.1) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl -169:sc= 0 (180deg=-0.119) 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= -2.37 X(o=-2.4,f=-2.5) USER MOD Single : A 150 TYR OH : rot 90:sc= -0.45 USER MOD Single : A 151 SER OG : rot -5:sc= 0.142 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 77:sc= 0.84 USER MOD Single : A 159 THR OG1 : rot -35:sc= 0.382 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -0.636 K(o=-0.64,f=-5.3!) USER MOD Single : A 173 THR OG1 : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot 35:sc= -0.264 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -14.443 1.967 -15.389 1.00 63.15 N ATOM 60 CA THR A 5 -14.041 0.899 -14.462 1.00 20.43 C ATOM 61 C THR A 5 -12.855 0.081 -15.025 1.00 3.11 C ATOM 62 O THR A 5 -11.914 -0.249 -14.287 1.00 53.30 O ATOM 63 CB THR A 5 -15.262 -0.032 -14.146 1.00 40.54 C ATOM 64 OG1 THR A 5 -16.359 0.779 -13.686 1.00 4.33 O ATOM 65 CG2 THR A 5 -14.934 -1.095 -13.078 1.00 71.35 C ATOM 0 HA THR A 5 -13.707 1.363 -13.534 1.00 20.43 H new ATOM 0 HB THR A 5 -15.522 -0.561 -15.063 1.00 40.54 H new ATOM 0 HG1 THR A 5 -16.346 1.641 -14.152 1.00 4.33 H new ATOM 0 HG21 THR A 5 -15.814 -1.713 -12.897 1.00 71.35 H new ATOM 0 HG22 THR A 5 -14.116 -1.723 -13.429 1.00 71.35 H new ATOM 0 HG23 THR A 5 -14.640 -0.601 -12.152 1.00 71.35 H new ATOM 73 N GLU A 6 -12.896 -0.232 -16.340 1.00 43.11 N ATOM 74 CA GLU A 6 -11.823 -1.004 -17.010 1.00 44.21 C ATOM 75 C GLU A 6 -10.538 -0.171 -17.184 1.00 62.33 C ATOM 76 O GLU A 6 -9.485 -0.729 -17.451 1.00 50.32 O ATOM 77 CB GLU A 6 -12.276 -1.546 -18.393 1.00 12.44 C ATOM 78 CG GLU A 6 -12.395 -0.478 -19.496 1.00 71.45 C ATOM 79 CD GLU A 6 -12.791 -1.051 -20.860 1.00 51.34 C ATOM 80 OE1 GLU A 6 -11.911 -1.605 -21.556 1.00 63.54 O ATOM 81 OE2 GLU A 6 -13.977 -0.961 -21.242 1.00 54.42 O ATOM 0 H GLU A 6 -13.661 0.038 -16.959 1.00 43.11 H new ATOM 0 HA GLU A 6 -11.607 -1.849 -16.356 1.00 44.21 H new ATOM 0 HB2 GLU A 6 -11.568 -2.308 -18.719 1.00 12.44 H new ATOM 0 HB3 GLU A 6 -13.242 -2.038 -18.277 1.00 12.44 H new ATOM 0 HG2 GLU A 6 -13.134 0.264 -19.194 1.00 71.45 H new ATOM 0 HG3 GLU A 6 -11.442 0.042 -19.592 1.00 71.45 H new ATOM 88 N ASP A 7 -10.650 1.167 -17.039 1.00 42.11 N ATOM 89 CA ASP A 7 -9.491 2.095 -17.087 1.00 14.51 C ATOM 90 C ASP A 7 -8.412 1.643 -16.076 1.00 54.24 C ATOM 91 O ASP A 7 -7.210 1.662 -16.358 1.00 2.10 O ATOM 92 CB ASP A 7 -9.956 3.533 -16.761 1.00 61.22 C ATOM 93 CG ASP A 7 -8.832 4.578 -16.862 1.00 4.04 C ATOM 94 OD1 ASP A 7 -8.120 4.815 -15.858 1.00 35.41 O ATOM 95 OD2 ASP A 7 -8.652 5.165 -17.954 1.00 25.32 O ATOM 0 H ASP A 7 -11.542 1.637 -16.886 1.00 42.11 H new ATOM 0 HA ASP A 7 -9.063 2.080 -18.089 1.00 14.51 H new ATOM 0 HB2 ASP A 7 -10.761 3.809 -17.442 1.00 61.22 H new ATOM 0 HB3 ASP A 7 -10.370 3.553 -15.753 1.00 61.22 H new ATOM 100 N TRP A 8 -8.907 1.246 -14.898 1.00 52.24 N ATOM 101 CA TRP A 8 -8.135 0.613 -13.832 1.00 71.13 C ATOM 102 C TRP A 8 -7.327 -0.607 -14.343 1.00 14.31 C ATOM 103 O TRP A 8 -6.110 -0.606 -14.212 1.00 10.53 O ATOM 104 CB TRP A 8 -9.112 0.238 -12.692 1.00 43.32 C ATOM 105 CG TRP A 8 -8.548 -0.636 -11.599 1.00 50.33 C ATOM 106 CD1 TRP A 8 -7.738 -0.272 -10.555 1.00 15.32 C ATOM 107 CD2 TRP A 8 -8.784 -2.033 -11.454 1.00 63.44 C ATOM 108 NE1 TRP A 8 -7.474 -1.365 -9.771 1.00 74.51 N ATOM 109 CE2 TRP A 8 -8.107 -2.458 -10.305 1.00 32.31 C ATOM 110 CE3 TRP A 8 -9.515 -2.961 -12.196 1.00 42.12 C ATOM 111 CZ2 TRP A 8 -8.136 -3.781 -9.884 1.00 51.03 C ATOM 112 CZ3 TRP A 8 -9.543 -4.267 -11.778 1.00 11.23 C ATOM 113 CH2 TRP A 8 -8.862 -4.664 -10.630 1.00 43.21 C ATOM 0 H TRP A 8 -9.891 1.362 -14.656 1.00 52.24 H new ATOM 0 HA TRP A 8 -7.388 1.311 -13.454 1.00 71.13 H new ATOM 0 HB2 TRP A 8 -9.482 1.158 -12.240 1.00 43.32 H new ATOM 0 HB3 TRP A 8 -9.972 -0.270 -13.129 1.00 43.32 H new ATOM 0 HD1 TRP A 8 -7.364 0.725 -10.377 1.00 15.32 H new ATOM 0 HE1 TRP A 8 -6.900 -1.365 -8.928 1.00 74.51 H new ATOM 0 HE3 TRP A 8 -10.049 -2.656 -13.084 1.00 42.12 H new ATOM 0 HZ2 TRP A 8 -7.604 -4.099 -9.000 1.00 51.03 H new ATOM 0 HZ3 TRP A 8 -10.100 -4.997 -12.346 1.00 11.23 H new ATOM 0 HH2 TRP A 8 -8.910 -5.698 -10.322 1.00 43.21 H new ATOM 124 N GLU A 9 -7.987 -1.622 -14.951 1.00 3.10 N ATOM 125 CA GLU A 9 -7.275 -2.855 -15.421 1.00 42.43 C ATOM 126 C GLU A 9 -6.366 -2.563 -16.646 1.00 51.31 C ATOM 127 O GLU A 9 -5.368 -3.267 -16.871 1.00 44.24 O ATOM 128 CB GLU A 9 -8.269 -4.014 -15.743 1.00 51.52 C ATOM 129 CG GLU A 9 -9.218 -3.744 -16.923 1.00 70.11 C ATOM 130 CD GLU A 9 -10.104 -4.939 -17.307 1.00 64.01 C ATOM 131 OE1 GLU A 9 -9.621 -5.820 -18.051 1.00 32.51 O ATOM 132 OE2 GLU A 9 -11.286 -4.985 -16.901 1.00 51.13 O ATOM 0 H GLU A 9 -8.991 -1.622 -15.129 1.00 3.10 H new ATOM 0 HA GLU A 9 -6.639 -3.178 -14.597 1.00 42.43 H new ATOM 0 HB2 GLU A 9 -7.696 -4.916 -15.956 1.00 51.52 H new ATOM 0 HB3 GLU A 9 -8.866 -4.218 -14.854 1.00 51.52 H new ATOM 0 HG2 GLU A 9 -9.858 -2.898 -16.673 1.00 70.11 H new ATOM 0 HG3 GLU A 9 -8.626 -3.452 -17.790 1.00 70.11 H new ATOM 139 N THR A 10 -6.718 -1.498 -17.398 1.00 55.14 N ATOM 140 CA THR A 10 -5.982 -1.044 -18.595 1.00 11.41 C ATOM 141 C THR A 10 -4.580 -0.532 -18.205 1.00 52.42 C ATOM 142 O THR A 10 -3.572 -0.961 -18.781 1.00 1.13 O ATOM 143 CB THR A 10 -6.805 0.063 -19.353 1.00 54.21 C ATOM 144 OG1 THR A 10 -8.059 -0.498 -19.791 1.00 3.22 O ATOM 145 CG2 THR A 10 -6.054 0.644 -20.572 1.00 24.51 C ATOM 0 H THR A 10 -7.533 -0.922 -17.187 1.00 55.14 H new ATOM 0 HA THR A 10 -5.851 -1.889 -19.271 1.00 11.41 H new ATOM 0 HB THR A 10 -6.964 0.883 -18.653 1.00 54.21 H new ATOM 0 HG1 THR A 10 -8.693 -0.505 -19.044 1.00 3.22 H new ATOM 0 HG21 THR A 10 -6.672 1.402 -21.053 1.00 24.51 H new ATOM 0 HG22 THR A 10 -5.118 1.095 -20.242 1.00 24.51 H new ATOM 0 HG23 THR A 10 -5.841 -0.155 -21.283 1.00 24.51 H new ATOM 153 N GLN A 11 -4.530 0.386 -17.218 1.00 1.54 N ATOM 154 CA GLN A 11 -3.259 0.881 -16.656 1.00 20.54 C ATOM 155 C GLN A 11 -2.557 -0.213 -15.818 1.00 53.32 C ATOM 156 O GLN A 11 -1.336 -0.339 -15.869 1.00 62.31 O ATOM 157 CB GLN A 11 -3.492 2.162 -15.799 1.00 54.50 C ATOM 158 CG GLN A 11 -4.414 1.971 -14.580 1.00 63.10 C ATOM 159 CD GLN A 11 -4.700 3.256 -13.810 1.00 73.12 C ATOM 160 OE1 GLN A 11 -3.988 3.605 -12.866 1.00 33.10 O ATOM 161 NE2 GLN A 11 -5.751 3.965 -14.198 1.00 10.41 N ATOM 0 H GLN A 11 -5.360 0.800 -16.793 1.00 1.54 H new ATOM 0 HA GLN A 11 -2.606 1.140 -17.489 1.00 20.54 H new ATOM 0 HB2 GLN A 11 -2.526 2.529 -15.451 1.00 54.50 H new ATOM 0 HB3 GLN A 11 -3.916 2.936 -16.438 1.00 54.50 H new ATOM 0 HG2 GLN A 11 -5.359 1.543 -14.916 1.00 63.10 H new ATOM 0 HG3 GLN A 11 -3.959 1.248 -13.903 1.00 63.10 H new ATOM 0 HE21 GLN A 11 -6.319 3.647 -14.983 1.00 10.41 H new ATOM 0 HE22 GLN A 11 -5.992 4.828 -13.711 1.00 10.41 H new ATOM 170 N LEU A 12 -3.363 -1.030 -15.095 1.00 41.53 N ATOM 171 CA LEU A 12 -2.866 -1.975 -14.068 1.00 33.35 C ATOM 172 C LEU A 12 -1.980 -3.082 -14.651 1.00 11.02 C ATOM 173 O LEU A 12 -1.024 -3.488 -14.003 1.00 42.41 O ATOM 174 CB LEU A 12 -4.039 -2.611 -13.282 1.00 62.34 C ATOM 175 CG LEU A 12 -3.656 -3.608 -12.139 1.00 13.33 C ATOM 176 CD1 LEU A 12 -2.769 -2.941 -11.055 1.00 25.14 C ATOM 177 CD2 LEU A 12 -4.917 -4.249 -11.530 1.00 53.34 C ATOM 0 H LEU A 12 -4.376 -1.051 -15.209 1.00 41.53 H new ATOM 0 HA LEU A 12 -2.250 -1.383 -13.391 1.00 33.35 H new ATOM 0 HB2 LEU A 12 -4.634 -1.807 -12.848 1.00 62.34 H new ATOM 0 HB3 LEU A 12 -4.680 -3.135 -13.991 1.00 62.34 H new ATOM 0 HG LEU A 12 -3.056 -4.402 -12.583 1.00 13.33 H new ATOM 0 HD11 LEU A 12 -2.528 -3.671 -10.282 1.00 25.14 H new ATOM 0 HD12 LEU A 12 -1.848 -2.578 -11.511 1.00 25.14 H new ATOM 0 HD13 LEU A 12 -3.307 -2.104 -10.609 1.00 25.14 H new ATOM 0 HD21 LEU A 12 -4.628 -4.939 -10.737 1.00 53.34 H new ATOM 0 HD22 LEU A 12 -5.558 -3.470 -11.117 1.00 53.34 H new ATOM 0 HD23 LEU A 12 -5.459 -4.792 -12.304 1.00 53.34 H new ATOM 189 N GLN A 13 -2.306 -3.576 -15.860 1.00 44.13 N ATOM 190 CA GLN A 13 -1.519 -4.648 -16.511 1.00 4.55 C ATOM 191 C GLN A 13 -0.055 -4.195 -16.776 1.00 21.34 C ATOM 192 O GLN A 13 0.864 -5.015 -16.775 1.00 74.22 O ATOM 193 CB GLN A 13 -2.243 -5.137 -17.805 1.00 2.34 C ATOM 194 CG GLN A 13 -2.446 -4.079 -18.928 1.00 62.53 C ATOM 195 CD GLN A 13 -1.250 -3.885 -19.878 1.00 71.25 C ATOM 196 OE1 GLN A 13 -1.014 -2.792 -20.386 1.00 22.15 O ATOM 197 NE2 GLN A 13 -0.511 -4.950 -20.155 1.00 51.31 N ATOM 0 H GLN A 13 -3.105 -3.254 -16.406 1.00 44.13 H new ATOM 0 HA GLN A 13 -1.454 -5.499 -15.833 1.00 4.55 H new ATOM 0 HB2 GLN A 13 -1.675 -5.970 -18.220 1.00 2.34 H new ATOM 0 HB3 GLN A 13 -3.221 -5.527 -17.522 1.00 2.34 H new ATOM 0 HG2 GLN A 13 -3.315 -4.365 -19.520 1.00 62.53 H new ATOM 0 HG3 GLN A 13 -2.678 -3.121 -18.463 1.00 62.53 H new ATOM 0 HE21 GLN A 13 -0.727 -5.847 -19.721 1.00 51.31 H new ATOM 0 HE22 GLN A 13 0.273 -4.872 -20.803 1.00 51.31 H new ATOM 206 N ALA A 14 0.135 -2.872 -16.964 1.00 41.14 N ATOM 207 CA ALA A 14 1.462 -2.255 -17.168 1.00 60.41 C ATOM 208 C ALA A 14 2.117 -1.899 -15.812 1.00 25.22 C ATOM 209 O ALA A 14 3.307 -2.180 -15.592 1.00 10.33 O ATOM 210 CB ALA A 14 1.306 -1.012 -18.058 1.00 3.14 C ATOM 0 H ALA A 14 -0.631 -2.199 -16.979 1.00 41.14 H new ATOM 0 HA ALA A 14 2.121 -2.966 -17.666 1.00 60.41 H new ATOM 0 HB1 ALA A 14 2.281 -0.551 -18.213 1.00 3.14 H new ATOM 0 HB2 ALA A 14 0.885 -1.304 -19.020 1.00 3.14 H new ATOM 0 HB3 ALA A 14 0.640 -0.298 -17.573 1.00 3.14 H new ATOM 216 N ASN A 15 1.300 -1.298 -14.911 1.00 55.55 N ATOM 217 CA ASN A 15 1.705 -0.894 -13.536 1.00 41.22 C ATOM 218 C ASN A 15 2.224 -2.094 -12.725 1.00 33.52 C ATOM 219 O ASN A 15 3.171 -1.970 -11.949 1.00 52.11 O ATOM 220 CB ASN A 15 0.501 -0.245 -12.782 1.00 11.30 C ATOM 221 CG ASN A 15 0.112 1.151 -13.287 1.00 34.22 C ATOM 222 OD1 ASN A 15 0.324 1.499 -14.443 1.00 34.42 O ATOM 223 ND2 ASN A 15 -0.475 1.958 -12.416 1.00 32.40 N ATOM 0 H ASN A 15 0.327 -1.076 -15.120 1.00 55.55 H new ATOM 0 HA ASN A 15 2.511 -0.167 -13.635 1.00 41.22 H new ATOM 0 HB2 ASN A 15 -0.363 -0.903 -12.869 1.00 11.30 H new ATOM 0 HB3 ASN A 15 0.745 -0.179 -11.722 1.00 11.30 H new ATOM 0 HD21 ASN A 15 -0.762 2.894 -12.701 1.00 32.40 H new ATOM 0 HD22 ASN A 15 -0.640 1.643 -11.460 1.00 32.40 H new ATOM 230 N ARG A 16 1.572 -3.247 -12.940 1.00 44.33 N ATOM 231 CA ARG A 16 1.870 -4.519 -12.259 1.00 25.35 C ATOM 232 C ARG A 16 3.298 -4.975 -12.570 1.00 11.11 C ATOM 233 O ARG A 16 4.066 -5.296 -11.667 1.00 3.22 O ATOM 234 CB ARG A 16 0.869 -5.603 -12.737 1.00 41.01 C ATOM 235 CG ARG A 16 1.045 -7.004 -12.109 1.00 41.13 C ATOM 236 CD ARG A 16 0.234 -8.080 -12.858 1.00 73.05 C ATOM 237 NE ARG A 16 -1.182 -7.695 -13.046 1.00 14.35 N ATOM 238 CZ ARG A 16 -2.221 -8.539 -13.111 1.00 62.53 C ATOM 239 NH1 ARG A 16 -2.044 -9.855 -12.996 1.00 32.02 N ATOM 240 NH2 ARG A 16 -3.433 -8.056 -13.323 1.00 2.21 N ATOM 0 H ARG A 16 0.805 -3.324 -13.608 1.00 44.33 H new ATOM 0 HA ARG A 16 1.776 -4.372 -11.183 1.00 25.35 H new ATOM 0 HB2 ARG A 16 -0.142 -5.255 -12.526 1.00 41.01 H new ATOM 0 HB3 ARG A 16 0.954 -5.697 -13.820 1.00 41.01 H new ATOM 0 HG2 ARG A 16 2.101 -7.275 -12.117 1.00 41.13 H new ATOM 0 HG3 ARG A 16 0.732 -6.975 -11.065 1.00 41.13 H new ATOM 0 HD2 ARG A 16 0.690 -8.262 -13.831 1.00 73.05 H new ATOM 0 HD3 ARG A 16 0.282 -9.017 -12.304 1.00 73.05 H new ATOM 0 HE ARG A 16 -1.385 -6.699 -13.134 1.00 14.35 H new ATOM 0 HH11 ARG A 16 -1.107 -10.233 -12.856 1.00 32.02 H new ATOM 0 HH12 ARG A 16 -2.845 -10.484 -13.048 1.00 32.02 H new ATOM 0 HH21 ARG A 16 -3.569 -7.051 -13.435 1.00 2.21 H new ATOM 0 HH22 ARG A 16 -4.232 -8.688 -13.375 1.00 2.21 H new ATOM 254 N ASP A 17 3.628 -4.949 -13.874 1.00 65.22 N ATOM 255 CA ASP A 17 4.887 -5.488 -14.408 1.00 21.11 C ATOM 256 C ASP A 17 6.089 -4.672 -13.903 1.00 74.24 C ATOM 257 O ASP A 17 7.100 -5.236 -13.462 1.00 12.25 O ATOM 258 CB ASP A 17 4.834 -5.493 -15.958 1.00 30.24 C ATOM 259 CG ASP A 17 6.105 -6.084 -16.601 1.00 32.12 C ATOM 260 OD1 ASP A 17 6.217 -7.332 -16.687 1.00 2.41 O ATOM 261 OD2 ASP A 17 7.005 -5.311 -17.014 1.00 32.53 O ATOM 0 H ASP A 17 3.022 -4.550 -14.591 1.00 65.22 H new ATOM 0 HA ASP A 17 5.012 -6.512 -14.055 1.00 21.11 H new ATOM 0 HB2 ASP A 17 3.967 -6.067 -16.285 1.00 30.24 H new ATOM 0 HB3 ASP A 17 4.693 -4.473 -16.315 1.00 30.24 H new ATOM 266 N GLU A 18 5.945 -3.333 -13.945 1.00 22.23 N ATOM 267 CA GLU A 18 7.000 -2.399 -13.513 1.00 24.15 C ATOM 268 C GLU A 18 7.132 -2.354 -11.975 1.00 15.11 C ATOM 269 O GLU A 18 8.189 -1.983 -11.452 1.00 1.14 O ATOM 270 CB GLU A 18 6.756 -0.981 -14.085 1.00 74.53 C ATOM 271 CG GLU A 18 5.450 -0.305 -13.624 1.00 61.51 C ATOM 272 CD GLU A 18 5.341 1.153 -14.082 1.00 55.21 C ATOM 273 OE1 GLU A 18 4.970 1.395 -15.247 1.00 32.25 O ATOM 274 OE2 GLU A 18 5.653 2.066 -13.281 1.00 70.41 O ATOM 0 H GLU A 18 5.098 -2.872 -14.278 1.00 22.23 H new ATOM 0 HA GLU A 18 7.943 -2.772 -13.912 1.00 24.15 H new ATOM 0 HB2 GLU A 18 7.595 -0.344 -13.805 1.00 74.53 H new ATOM 0 HB3 GLU A 18 6.751 -1.041 -15.173 1.00 74.53 H new ATOM 0 HG2 GLU A 18 4.600 -0.867 -14.011 1.00 61.51 H new ATOM 0 HG3 GLU A 18 5.390 -0.345 -12.536 1.00 61.51 H new ATOM 281 N LYS A 19 6.065 -2.733 -11.258 1.00 72.13 N ATOM 282 CA LYS A 19 6.070 -2.775 -9.780 1.00 21.34 C ATOM 283 C LYS A 19 6.642 -4.121 -9.282 1.00 43.41 C ATOM 284 O LYS A 19 7.250 -4.197 -8.212 1.00 52.50 O ATOM 285 CB LYS A 19 4.630 -2.552 -9.235 1.00 62.34 C ATOM 286 CG LYS A 19 4.514 -2.300 -7.703 1.00 14.14 C ATOM 287 CD LYS A 19 4.586 -0.801 -7.290 1.00 35.11 C ATOM 288 CE LYS A 19 5.956 -0.134 -7.500 1.00 32.40 C ATOM 289 NZ LYS A 19 5.931 1.302 -7.103 1.00 74.01 N ATOM 0 H LYS A 19 5.179 -3.018 -11.677 1.00 72.13 H new ATOM 0 HA LYS A 19 6.709 -1.975 -9.406 1.00 21.34 H new ATOM 0 HB2 LYS A 19 4.192 -1.702 -9.758 1.00 62.34 H new ATOM 0 HB3 LYS A 19 4.028 -3.425 -9.487 1.00 62.34 H new ATOM 0 HG2 LYS A 19 3.571 -2.717 -7.349 1.00 14.14 H new ATOM 0 HG3 LYS A 19 5.312 -2.842 -7.197 1.00 14.14 H new ATOM 0 HD2 LYS A 19 3.838 -0.247 -7.857 1.00 35.11 H new ATOM 0 HD3 LYS A 19 4.315 -0.716 -6.238 1.00 35.11 H new ATOM 0 HE2 LYS A 19 6.711 -0.661 -6.917 1.00 32.40 H new ATOM 0 HE3 LYS A 19 6.246 -0.218 -8.547 1.00 32.40 H new ATOM 0 HZ1 LYS A 19 6.837 1.555 -6.659 1.00 74.01 H new ATOM 0 HZ2 LYS A 19 5.782 1.893 -7.946 1.00 74.01 H new ATOM 0 HZ3 LYS A 19 5.157 1.462 -6.427 1.00 74.01 H new ATOM 303 N ASP A 20 6.435 -5.172 -10.090 1.00 11.22 N ATOM 304 CA ASP A 20 6.897 -6.544 -9.798 1.00 34.02 C ATOM 305 C ASP A 20 8.422 -6.653 -9.950 1.00 5.54 C ATOM 306 O ASP A 20 9.103 -7.295 -9.138 1.00 52.43 O ATOM 307 CB ASP A 20 6.175 -7.538 -10.744 1.00 52.12 C ATOM 308 CG ASP A 20 6.534 -9.006 -10.483 1.00 15.45 C ATOM 309 OD1 ASP A 20 6.429 -9.442 -9.325 1.00 71.23 O ATOM 310 OD2 ASP A 20 6.879 -9.736 -11.435 1.00 61.15 O ATOM 0 H ASP A 20 5.936 -5.095 -10.976 1.00 11.22 H new ATOM 0 HA ASP A 20 6.653 -6.791 -8.765 1.00 34.02 H new ATOM 0 HB2 ASP A 20 5.098 -7.412 -10.636 1.00 52.12 H new ATOM 0 HB3 ASP A 20 6.423 -7.290 -11.776 1.00 52.12 H new ATOM 315 N ARG A 21 8.941 -5.950 -10.968 1.00 11.22 N ATOM 316 CA ARG A 21 10.376 -5.969 -11.317 1.00 34.21 C ATOM 317 C ARG A 21 11.212 -5.175 -10.301 1.00 52.55 C ATOM 318 O ARG A 21 12.432 -5.235 -10.334 1.00 20.54 O ATOM 319 CB ARG A 21 10.609 -5.395 -12.729 1.00 4.01 C ATOM 320 CG ARG A 21 10.304 -3.891 -12.872 1.00 64.04 C ATOM 321 CD ARG A 21 10.684 -3.326 -14.246 1.00 12.33 C ATOM 322 NE ARG A 21 10.041 -4.056 -15.360 1.00 32.34 N ATOM 323 CZ ARG A 21 10.620 -4.341 -16.541 1.00 74.35 C ATOM 324 NH1 ARG A 21 11.877 -3.985 -16.793 1.00 25.50 N ATOM 325 NH2 ARG A 21 9.932 -4.989 -17.469 1.00 74.41 N ATOM 0 H ARG A 21 8.381 -5.351 -11.575 1.00 11.22 H new ATOM 0 HA ARG A 21 10.695 -7.011 -11.296 1.00 34.21 H new ATOM 0 HB2 ARG A 21 11.648 -5.569 -13.010 1.00 4.01 H new ATOM 0 HB3 ARG A 21 9.990 -5.946 -13.437 1.00 4.01 H new ATOM 0 HG2 ARG A 21 9.241 -3.724 -12.699 1.00 64.04 H new ATOM 0 HG3 ARG A 21 10.842 -3.342 -12.099 1.00 64.04 H new ATOM 0 HD2 ARG A 21 10.400 -2.275 -14.294 1.00 12.33 H new ATOM 0 HD3 ARG A 21 11.767 -3.369 -14.365 1.00 12.33 H new ATOM 0 HE ARG A 21 9.080 -4.369 -15.222 1.00 32.34 H new ATOM 0 HH11 ARG A 21 12.418 -3.488 -16.085 1.00 25.50 H new ATOM 0 HH12 ARG A 21 12.300 -4.209 -17.694 1.00 25.50 H new ATOM 0 HH21 ARG A 21 8.968 -5.269 -17.287 1.00 74.41 H new ATOM 0 HH22 ARG A 21 10.366 -5.208 -18.366 1.00 74.41 H new ATOM 339 N PHE A 22 10.527 -4.393 -9.445 1.00 34.05 N ATOM 340 CA PHE A 22 11.143 -3.636 -8.337 1.00 61.12 C ATOM 341 C PHE A 22 11.880 -4.588 -7.364 1.00 21.34 C ATOM 342 O PHE A 22 12.993 -4.302 -6.910 1.00 4.21 O ATOM 343 CB PHE A 22 10.019 -2.848 -7.607 1.00 30.00 C ATOM 344 CG PHE A 22 10.486 -1.805 -6.599 1.00 53.11 C ATOM 345 CD1 PHE A 22 10.683 -2.132 -5.253 1.00 23.52 C ATOM 346 CD2 PHE A 22 10.707 -0.486 -6.998 1.00 61.25 C ATOM 347 CE1 PHE A 22 11.086 -1.173 -4.348 1.00 34.20 C ATOM 348 CE2 PHE A 22 11.105 0.468 -6.087 1.00 65.04 C ATOM 349 CZ PHE A 22 11.294 0.125 -4.768 1.00 64.23 C ATOM 0 H PHE A 22 9.517 -4.267 -9.504 1.00 34.05 H new ATOM 0 HA PHE A 22 11.887 -2.941 -8.726 1.00 61.12 H new ATOM 0 HB2 PHE A 22 9.404 -2.351 -8.357 1.00 30.00 H new ATOM 0 HB3 PHE A 22 9.377 -3.562 -7.091 1.00 30.00 H new ATOM 0 HD1 PHE A 22 10.518 -3.146 -4.919 1.00 23.52 H new ATOM 0 HD2 PHE A 22 10.564 -0.210 -8.032 1.00 61.25 H new ATOM 0 HE1 PHE A 22 11.239 -1.437 -3.312 1.00 34.20 H new ATOM 0 HE2 PHE A 22 11.269 1.486 -6.409 1.00 65.04 H new ATOM 0 HZ PHE A 22 11.607 0.876 -4.057 1.00 64.23 H new ATOM 359 N PHE A 23 11.238 -5.738 -7.094 1.00 62.42 N ATOM 360 CA PHE A 23 11.767 -6.798 -6.208 1.00 43.24 C ATOM 361 C PHE A 23 12.848 -7.652 -6.903 1.00 22.23 C ATOM 362 O PHE A 23 13.464 -8.502 -6.259 1.00 70.12 O ATOM 363 CB PHE A 23 10.598 -7.693 -5.687 1.00 23.10 C ATOM 364 CG PHE A 23 9.812 -7.088 -4.516 1.00 21.22 C ATOM 365 CD1 PHE A 23 9.252 -5.809 -4.597 1.00 71.21 C ATOM 366 CD2 PHE A 23 9.668 -7.791 -3.314 1.00 33.44 C ATOM 367 CE1 PHE A 23 8.580 -5.264 -3.520 1.00 60.21 C ATOM 368 CE2 PHE A 23 9.007 -7.240 -2.237 1.00 52.22 C ATOM 369 CZ PHE A 23 8.463 -5.981 -2.340 1.00 72.12 C ATOM 0 H PHE A 23 10.325 -5.963 -7.489 1.00 62.42 H new ATOM 0 HA PHE A 23 12.248 -6.312 -5.359 1.00 43.24 H new ATOM 0 HB2 PHE A 23 9.910 -7.886 -6.510 1.00 23.10 H new ATOM 0 HB3 PHE A 23 11.004 -8.656 -5.378 1.00 23.10 H new ATOM 0 HD1 PHE A 23 9.346 -5.241 -5.511 1.00 71.21 H new ATOM 0 HD2 PHE A 23 10.083 -8.784 -3.229 1.00 33.44 H new ATOM 0 HE1 PHE A 23 8.145 -4.278 -3.598 1.00 60.21 H new ATOM 0 HE2 PHE A 23 8.917 -7.795 -1.315 1.00 52.22 H new ATOM 0 HZ PHE A 23 7.943 -5.549 -1.498 1.00 72.12 H new ATOM 379 N SER A 24 13.057 -7.444 -8.212 1.00 72.15 N ATOM 380 CA SER A 24 14.086 -8.166 -8.979 1.00 75.44 C ATOM 381 C SER A 24 15.301 -7.265 -9.270 1.00 21.24 C ATOM 382 O SER A 24 16.446 -7.646 -8.990 1.00 25.30 O ATOM 383 CB SER A 24 13.489 -8.692 -10.307 1.00 31.35 C ATOM 384 OG SER A 24 14.438 -9.453 -11.042 1.00 45.23 O ATOM 0 H SER A 24 12.522 -6.776 -8.766 1.00 72.15 H new ATOM 0 HA SER A 24 14.425 -9.009 -8.376 1.00 75.44 H new ATOM 0 HB2 SER A 24 12.614 -9.307 -10.095 1.00 31.35 H new ATOM 0 HB3 SER A 24 13.149 -7.851 -10.912 1.00 31.35 H new ATOM 0 HG SER A 24 14.029 -9.771 -11.874 1.00 45.23 H new ATOM 390 N GLU A 25 15.039 -6.051 -9.793 1.00 41.11 N ATOM 391 CA GLU A 25 16.044 -5.236 -10.509 1.00 12.01 C ATOM 392 C GLU A 25 16.490 -4.031 -9.659 1.00 24.14 C ATOM 393 O GLU A 25 17.689 -3.742 -9.581 1.00 51.42 O ATOM 394 CB GLU A 25 15.465 -4.762 -11.879 1.00 72.30 C ATOM 395 CG GLU A 25 15.022 -5.906 -12.821 1.00 34.15 C ATOM 396 CD GLU A 25 14.605 -5.427 -14.228 1.00 64.42 C ATOM 397 OE1 GLU A 25 15.493 -5.139 -15.056 1.00 44.34 O ATOM 398 OE2 GLU A 25 13.396 -5.343 -14.518 1.00 60.54 O ATOM 0 H GLU A 25 14.123 -5.606 -9.731 1.00 41.11 H new ATOM 0 HA GLU A 25 16.923 -5.854 -10.692 1.00 12.01 H new ATOM 0 HB2 GLU A 25 14.611 -4.112 -11.692 1.00 72.30 H new ATOM 0 HB3 GLU A 25 16.218 -4.161 -12.388 1.00 72.30 H new ATOM 0 HG2 GLU A 25 15.839 -6.621 -12.918 1.00 34.15 H new ATOM 0 HG3 GLU A 25 14.186 -6.437 -12.365 1.00 34.15 H new ATOM 405 N HIS A 26 15.519 -3.332 -9.026 1.00 3.40 N ATOM 406 CA HIS A 26 15.812 -2.152 -8.172 1.00 4.30 C ATOM 407 C HIS A 26 16.573 -2.600 -6.914 1.00 71.14 C ATOM 408 O HIS A 26 17.629 -2.062 -6.564 1.00 52.10 O ATOM 409 CB HIS A 26 14.504 -1.416 -7.770 1.00 1.05 C ATOM 410 CG HIS A 26 14.732 -0.230 -6.857 1.00 74.13 C ATOM 411 ND1 HIS A 26 14.669 -0.351 -5.486 1.00 14.22 N ATOM 412 CD2 HIS A 26 15.063 1.048 -7.165 1.00 72.30 C ATOM 413 CE1 HIS A 26 14.970 0.840 -5.002 1.00 71.13 C ATOM 414 NE2 HIS A 26 15.212 1.715 -5.981 1.00 50.04 N ATOM 0 H HIS A 26 14.527 -3.562 -9.089 1.00 3.40 H new ATOM 0 HA HIS A 26 16.429 -1.458 -8.742 1.00 4.30 H new ATOM 0 HB2 HIS A 26 13.996 -1.077 -8.673 1.00 1.05 H new ATOM 0 HB3 HIS A 26 13.837 -2.122 -7.275 1.00 1.05 H new ATOM 0 HD2 HIS A 26 15.185 1.460 -8.156 1.00 72.30 H new ATOM 0 HE1 HIS A 26 15.015 1.076 -3.949 1.00 71.13 H new ATOM 0 HE2 HIS A 26 15.461 2.697 -5.867 1.00 50.04 H new ATOM 422 N ARG A 27 15.994 -3.601 -6.260 1.00 3.55 N ATOM 423 CA ARG A 27 16.558 -4.269 -5.084 1.00 42.41 C ATOM 424 C ARG A 27 16.535 -5.772 -5.319 1.00 5.33 C ATOM 425 O ARG A 27 15.686 -6.276 -6.068 1.00 30.15 O ATOM 426 CB ARG A 27 15.754 -3.886 -3.798 1.00 41.43 C ATOM 427 CG ARG A 27 16.163 -2.523 -3.202 1.00 55.41 C ATOM 428 CD ARG A 27 17.623 -2.532 -2.665 1.00 42.43 C ATOM 429 NE ARG A 27 18.399 -1.363 -3.095 1.00 12.43 N ATOM 430 CZ ARG A 27 19.735 -1.260 -3.027 1.00 55.22 C ATOM 431 NH1 ARG A 27 20.475 -2.256 -2.548 1.00 10.02 N ATOM 432 NH2 ARG A 27 20.324 -0.150 -3.440 1.00 45.31 N ATOM 0 H ARG A 27 15.091 -3.985 -6.539 1.00 3.55 H new ATOM 0 HA ARG A 27 17.588 -3.945 -4.932 1.00 42.41 H new ATOM 0 HB2 ARG A 27 14.691 -3.865 -4.036 1.00 41.43 H new ATOM 0 HB3 ARG A 27 15.897 -4.661 -3.045 1.00 41.43 H new ATOM 0 HG2 ARG A 27 16.063 -1.750 -3.964 1.00 55.41 H new ATOM 0 HG3 ARG A 27 15.481 -2.263 -2.392 1.00 55.41 H new ATOM 0 HD2 ARG A 27 17.603 -2.568 -1.576 1.00 42.43 H new ATOM 0 HD3 ARG A 27 18.124 -3.439 -3.005 1.00 42.43 H new ATOM 0 HE ARG A 27 17.884 -0.569 -3.474 1.00 12.43 H new ATOM 0 HH11 ARG A 27 20.028 -3.114 -2.226 1.00 10.02 H new ATOM 0 HH12 ARG A 27 21.490 -2.162 -2.503 1.00 10.02 H new ATOM 0 HH21 ARG A 27 19.763 0.619 -3.807 1.00 45.31 H new ATOM 0 HH22 ARG A 27 21.339 -0.063 -3.392 1.00 45.31 H new ATOM 446 N GLN A 28 17.494 -6.482 -4.702 1.00 71.42 N ATOM 447 CA GLN A 28 17.501 -7.951 -4.688 1.00 31.34 C ATOM 448 C GLN A 28 16.272 -8.453 -3.911 1.00 34.43 C ATOM 449 O GLN A 28 15.815 -7.778 -2.969 1.00 41.14 O ATOM 450 CB GLN A 28 18.853 -8.494 -4.109 1.00 20.42 C ATOM 451 CG GLN A 28 19.233 -8.005 -2.686 1.00 73.35 C ATOM 452 CD GLN A 28 18.505 -8.725 -1.539 1.00 73.31 C ATOM 453 OE1 GLN A 28 18.200 -9.918 -1.626 1.00 61.24 O ATOM 454 NE2 GLN A 28 18.218 -8.011 -0.467 1.00 54.14 N ATOM 0 H GLN A 28 18.277 -6.058 -4.205 1.00 71.42 H new ATOM 0 HA GLN A 28 17.432 -8.336 -5.705 1.00 31.34 H new ATOM 0 HB2 GLN A 28 18.808 -9.583 -4.097 1.00 20.42 H new ATOM 0 HB3 GLN A 28 19.655 -8.216 -4.793 1.00 20.42 H new ATOM 0 HG2 GLN A 28 20.307 -8.129 -2.550 1.00 73.35 H new ATOM 0 HG3 GLN A 28 19.024 -6.938 -2.616 1.00 73.35 H new ATOM 0 HE21 GLN A 28 18.483 -7.027 -0.424 1.00 54.14 H new ATOM 0 HE22 GLN A 28 17.731 -8.443 0.318 1.00 54.14 H new ATOM 463 N SER A 29 15.714 -9.597 -4.346 1.00 42.45 N ATOM 464 CA SER A 29 14.500 -10.171 -3.744 1.00 63.12 C ATOM 465 C SER A 29 14.696 -10.425 -2.227 1.00 20.41 C ATOM 466 O SER A 29 15.625 -11.134 -1.843 1.00 24.40 O ATOM 467 CB SER A 29 14.115 -11.481 -4.478 1.00 15.31 C ATOM 468 OG SER A 29 12.878 -12.005 -4.013 1.00 22.24 O ATOM 0 H SER A 29 16.090 -10.145 -5.120 1.00 42.45 H new ATOM 0 HA SER A 29 13.686 -9.455 -3.855 1.00 63.12 H new ATOM 0 HB2 SER A 29 14.049 -11.291 -5.549 1.00 15.31 H new ATOM 0 HB3 SER A 29 14.901 -12.223 -4.334 1.00 15.31 H new ATOM 0 HG SER A 29 12.668 -12.829 -4.500 1.00 22.24 H new ATOM 474 N PRO A 30 13.829 -9.829 -1.343 1.00 3.10 N ATOM 475 CA PRO A 30 13.871 -10.095 0.118 1.00 13.12 C ATOM 476 C PRO A 30 13.299 -11.484 0.453 1.00 14.11 C ATOM 477 O PRO A 30 13.550 -12.034 1.521 1.00 72.43 O ATOM 478 CB PRO A 30 12.983 -8.971 0.693 1.00 13.21 C ATOM 479 CG PRO A 30 11.984 -8.715 -0.390 1.00 64.43 C ATOM 480 CD PRO A 30 12.765 -8.832 -1.680 1.00 44.55 C ATOM 0 HA PRO A 30 14.882 -10.100 0.526 1.00 13.12 H new ATOM 0 HB2 PRO A 30 12.498 -9.279 1.620 1.00 13.21 H new ATOM 0 HB3 PRO A 30 13.565 -8.078 0.919 1.00 13.21 H new ATOM 0 HG2 PRO A 30 11.170 -9.439 -0.355 1.00 64.43 H new ATOM 0 HG3 PRO A 30 11.536 -7.726 -0.288 1.00 64.43 H new ATOM 0 HD2 PRO A 30 12.137 -9.175 -2.502 1.00 44.55 H new ATOM 0 HD3 PRO A 30 13.190 -7.875 -1.982 1.00 44.55 H new ATOM 488 N ILE A 31 12.503 -12.012 -0.486 1.00 41.12 N ATOM 489 CA ILE A 31 11.858 -13.318 -0.384 1.00 4.40 C ATOM 490 C ILE A 31 12.960 -14.425 -0.422 1.00 72.14 C ATOM 491 O ILE A 31 13.592 -14.597 -1.467 1.00 53.14 O ATOM 492 CB ILE A 31 10.811 -13.500 -1.567 1.00 4.12 C ATOM 493 CG1 ILE A 31 9.970 -12.190 -1.822 1.00 30.00 C ATOM 494 CG2 ILE A 31 9.878 -14.702 -1.311 1.00 74.44 C ATOM 495 CD1 ILE A 31 9.109 -11.700 -0.660 1.00 33.20 C ATOM 0 H ILE A 31 12.287 -11.527 -1.357 1.00 41.12 H new ATOM 0 HA ILE A 31 11.310 -13.398 0.555 1.00 4.40 H new ATOM 0 HB ILE A 31 11.389 -13.700 -2.469 1.00 4.12 H new ATOM 0 HG12 ILE A 31 10.658 -11.391 -2.099 1.00 30.00 H new ATOM 0 HG13 ILE A 31 9.320 -12.363 -2.680 1.00 30.00 H new ATOM 0 HG21 ILE A 31 9.174 -14.799 -2.138 1.00 74.44 H new ATOM 0 HG22 ILE A 31 10.472 -15.613 -1.231 1.00 74.44 H new ATOM 0 HG23 ILE A 31 9.328 -14.545 -0.383 1.00 74.44 H new ATOM 0 HD11 ILE A 31 8.580 -10.794 -0.956 1.00 33.20 H new ATOM 0 HD12 ILE A 31 8.387 -12.471 -0.392 1.00 33.20 H new ATOM 0 HD13 ILE A 31 9.745 -11.484 0.198 1.00 33.20 H new ATOM 507 N PRO A 32 13.238 -15.148 0.732 1.00 2.01 N ATOM 508 CA PRO A 32 14.363 -16.138 0.839 1.00 33.43 C ATOM 509 C PRO A 32 14.261 -17.309 -0.199 1.00 14.24 C ATOM 510 O PRO A 32 13.184 -17.510 -0.771 1.00 62.21 O ATOM 511 CB PRO A 32 14.276 -16.616 2.325 1.00 22.52 C ATOM 512 CG PRO A 32 12.905 -16.260 2.793 1.00 21.51 C ATOM 513 CD PRO A 32 12.501 -15.034 2.017 1.00 2.13 C ATOM 0 HA PRO A 32 15.331 -15.700 0.597 1.00 33.43 H new ATOM 0 HB2 PRO A 32 14.447 -17.690 2.400 1.00 22.52 H new ATOM 0 HB3 PRO A 32 15.036 -16.129 2.936 1.00 22.52 H new ATOM 0 HG2 PRO A 32 12.208 -17.080 2.616 1.00 21.51 H new ATOM 0 HG3 PRO A 32 12.899 -16.062 3.865 1.00 21.51 H new ATOM 0 HD2 PRO A 32 11.423 -15.004 1.855 1.00 2.13 H new ATOM 0 HD3 PRO A 32 12.769 -14.121 2.549 1.00 2.13 H new ATOM 521 N PRO A 33 15.382 -18.104 -0.442 1.00 73.14 N ATOM 522 CA PRO A 33 15.537 -19.012 -1.631 1.00 24.01 C ATOM 523 C PRO A 33 14.305 -19.902 -1.929 1.00 62.35 C ATOM 524 O PRO A 33 13.679 -19.752 -2.979 1.00 54.45 O ATOM 525 CB PRO A 33 16.799 -19.874 -1.278 1.00 75.32 C ATOM 526 CG PRO A 33 17.043 -19.635 0.185 1.00 40.52 C ATOM 527 CD PRO A 33 16.589 -18.217 0.430 1.00 53.43 C ATOM 0 HA PRO A 33 15.642 -18.432 -2.548 1.00 24.01 H new ATOM 0 HB2 PRO A 33 16.623 -20.931 -1.480 1.00 75.32 H new ATOM 0 HB3 PRO A 33 17.660 -19.574 -1.875 1.00 75.32 H new ATOM 0 HG2 PRO A 33 16.483 -20.340 0.799 1.00 40.52 H new ATOM 0 HG3 PRO A 33 18.096 -19.761 0.435 1.00 40.52 H new ATOM 0 HD2 PRO A 33 16.348 -18.044 1.479 1.00 53.43 H new ATOM 0 HD3 PRO A 33 17.356 -17.493 0.156 1.00 53.43 H new ATOM 535 N GLU A 34 13.961 -20.786 -0.972 1.00 32.34 N ATOM 536 CA GLU A 34 12.848 -21.761 -1.092 1.00 30.05 C ATOM 537 C GLU A 34 11.483 -21.072 -1.310 1.00 14.43 C ATOM 538 O GLU A 34 10.636 -21.582 -2.061 1.00 41.03 O ATOM 539 CB GLU A 34 12.805 -22.702 0.161 1.00 72.54 C ATOM 540 CG GLU A 34 12.465 -22.045 1.521 1.00 44.22 C ATOM 541 CD GLU A 34 13.495 -21.001 1.992 1.00 71.35 C ATOM 542 OE1 GLU A 34 14.573 -21.395 2.487 1.00 13.43 O ATOM 543 OE2 GLU A 34 13.248 -19.792 1.843 1.00 61.42 O ATOM 0 H GLU A 34 14.452 -20.847 -0.080 1.00 32.34 H new ATOM 0 HA GLU A 34 13.042 -22.364 -1.979 1.00 30.05 H new ATOM 0 HB2 GLU A 34 12.072 -23.486 -0.029 1.00 72.54 H new ATOM 0 HB3 GLU A 34 13.776 -23.189 0.253 1.00 72.54 H new ATOM 0 HG2 GLU A 34 11.488 -21.568 1.447 1.00 44.22 H new ATOM 0 HG3 GLU A 34 12.382 -22.825 2.278 1.00 44.22 H new ATOM 550 N GLU A 35 11.299 -19.905 -0.657 1.00 14.44 N ATOM 551 CA GLU A 35 10.070 -19.105 -0.757 1.00 71.02 C ATOM 552 C GLU A 35 9.858 -18.591 -2.184 1.00 32.25 C ATOM 553 O GLU A 35 8.847 -18.916 -2.802 1.00 41.22 O ATOM 554 CB GLU A 35 10.111 -17.929 0.252 1.00 52.23 C ATOM 555 CG GLU A 35 10.102 -18.350 1.728 1.00 22.52 C ATOM 556 CD GLU A 35 8.737 -18.849 2.231 1.00 42.34 C ATOM 557 OE1 GLU A 35 8.381 -20.022 1.989 1.00 32.00 O ATOM 558 OE2 GLU A 35 8.019 -18.071 2.892 1.00 22.35 O ATOM 0 H GLU A 35 12.004 -19.494 -0.045 1.00 14.44 H new ATOM 0 HA GLU A 35 9.225 -19.747 -0.509 1.00 71.02 H new ATOM 0 HB2 GLU A 35 11.006 -17.337 0.063 1.00 52.23 H new ATOM 0 HB3 GLU A 35 9.255 -17.280 0.068 1.00 52.23 H new ATOM 0 HG2 GLU A 35 10.841 -19.138 1.874 1.00 22.52 H new ATOM 0 HG3 GLU A 35 10.414 -17.503 2.338 1.00 22.52 H new ATOM 565 N ARG A 36 10.824 -17.816 -2.721 1.00 55.13 N ATOM 566 CA ARG A 36 10.720 -17.255 -4.086 1.00 5.44 C ATOM 567 C ARG A 36 10.838 -18.326 -5.185 1.00 1.53 C ATOM 568 O ARG A 36 10.440 -18.082 -6.330 1.00 61.23 O ATOM 569 CB ARG A 36 11.778 -16.150 -4.308 1.00 33.12 C ATOM 570 CG ARG A 36 13.235 -16.636 -4.208 1.00 74.11 C ATOM 571 CD ARG A 36 14.253 -15.533 -4.529 1.00 30.42 C ATOM 572 NE ARG A 36 14.131 -15.013 -5.908 1.00 31.23 N ATOM 573 CZ ARG A 36 15.119 -14.422 -6.607 1.00 34.30 C ATOM 574 NH1 ARG A 36 16.331 -14.260 -6.075 1.00 10.12 N ATOM 575 NH2 ARG A 36 14.880 -13.985 -7.841 1.00 24.23 N ATOM 0 H ARG A 36 11.683 -17.565 -2.232 1.00 55.13 H new ATOM 0 HA ARG A 36 9.722 -16.823 -4.164 1.00 5.44 H new ATOM 0 HB2 ARG A 36 11.622 -15.707 -5.292 1.00 33.12 H new ATOM 0 HB3 ARG A 36 11.620 -15.360 -3.574 1.00 33.12 H new ATOM 0 HG2 ARG A 36 13.419 -17.013 -3.202 1.00 74.11 H new ATOM 0 HG3 ARG A 36 13.383 -17.471 -4.893 1.00 74.11 H new ATOM 0 HD2 ARG A 36 14.123 -14.711 -3.825 1.00 30.42 H new ATOM 0 HD3 ARG A 36 15.260 -15.923 -4.382 1.00 30.42 H new ATOM 0 HE ARG A 36 13.225 -15.110 -6.367 1.00 31.23 H new ATOM 0 HH11 ARG A 36 16.519 -14.585 -5.127 1.00 10.12 H new ATOM 0 HH12 ARG A 36 17.070 -13.811 -6.616 1.00 10.12 H new ATOM 0 HH21 ARG A 36 13.953 -14.099 -8.252 1.00 24.23 H new ATOM 0 HH22 ARG A 36 15.624 -13.536 -8.376 1.00 24.23 H new ATOM 589 N ASP A 37 11.393 -19.496 -4.827 1.00 1.44 N ATOM 590 CA ASP A 37 11.526 -20.643 -5.745 1.00 22.22 C ATOM 591 C ASP A 37 10.134 -21.196 -6.129 1.00 1.35 C ATOM 592 O ASP A 37 9.935 -21.691 -7.247 1.00 62.01 O ATOM 593 CB ASP A 37 12.407 -21.741 -5.087 1.00 53.12 C ATOM 594 CG ASP A 37 12.728 -22.919 -6.021 1.00 44.43 C ATOM 595 OD1 ASP A 37 13.437 -22.709 -7.033 1.00 53.42 O ATOM 596 OD2 ASP A 37 12.271 -24.054 -5.764 1.00 4.40 O ATOM 0 H ASP A 37 11.763 -19.675 -3.893 1.00 1.44 H new ATOM 0 HA ASP A 37 12.013 -20.313 -6.663 1.00 22.22 H new ATOM 0 HB2 ASP A 37 13.341 -21.291 -4.750 1.00 53.12 H new ATOM 0 HB3 ASP A 37 11.898 -22.120 -4.201 1.00 53.12 H new ATOM 601 N ASP A 38 9.178 -21.094 -5.180 1.00 43.20 N ATOM 602 CA ASP A 38 7.770 -21.505 -5.392 1.00 33.35 C ATOM 603 C ASP A 38 6.870 -20.299 -5.739 1.00 4.42 C ATOM 604 O ASP A 38 5.962 -20.412 -6.577 1.00 5.24 O ATOM 605 CB ASP A 38 7.245 -22.190 -4.109 1.00 50.51 C ATOM 606 CG ASP A 38 5.836 -22.800 -4.277 1.00 53.21 C ATOM 607 OD1 ASP A 38 5.739 -23.933 -4.801 1.00 31.43 O ATOM 608 OD2 ASP A 38 4.821 -22.157 -3.903 1.00 34.25 O ATOM 0 H ASP A 38 9.359 -20.725 -4.246 1.00 43.20 H new ATOM 0 HA ASP A 38 7.739 -22.197 -6.234 1.00 33.35 H new ATOM 0 HB2 ASP A 38 7.941 -22.975 -3.814 1.00 50.51 H new ATOM 0 HB3 ASP A 38 7.224 -21.461 -3.299 1.00 50.51 H new ATOM 613 N PHE A 39 7.137 -19.148 -5.107 1.00 74.24 N ATOM 614 CA PHE A 39 6.392 -17.900 -5.351 1.00 1.43 C ATOM 615 C PHE A 39 7.347 -16.932 -6.054 1.00 51.03 C ATOM 616 O PHE A 39 8.134 -16.252 -5.391 1.00 13.33 O ATOM 617 CB PHE A 39 5.910 -17.272 -3.999 1.00 42.01 C ATOM 618 CG PHE A 39 5.134 -18.208 -3.066 1.00 60.11 C ATOM 619 CD1 PHE A 39 3.768 -18.412 -3.240 1.00 52.04 C ATOM 620 CD2 PHE A 39 5.767 -18.869 -2.005 1.00 11.43 C ATOM 621 CE1 PHE A 39 3.060 -19.244 -2.390 1.00 41.51 C ATOM 622 CE2 PHE A 39 5.058 -19.700 -1.155 1.00 5.11 C ATOM 623 CZ PHE A 39 3.704 -19.885 -1.348 1.00 32.02 C ATOM 0 H PHE A 39 7.876 -19.053 -4.411 1.00 74.24 H new ATOM 0 HA PHE A 39 5.511 -18.100 -5.961 1.00 1.43 H new ATOM 0 HB2 PHE A 39 6.782 -16.897 -3.463 1.00 42.01 H new ATOM 0 HB3 PHE A 39 5.280 -16.411 -4.224 1.00 42.01 H new ATOM 0 HD1 PHE A 39 3.254 -17.914 -4.049 1.00 52.04 H new ATOM 0 HD2 PHE A 39 6.826 -18.728 -1.848 1.00 11.43 H new ATOM 0 HE1 PHE A 39 2.001 -19.393 -2.541 1.00 41.51 H new ATOM 0 HE2 PHE A 39 5.563 -20.202 -0.343 1.00 5.11 H new ATOM 0 HZ PHE A 39 3.147 -20.531 -0.685 1.00 32.02 H new ATOM 633 N ASP A 40 7.252 -16.815 -7.382 1.00 23.44 N ATOM 634 CA ASP A 40 8.221 -16.009 -8.157 1.00 61.11 C ATOM 635 C ASP A 40 7.540 -14.722 -8.615 1.00 21.52 C ATOM 636 O ASP A 40 6.975 -14.638 -9.715 1.00 72.25 O ATOM 637 CB ASP A 40 8.800 -16.823 -9.345 1.00 74.43 C ATOM 638 CG ASP A 40 9.915 -16.074 -10.110 1.00 22.32 C ATOM 639 OD1 ASP A 40 11.047 -15.987 -9.583 1.00 61.43 O ATOM 640 OD2 ASP A 40 9.668 -15.574 -11.233 1.00 24.20 O ATOM 0 H ASP A 40 6.526 -17.259 -7.944 1.00 23.44 H new ATOM 0 HA ASP A 40 9.070 -15.746 -7.526 1.00 61.11 H new ATOM 0 HB2 ASP A 40 9.196 -17.767 -8.971 1.00 74.43 H new ATOM 0 HB3 ASP A 40 7.994 -17.067 -10.037 1.00 74.43 H new ATOM 645 N GLY A 41 7.517 -13.757 -7.694 1.00 35.23 N ATOM 646 CA GLY A 41 6.937 -12.448 -7.930 1.00 64.34 C ATOM 647 C GLY A 41 6.374 -11.859 -6.648 1.00 71.43 C ATOM 648 O GLY A 41 6.599 -12.396 -5.551 1.00 61.04 O ATOM 0 H GLY A 41 7.906 -13.870 -6.758 1.00 35.23 H new ATOM 0 HA2 GLY A 41 7.695 -11.780 -8.339 1.00 64.34 H new ATOM 0 HA3 GLY A 41 6.146 -12.527 -8.676 1.00 64.34 H new ATOM 652 N LEU A 42 5.652 -10.742 -6.792 1.00 73.11 N ATOM 653 CA LEU A 42 4.807 -10.186 -5.737 1.00 20.13 C ATOM 654 C LEU A 42 3.533 -11.029 -5.603 1.00 44.34 C ATOM 655 O LEU A 42 2.663 -10.991 -6.480 1.00 54.12 O ATOM 656 CB LEU A 42 4.460 -8.691 -6.030 1.00 52.20 C ATOM 657 CG LEU A 42 5.609 -7.684 -5.733 1.00 34.23 C ATOM 658 CD1 LEU A 42 5.279 -6.254 -6.220 1.00 13.14 C ATOM 659 CD2 LEU A 42 5.935 -7.703 -4.227 1.00 74.13 C ATOM 0 H LEU A 42 5.640 -10.196 -7.653 1.00 73.11 H new ATOM 0 HA LEU A 42 5.352 -10.217 -4.793 1.00 20.13 H new ATOM 0 HB2 LEU A 42 4.176 -8.597 -7.078 1.00 52.20 H new ATOM 0 HB3 LEU A 42 3.589 -8.412 -5.437 1.00 52.20 H new ATOM 0 HG LEU A 42 6.489 -8.000 -6.294 1.00 34.23 H new ATOM 0 HD11 LEU A 42 6.112 -5.590 -5.989 1.00 13.14 H new ATOM 0 HD12 LEU A 42 5.112 -6.266 -7.297 1.00 13.14 H new ATOM 0 HD13 LEU A 42 4.380 -5.897 -5.717 1.00 13.14 H new ATOM 0 HD21 LEU A 42 6.740 -6.998 -4.020 1.00 74.13 H new ATOM 0 HD22 LEU A 42 5.049 -7.419 -3.659 1.00 74.13 H new ATOM 0 HD23 LEU A 42 6.247 -8.706 -3.935 1.00 74.13 H new ATOM 671 N SER A 43 3.485 -11.853 -4.549 1.00 74.42 N ATOM 672 CA SER A 43 2.260 -12.511 -4.111 1.00 4.32 C ATOM 673 C SER A 43 1.322 -11.451 -3.499 1.00 53.11 C ATOM 674 O SER A 43 1.674 -10.801 -2.503 1.00 14.01 O ATOM 675 CB SER A 43 2.600 -13.608 -3.074 1.00 60.34 C ATOM 676 OG SER A 43 3.576 -14.503 -3.584 1.00 41.03 O ATOM 0 H SER A 43 4.300 -12.079 -3.978 1.00 74.42 H new ATOM 0 HA SER A 43 1.762 -12.985 -4.957 1.00 4.32 H new ATOM 0 HB2 SER A 43 2.968 -13.146 -2.158 1.00 60.34 H new ATOM 0 HB3 SER A 43 1.697 -14.159 -2.813 1.00 60.34 H new ATOM 0 HG SER A 43 3.776 -15.187 -2.911 1.00 41.03 H new ATOM 682 N TYR A 44 0.156 -11.268 -4.125 1.00 4.24 N ATOM 683 CA TYR A 44 -0.867 -10.319 -3.660 1.00 44.41 C ATOM 684 C TYR A 44 -2.267 -10.869 -3.961 1.00 52.01 C ATOM 685 O TYR A 44 -2.413 -11.967 -4.516 1.00 53.41 O ATOM 686 CB TYR A 44 -0.640 -8.892 -4.273 1.00 20.01 C ATOM 687 CG TYR A 44 -0.765 -8.758 -5.807 1.00 12.51 C ATOM 688 CD1 TYR A 44 -1.993 -8.472 -6.409 1.00 2.21 C ATOM 689 CD2 TYR A 44 0.338 -8.898 -6.650 1.00 34.54 C ATOM 690 CE1 TYR A 44 -2.121 -8.341 -7.774 1.00 43.14 C ATOM 691 CE2 TYR A 44 0.211 -8.763 -8.021 1.00 30.05 C ATOM 692 CZ TYR A 44 -1.021 -8.487 -8.573 1.00 42.20 C ATOM 693 OH TYR A 44 -1.152 -8.365 -9.936 1.00 54.30 O ATOM 0 H TYR A 44 -0.108 -11.773 -4.971 1.00 4.24 H new ATOM 0 HA TYR A 44 -0.780 -10.206 -2.579 1.00 44.41 H new ATOM 0 HB2 TYR A 44 -1.355 -8.209 -3.814 1.00 20.01 H new ATOM 0 HB3 TYR A 44 0.355 -8.554 -3.984 1.00 20.01 H new ATOM 0 HD1 TYR A 44 -2.867 -8.350 -5.786 1.00 2.21 H new ATOM 0 HD2 TYR A 44 1.307 -9.115 -6.225 1.00 34.54 H new ATOM 0 HE1 TYR A 44 -3.085 -8.124 -8.211 1.00 43.14 H new ATOM 0 HE2 TYR A 44 1.076 -8.874 -8.658 1.00 30.05 H new ATOM 0 HH TYR A 44 -1.883 -7.745 -10.140 1.00 54.30 H new ATOM 703 N PHE A 45 -3.287 -10.083 -3.602 1.00 4.40 N ATOM 704 CA PHE A 45 -4.693 -10.474 -3.764 1.00 43.10 C ATOM 705 C PHE A 45 -5.096 -10.194 -5.223 1.00 4.54 C ATOM 706 O PHE A 45 -4.866 -9.084 -5.708 1.00 73.30 O ATOM 707 CB PHE A 45 -5.591 -9.680 -2.776 1.00 11.03 C ATOM 708 CG PHE A 45 -5.102 -9.689 -1.329 1.00 60.22 C ATOM 709 CD1 PHE A 45 -5.191 -10.842 -0.555 1.00 45.31 C ATOM 710 CD2 PHE A 45 -4.548 -8.546 -0.745 1.00 23.42 C ATOM 711 CE1 PHE A 45 -4.748 -10.851 0.751 1.00 3.11 C ATOM 712 CE2 PHE A 45 -4.106 -8.559 0.563 1.00 73.54 C ATOM 713 CZ PHE A 45 -4.203 -9.711 1.310 1.00 45.32 C ATOM 0 H PHE A 45 -3.162 -9.158 -3.191 1.00 4.40 H new ATOM 0 HA PHE A 45 -4.823 -11.533 -3.542 1.00 43.10 H new ATOM 0 HB2 PHE A 45 -5.659 -8.647 -3.117 1.00 11.03 H new ATOM 0 HB3 PHE A 45 -6.599 -10.094 -2.808 1.00 11.03 H new ATOM 0 HD1 PHE A 45 -5.612 -11.740 -0.982 1.00 45.31 H new ATOM 0 HD2 PHE A 45 -4.464 -7.639 -1.326 1.00 23.42 H new ATOM 0 HE1 PHE A 45 -4.827 -11.753 1.339 1.00 3.11 H new ATOM 0 HE2 PHE A 45 -3.684 -7.666 1.000 1.00 73.54 H new ATOM 0 HZ PHE A 45 -3.854 -9.724 2.332 1.00 45.32 H new ATOM 723 N ASP A 46 -5.721 -11.180 -5.904 1.00 71.44 N ATOM 724 CA ASP A 46 -5.974 -11.115 -7.364 1.00 31.42 C ATOM 725 C ASP A 46 -6.841 -9.878 -7.707 1.00 52.03 C ATOM 726 O ASP A 46 -7.861 -9.654 -7.042 1.00 31.01 O ATOM 727 CB ASP A 46 -6.654 -12.419 -7.870 1.00 34.21 C ATOM 728 CG ASP A 46 -6.960 -12.418 -9.388 1.00 21.33 C ATOM 729 OD1 ASP A 46 -6.066 -12.769 -10.190 1.00 62.21 O ATOM 730 OD2 ASP A 46 -8.092 -12.070 -9.784 1.00 14.33 O ATOM 0 H ASP A 46 -6.062 -12.035 -5.465 1.00 71.44 H new ATOM 0 HA ASP A 46 -5.015 -11.018 -7.872 1.00 31.42 H new ATOM 0 HB2 ASP A 46 -6.009 -13.267 -7.640 1.00 34.21 H new ATOM 0 HB3 ASP A 46 -7.584 -12.569 -7.322 1.00 34.21 H new ATOM 735 N PRO A 47 -6.421 -9.049 -8.727 1.00 70.14 N ATOM 736 CA PRO A 47 -7.078 -7.758 -9.066 1.00 62.13 C ATOM 737 C PRO A 47 -8.612 -7.877 -9.258 1.00 34.31 C ATOM 738 O PRO A 47 -9.083 -8.498 -10.215 1.00 34.44 O ATOM 739 CB PRO A 47 -6.361 -7.327 -10.386 1.00 1.34 C ATOM 740 CG PRO A 47 -5.667 -8.558 -10.884 1.00 5.13 C ATOM 741 CD PRO A 47 -5.269 -9.301 -9.640 1.00 73.44 C ATOM 0 HA PRO A 47 -6.981 -7.030 -8.260 1.00 62.13 H new ATOM 0 HB2 PRO A 47 -7.078 -6.957 -11.119 1.00 1.34 H new ATOM 0 HB3 PRO A 47 -5.649 -6.522 -10.201 1.00 1.34 H new ATOM 0 HG2 PRO A 47 -6.327 -9.159 -11.510 1.00 5.13 H new ATOM 0 HG3 PRO A 47 -4.797 -8.305 -11.489 1.00 5.13 H new ATOM 0 HD2 PRO A 47 -5.128 -10.365 -9.831 1.00 73.44 H new ATOM 0 HD3 PRO A 47 -4.334 -8.925 -9.225 1.00 73.44 H new ATOM 749 N ASP A 48 -9.377 -7.276 -8.323 1.00 11.20 N ATOM 750 CA ASP A 48 -10.858 -7.287 -8.352 1.00 1.34 C ATOM 751 C ASP A 48 -11.407 -5.842 -8.394 1.00 21.53 C ATOM 752 O ASP A 48 -11.116 -5.058 -7.487 1.00 20.12 O ATOM 753 CB ASP A 48 -11.427 -8.033 -7.120 1.00 33.24 C ATOM 754 CG ASP A 48 -12.971 -8.098 -7.122 1.00 41.40 C ATOM 755 OD1 ASP A 48 -13.558 -8.564 -8.119 1.00 25.12 O ATOM 756 OD2 ASP A 48 -13.606 -7.697 -6.129 1.00 21.54 O ATOM 0 H ASP A 48 -8.988 -6.770 -7.527 1.00 11.20 H new ATOM 0 HA ASP A 48 -11.175 -7.813 -9.253 1.00 1.34 H new ATOM 0 HB2 ASP A 48 -11.025 -9.046 -7.096 1.00 33.24 H new ATOM 0 HB3 ASP A 48 -11.090 -7.535 -6.211 1.00 33.24 H new ATOM 761 N PRO A 49 -12.222 -5.462 -9.432 1.00 55.54 N ATOM 762 CA PRO A 49 -12.799 -4.102 -9.527 1.00 53.30 C ATOM 763 C PRO A 49 -13.863 -3.837 -8.437 1.00 4.14 C ATOM 764 O PRO A 49 -13.996 -2.710 -7.958 1.00 12.22 O ATOM 765 CB PRO A 49 -13.427 -4.049 -10.952 1.00 30.42 C ATOM 766 CG PRO A 49 -12.955 -5.292 -11.658 1.00 73.21 C ATOM 767 CD PRO A 49 -12.644 -6.305 -10.582 1.00 74.12 C ATOM 0 HA PRO A 49 -12.043 -3.333 -9.370 1.00 53.30 H new ATOM 0 HB2 PRO A 49 -14.515 -4.020 -10.898 1.00 30.42 H new ATOM 0 HB3 PRO A 49 -13.110 -3.153 -11.485 1.00 30.42 H new ATOM 0 HG2 PRO A 49 -13.722 -5.668 -12.335 1.00 73.21 H new ATOM 0 HG3 PRO A 49 -12.072 -5.084 -12.261 1.00 73.21 H new ATOM 0 HD2 PRO A 49 -13.515 -6.913 -10.337 1.00 74.12 H new ATOM 0 HD3 PRO A 49 -11.854 -6.990 -10.890 1.00 74.12 H new ATOM 775 N ASP A 50 -14.604 -4.896 -8.047 1.00 50.32 N ATOM 776 CA ASP A 50 -15.742 -4.786 -7.101 1.00 52.21 C ATOM 777 C ASP A 50 -15.275 -4.533 -5.655 1.00 33.34 C ATOM 778 O ASP A 50 -16.034 -3.991 -4.846 1.00 72.13 O ATOM 779 CB ASP A 50 -16.622 -6.060 -7.187 1.00 50.20 C ATOM 780 CG ASP A 50 -17.943 -5.957 -6.391 1.00 71.50 C ATOM 781 OD1 ASP A 50 -18.849 -5.205 -6.823 1.00 42.20 O ATOM 782 OD2 ASP A 50 -18.084 -6.622 -5.336 1.00 74.45 O ATOM 0 H ASP A 50 -14.434 -5.847 -8.375 1.00 50.32 H new ATOM 0 HA ASP A 50 -16.337 -3.920 -7.392 1.00 52.21 H new ATOM 0 HB2 ASP A 50 -16.853 -6.261 -8.233 1.00 50.20 H new ATOM 0 HB3 ASP A 50 -16.051 -6.911 -6.817 1.00 50.20 H new ATOM 787 N TYR A 51 -14.011 -4.892 -5.349 1.00 32.44 N ATOM 788 CA TYR A 51 -13.431 -4.696 -4.001 1.00 10.13 C ATOM 789 C TYR A 51 -12.765 -3.302 -3.896 1.00 43.22 C ATOM 790 O TYR A 51 -12.258 -2.914 -2.833 1.00 41.52 O ATOM 791 CB TYR A 51 -12.419 -5.834 -3.668 1.00 51.32 C ATOM 792 CG TYR A 51 -11.962 -5.896 -2.202 1.00 4.42 C ATOM 793 CD1 TYR A 51 -12.832 -5.563 -1.155 1.00 71.10 C ATOM 794 CD2 TYR A 51 -10.667 -6.294 -1.862 1.00 72.05 C ATOM 795 CE1 TYR A 51 -12.427 -5.622 0.157 1.00 45.11 C ATOM 796 CE2 TYR A 51 -10.264 -6.355 -0.547 1.00 63.43 C ATOM 797 CZ TYR A 51 -11.150 -6.017 0.457 1.00 63.52 C ATOM 798 OH TYR A 51 -10.756 -6.074 1.767 1.00 44.42 O ATOM 0 H TYR A 51 -13.370 -5.320 -6.017 1.00 32.44 H new ATOM 0 HA TYR A 51 -14.235 -4.740 -3.266 1.00 10.13 H new ATOM 0 HB2 TYR A 51 -12.872 -6.790 -3.931 1.00 51.32 H new ATOM 0 HB3 TYR A 51 -11.540 -5.713 -4.301 1.00 51.32 H new ATOM 0 HD1 TYR A 51 -13.841 -5.254 -1.384 1.00 71.10 H new ATOM 0 HD2 TYR A 51 -9.970 -6.558 -2.644 1.00 72.05 H new ATOM 0 HE1 TYR A 51 -13.113 -5.358 0.948 1.00 45.11 H new ATOM 0 HE2 TYR A 51 -9.259 -6.666 -0.302 1.00 63.43 H new ATOM 0 HH TYR A 51 -11.418 -6.577 2.286 1.00 44.42 H new ATOM 808 N ARG A 52 -12.776 -2.549 -5.008 1.00 31.43 N ATOM 809 CA ARG A 52 -12.256 -1.182 -5.035 1.00 52.03 C ATOM 810 C ARG A 52 -13.332 -0.219 -4.490 1.00 64.35 C ATOM 811 O ARG A 52 -14.479 -0.248 -4.945 1.00 24.32 O ATOM 812 CB ARG A 52 -11.811 -0.799 -6.478 1.00 74.22 C ATOM 813 CG ARG A 52 -10.979 0.501 -6.550 1.00 30.11 C ATOM 814 CD ARG A 52 -10.191 0.666 -7.867 1.00 51.32 C ATOM 815 NE ARG A 52 -11.045 1.044 -9.010 1.00 21.43 N ATOM 816 CZ ARG A 52 -10.699 1.922 -9.974 1.00 64.51 C ATOM 817 NH1 ARG A 52 -9.511 2.533 -9.948 1.00 45.52 N ATOM 818 NH2 ARG A 52 -11.537 2.171 -10.972 1.00 33.32 N ATOM 0 H ARG A 52 -13.143 -2.871 -5.903 1.00 31.43 H new ATOM 0 HA ARG A 52 -11.375 -1.108 -4.398 1.00 52.03 H new ATOM 0 HB2 ARG A 52 -11.226 -1.618 -6.897 1.00 74.22 H new ATOM 0 HB3 ARG A 52 -12.697 -0.688 -7.104 1.00 74.22 H new ATOM 0 HG2 ARG A 52 -11.645 1.355 -6.427 1.00 30.11 H new ATOM 0 HG3 ARG A 52 -10.279 0.520 -5.714 1.00 30.11 H new ATOM 0 HD2 ARG A 52 -9.421 1.425 -7.730 1.00 51.32 H new ATOM 0 HD3 ARG A 52 -9.680 -0.269 -8.097 1.00 51.32 H new ATOM 0 HE ARG A 52 -11.965 0.609 -9.076 1.00 21.43 H new ATOM 0 HH11 ARG A 52 -8.853 2.338 -9.193 1.00 45.52 H new ATOM 0 HH12 ARG A 52 -9.262 3.195 -10.683 1.00 45.52 H new ATOM 0 HH21 ARG A 52 -12.440 1.699 -11.009 1.00 33.32 H new ATOM 0 HH22 ARG A 52 -11.278 2.834 -11.702 1.00 33.32 H new ATOM 832 N VAL A 53 -12.953 0.611 -3.502 1.00 11.24 N ATOM 833 CA VAL A 53 -13.854 1.582 -2.841 1.00 23.42 C ATOM 834 C VAL A 53 -13.362 3.013 -3.133 1.00 43.34 C ATOM 835 O VAL A 53 -12.289 3.198 -3.725 1.00 43.02 O ATOM 836 CB VAL A 53 -13.928 1.348 -1.272 1.00 62.35 C ATOM 837 CG1 VAL A 53 -14.501 -0.050 -0.930 1.00 30.40 C ATOM 838 CG2 VAL A 53 -12.553 1.569 -0.587 1.00 73.31 C ATOM 0 H VAL A 53 -12.002 0.629 -3.133 1.00 11.24 H new ATOM 0 HA VAL A 53 -14.858 1.439 -3.242 1.00 23.42 H new ATOM 0 HB VAL A 53 -14.614 2.096 -0.874 1.00 62.35 H new ATOM 0 HG11 VAL A 53 -14.536 -0.174 0.152 1.00 30.40 H new ATOM 0 HG12 VAL A 53 -15.507 -0.141 -1.339 1.00 30.40 H new ATOM 0 HG13 VAL A 53 -13.863 -0.821 -1.363 1.00 30.40 H new ATOM 0 HG21 VAL A 53 -12.649 1.399 0.485 1.00 73.31 H new ATOM 0 HG22 VAL A 53 -11.824 0.872 -1.001 1.00 73.31 H new ATOM 0 HG23 VAL A 53 -12.219 2.591 -0.763 1.00 73.31 H new ATOM 848 N GLU A 54 -14.155 4.016 -2.734 1.00 55.42 N ATOM 849 CA GLU A 54 -13.758 5.441 -2.802 1.00 23.45 C ATOM 850 C GLU A 54 -13.498 5.966 -1.378 1.00 20.31 C ATOM 851 O GLU A 54 -14.068 5.447 -0.409 1.00 23.44 O ATOM 852 CB GLU A 54 -14.854 6.278 -3.520 1.00 55.31 C ATOM 853 CG GLU A 54 -16.232 6.296 -2.813 1.00 23.41 C ATOM 854 CD GLU A 54 -17.334 6.983 -3.640 1.00 33.44 C ATOM 855 OE1 GLU A 54 -17.437 8.230 -3.599 1.00 3.34 O ATOM 856 OE2 GLU A 54 -18.102 6.280 -4.337 1.00 13.11 O ATOM 0 H GLU A 54 -15.090 3.870 -2.354 1.00 55.42 H new ATOM 0 HA GLU A 54 -12.840 5.536 -3.383 1.00 23.45 H new ATOM 0 HB2 GLU A 54 -14.500 7.304 -3.619 1.00 55.31 H new ATOM 0 HB3 GLU A 54 -14.985 5.887 -4.529 1.00 55.31 H new ATOM 0 HG2 GLU A 54 -16.535 5.271 -2.598 1.00 23.41 H new ATOM 0 HG3 GLU A 54 -16.134 6.808 -1.855 1.00 23.41 H new ATOM 863 N ALA A 55 -12.635 6.989 -1.264 1.00 24.43 N ATOM 864 CA ALA A 55 -12.210 7.549 0.032 1.00 32.25 C ATOM 865 C ALA A 55 -11.911 9.048 -0.088 1.00 10.50 C ATOM 866 O ALA A 55 -11.494 9.523 -1.145 1.00 65.15 O ATOM 867 CB ALA A 55 -10.973 6.797 0.553 1.00 52.44 C ATOM 0 H ALA A 55 -12.211 7.452 -2.068 1.00 24.43 H new ATOM 0 HA ALA A 55 -13.027 7.424 0.743 1.00 32.25 H new ATOM 0 HB1 ALA A 55 -10.667 7.219 1.511 1.00 52.44 H new ATOM 0 HB2 ALA A 55 -11.216 5.742 0.682 1.00 52.44 H new ATOM 0 HB3 ALA A 55 -10.158 6.897 -0.164 1.00 52.44 H new ATOM 873 N THR A 56 -12.133 9.775 1.011 1.00 32.42 N ATOM 874 CA THR A 56 -11.846 11.205 1.125 1.00 72.33 C ATOM 875 C THR A 56 -10.469 11.403 1.785 1.00 55.30 C ATOM 876 O THR A 56 -10.208 10.864 2.859 1.00 73.44 O ATOM 877 CB THR A 56 -12.950 11.909 1.980 1.00 43.12 C ATOM 878 OG1 THR A 56 -14.249 11.591 1.442 1.00 14.13 O ATOM 879 CG2 THR A 56 -12.773 13.440 2.021 1.00 22.24 C ATOM 0 H THR A 56 -12.526 9.376 1.864 1.00 32.42 H new ATOM 0 HA THR A 56 -11.837 11.648 0.129 1.00 72.33 H new ATOM 0 HB THR A 56 -12.858 11.540 3.002 1.00 43.12 H new ATOM 0 HG1 THR A 56 -14.942 12.030 1.978 1.00 14.13 H new ATOM 0 HG21 THR A 56 -13.564 13.882 2.627 1.00 22.24 H new ATOM 0 HG22 THR A 56 -11.804 13.683 2.457 1.00 22.24 H new ATOM 0 HG23 THR A 56 -12.826 13.840 1.008 1.00 22.24 H new ATOM 887 N VAL A 57 -9.613 12.181 1.125 1.00 24.44 N ATOM 888 CA VAL A 57 -8.274 12.545 1.611 1.00 72.12 C ATOM 889 C VAL A 57 -8.405 13.595 2.726 1.00 55.11 C ATOM 890 O VAL A 57 -9.236 14.495 2.628 1.00 51.15 O ATOM 891 CB VAL A 57 -7.407 13.140 0.436 1.00 4.30 C ATOM 892 CG1 VAL A 57 -5.934 13.374 0.860 1.00 11.55 C ATOM 893 CG2 VAL A 57 -7.503 12.245 -0.815 1.00 10.42 C ATOM 0 H VAL A 57 -9.832 12.588 0.216 1.00 24.44 H new ATOM 0 HA VAL A 57 -7.783 11.651 1.996 1.00 72.12 H new ATOM 0 HB VAL A 57 -7.817 14.118 0.185 1.00 4.30 H new ATOM 0 HG11 VAL A 57 -5.374 13.784 0.020 1.00 11.55 H new ATOM 0 HG12 VAL A 57 -5.902 14.075 1.694 1.00 11.55 H new ATOM 0 HG13 VAL A 57 -5.488 12.427 1.165 1.00 11.55 H new ATOM 0 HG21 VAL A 57 -6.898 12.672 -1.615 1.00 10.42 H new ATOM 0 HG22 VAL A 57 -7.137 11.246 -0.577 1.00 10.42 H new ATOM 0 HG23 VAL A 57 -8.542 12.183 -1.139 1.00 10.42 H new ATOM 903 N THR A 58 -7.607 13.454 3.787 1.00 53.44 N ATOM 904 CA THR A 58 -7.572 14.402 4.901 1.00 62.40 C ATOM 905 C THR A 58 -6.101 14.695 5.228 1.00 3.41 C ATOM 906 O THR A 58 -5.420 13.904 5.892 1.00 61.23 O ATOM 907 CB THR A 58 -8.350 13.841 6.140 1.00 74.14 C ATOM 908 OG1 THR A 58 -9.670 13.430 5.732 1.00 1.33 O ATOM 909 CG2 THR A 58 -8.483 14.888 7.258 1.00 45.22 C ATOM 0 H THR A 58 -6.962 12.672 3.897 1.00 53.44 H new ATOM 0 HA THR A 58 -8.071 15.331 4.625 1.00 62.40 H new ATOM 0 HB THR A 58 -7.783 12.995 6.529 1.00 74.14 H new ATOM 0 HG1 THR A 58 -10.157 13.078 6.506 1.00 1.33 H new ATOM 0 HG21 THR A 58 -9.029 14.457 8.097 1.00 45.22 H new ATOM 0 HG22 THR A 58 -7.491 15.194 7.589 1.00 45.22 H new ATOM 0 HG23 THR A 58 -9.024 15.756 6.881 1.00 45.22 H new ATOM 917 N VAL A 59 -5.627 15.830 4.712 1.00 61.25 N ATOM 918 CA VAL A 59 -4.220 16.243 4.772 1.00 10.14 C ATOM 919 C VAL A 59 -3.950 16.956 6.105 1.00 42.43 C ATOM 920 O VAL A 59 -4.802 17.700 6.599 1.00 63.40 O ATOM 921 CB VAL A 59 -3.865 17.173 3.537 1.00 43.41 C ATOM 922 CG1 VAL A 59 -2.470 17.838 3.666 1.00 75.01 C ATOM 923 CG2 VAL A 59 -3.963 16.364 2.221 1.00 44.03 C ATOM 0 H VAL A 59 -6.222 16.504 4.230 1.00 61.25 H new ATOM 0 HA VAL A 59 -3.580 15.362 4.716 1.00 10.14 H new ATOM 0 HB VAL A 59 -4.594 17.983 3.523 1.00 43.41 H new ATOM 0 HG11 VAL A 59 -2.282 18.462 2.792 1.00 75.01 H new ATOM 0 HG12 VAL A 59 -2.442 18.454 4.565 1.00 75.01 H new ATOM 0 HG13 VAL A 59 -1.704 17.066 3.732 1.00 75.01 H new ATOM 0 HG21 VAL A 59 -3.718 17.010 1.378 1.00 44.03 H new ATOM 0 HG22 VAL A 59 -3.263 15.529 2.254 1.00 44.03 H new ATOM 0 HG23 VAL A 59 -4.977 15.983 2.103 1.00 44.03 H new ATOM 933 N HIS A 60 -2.779 16.675 6.702 1.00 3.24 N ATOM 934 CA HIS A 60 -2.333 17.302 7.960 1.00 45.11 C ATOM 935 C HIS A 60 -1.364 18.451 7.645 1.00 34.32 C ATOM 936 O HIS A 60 -0.381 18.251 6.929 1.00 70.44 O ATOM 937 CB HIS A 60 -1.661 16.235 8.859 1.00 15.41 C ATOM 938 CG HIS A 60 -2.621 15.177 9.355 1.00 60.15 C ATOM 939 ND1 HIS A 60 -3.419 14.424 8.511 1.00 31.33 N ATOM 940 CD2 HIS A 60 -2.942 14.781 10.613 1.00 23.01 C ATOM 941 CE1 HIS A 60 -4.180 13.626 9.225 1.00 21.11 C ATOM 942 NE2 HIS A 60 -3.912 13.818 10.502 1.00 31.54 N ATOM 0 H HIS A 60 -2.111 16.003 6.324 1.00 3.24 H new ATOM 0 HA HIS A 60 -3.189 17.713 8.496 1.00 45.11 H new ATOM 0 HB2 HIS A 60 -0.858 15.754 8.301 1.00 15.41 H new ATOM 0 HB3 HIS A 60 -1.202 16.729 9.715 1.00 15.41 H new ATOM 0 HD2 HIS A 60 -2.513 15.155 11.531 1.00 23.01 H new ATOM 0 HE1 HIS A 60 -4.905 12.929 8.832 1.00 21.11 H new ATOM 0 HE2 HIS A 60 -4.354 13.330 11.281 1.00 31.54 H new ATOM 951 N GLU A 61 -1.659 19.652 8.181 1.00 52.23 N ATOM 952 CA GLU A 61 -0.849 20.874 7.945 1.00 3.21 C ATOM 953 C GLU A 61 0.538 20.768 8.616 1.00 72.13 C ATOM 954 O GLU A 61 1.502 21.385 8.156 1.00 14.23 O ATOM 955 CB GLU A 61 -1.615 22.128 8.443 1.00 12.33 C ATOM 956 CG GLU A 61 -1.962 22.115 9.946 1.00 62.20 C ATOM 957 CD GLU A 61 -2.857 23.283 10.369 1.00 73.01 C ATOM 958 OE1 GLU A 61 -4.079 23.225 10.119 1.00 35.11 O ATOM 959 OE2 GLU A 61 -2.348 24.266 10.953 1.00 53.45 O ATOM 0 H GLU A 61 -2.463 19.807 8.789 1.00 52.23 H new ATOM 0 HA GLU A 61 -0.683 20.972 6.872 1.00 3.21 H new ATOM 0 HB2 GLU A 61 -1.015 23.012 8.230 1.00 12.33 H new ATOM 0 HB3 GLU A 61 -2.538 22.224 7.871 1.00 12.33 H new ATOM 0 HG2 GLU A 61 -2.461 21.177 10.189 1.00 62.20 H new ATOM 0 HG3 GLU A 61 -1.039 22.144 10.525 1.00 62.20 H new ATOM 966 N THR A 62 0.614 19.974 9.702 1.00 51.34 N ATOM 967 CA THR A 62 1.859 19.672 10.425 1.00 45.25 C ATOM 968 C THR A 62 2.155 18.150 10.304 1.00 20.11 C ATOM 969 O THR A 62 1.573 17.350 11.045 1.00 21.44 O ATOM 970 CB THR A 62 1.754 20.104 11.935 1.00 72.32 C ATOM 971 OG1 THR A 62 0.598 19.497 12.545 1.00 21.24 O ATOM 972 CG2 THR A 62 1.665 21.631 12.103 1.00 41.43 C ATOM 0 H THR A 62 -0.204 19.518 10.106 1.00 51.34 H new ATOM 0 HA THR A 62 2.679 20.238 9.983 1.00 45.25 H new ATOM 0 HB THR A 62 2.666 19.763 12.426 1.00 72.32 H new ATOM 0 HG1 THR A 62 0.506 18.575 12.226 1.00 21.24 H new ATOM 0 HG21 THR A 62 1.594 21.877 13.163 1.00 41.43 H new ATOM 0 HG22 THR A 62 2.556 22.096 11.681 1.00 41.43 H new ATOM 0 HG23 THR A 62 0.781 22.003 11.584 1.00 41.43 H new ATOM 980 N PRO A 63 3.014 17.719 9.320 1.00 12.42 N ATOM 981 CA PRO A 63 3.365 16.283 9.126 1.00 24.23 C ATOM 982 C PRO A 63 4.222 15.721 10.289 1.00 63.03 C ATOM 983 O PRO A 63 5.272 16.287 10.625 1.00 11.40 O ATOM 984 CB PRO A 63 4.150 16.296 7.788 1.00 61.23 C ATOM 985 CG PRO A 63 4.724 17.676 7.683 1.00 70.20 C ATOM 986 CD PRO A 63 3.691 18.587 8.308 1.00 21.42 C ATOM 0 HA PRO A 63 2.489 15.635 9.107 1.00 24.23 H new ATOM 0 HB2 PRO A 63 4.936 15.541 7.785 1.00 61.23 H new ATOM 0 HB3 PRO A 63 3.495 16.077 6.945 1.00 61.23 H new ATOM 0 HG2 PRO A 63 5.678 17.746 8.206 1.00 70.20 H new ATOM 0 HG3 PRO A 63 4.910 17.947 6.644 1.00 70.20 H new ATOM 0 HD2 PRO A 63 4.154 19.457 8.773 1.00 21.42 H new ATOM 0 HD3 PRO A 63 2.986 18.960 7.566 1.00 21.42 H new ATOM 994 N GLU A 64 3.766 14.610 10.903 1.00 41.21 N ATOM 995 CA GLU A 64 4.457 13.973 12.047 1.00 24.22 C ATOM 996 C GLU A 64 5.407 12.863 11.567 1.00 54.50 C ATOM 997 O GLU A 64 5.281 12.357 10.444 1.00 24.53 O ATOM 998 CB GLU A 64 3.408 13.430 13.068 1.00 61.45 C ATOM 999 CG GLU A 64 2.481 12.321 12.526 1.00 20.12 C ATOM 1000 CD GLU A 64 1.227 12.096 13.383 1.00 51.04 C ATOM 1001 OE1 GLU A 64 0.230 12.826 13.185 1.00 41.10 O ATOM 1002 OE2 GLU A 64 1.233 11.201 14.255 1.00 4.51 O ATOM 0 H GLU A 64 2.911 14.129 10.622 1.00 41.21 H new ATOM 0 HA GLU A 64 5.067 14.722 12.552 1.00 24.22 H new ATOM 0 HB2 GLU A 64 3.938 13.046 13.940 1.00 61.45 H new ATOM 0 HB3 GLU A 64 2.792 14.262 13.410 1.00 61.45 H new ATOM 0 HG2 GLU A 64 2.176 12.577 11.511 1.00 20.12 H new ATOM 0 HG3 GLU A 64 3.041 11.388 12.465 1.00 20.12 H new ATOM 1009 N SER A 65 6.352 12.496 12.446 1.00 23.52 N ATOM 1010 CA SER A 65 7.435 11.551 12.145 1.00 10.42 C ATOM 1011 C SER A 65 6.989 10.111 12.467 1.00 4.10 C ATOM 1012 O SER A 65 6.750 9.775 13.635 1.00 0.40 O ATOM 1013 CB SER A 65 8.665 11.944 12.986 1.00 12.54 C ATOM 1014 OG SER A 65 8.980 13.318 12.810 1.00 60.52 O ATOM 0 H SER A 65 6.384 12.854 13.401 1.00 23.52 H new ATOM 0 HA SER A 65 7.687 11.590 11.085 1.00 10.42 H new ATOM 0 HB2 SER A 65 8.470 11.743 14.039 1.00 12.54 H new ATOM 0 HB3 SER A 65 9.519 11.331 12.698 1.00 12.54 H new ATOM 0 HG SER A 65 9.763 13.546 13.354 1.00 60.52 H new ATOM 1020 N VAL A 66 6.829 9.285 11.416 1.00 51.54 N ATOM 1021 CA VAL A 66 6.455 7.856 11.531 1.00 74.04 C ATOM 1022 C VAL A 66 7.533 7.009 10.816 1.00 71.11 C ATOM 1023 O VAL A 66 7.664 7.090 9.592 1.00 43.34 O ATOM 1024 CB VAL A 66 5.031 7.577 10.881 1.00 71.12 C ATOM 1025 CG1 VAL A 66 4.460 6.199 11.317 1.00 15.34 C ATOM 1026 CG2 VAL A 66 4.034 8.733 11.181 1.00 33.32 C ATOM 0 H VAL A 66 6.956 9.591 10.451 1.00 51.54 H new ATOM 0 HA VAL A 66 6.395 7.588 12.586 1.00 74.04 H new ATOM 0 HB VAL A 66 5.169 7.538 9.800 1.00 71.12 H new ATOM 0 HG11 VAL A 66 3.486 6.045 10.852 1.00 15.34 H new ATOM 0 HG12 VAL A 66 5.141 5.407 11.004 1.00 15.34 H new ATOM 0 HG13 VAL A 66 4.352 6.177 12.401 1.00 15.34 H new ATOM 0 HG21 VAL A 66 3.070 8.511 10.722 1.00 33.32 H new ATOM 0 HG22 VAL A 66 3.908 8.834 12.259 1.00 33.32 H new ATOM 0 HG23 VAL A 66 4.424 9.665 10.772 1.00 33.32 H new ATOM 1036 N ASP A 67 8.308 6.216 11.582 1.00 2.24 N ATOM 1037 CA ASP A 67 9.461 5.461 11.037 1.00 24.35 C ATOM 1038 C ASP A 67 8.987 4.178 10.319 1.00 74.12 C ATOM 1039 O ASP A 67 8.432 3.253 10.934 1.00 25.53 O ATOM 1040 CB ASP A 67 10.515 5.151 12.147 1.00 23.25 C ATOM 1041 CG ASP A 67 9.994 4.274 13.305 1.00 30.21 C ATOM 1042 OD1 ASP A 67 9.192 4.776 14.123 1.00 35.31 O ATOM 1043 OD2 ASP A 67 10.388 3.085 13.401 1.00 23.03 O ATOM 0 H ASP A 67 8.159 6.080 12.582 1.00 2.24 H new ATOM 0 HA ASP A 67 9.956 6.089 10.296 1.00 24.35 H new ATOM 0 HB2 ASP A 67 11.369 4.653 11.689 1.00 23.25 H new ATOM 0 HB3 ASP A 67 10.878 6.093 12.558 1.00 23.25 H new ATOM 1048 N LEU A 68 9.170 4.159 8.988 1.00 22.25 N ATOM 1049 CA LEU A 68 8.798 3.023 8.121 1.00 40.15 C ATOM 1050 C LEU A 68 10.056 2.591 7.333 1.00 50.54 C ATOM 1051 O LEU A 68 11.016 3.366 7.215 1.00 23.32 O ATOM 1052 CB LEU A 68 7.643 3.426 7.134 1.00 71.20 C ATOM 1053 CG LEU A 68 6.482 4.329 7.699 1.00 13.51 C ATOM 1054 CD1 LEU A 68 5.463 4.677 6.602 1.00 51.12 C ATOM 1055 CD2 LEU A 68 5.762 3.706 8.911 1.00 71.13 C ATOM 0 H LEU A 68 9.584 4.938 8.477 1.00 22.25 H new ATOM 0 HA LEU A 68 8.432 2.197 8.730 1.00 40.15 H new ATOM 0 HB2 LEU A 68 8.091 3.946 6.287 1.00 71.20 H new ATOM 0 HB3 LEU A 68 7.198 2.510 6.746 1.00 71.20 H new ATOM 0 HG LEU A 68 6.961 5.244 8.047 1.00 13.51 H new ATOM 0 HD11 LEU A 68 4.674 5.301 7.023 1.00 51.12 H new ATOM 0 HD12 LEU A 68 5.964 5.218 5.799 1.00 51.12 H new ATOM 0 HD13 LEU A 68 5.028 3.760 6.206 1.00 51.12 H new ATOM 0 HD21 LEU A 68 4.974 4.378 9.251 1.00 71.13 H new ATOM 0 HD22 LEU A 68 5.324 2.750 8.622 1.00 71.13 H new ATOM 0 HD23 LEU A 68 6.478 3.548 9.718 1.00 71.13 H new ATOM 1067 N GLU A 69 10.056 1.352 6.818 1.00 51.45 N ATOM 1068 CA GLU A 69 11.131 0.855 5.926 1.00 70.44 C ATOM 1069 C GLU A 69 11.132 1.617 4.582 1.00 52.21 C ATOM 1070 O GLU A 69 10.063 1.945 4.040 1.00 22.00 O ATOM 1071 CB GLU A 69 10.961 -0.664 5.660 1.00 41.13 C ATOM 1072 CG GLU A 69 9.561 -1.053 5.137 1.00 34.52 C ATOM 1073 CD GLU A 69 9.418 -2.543 4.821 1.00 63.52 C ATOM 1074 OE1 GLU A 69 10.042 -2.992 3.860 1.00 2.41 O ATOM 1075 OE2 GLU A 69 8.673 -3.258 5.516 1.00 34.11 O ATOM 0 H GLU A 69 9.322 0.668 7.002 1.00 51.45 H new ATOM 0 HA GLU A 69 12.083 1.027 6.428 1.00 70.44 H new ATOM 0 HB2 GLU A 69 11.711 -0.982 4.935 1.00 41.13 H new ATOM 0 HB3 GLU A 69 11.158 -1.209 6.583 1.00 41.13 H new ATOM 0 HG2 GLU A 69 8.814 -0.774 5.880 1.00 34.52 H new ATOM 0 HG3 GLU A 69 9.345 -0.477 4.237 1.00 34.52 H new ATOM 1082 N THR A 70 12.336 1.921 4.070 1.00 65.23 N ATOM 1083 CA THR A 70 12.514 2.461 2.710 1.00 61.33 C ATOM 1084 C THR A 70 12.681 1.300 1.710 1.00 51.52 C ATOM 1085 O THR A 70 12.665 0.121 2.095 1.00 32.32 O ATOM 1086 CB THR A 70 13.750 3.439 2.627 1.00 44.13 C ATOM 1087 OG1 THR A 70 13.756 4.146 1.370 1.00 2.42 O ATOM 1088 CG2 THR A 70 15.095 2.707 2.804 1.00 4.13 C ATOM 0 H THR A 70 13.209 1.801 4.583 1.00 65.23 H new ATOM 0 HA THR A 70 11.625 3.038 2.455 1.00 61.33 H new ATOM 0 HB THR A 70 13.641 4.145 3.450 1.00 44.13 H new ATOM 0 HG1 THR A 70 13.224 4.965 1.453 1.00 2.42 H new ATOM 0 HG21 THR A 70 15.912 3.426 2.738 1.00 4.13 H new ATOM 0 HG22 THR A 70 15.118 2.219 3.778 1.00 4.13 H new ATOM 0 HG23 THR A 70 15.207 1.958 2.020 1.00 4.13 H new ATOM 1096 N SER A 71 12.843 1.664 0.433 1.00 34.11 N ATOM 1097 CA SER A 71 13.065 0.728 -0.659 1.00 43.34 C ATOM 1098 C SER A 71 14.411 0.004 -0.489 1.00 35.10 C ATOM 1099 O SER A 71 14.463 -1.232 -0.485 1.00 4.42 O ATOM 1100 CB SER A 71 13.006 1.498 -1.996 1.00 64.12 C ATOM 1101 OG SER A 71 13.844 2.645 -1.980 1.00 4.11 O ATOM 0 H SER A 71 12.822 2.638 0.131 1.00 34.11 H new ATOM 0 HA SER A 71 12.287 -0.035 -0.653 1.00 43.34 H new ATOM 0 HB2 SER A 71 13.308 0.838 -2.809 1.00 64.12 H new ATOM 0 HB3 SER A 71 11.978 1.801 -2.196 1.00 64.12 H new ATOM 0 HG SER A 71 14.771 2.376 -2.151 1.00 4.11 H new ATOM 1107 N ASP A 72 15.500 0.790 -0.345 1.00 33.42 N ATOM 1108 CA ASP A 72 16.883 0.270 -0.223 1.00 64.33 C ATOM 1109 C ASP A 72 17.238 -0.204 1.217 1.00 12.13 C ATOM 1110 O ASP A 72 18.188 0.306 1.832 1.00 24.01 O ATOM 1111 CB ASP A 72 17.890 1.360 -0.713 1.00 4.33 C ATOM 1112 CG ASP A 72 17.494 2.009 -2.053 1.00 65.33 C ATOM 1113 OD1 ASP A 72 16.758 3.017 -2.031 1.00 33.24 O ATOM 1114 OD2 ASP A 72 17.905 1.523 -3.130 1.00 24.23 O ATOM 0 H ASP A 72 15.446 1.808 -0.310 1.00 33.42 H new ATOM 0 HA ASP A 72 16.955 -0.616 -0.853 1.00 64.33 H new ATOM 0 HB2 ASP A 72 17.970 2.137 0.048 1.00 4.33 H new ATOM 0 HB3 ASP A 72 18.878 0.911 -0.815 1.00 4.33 H new ATOM 1119 N ASP A 73 16.424 -1.142 1.750 1.00 23.24 N ATOM 1120 CA ASP A 73 16.700 -1.979 2.966 1.00 51.41 C ATOM 1121 C ASP A 73 17.091 -1.237 4.270 1.00 51.54 C ATOM 1122 O ASP A 73 17.497 -1.890 5.239 1.00 42.43 O ATOM 1123 CB ASP A 73 17.685 -3.163 2.643 1.00 53.33 C ATOM 1124 CG ASP A 73 19.095 -2.749 2.174 1.00 52.11 C ATOM 1125 OD1 ASP A 73 19.927 -2.355 3.020 1.00 63.33 O ATOM 1126 OD2 ASP A 73 19.384 -2.840 0.961 1.00 53.44 O ATOM 0 H ASP A 73 15.516 -1.355 1.337 1.00 23.24 H new ATOM 0 HA ASP A 73 15.717 -2.380 3.212 1.00 51.41 H new ATOM 0 HB2 ASP A 73 17.786 -3.782 3.535 1.00 53.33 H new ATOM 0 HB3 ASP A 73 17.234 -3.787 1.871 1.00 53.33 H new ATOM 1131 N ARG A 74 16.887 0.084 4.331 1.00 33.53 N ATOM 1132 CA ARG A 74 17.195 0.895 5.534 1.00 40.22 C ATOM 1133 C ARG A 74 15.859 1.269 6.246 1.00 60.21 C ATOM 1134 O ARG A 74 14.774 0.868 5.800 1.00 14.13 O ATOM 1135 CB ARG A 74 18.044 2.142 5.092 1.00 5.32 C ATOM 1136 CG ARG A 74 18.772 2.907 6.226 1.00 43.34 C ATOM 1137 CD ARG A 74 19.747 3.987 5.724 1.00 24.31 C ATOM 1138 NE ARG A 74 20.976 3.408 5.132 1.00 32.22 N ATOM 1139 CZ ARG A 74 21.698 3.947 4.134 1.00 25.33 C ATOM 1140 NH1 ARG A 74 21.339 5.095 3.558 1.00 50.43 N ATOM 1141 NH2 ARG A 74 22.806 3.341 3.736 1.00 43.11 N ATOM 0 H ARG A 74 16.506 0.627 3.556 1.00 33.53 H new ATOM 0 HA ARG A 74 17.792 0.341 6.258 1.00 40.22 H new ATOM 0 HB2 ARG A 74 18.789 1.811 4.368 1.00 5.32 H new ATOM 0 HB3 ARG A 74 17.385 2.840 4.575 1.00 5.32 H new ATOM 0 HG2 ARG A 74 18.028 3.375 6.871 1.00 43.34 H new ATOM 0 HG3 ARG A 74 19.321 2.192 6.839 1.00 43.34 H new ATOM 0 HD2 ARG A 74 19.246 4.607 4.981 1.00 24.31 H new ATOM 0 HD3 ARG A 74 20.019 4.640 6.553 1.00 24.31 H new ATOM 0 HE ARG A 74 21.303 2.522 5.516 1.00 32.22 H new ATOM 0 HH11 ARG A 74 20.501 5.583 3.873 1.00 50.43 H new ATOM 0 HH12 ARG A 74 21.903 5.485 2.802 1.00 50.43 H new ATOM 0 HH21 ARG A 74 23.103 2.475 4.186 1.00 43.11 H new ATOM 0 HH22 ARG A 74 23.362 3.740 2.980 1.00 43.11 H new ATOM 1155 N THR A 75 15.949 2.049 7.334 1.00 54.44 N ATOM 1156 CA THR A 75 14.799 2.518 8.114 1.00 34.35 C ATOM 1157 C THR A 75 14.870 4.049 8.097 1.00 15.12 C ATOM 1158 O THR A 75 15.932 4.619 8.396 1.00 52.11 O ATOM 1159 CB THR A 75 14.840 1.984 9.583 1.00 74.03 C ATOM 1160 OG1 THR A 75 15.033 0.558 9.567 1.00 53.12 O ATOM 1161 CG2 THR A 75 13.545 2.325 10.358 1.00 30.41 C ATOM 0 H THR A 75 16.842 2.377 7.702 1.00 54.44 H new ATOM 0 HA THR A 75 13.868 2.151 7.683 1.00 34.35 H new ATOM 0 HB THR A 75 15.670 2.472 10.095 1.00 74.03 H new ATOM 0 HG1 THR A 75 15.375 0.264 10.437 1.00 53.12 H new ATOM 0 HG21 THR A 75 13.616 1.936 11.374 1.00 30.41 H new ATOM 0 HG22 THR A 75 13.416 3.407 10.392 1.00 30.41 H new ATOM 0 HG23 THR A 75 12.690 1.873 9.855 1.00 30.41 H new ATOM 1169 N VAL A 76 13.763 4.714 7.747 1.00 70.14 N ATOM 1170 CA VAL A 76 13.741 6.176 7.525 1.00 40.40 C ATOM 1171 C VAL A 76 12.439 6.781 8.062 1.00 14.14 C ATOM 1172 O VAL A 76 11.403 6.112 8.137 1.00 74.15 O ATOM 1173 CB VAL A 76 13.922 6.579 6.004 1.00 21.24 C ATOM 1174 CG1 VAL A 76 15.355 6.301 5.486 1.00 4.15 C ATOM 1175 CG2 VAL A 76 12.865 5.902 5.120 1.00 1.15 C ATOM 0 H VAL A 76 12.859 4.263 7.609 1.00 70.14 H new ATOM 0 HA VAL A 76 14.595 6.578 8.070 1.00 40.40 H new ATOM 0 HB VAL A 76 13.771 7.657 5.942 1.00 21.24 H new ATOM 0 HG11 VAL A 76 15.427 6.595 4.439 1.00 4.15 H new ATOM 0 HG12 VAL A 76 16.072 6.875 6.073 1.00 4.15 H new ATOM 0 HG13 VAL A 76 15.576 5.238 5.581 1.00 4.15 H new ATOM 0 HG21 VAL A 76 13.015 6.198 4.082 1.00 1.15 H new ATOM 0 HG22 VAL A 76 12.958 4.819 5.206 1.00 1.15 H new ATOM 0 HG23 VAL A 76 11.870 6.207 5.444 1.00 1.15 H new ATOM 1185 N ARG A 77 12.530 8.060 8.429 1.00 33.05 N ATOM 1186 CA ARG A 77 11.398 8.857 8.899 1.00 65.05 C ATOM 1187 C ARG A 77 10.505 9.240 7.704 1.00 12.25 C ATOM 1188 O ARG A 77 10.979 9.828 6.727 1.00 24.23 O ATOM 1189 CB ARG A 77 11.951 10.108 9.660 1.00 12.32 C ATOM 1190 CG ARG A 77 10.915 11.186 10.103 1.00 43.52 C ATOM 1191 CD ARG A 77 10.697 12.295 9.057 1.00 14.32 C ATOM 1192 NE ARG A 77 11.977 12.931 8.691 1.00 4.32 N ATOM 1193 CZ ARG A 77 12.433 13.131 7.442 1.00 31.31 C ATOM 1194 NH1 ARG A 77 11.721 12.767 6.391 1.00 45.22 N ATOM 1195 NH2 ARG A 77 13.629 13.669 7.256 1.00 24.53 N ATOM 0 H ARG A 77 13.408 8.579 8.407 1.00 33.05 H new ATOM 0 HA ARG A 77 10.778 8.288 9.591 1.00 65.05 H new ATOM 0 HB2 ARG A 77 12.476 9.758 10.549 1.00 12.32 H new ATOM 0 HB3 ARG A 77 12.691 10.592 9.022 1.00 12.32 H new ATOM 0 HG2 ARG A 77 9.962 10.699 10.309 1.00 43.52 H new ATOM 0 HG3 ARG A 77 11.250 11.639 11.036 1.00 43.52 H new ATOM 0 HD2 ARG A 77 10.228 11.875 8.168 1.00 14.32 H new ATOM 0 HD3 ARG A 77 10.013 13.046 9.454 1.00 14.32 H new ATOM 0 HE ARG A 77 12.571 13.249 9.457 1.00 4.32 H new ATOM 0 HH11 ARG A 77 10.810 12.327 6.520 1.00 45.22 H new ATOM 0 HH12 ARG A 77 12.082 12.926 5.450 1.00 45.22 H new ATOM 0 HH21 ARG A 77 14.201 13.930 8.059 1.00 24.53 H new ATOM 0 HH22 ARG A 77 13.978 13.822 6.310 1.00 24.53 H new ATOM 1209 N TYR A 78 9.225 8.869 7.790 1.00 32.54 N ATOM 1210 CA TYR A 78 8.186 9.314 6.847 1.00 31.21 C ATOM 1211 C TYR A 78 7.385 10.435 7.505 1.00 51.03 C ATOM 1212 O TYR A 78 7.236 10.475 8.733 1.00 33.32 O ATOM 1213 CB TYR A 78 7.239 8.151 6.434 1.00 2.25 C ATOM 1214 CG TYR A 78 7.809 7.172 5.393 1.00 65.43 C ATOM 1215 CD1 TYR A 78 8.987 6.466 5.628 1.00 25.34 C ATOM 1216 CD2 TYR A 78 7.150 6.938 4.178 1.00 61.12 C ATOM 1217 CE1 TYR A 78 9.483 5.575 4.697 1.00 14.15 C ATOM 1218 CE2 TYR A 78 7.643 6.046 3.249 1.00 54.11 C ATOM 1219 CZ TYR A 78 8.811 5.368 3.511 1.00 44.03 C ATOM 1220 OH TYR A 78 9.311 4.477 2.586 1.00 34.21 O ATOM 0 H TYR A 78 8.874 8.248 8.519 1.00 32.54 H new ATOM 0 HA TYR A 78 8.669 9.670 5.937 1.00 31.21 H new ATOM 0 HB2 TYR A 78 6.971 7.588 7.328 1.00 2.25 H new ATOM 0 HB3 TYR A 78 6.318 8.579 6.039 1.00 2.25 H new ATOM 0 HD1 TYR A 78 9.521 6.618 6.554 1.00 25.34 H new ATOM 0 HD2 TYR A 78 6.234 7.469 3.964 1.00 61.12 H new ATOM 0 HE1 TYR A 78 10.399 5.039 4.898 1.00 14.15 H new ATOM 0 HE2 TYR A 78 7.115 5.881 2.321 1.00 54.11 H new ATOM 0 HH TYR A 78 9.564 3.645 3.037 1.00 34.21 H new ATOM 1230 N LEU A 79 6.898 11.351 6.675 1.00 54.11 N ATOM 1231 CA LEU A 79 6.037 12.450 7.109 1.00 73.04 C ATOM 1232 C LEU A 79 4.586 12.096 6.797 1.00 43.32 C ATOM 1233 O LEU A 79 4.270 11.669 5.673 1.00 54.20 O ATOM 1234 CB LEU A 79 6.467 13.779 6.432 1.00 2.20 C ATOM 1235 CG LEU A 79 7.802 14.404 6.961 1.00 62.34 C ATOM 1236 CD1 LEU A 79 8.127 15.725 6.228 1.00 74.25 C ATOM 1237 CD2 LEU A 79 7.757 14.611 8.502 1.00 50.33 C ATOM 0 H LEU A 79 7.090 11.353 5.673 1.00 54.11 H new ATOM 0 HA LEU A 79 6.135 12.596 8.185 1.00 73.04 H new ATOM 0 HB2 LEU A 79 6.567 13.605 5.361 1.00 2.20 H new ATOM 0 HB3 LEU A 79 5.668 14.508 6.563 1.00 2.20 H new ATOM 0 HG LEU A 79 8.605 13.699 6.747 1.00 62.34 H new ATOM 0 HD11 LEU A 79 9.059 16.136 6.616 1.00 74.25 H new ATOM 0 HD12 LEU A 79 8.232 15.532 5.160 1.00 74.25 H new ATOM 0 HD13 LEU A 79 7.320 16.439 6.390 1.00 74.25 H new ATOM 0 HD21 LEU A 79 8.698 15.046 8.838 1.00 50.33 H new ATOM 0 HD22 LEU A 79 6.936 15.282 8.755 1.00 50.33 H new ATOM 0 HD23 LEU A 79 7.605 13.650 8.994 1.00 50.33 H new ATOM 1249 N HIS A 80 3.716 12.240 7.814 1.00 2.20 N ATOM 1250 CA HIS A 80 2.289 11.950 7.685 1.00 55.32 C ATOM 1251 C HIS A 80 1.616 13.102 6.936 1.00 23.52 C ATOM 1252 O HIS A 80 1.366 14.180 7.494 1.00 62.13 O ATOM 1253 CB HIS A 80 1.666 11.725 9.083 1.00 62.40 C ATOM 1254 CG HIS A 80 0.197 11.382 9.089 1.00 34.33 C ATOM 1255 ND1 HIS A 80 -0.600 11.701 10.157 1.00 64.45 N ATOM 1256 CD2 HIS A 80 -0.551 10.735 8.159 1.00 12.05 C ATOM 1257 CE1 HIS A 80 -1.794 11.245 9.858 1.00 31.15 C ATOM 1258 NE2 HIS A 80 -1.813 10.658 8.658 1.00 51.43 N ATOM 0 H HIS A 80 3.989 12.560 8.743 1.00 2.20 H new ATOM 0 HA HIS A 80 2.137 11.034 7.114 1.00 55.32 H new ATOM 0 HB2 HIS A 80 2.211 10.923 9.580 1.00 62.40 H new ATOM 0 HB3 HIS A 80 1.814 12.627 9.677 1.00 62.40 H new ATOM 0 HD1 HIS A 80 -0.323 12.191 11.008 1.00 64.45 H new ATOM 0 HD2 HIS A 80 -0.210 10.355 7.207 1.00 12.05 H new ATOM 0 HE1 HIS A 80 -2.656 11.334 10.503 1.00 31.15 H new ATOM 1266 N VAL A 81 1.367 12.867 5.648 1.00 24.34 N ATOM 1267 CA VAL A 81 0.840 13.890 4.740 1.00 70.14 C ATOM 1268 C VAL A 81 -0.687 13.828 4.602 1.00 20.22 C ATOM 1269 O VAL A 81 -1.327 14.873 4.482 1.00 72.43 O ATOM 1270 CB VAL A 81 1.550 13.809 3.339 1.00 12.20 C ATOM 1271 CG1 VAL A 81 3.076 14.037 3.498 1.00 41.02 C ATOM 1272 CG2 VAL A 81 1.250 12.475 2.613 1.00 43.32 C ATOM 0 H VAL A 81 1.524 11.963 5.203 1.00 24.34 H new ATOM 0 HA VAL A 81 1.066 14.860 5.184 1.00 70.14 H new ATOM 0 HB VAL A 81 1.145 14.603 2.711 1.00 12.20 H new ATOM 0 HG11 VAL A 81 3.556 13.979 2.521 1.00 41.02 H new ATOM 0 HG12 VAL A 81 3.254 15.021 3.931 1.00 41.02 H new ATOM 0 HG13 VAL A 81 3.492 13.272 4.153 1.00 41.02 H new ATOM 0 HG21 VAL A 81 1.760 12.462 1.650 1.00 43.32 H new ATOM 0 HG22 VAL A 81 1.603 11.642 3.222 1.00 43.32 H new ATOM 0 HG23 VAL A 81 0.176 12.380 2.456 1.00 43.32 H new ATOM 1282 N ALA A 82 -1.277 12.619 4.660 1.00 2.24 N ATOM 1283 CA ALA A 82 -2.728 12.441 4.424 1.00 1.23 C ATOM 1284 C ALA A 82 -3.294 11.252 5.210 1.00 44.12 C ATOM 1285 O ALA A 82 -2.549 10.433 5.743 1.00 11.50 O ATOM 1286 CB ALA A 82 -3.003 12.278 2.912 1.00 65.12 C ATOM 0 H ALA A 82 -0.777 11.754 4.867 1.00 2.24 H new ATOM 0 HA ALA A 82 -3.237 13.335 4.784 1.00 1.23 H new ATOM 0 HB1 ALA A 82 -4.073 12.148 2.749 1.00 65.12 H new ATOM 0 HB2 ALA A 82 -2.661 13.167 2.382 1.00 65.12 H new ATOM 0 HB3 ALA A 82 -2.470 11.404 2.537 1.00 65.12 H new ATOM 1292 N THR A 83 -4.633 11.204 5.293 1.00 61.32 N ATOM 1293 CA THR A 83 -5.397 10.078 5.850 1.00 11.23 C ATOM 1294 C THR A 83 -6.641 9.871 4.962 1.00 64.21 C ATOM 1295 O THR A 83 -7.390 10.820 4.709 1.00 60.32 O ATOM 1296 CB THR A 83 -5.824 10.358 7.335 1.00 30.31 C ATOM 1297 OG1 THR A 83 -4.662 10.678 8.120 1.00 43.40 O ATOM 1298 CG2 THR A 83 -6.549 9.156 7.968 1.00 4.31 C ATOM 0 H THR A 83 -5.228 11.966 4.967 1.00 61.32 H new ATOM 0 HA THR A 83 -4.778 9.181 5.860 1.00 11.23 H new ATOM 0 HB THR A 83 -6.519 11.198 7.322 1.00 30.31 H new ATOM 0 HG1 THR A 83 -4.318 9.863 8.542 1.00 43.40 H new ATOM 0 HG21 THR A 83 -6.825 9.397 8.995 1.00 4.31 H new ATOM 0 HG22 THR A 83 -7.448 8.930 7.394 1.00 4.31 H new ATOM 0 HG23 THR A 83 -5.888 8.289 7.964 1.00 4.31 H new ATOM 1306 N LEU A 84 -6.853 8.634 4.488 1.00 14.04 N ATOM 1307 CA LEU A 84 -7.877 8.321 3.472 1.00 43.55 C ATOM 1308 C LEU A 84 -9.073 7.656 4.174 1.00 43.00 C ATOM 1309 O LEU A 84 -9.017 6.476 4.512 1.00 64.44 O ATOM 1310 CB LEU A 84 -7.277 7.393 2.364 1.00 73.21 C ATOM 1311 CG LEU A 84 -5.892 7.827 1.759 1.00 35.53 C ATOM 1312 CD1 LEU A 84 -5.469 6.895 0.605 1.00 32.33 C ATOM 1313 CD2 LEU A 84 -5.871 9.314 1.320 1.00 25.14 C ATOM 0 H LEU A 84 -6.321 7.820 4.796 1.00 14.04 H new ATOM 0 HA LEU A 84 -8.213 9.234 2.982 1.00 43.55 H new ATOM 0 HB2 LEU A 84 -7.169 6.391 2.780 1.00 73.21 H new ATOM 0 HB3 LEU A 84 -7.998 7.324 1.550 1.00 73.21 H new ATOM 0 HG LEU A 84 -5.158 7.730 2.559 1.00 35.53 H new ATOM 0 HD11 LEU A 84 -4.508 7.221 0.208 1.00 32.33 H new ATOM 0 HD12 LEU A 84 -5.381 5.874 0.976 1.00 32.33 H new ATOM 0 HD13 LEU A 84 -6.219 6.931 -0.185 1.00 32.33 H new ATOM 0 HD21 LEU A 84 -4.891 9.559 0.910 1.00 25.14 H new ATOM 0 HD22 LEU A 84 -6.634 9.480 0.559 1.00 25.14 H new ATOM 0 HD23 LEU A 84 -6.073 9.951 2.181 1.00 25.14 H new ATOM 1325 N SER A 85 -10.122 8.445 4.427 1.00 43.33 N ATOM 1326 CA SER A 85 -11.324 8.019 5.161 1.00 42.10 C ATOM 1327 C SER A 85 -12.393 7.441 4.212 1.00 51.25 C ATOM 1328 O SER A 85 -12.777 8.085 3.243 1.00 13.51 O ATOM 1329 CB SER A 85 -11.890 9.234 5.921 1.00 13.52 C ATOM 1330 OG SER A 85 -10.920 9.760 6.811 1.00 10.23 O ATOM 0 H SER A 85 -10.163 9.418 4.122 1.00 43.33 H new ATOM 0 HA SER A 85 -11.050 7.228 5.859 1.00 42.10 H new ATOM 0 HB2 SER A 85 -12.196 10.003 5.212 1.00 13.52 H new ATOM 0 HB3 SER A 85 -12.780 8.940 6.477 1.00 13.52 H new ATOM 0 HG SER A 85 -11.295 10.532 7.284 1.00 10.23 H new ATOM 1336 N PHE A 86 -12.898 6.252 4.543 1.00 75.41 N ATOM 1337 CA PHE A 86 -13.901 5.511 3.753 1.00 63.13 C ATOM 1338 C PHE A 86 -14.715 4.609 4.694 1.00 4.41 C ATOM 1339 O PHE A 86 -14.541 4.660 5.909 1.00 23.32 O ATOM 1340 CB PHE A 86 -13.218 4.673 2.623 1.00 41.44 C ATOM 1341 CG PHE A 86 -12.093 3.725 3.072 1.00 15.04 C ATOM 1342 CD1 PHE A 86 -10.788 4.195 3.236 1.00 52.30 C ATOM 1343 CD2 PHE A 86 -12.329 2.371 3.316 1.00 42.03 C ATOM 1344 CE1 PHE A 86 -9.764 3.352 3.630 1.00 33.11 C ATOM 1345 CE2 PHE A 86 -11.301 1.531 3.710 1.00 73.32 C ATOM 1346 CZ PHE A 86 -10.023 2.022 3.866 1.00 40.53 C ATOM 0 H PHE A 86 -12.617 5.758 5.390 1.00 75.41 H new ATOM 0 HA PHE A 86 -14.571 6.220 3.267 1.00 63.13 H new ATOM 0 HB2 PHE A 86 -13.985 4.083 2.122 1.00 41.44 H new ATOM 0 HB3 PHE A 86 -12.812 5.362 1.882 1.00 41.44 H new ATOM 0 HD1 PHE A 86 -10.574 5.237 3.052 1.00 52.30 H new ATOM 0 HD2 PHE A 86 -13.326 1.973 3.196 1.00 42.03 H new ATOM 0 HE1 PHE A 86 -8.763 3.738 3.752 1.00 33.11 H new ATOM 0 HE2 PHE A 86 -11.502 0.486 3.896 1.00 73.32 H new ATOM 0 HZ PHE A 86 -9.225 1.363 4.174 1.00 40.53 H new ATOM 1356 N ASP A 87 -15.604 3.801 4.117 1.00 14.35 N ATOM 1357 CA ASP A 87 -16.365 2.775 4.845 1.00 31.14 C ATOM 1358 C ASP A 87 -15.986 1.402 4.278 1.00 21.03 C ATOM 1359 O ASP A 87 -16.049 1.189 3.062 1.00 13.13 O ATOM 1360 CB ASP A 87 -17.892 3.030 4.725 1.00 45.43 C ATOM 1361 CG ASP A 87 -18.746 1.938 5.411 1.00 60.23 C ATOM 1362 OD1 ASP A 87 -18.734 1.852 6.659 1.00 74.31 O ATOM 1363 OD2 ASP A 87 -19.447 1.175 4.714 1.00 50.43 O ATOM 0 H ASP A 87 -15.821 3.837 3.121 1.00 14.35 H new ATOM 0 HA ASP A 87 -16.119 2.813 5.906 1.00 31.14 H new ATOM 0 HB2 ASP A 87 -18.128 3.998 5.167 1.00 45.43 H new ATOM 0 HB3 ASP A 87 -18.163 3.086 3.671 1.00 45.43 H new ATOM 1368 N LEU A 88 -15.556 0.495 5.157 1.00 74.41 N ATOM 1369 CA LEU A 88 -15.188 -0.879 4.797 1.00 0.34 C ATOM 1370 C LEU A 88 -15.621 -1.790 5.948 1.00 64.40 C ATOM 1371 O LEU A 88 -15.509 -1.393 7.123 1.00 54.40 O ATOM 1372 CB LEU A 88 -13.661 -0.998 4.533 1.00 33.43 C ATOM 1373 CG LEU A 88 -13.133 -2.398 4.072 1.00 11.12 C ATOM 1374 CD1 LEU A 88 -13.709 -2.802 2.692 1.00 13.53 C ATOM 1375 CD2 LEU A 88 -11.586 -2.438 4.072 1.00 22.34 C ATOM 0 H LEU A 88 -15.452 0.695 6.152 1.00 74.41 H new ATOM 0 HA LEU A 88 -15.688 -1.174 3.875 1.00 0.34 H new ATOM 0 HB2 LEU A 88 -13.389 -0.265 3.773 1.00 33.43 H new ATOM 0 HB3 LEU A 88 -13.135 -0.720 5.447 1.00 33.43 H new ATOM 0 HG LEU A 88 -13.485 -3.134 4.795 1.00 11.12 H new ATOM 0 HD11 LEU A 88 -13.319 -3.779 2.407 1.00 13.53 H new ATOM 0 HD12 LEU A 88 -14.796 -2.848 2.751 1.00 13.53 H new ATOM 0 HD13 LEU A 88 -13.417 -2.063 1.946 1.00 13.53 H new ATOM 0 HD21 LEU A 88 -11.247 -3.422 3.748 1.00 22.34 H new ATOM 0 HD22 LEU A 88 -11.202 -1.679 3.390 1.00 22.34 H new ATOM 0 HD23 LEU A 88 -11.217 -2.241 5.078 1.00 22.34 H new ATOM 1387 N ASP A 89 -16.140 -2.980 5.582 1.00 2.22 N ATOM 1388 CA ASP A 89 -16.682 -3.995 6.512 1.00 44.53 C ATOM 1389 C ASP A 89 -18.041 -3.540 7.078 1.00 32.44 C ATOM 1390 O ASP A 89 -19.093 -4.070 6.700 1.00 34.12 O ATOM 1391 CB ASP A 89 -15.684 -4.346 7.648 1.00 52.21 C ATOM 1392 CG ASP A 89 -16.207 -5.443 8.590 1.00 50.10 C ATOM 1393 OD1 ASP A 89 -16.161 -6.635 8.215 1.00 4.31 O ATOM 1394 OD2 ASP A 89 -16.670 -5.118 9.703 1.00 45.44 O ATOM 0 H ASP A 89 -16.196 -3.270 4.606 1.00 2.22 H new ATOM 0 HA ASP A 89 -16.836 -4.911 5.941 1.00 44.53 H new ATOM 0 HB2 ASP A 89 -14.741 -4.672 7.208 1.00 52.21 H new ATOM 0 HB3 ASP A 89 -15.472 -3.448 8.228 1.00 52.21 H new ATOM 1399 N GLY A 90 -17.996 -2.559 7.986 1.00 22.21 N ATOM 1400 CA GLY A 90 -19.200 -1.949 8.548 1.00 31.24 C ATOM 1401 C GLY A 90 -18.886 -0.726 9.390 1.00 72.50 C ATOM 1402 O GLY A 90 -19.661 -0.374 10.286 1.00 2.41 O ATOM 0 H GLY A 90 -17.126 -2.169 8.349 1.00 22.21 H new ATOM 0 HA2 GLY A 90 -19.874 -1.667 7.739 1.00 31.24 H new ATOM 0 HA3 GLY A 90 -19.725 -2.683 9.159 1.00 31.24 H new ATOM 1406 N GLU A 91 -17.749 -0.071 9.094 1.00 5.52 N ATOM 1407 CA GLU A 91 -17.226 1.045 9.902 1.00 34.12 C ATOM 1408 C GLU A 91 -16.435 2.036 9.031 1.00 51.11 C ATOM 1409 O GLU A 91 -15.955 1.679 7.944 1.00 72.45 O ATOM 1410 CB GLU A 91 -16.308 0.479 11.018 1.00 42.43 C ATOM 1411 CG GLU A 91 -15.102 -0.324 10.481 1.00 45.14 C ATOM 1412 CD GLU A 91 -14.108 -0.777 11.560 1.00 72.24 C ATOM 1413 OE1 GLU A 91 -13.721 0.053 12.412 1.00 61.33 O ATOM 1414 OE2 GLU A 91 -13.643 -1.938 11.512 1.00 45.13 O ATOM 0 H GLU A 91 -17.167 -0.300 8.288 1.00 5.52 H new ATOM 0 HA GLU A 91 -18.066 1.580 10.345 1.00 34.12 H new ATOM 0 HB2 GLU A 91 -15.941 1.304 11.628 1.00 42.43 H new ATOM 0 HB3 GLU A 91 -16.899 -0.163 11.672 1.00 42.43 H new ATOM 0 HG2 GLU A 91 -15.473 -1.203 9.954 1.00 45.14 H new ATOM 0 HG3 GLU A 91 -14.572 0.286 9.750 1.00 45.14 H new ATOM 1421 N SER A 92 -16.283 3.270 9.546 1.00 35.43 N ATOM 1422 CA SER A 92 -15.527 4.335 8.875 1.00 30.11 C ATOM 1423 C SER A 92 -14.010 4.080 9.045 1.00 31.31 C ATOM 1424 O SER A 92 -13.384 4.522 10.019 1.00 43.24 O ATOM 1425 CB SER A 92 -15.951 5.728 9.407 1.00 14.12 C ATOM 1426 OG SER A 92 -15.344 6.777 8.666 1.00 43.21 O ATOM 0 H SER A 92 -16.683 3.554 10.440 1.00 35.43 H new ATOM 0 HA SER A 92 -15.752 4.325 7.808 1.00 30.11 H new ATOM 0 HB2 SER A 92 -17.035 5.824 9.353 1.00 14.12 H new ATOM 0 HB3 SER A 92 -15.675 5.817 10.458 1.00 14.12 H new ATOM 0 HG SER A 92 -15.633 7.641 9.026 1.00 43.21 H new ATOM 1432 N ARG A 93 -13.468 3.279 8.115 1.00 21.40 N ATOM 1433 CA ARG A 93 -12.042 2.908 8.064 1.00 23.03 C ATOM 1434 C ARG A 93 -11.192 4.019 7.440 1.00 34.14 C ATOM 1435 O ARG A 93 -11.604 4.649 6.478 1.00 51.13 O ATOM 1436 CB ARG A 93 -11.867 1.593 7.258 1.00 65.22 C ATOM 1437 CG ARG A 93 -12.467 0.330 7.915 1.00 41.31 C ATOM 1438 CD ARG A 93 -11.613 -0.214 9.076 1.00 61.22 C ATOM 1439 NE ARG A 93 -11.549 0.681 10.248 1.00 73.32 N ATOM 1440 CZ ARG A 93 -10.433 1.263 10.738 1.00 34.52 C ATOM 1441 NH1 ARG A 93 -9.251 1.071 10.153 1.00 52.40 N ATOM 1442 NH2 ARG A 93 -10.499 2.001 11.828 1.00 3.54 N ATOM 0 H ARG A 93 -14.017 2.862 7.363 1.00 21.40 H new ATOM 0 HA ARG A 93 -11.698 2.759 9.088 1.00 23.03 H new ATOM 0 HB2 ARG A 93 -12.324 1.724 6.277 1.00 65.22 H new ATOM 0 HB3 ARG A 93 -10.802 1.426 7.094 1.00 65.22 H new ATOM 0 HG2 ARG A 93 -13.466 0.560 8.284 1.00 41.31 H new ATOM 0 HG3 ARG A 93 -12.578 -0.447 7.159 1.00 41.31 H new ATOM 0 HD2 ARG A 93 -12.016 -1.177 9.389 1.00 61.22 H new ATOM 0 HD3 ARG A 93 -10.601 -0.395 8.715 1.00 61.22 H new ATOM 0 HE ARG A 93 -12.426 0.877 10.731 1.00 73.32 H new ATOM 0 HH11 ARG A 93 -9.182 0.479 9.325 1.00 52.40 H new ATOM 0 HH12 ARG A 93 -8.416 1.516 10.533 1.00 52.40 H new ATOM 0 HH21 ARG A 93 -11.393 2.133 12.301 1.00 3.54 H new ATOM 0 HH22 ARG A 93 -9.656 2.441 12.198 1.00 3.54 H new ATOM 1456 N ASP A 94 -9.988 4.226 7.986 1.00 40.35 N ATOM 1457 CA ASP A 94 -9.040 5.239 7.485 1.00 13.23 C ATOM 1458 C ASP A 94 -7.631 4.635 7.351 1.00 30.35 C ATOM 1459 O ASP A 94 -7.159 3.935 8.254 1.00 22.43 O ATOM 1460 CB ASP A 94 -9.040 6.494 8.404 1.00 44.20 C ATOM 1461 CG ASP A 94 -8.565 6.222 9.847 1.00 50.53 C ATOM 1462 OD1 ASP A 94 -9.295 5.548 10.606 1.00 62.22 O ATOM 1463 OD2 ASP A 94 -7.467 6.673 10.226 1.00 73.24 O ATOM 0 H ASP A 94 -9.640 3.699 8.787 1.00 40.35 H new ATOM 0 HA ASP A 94 -9.361 5.559 6.494 1.00 13.23 H new ATOM 0 HB2 ASP A 94 -8.399 7.256 7.960 1.00 44.20 H new ATOM 0 HB3 ASP A 94 -10.049 6.906 8.437 1.00 44.20 H new ATOM 1468 N LEU A 95 -6.984 4.896 6.198 1.00 53.14 N ATOM 1469 CA LEU A 95 -5.607 4.447 5.906 1.00 44.41 C ATOM 1470 C LEU A 95 -4.724 5.669 5.663 1.00 72.22 C ATOM 1471 O LEU A 95 -5.017 6.484 4.792 1.00 44.12 O ATOM 1472 CB LEU A 95 -5.573 3.489 4.680 1.00 73.41 C ATOM 1473 CG LEU A 95 -6.289 2.117 4.877 1.00 54.51 C ATOM 1474 CD1 LEU A 95 -6.095 1.197 3.650 1.00 44.33 C ATOM 1475 CD2 LEU A 95 -5.821 1.432 6.179 1.00 63.24 C ATOM 0 H LEU A 95 -7.405 5.429 5.437 1.00 53.14 H new ATOM 0 HA LEU A 95 -5.228 3.889 6.762 1.00 44.41 H new ATOM 0 HB2 LEU A 95 -6.029 3.998 3.831 1.00 73.41 H new ATOM 0 HB3 LEU A 95 -4.532 3.301 4.417 1.00 73.41 H new ATOM 0 HG LEU A 95 -7.358 2.309 4.969 1.00 54.51 H new ATOM 0 HD11 LEU A 95 -6.607 0.250 3.821 1.00 44.33 H new ATOM 0 HD12 LEU A 95 -6.510 1.679 2.765 1.00 44.33 H new ATOM 0 HD13 LEU A 95 -5.032 1.013 3.498 1.00 44.33 H new ATOM 0 HD21 LEU A 95 -6.335 0.478 6.293 1.00 63.24 H new ATOM 0 HD22 LEU A 95 -4.745 1.262 6.134 1.00 63.24 H new ATOM 0 HD23 LEU A 95 -6.052 2.072 7.030 1.00 63.24 H new ATOM 1487 N HIS A 96 -3.619 5.760 6.402 1.00 44.31 N ATOM 1488 CA HIS A 96 -2.792 6.965 6.441 1.00 72.44 C ATOM 1489 C HIS A 96 -1.746 6.897 5.331 1.00 63.11 C ATOM 1490 O HIS A 96 -1.037 5.893 5.199 1.00 13.21 O ATOM 1491 CB HIS A 96 -2.110 7.101 7.822 1.00 74.22 C ATOM 1492 CG HIS A 96 -3.066 7.231 8.977 1.00 31.13 C ATOM 1493 ND1 HIS A 96 -3.168 8.392 9.690 1.00 24.34 N ATOM 1494 CD2 HIS A 96 -3.930 6.325 9.497 1.00 43.53 C ATOM 1495 CE1 HIS A 96 -4.076 8.175 10.611 1.00 51.32 C ATOM 1496 NE2 HIS A 96 -4.570 6.939 10.534 1.00 14.10 N ATOM 0 H HIS A 96 -3.272 5.002 6.990 1.00 44.31 H new ATOM 0 HA HIS A 96 -3.421 7.841 6.285 1.00 72.44 H new ATOM 0 HB2 HIS A 96 -1.475 6.230 7.988 1.00 74.22 H new ATOM 0 HB3 HIS A 96 -1.457 7.973 7.807 1.00 74.22 H new ATOM 0 HD1 HIS A 96 -2.644 9.253 9.537 1.00 24.34 H new ATOM 0 HD2 HIS A 96 -4.083 5.312 9.156 1.00 43.53 H new ATOM 0 HE1 HIS A 96 -4.386 8.907 11.342 1.00 51.32 H new ATOM 1504 N ALA A 97 -1.651 7.982 4.558 1.00 12.34 N ATOM 1505 CA ALA A 97 -0.737 8.102 3.427 1.00 14.14 C ATOM 1506 C ALA A 97 0.477 8.897 3.883 1.00 55.10 C ATOM 1507 O ALA A 97 0.338 9.999 4.435 1.00 14.10 O ATOM 1508 CB ALA A 97 -1.437 8.801 2.247 1.00 54.42 C ATOM 0 H ALA A 97 -2.220 8.816 4.706 1.00 12.34 H new ATOM 0 HA ALA A 97 -0.425 7.115 3.086 1.00 14.14 H new ATOM 0 HB1 ALA A 97 -0.744 8.884 1.410 1.00 54.42 H new ATOM 0 HB2 ALA A 97 -2.306 8.218 1.942 1.00 54.42 H new ATOM 0 HB3 ALA A 97 -1.758 9.797 2.552 1.00 54.42 H new ATOM 1514 N PHE A 98 1.660 8.312 3.686 1.00 45.24 N ATOM 1515 CA PHE A 98 2.938 8.917 4.058 1.00 70.33 C ATOM 1516 C PHE A 98 3.850 8.977 2.826 1.00 31.03 C ATOM 1517 O PHE A 98 3.550 8.401 1.772 1.00 40.31 O ATOM 1518 CB PHE A 98 3.657 8.090 5.171 1.00 73.20 C ATOM 1519 CG PHE A 98 2.795 7.598 6.337 1.00 23.13 C ATOM 1520 CD1 PHE A 98 2.529 8.410 7.431 1.00 14.15 C ATOM 1521 CD2 PHE A 98 2.282 6.303 6.351 1.00 25.11 C ATOM 1522 CE1 PHE A 98 1.777 7.946 8.496 1.00 23.10 C ATOM 1523 CE2 PHE A 98 1.530 5.843 7.417 1.00 25.35 C ATOM 1524 CZ PHE A 98 1.280 6.663 8.487 1.00 54.50 C ATOM 0 H PHE A 98 1.757 7.392 3.257 1.00 45.24 H new ATOM 0 HA PHE A 98 2.738 9.918 4.440 1.00 70.33 H new ATOM 0 HB2 PHE A 98 4.120 7.222 4.702 1.00 73.20 H new ATOM 0 HB3 PHE A 98 4.463 8.700 5.579 1.00 73.20 H new ATOM 0 HD1 PHE A 98 2.915 9.419 7.451 1.00 14.15 H new ATOM 0 HD2 PHE A 98 2.475 5.647 5.515 1.00 25.11 H new ATOM 0 HE1 PHE A 98 1.579 8.593 9.338 1.00 23.10 H new ATOM 0 HE2 PHE A 98 1.139 4.836 7.406 1.00 25.35 H new ATOM 0 HZ PHE A 98 0.695 6.303 9.320 1.00 54.50 H new ATOM 1534 N ARG A 99 4.957 9.688 3.003 1.00 1.22 N ATOM 1535 CA ARG A 99 6.092 9.737 2.075 1.00 45.23 C ATOM 1536 C ARG A 99 7.257 10.381 2.835 1.00 12.25 C ATOM 1537 O ARG A 99 7.010 11.260 3.673 1.00 4.15 O ATOM 1538 CB ARG A 99 5.731 10.500 0.774 1.00 62.32 C ATOM 1539 CG ARG A 99 5.299 11.985 0.959 1.00 63.00 C ATOM 1540 CD ARG A 99 4.037 12.344 0.155 1.00 52.34 C ATOM 1541 NE ARG A 99 4.199 12.142 -1.298 1.00 43.23 N ATOM 1542 CZ ARG A 99 3.356 12.592 -2.236 1.00 1.45 C ATOM 1543 NH1 ARG A 99 2.262 13.284 -1.913 1.00 22.24 N ATOM 1544 NH2 ARG A 99 3.616 12.343 -3.507 1.00 5.12 N ATOM 0 H ARG A 99 5.099 10.271 3.828 1.00 1.22 H new ATOM 0 HA ARG A 99 6.373 8.737 1.745 1.00 45.23 H new ATOM 0 HB2 ARG A 99 6.593 10.472 0.107 1.00 62.32 H new ATOM 0 HB3 ARG A 99 4.923 9.966 0.274 1.00 62.32 H new ATOM 0 HG2 ARG A 99 5.117 12.177 2.017 1.00 63.00 H new ATOM 0 HG3 ARG A 99 6.117 12.637 0.653 1.00 63.00 H new ATOM 0 HD2 ARG A 99 3.203 11.738 0.509 1.00 52.34 H new ATOM 0 HD3 ARG A 99 3.777 13.385 0.344 1.00 52.34 H new ATOM 0 HE ARG A 99 5.017 11.619 -1.612 1.00 43.23 H new ATOM 0 HH11 ARG A 99 2.053 13.480 -0.934 1.00 22.24 H new ATOM 0 HH12 ARG A 99 1.634 13.617 -2.645 1.00 22.24 H new ATOM 0 HH21 ARG A 99 4.450 11.814 -3.763 1.00 5.12 H new ATOM 0 HH22 ARG A 99 2.983 12.679 -4.232 1.00 5.12 H new ATOM 1558 N GLN A 100 8.502 9.933 2.536 1.00 20.23 N ATOM 1559 CA GLN A 100 9.691 10.150 3.401 1.00 70.34 C ATOM 1560 C GLN A 100 9.816 11.604 3.900 1.00 42.35 C ATOM 1561 O GLN A 100 9.538 11.866 5.076 1.00 73.23 O ATOM 1562 CB GLN A 100 10.983 9.677 2.686 1.00 33.41 C ATOM 1563 CG GLN A 100 10.978 8.175 2.321 1.00 4.12 C ATOM 1564 CD GLN A 100 12.289 7.652 1.722 1.00 52.55 C ATOM 1565 OE1 GLN A 100 12.279 6.751 0.882 1.00 23.14 O ATOM 1566 NE2 GLN A 100 13.428 8.164 2.183 1.00 20.01 N ATOM 0 H GLN A 100 8.711 9.409 1.686 1.00 20.23 H new ATOM 0 HA GLN A 100 9.549 9.540 4.293 1.00 70.34 H new ATOM 0 HB2 GLN A 100 11.119 10.262 1.777 1.00 33.41 H new ATOM 0 HB3 GLN A 100 11.839 9.883 3.329 1.00 33.41 H new ATOM 0 HG2 GLN A 100 10.750 7.599 3.218 1.00 4.12 H new ATOM 0 HG3 GLN A 100 10.172 7.991 1.610 1.00 4.12 H new ATOM 0 HE21 GLN A 100 13.407 8.910 2.879 1.00 20.01 H new ATOM 0 HE22 GLN A 100 14.321 7.811 1.841 1.00 20.01 H new ATOM 1575 N ALA A 101 10.204 12.544 3.021 1.00 43.43 N ATOM 1576 CA ALA A 101 10.195 13.980 3.362 1.00 34.51 C ATOM 1577 C ALA A 101 9.196 14.745 2.477 1.00 34.11 C ATOM 1578 O ALA A 101 8.077 15.050 2.908 1.00 53.11 O ATOM 1579 CB ALA A 101 11.620 14.559 3.267 1.00 73.44 C ATOM 0 H ALA A 101 10.526 12.339 2.075 1.00 43.43 H new ATOM 0 HA ALA A 101 9.861 14.099 4.393 1.00 34.51 H new ATOM 0 HB1 ALA A 101 11.600 15.619 3.521 1.00 73.44 H new ATOM 0 HB2 ALA A 101 12.274 14.032 3.962 1.00 73.44 H new ATOM 0 HB3 ALA A 101 11.996 14.436 2.251 1.00 73.44 H new ATOM 1585 N ALA A 102 9.595 15.003 1.222 1.00 51.31 N ATOM 1586 CA ALA A 102 8.846 15.857 0.279 1.00 32.34 C ATOM 1587 C ALA A 102 8.714 15.192 -1.097 1.00 12.44 C ATOM 1588 O ALA A 102 8.934 15.849 -2.128 1.00 54.42 O ATOM 1589 CB ALA A 102 9.504 17.250 0.183 1.00 54.31 C ATOM 0 H ALA A 102 10.455 14.622 0.827 1.00 51.31 H new ATOM 0 HA ALA A 102 7.834 15.988 0.662 1.00 32.34 H new ATOM 0 HB1 ALA A 102 8.942 17.870 -0.515 1.00 54.31 H new ATOM 0 HB2 ALA A 102 9.505 17.720 1.166 1.00 54.31 H new ATOM 0 HB3 ALA A 102 10.530 17.144 -0.170 1.00 54.31 H new ATOM 1595 N ASP A 103 8.396 13.882 -1.111 1.00 40.41 N ATOM 1596 CA ASP A 103 8.189 13.128 -2.370 1.00 71.33 C ATOM 1597 C ASP A 103 7.097 13.806 -3.228 1.00 62.15 C ATOM 1598 O ASP A 103 6.054 14.210 -2.706 1.00 72.11 O ATOM 1599 CB ASP A 103 7.781 11.660 -2.071 1.00 12.20 C ATOM 1600 CG ASP A 103 7.355 10.865 -3.333 1.00 23.23 C ATOM 1601 OD1 ASP A 103 8.236 10.319 -4.028 1.00 14.02 O ATOM 1602 OD2 ASP A 103 6.132 10.812 -3.641 1.00 71.35 O ATOM 0 H ASP A 103 8.276 13.322 -0.267 1.00 40.41 H new ATOM 0 HA ASP A 103 9.129 13.126 -2.922 1.00 71.33 H new ATOM 0 HB2 ASP A 103 8.618 11.149 -1.595 1.00 12.20 H new ATOM 0 HB3 ASP A 103 6.958 11.659 -1.356 1.00 12.20 H new ATOM 1607 N GLU A 104 7.354 13.929 -4.534 1.00 52.34 N ATOM 1608 CA GLU A 104 6.400 14.521 -5.493 1.00 54.14 C ATOM 1609 C GLU A 104 6.169 13.576 -6.684 1.00 71.35 C ATOM 1610 O GLU A 104 5.641 13.989 -7.721 1.00 21.30 O ATOM 1611 CB GLU A 104 6.907 15.914 -5.956 1.00 41.50 C ATOM 1612 CG GLU A 104 8.297 15.911 -6.623 1.00 70.13 C ATOM 1613 CD GLU A 104 8.678 17.286 -7.193 1.00 62.03 C ATOM 1614 OE1 GLU A 104 8.211 17.626 -8.305 1.00 51.53 O ATOM 1615 OE2 GLU A 104 9.425 18.039 -6.529 1.00 13.11 O ATOM 0 H GLU A 104 8.228 13.623 -4.962 1.00 52.34 H new ATOM 0 HA GLU A 104 5.439 14.660 -4.998 1.00 54.14 H new ATOM 0 HB2 GLU A 104 6.185 16.333 -6.657 1.00 41.50 H new ATOM 0 HB3 GLU A 104 6.936 16.579 -5.093 1.00 41.50 H new ATOM 0 HG2 GLU A 104 9.046 15.603 -5.893 1.00 70.13 H new ATOM 0 HG3 GLU A 104 8.310 15.172 -7.424 1.00 70.13 H new ATOM 1622 N SER A 105 6.515 12.287 -6.500 1.00 4.01 N ATOM 1623 CA SER A 105 6.262 11.227 -7.494 1.00 2.43 C ATOM 1624 C SER A 105 4.810 10.699 -7.400 1.00 71.10 C ATOM 1625 O SER A 105 4.493 9.668 -7.997 1.00 70.22 O ATOM 1626 CB SER A 105 7.263 10.071 -7.258 1.00 50.22 C ATOM 1627 OG SER A 105 8.593 10.555 -7.133 1.00 2.41 O ATOM 0 H SER A 105 6.979 11.951 -5.656 1.00 4.01 H new ATOM 0 HA SER A 105 6.397 11.643 -8.492 1.00 2.43 H new ATOM 0 HB2 SER A 105 6.986 9.526 -6.355 1.00 50.22 H new ATOM 0 HB3 SER A 105 7.207 9.365 -8.086 1.00 50.22 H new ATOM 0 HG SER A 105 8.838 10.598 -6.185 1.00 2.41 H new ATOM 1633 N ARG A 106 3.945 11.423 -6.634 1.00 4.31 N ATOM 1634 CA ARG A 106 2.538 11.041 -6.344 1.00 24.25 C ATOM 1635 C ARG A 106 2.472 9.764 -5.480 1.00 72.42 C ATOM 1636 O ARG A 106 1.392 9.229 -5.258 1.00 70.23 O ATOM 1637 CB ARG A 106 1.674 10.894 -7.645 1.00 12.34 C ATOM 1638 CG ARG A 106 1.620 12.155 -8.547 1.00 34.30 C ATOM 1639 CD ARG A 106 1.070 13.404 -7.831 1.00 71.32 C ATOM 1640 NE ARG A 106 1.127 14.608 -8.686 1.00 33.12 N ATOM 1641 CZ ARG A 106 2.142 15.499 -8.722 1.00 51.02 C ATOM 1642 NH1 ARG A 106 3.216 15.346 -7.959 1.00 21.50 N ATOM 1643 NH2 ARG A 106 2.079 16.541 -9.534 1.00 51.44 N ATOM 0 H ARG A 106 4.214 12.303 -6.195 1.00 4.31 H new ATOM 0 HA ARG A 106 2.103 11.860 -5.771 1.00 24.25 H new ATOM 0 HB2 ARG A 106 2.067 10.064 -8.232 1.00 12.34 H new ATOM 0 HB3 ARG A 106 0.657 10.628 -7.358 1.00 12.34 H new ATOM 0 HG2 ARG A 106 2.623 12.370 -8.916 1.00 34.30 H new ATOM 0 HG3 ARG A 106 0.999 11.942 -9.417 1.00 34.30 H new ATOM 0 HD2 ARG A 106 0.038 13.223 -7.530 1.00 71.32 H new ATOM 0 HD3 ARG A 106 1.642 13.580 -6.920 1.00 71.32 H new ATOM 0 HE ARG A 106 0.332 14.781 -9.301 1.00 33.12 H new ATOM 0 HH11 ARG A 106 3.286 14.545 -7.331 1.00 21.50 H new ATOM 0 HH12 ARG A 106 3.972 16.029 -8.000 1.00 21.50 H new ATOM 0 HH21 ARG A 106 1.264 16.672 -10.133 1.00 51.44 H new ATOM 0 HH22 ARG A 106 2.845 17.214 -9.561 1.00 51.44 H new ATOM 1657 N THR A 107 3.623 9.339 -4.923 1.00 65.20 N ATOM 1658 CA THR A 107 3.743 8.056 -4.232 1.00 34.33 C ATOM 1659 C THR A 107 3.213 8.181 -2.790 1.00 73.44 C ATOM 1660 O THR A 107 3.927 8.638 -1.883 1.00 33.44 O ATOM 1661 CB THR A 107 5.233 7.572 -4.248 1.00 44.03 C ATOM 1662 OG1 THR A 107 5.737 7.640 -5.594 1.00 21.33 O ATOM 1663 CG2 THR A 107 5.386 6.130 -3.718 1.00 30.51 C ATOM 0 H THR A 107 4.488 9.879 -4.943 1.00 65.20 H new ATOM 0 HA THR A 107 3.141 7.311 -4.751 1.00 34.33 H new ATOM 0 HB THR A 107 5.802 8.227 -3.588 1.00 44.03 H new ATOM 0 HG1 THR A 107 5.042 7.346 -6.219 1.00 21.33 H new ATOM 0 HG21 THR A 107 6.436 5.840 -3.749 1.00 30.51 H new ATOM 0 HG22 THR A 107 5.026 6.080 -2.690 1.00 30.51 H new ATOM 0 HG23 THR A 107 4.804 5.450 -4.340 1.00 30.51 H new ATOM 1671 N LEU A 108 1.922 7.848 -2.615 1.00 13.42 N ATOM 1672 CA LEU A 108 1.283 7.775 -1.299 1.00 43.32 C ATOM 1673 C LEU A 108 1.400 6.342 -0.778 1.00 34.23 C ATOM 1674 O LEU A 108 0.857 5.400 -1.376 1.00 32.24 O ATOM 1675 CB LEU A 108 -0.203 8.206 -1.364 1.00 12.35 C ATOM 1676 CG LEU A 108 -0.501 9.623 -1.939 1.00 44.34 C ATOM 1677 CD1 LEU A 108 -1.999 9.965 -1.797 1.00 64.44 C ATOM 1678 CD2 LEU A 108 0.388 10.703 -1.279 1.00 12.23 C ATOM 0 H LEU A 108 1.295 7.622 -3.387 1.00 13.42 H new ATOM 0 HA LEU A 108 1.788 8.463 -0.621 1.00 43.32 H new ATOM 0 HB2 LEU A 108 -0.742 7.475 -1.967 1.00 12.35 H new ATOM 0 HB3 LEU A 108 -0.615 8.155 -0.356 1.00 12.35 H new ATOM 0 HG LEU A 108 -0.256 9.611 -3.001 1.00 44.34 H new ATOM 0 HD11 LEU A 108 -2.186 10.959 -2.205 1.00 64.44 H new ATOM 0 HD12 LEU A 108 -2.593 9.232 -2.342 1.00 64.44 H new ATOM 0 HD13 LEU A 108 -2.278 9.947 -0.743 1.00 64.44 H new ATOM 0 HD21 LEU A 108 0.152 11.678 -1.705 1.00 12.23 H new ATOM 0 HD22 LEU A 108 0.202 10.721 -0.205 1.00 12.23 H new ATOM 0 HD23 LEU A 108 1.437 10.472 -1.461 1.00 12.23 H new ATOM 1690 N PHE A 109 2.103 6.199 0.336 1.00 65.41 N ATOM 1691 CA PHE A 109 2.401 4.911 0.950 1.00 22.20 C ATOM 1692 C PHE A 109 1.386 4.698 2.079 1.00 74.45 C ATOM 1693 O PHE A 109 1.467 5.374 3.112 1.00 31.45 O ATOM 1694 CB PHE A 109 3.862 4.947 1.478 1.00 54.41 C ATOM 1695 CG PHE A 109 4.414 3.615 1.991 1.00 63.04 C ATOM 1696 CD1 PHE A 109 4.714 2.576 1.105 1.00 31.21 C ATOM 1697 CD2 PHE A 109 4.668 3.413 3.349 1.00 30.44 C ATOM 1698 CE1 PHE A 109 5.247 1.384 1.566 1.00 12.52 C ATOM 1699 CE2 PHE A 109 5.195 2.219 3.807 1.00 71.32 C ATOM 1700 CZ PHE A 109 5.487 1.209 2.918 1.00 12.42 C ATOM 0 H PHE A 109 2.491 6.990 0.850 1.00 65.41 H new ATOM 0 HA PHE A 109 2.322 4.084 0.244 1.00 22.20 H new ATOM 0 HB2 PHE A 109 4.510 5.304 0.677 1.00 54.41 H new ATOM 0 HB3 PHE A 109 3.920 5.678 2.284 1.00 54.41 H new ATOM 0 HD1 PHE A 109 4.528 2.705 0.049 1.00 31.21 H new ATOM 0 HD2 PHE A 109 4.449 4.202 4.053 1.00 30.44 H new ATOM 0 HE1 PHE A 109 5.476 0.590 0.870 1.00 12.52 H new ATOM 0 HE2 PHE A 109 5.377 2.079 4.862 1.00 71.32 H new ATOM 0 HZ PHE A 109 5.904 0.279 3.276 1.00 12.42 H new ATOM 1710 N VAL A 110 0.393 3.807 1.859 1.00 10.41 N ATOM 1711 CA VAL A 110 -0.697 3.545 2.834 1.00 74.31 C ATOM 1712 C VAL A 110 -0.547 2.136 3.468 1.00 2.25 C ATOM 1713 O VAL A 110 -1.029 1.136 2.917 1.00 30.42 O ATOM 1714 CB VAL A 110 -2.154 3.738 2.203 1.00 43.41 C ATOM 1715 CG1 VAL A 110 -2.505 5.230 2.030 1.00 72.45 C ATOM 1716 CG2 VAL A 110 -2.324 2.998 0.850 1.00 1.54 C ATOM 0 H VAL A 110 0.322 3.251 1.007 1.00 10.41 H new ATOM 0 HA VAL A 110 -0.598 4.293 3.621 1.00 74.31 H new ATOM 0 HB VAL A 110 -2.847 3.291 2.916 1.00 43.41 H new ATOM 0 HG11 VAL A 110 -3.502 5.322 1.599 1.00 72.45 H new ATOM 0 HG12 VAL A 110 -2.483 5.724 3.001 1.00 72.45 H new ATOM 0 HG13 VAL A 110 -1.778 5.700 1.367 1.00 72.45 H new ATOM 0 HG21 VAL A 110 -3.331 3.164 0.469 1.00 1.54 H new ATOM 0 HG22 VAL A 110 -1.597 3.379 0.133 1.00 1.54 H new ATOM 0 HG23 VAL A 110 -2.163 1.930 0.997 1.00 1.54 H new ATOM 1726 N PRO A 111 0.172 2.020 4.638 1.00 3.20 N ATOM 1727 CA PRO A 111 0.195 0.778 5.428 1.00 4.44 C ATOM 1728 C PRO A 111 -1.192 0.490 6.021 1.00 4.41 C ATOM 1729 O PRO A 111 -1.983 1.417 6.281 1.00 31.40 O ATOM 1730 CB PRO A 111 1.251 1.049 6.549 1.00 11.21 C ATOM 1731 CG PRO A 111 2.008 2.256 6.078 1.00 30.11 C ATOM 1732 CD PRO A 111 1.014 3.058 5.273 1.00 33.34 C ATOM 0 HA PRO A 111 0.452 -0.097 4.831 1.00 4.44 H new ATOM 0 HB2 PRO A 111 0.770 1.234 7.509 1.00 11.21 H new ATOM 0 HB3 PRO A 111 1.914 0.194 6.684 1.00 11.21 H new ATOM 0 HG2 PRO A 111 2.391 2.834 6.919 1.00 30.11 H new ATOM 0 HG3 PRO A 111 2.867 1.970 5.471 1.00 30.11 H new ATOM 0 HD2 PRO A 111 0.425 3.721 5.907 1.00 33.34 H new ATOM 0 HD3 PRO A 111 1.509 3.684 4.530 1.00 33.34 H new ATOM 1740 N PHE A 112 -1.474 -0.792 6.220 1.00 30.12 N ATOM 1741 CA PHE A 112 -2.656 -1.254 6.943 1.00 24.12 C ATOM 1742 C PHE A 112 -2.317 -2.524 7.721 1.00 55.13 C ATOM 1743 O PHE A 112 -1.209 -3.070 7.618 1.00 3.33 O ATOM 1744 CB PHE A 112 -3.884 -1.469 6.000 1.00 3.31 C ATOM 1745 CG PHE A 112 -3.797 -2.594 4.960 1.00 11.54 C ATOM 1746 CD1 PHE A 112 -3.291 -2.353 3.683 1.00 62.13 C ATOM 1747 CD2 PHE A 112 -4.271 -3.883 5.245 1.00 25.52 C ATOM 1748 CE1 PHE A 112 -3.255 -3.359 2.734 1.00 64.53 C ATOM 1749 CE2 PHE A 112 -4.227 -4.886 4.295 1.00 2.31 C ATOM 1750 CZ PHE A 112 -3.724 -4.623 3.040 1.00 44.42 C ATOM 0 H PHE A 112 -0.882 -1.550 5.880 1.00 30.12 H new ATOM 0 HA PHE A 112 -2.949 -0.475 7.646 1.00 24.12 H new ATOM 0 HB2 PHE A 112 -4.757 -1.657 6.624 1.00 3.31 H new ATOM 0 HB3 PHE A 112 -4.067 -0.535 5.469 1.00 3.31 H new ATOM 0 HD1 PHE A 112 -2.923 -1.369 3.432 1.00 62.13 H new ATOM 0 HD2 PHE A 112 -4.677 -4.095 6.223 1.00 25.52 H new ATOM 0 HE1 PHE A 112 -2.859 -3.156 1.750 1.00 64.53 H new ATOM 0 HE2 PHE A 112 -4.587 -5.875 4.537 1.00 2.31 H new ATOM 0 HZ PHE A 112 -3.696 -5.404 2.295 1.00 44.42 H new ATOM 1760 N ARG A 113 -3.274 -2.957 8.527 1.00 61.00 N ATOM 1761 CA ARG A 113 -3.264 -4.270 9.161 1.00 35.32 C ATOM 1762 C ARG A 113 -4.697 -4.771 9.174 1.00 24.05 C ATOM 1763 O ARG A 113 -5.567 -4.094 9.707 1.00 30.33 O ATOM 1764 CB ARG A 113 -2.714 -4.197 10.606 1.00 1.32 C ATOM 1765 CG ARG A 113 -2.728 -5.563 11.334 1.00 30.44 C ATOM 1766 CD ARG A 113 -2.432 -5.457 12.828 1.00 73.12 C ATOM 1767 NE ARG A 113 -1.124 -4.842 13.099 1.00 52.55 N ATOM 1768 CZ ARG A 113 -0.648 -4.564 14.318 1.00 3.41 C ATOM 1769 NH1 ARG A 113 -1.360 -4.827 15.406 1.00 31.25 N ATOM 1770 NH2 ARG A 113 0.531 -3.991 14.444 1.00 45.33 N ATOM 0 H ARG A 113 -4.094 -2.398 8.764 1.00 61.00 H new ATOM 0 HA ARG A 113 -2.613 -4.945 8.606 1.00 35.32 H new ATOM 0 HB2 ARG A 113 -1.693 -3.817 10.580 1.00 1.32 H new ATOM 0 HB3 ARG A 113 -3.306 -3.482 11.177 1.00 1.32 H new ATOM 0 HG2 ARG A 113 -3.703 -6.030 11.197 1.00 30.44 H new ATOM 0 HG3 ARG A 113 -1.992 -6.221 10.871 1.00 30.44 H new ATOM 0 HD2 ARG A 113 -3.213 -4.869 13.309 1.00 73.12 H new ATOM 0 HD3 ARG A 113 -2.462 -6.452 13.273 1.00 73.12 H new ATOM 0 HE ARG A 113 -0.536 -4.610 12.298 1.00 52.55 H new ATOM 0 HH11 ARG A 113 -2.285 -5.248 15.321 1.00 31.25 H new ATOM 0 HH12 ARG A 113 -0.982 -4.609 16.328 1.00 31.25 H new ATOM 0 HH21 ARG A 113 1.077 -3.761 13.614 1.00 45.33 H new ATOM 0 HH22 ARG A 113 0.898 -3.777 15.372 1.00 45.33 H new ATOM 1784 N ASP A 114 -4.942 -5.949 8.612 1.00 63.10 N ATOM 1785 CA ASP A 114 -6.292 -6.506 8.499 1.00 23.44 C ATOM 1786 C ASP A 114 -6.338 -7.816 9.304 1.00 42.23 C ATOM 1787 O ASP A 114 -5.416 -8.096 10.086 1.00 70.22 O ATOM 1788 CB ASP A 114 -6.648 -6.684 6.999 1.00 42.12 C ATOM 1789 CG ASP A 114 -5.948 -7.877 6.336 1.00 62.24 C ATOM 1790 OD1 ASP A 114 -4.706 -7.857 6.195 1.00 62.33 O ATOM 1791 OD2 ASP A 114 -6.647 -8.846 5.987 1.00 55.24 O ATOM 0 H ASP A 114 -4.214 -6.547 8.221 1.00 63.10 H new ATOM 0 HA ASP A 114 -7.046 -5.839 8.916 1.00 23.44 H new ATOM 0 HB2 ASP A 114 -7.727 -6.808 6.903 1.00 42.12 H new ATOM 0 HB3 ASP A 114 -6.383 -5.774 6.461 1.00 42.12 H new ATOM 1796 N LYS A 115 -7.394 -8.623 9.128 1.00 64.21 N ATOM 1797 CA LYS A 115 -7.610 -9.816 9.964 1.00 35.13 C ATOM 1798 C LYS A 115 -6.879 -11.051 9.417 1.00 12.11 C ATOM 1799 O LYS A 115 -6.706 -12.028 10.155 1.00 24.15 O ATOM 1800 CB LYS A 115 -9.126 -10.087 10.155 1.00 71.34 C ATOM 1801 CG LYS A 115 -9.929 -8.898 10.754 1.00 1.44 C ATOM 1802 CD LYS A 115 -9.334 -8.308 12.053 1.00 70.41 C ATOM 1803 CE LYS A 115 -9.326 -9.306 13.214 1.00 65.42 C ATOM 1804 NZ LYS A 115 -8.569 -8.788 14.377 1.00 32.35 N ATOM 0 H LYS A 115 -8.110 -8.474 8.417 1.00 64.21 H new ATOM 0 HA LYS A 115 -7.177 -9.610 10.943 1.00 35.13 H new ATOM 0 HB2 LYS A 115 -9.558 -10.350 9.190 1.00 71.34 H new ATOM 0 HB3 LYS A 115 -9.247 -10.953 10.805 1.00 71.34 H new ATOM 0 HG2 LYS A 115 -9.992 -8.107 10.007 1.00 1.44 H new ATOM 0 HG3 LYS A 115 -10.948 -9.229 10.955 1.00 1.44 H new ATOM 0 HD2 LYS A 115 -8.314 -7.975 11.860 1.00 70.41 H new ATOM 0 HD3 LYS A 115 -9.908 -7.427 12.342 1.00 70.41 H new ATOM 0 HE2 LYS A 115 -10.351 -9.523 13.514 1.00 65.42 H new ATOM 0 HE3 LYS A 115 -8.885 -10.246 12.883 1.00 65.42 H new ATOM 0 HZ1 LYS A 115 -8.586 -9.491 15.143 1.00 32.35 H new ATOM 0 HZ2 LYS A 115 -7.584 -8.605 14.097 1.00 32.35 H new ATOM 0 HZ3 LYS A 115 -9.005 -7.904 14.709 1.00 32.35 H new ATOM 1818 N THR A 116 -6.451 -11.021 8.132 1.00 33.04 N ATOM 1819 CA THR A 116 -5.637 -12.118 7.549 1.00 65.13 C ATOM 1820 C THR A 116 -4.197 -12.074 8.082 1.00 21.22 C ATOM 1821 O THR A 116 -3.519 -13.111 8.106 1.00 15.24 O ATOM 1822 CB THR A 116 -5.600 -12.102 5.982 1.00 45.53 C ATOM 1823 OG1 THR A 116 -4.859 -10.973 5.488 1.00 41.42 O ATOM 1824 CG2 THR A 116 -7.012 -12.109 5.384 1.00 2.52 C ATOM 0 H THR A 116 -6.652 -10.259 7.485 1.00 33.04 H new ATOM 0 HA THR A 116 -6.127 -13.041 7.858 1.00 65.13 H new ATOM 0 HB THR A 116 -5.092 -13.014 5.667 1.00 45.53 H new ATOM 0 HG1 THR A 116 -5.401 -10.161 5.578 1.00 41.42 H new ATOM 0 HG21 THR A 116 -6.946 -12.097 4.296 1.00 2.52 H new ATOM 0 HG22 THR A 116 -7.539 -13.007 5.706 1.00 2.52 H new ATOM 0 HG23 THR A 116 -7.556 -11.227 5.724 1.00 2.52 H new ATOM 1832 N THR A 117 -3.759 -10.865 8.501 1.00 32.34 N ATOM 1833 CA THR A 117 -2.411 -10.602 9.034 1.00 0.11 C ATOM 1834 C THR A 117 -2.078 -11.550 10.216 1.00 31.42 C ATOM 1835 O THR A 117 -2.760 -11.523 11.246 1.00 61.31 O ATOM 1836 CB THR A 117 -2.306 -9.105 9.499 1.00 52.30 C ATOM 1837 OG1 THR A 117 -2.486 -8.217 8.375 1.00 2.32 O ATOM 1838 CG2 THR A 117 -0.965 -8.793 10.198 1.00 25.45 C ATOM 0 H THR A 117 -4.347 -10.032 8.476 1.00 32.34 H new ATOM 0 HA THR A 117 -1.688 -10.788 8.240 1.00 0.11 H new ATOM 0 HB THR A 117 -3.100 -8.946 10.228 1.00 52.30 H new ATOM 0 HG1 THR A 117 -3.378 -8.350 7.993 1.00 2.32 H new ATOM 0 HG21 THR A 117 -0.946 -7.745 10.498 1.00 25.45 H new ATOM 0 HG22 THR A 117 -0.858 -9.425 11.080 1.00 25.45 H new ATOM 0 HG23 THR A 117 -0.142 -8.988 9.510 1.00 25.45 H new ATOM 1846 N GLY A 118 -1.040 -12.389 10.027 1.00 30.15 N ATOM 1847 CA GLY A 118 -0.600 -13.353 11.044 1.00 61.13 C ATOM 1848 C GLY A 118 -1.559 -14.533 11.227 1.00 70.43 C ATOM 1849 O GLY A 118 -1.575 -15.158 12.288 1.00 41.12 O ATOM 0 H GLY A 118 -0.489 -12.414 9.169 1.00 30.15 H new ATOM 0 HA2 GLY A 118 0.384 -13.734 10.769 1.00 61.13 H new ATOM 0 HA3 GLY A 118 -0.487 -12.836 11.997 1.00 61.13 H new ATOM 1853 N GLN A 119 -2.367 -14.829 10.185 1.00 20.41 N ATOM 1854 CA GLN A 119 -3.363 -15.927 10.196 1.00 15.33 C ATOM 1855 C GLN A 119 -3.164 -16.798 8.927 1.00 34.33 C ATOM 1856 O GLN A 119 -2.387 -17.763 8.948 1.00 32.44 O ATOM 1857 CB GLN A 119 -4.827 -15.359 10.292 1.00 73.11 C ATOM 1858 CG GLN A 119 -5.118 -14.459 11.519 1.00 54.31 C ATOM 1859 CD GLN A 119 -5.036 -15.185 12.868 1.00 21.44 C ATOM 1860 OE1 GLN A 119 -5.276 -16.386 12.958 1.00 71.14 O ATOM 1861 NE2 GLN A 119 -4.756 -14.449 13.931 1.00 74.05 N ATOM 0 H GLN A 119 -2.347 -14.311 9.307 1.00 20.41 H new ATOM 0 HA GLN A 119 -3.212 -16.550 11.077 1.00 15.33 H new ATOM 0 HB2 GLN A 119 -5.036 -14.788 9.388 1.00 73.11 H new ATOM 0 HB3 GLN A 119 -5.523 -16.198 10.307 1.00 73.11 H new ATOM 0 HG2 GLN A 119 -4.411 -13.630 11.522 1.00 54.31 H new ATOM 0 HG3 GLN A 119 -6.114 -14.029 11.411 1.00 54.31 H new ATOM 0 HE21 GLN A 119 -4.561 -13.453 13.825 1.00 74.05 H new ATOM 0 HE22 GLN A 119 -4.735 -14.877 14.857 1.00 74.05 H new ATOM 1870 N GLN A 120 -3.850 -16.439 7.817 1.00 30.33 N ATOM 1871 CA GLN A 120 -3.621 -17.056 6.488 1.00 23.31 C ATOM 1872 C GLN A 120 -2.495 -16.301 5.736 1.00 21.33 C ATOM 1873 O GLN A 120 -1.946 -16.797 4.749 1.00 71.12 O ATOM 1874 CB GLN A 120 -4.926 -17.071 5.657 1.00 23.11 C ATOM 1875 CG GLN A 120 -5.481 -15.683 5.318 1.00 54.34 C ATOM 1876 CD GLN A 120 -6.763 -15.734 4.496 1.00 2.11 C ATOM 1877 OE1 GLN A 120 -6.733 -15.757 3.269 1.00 21.55 O ATOM 1878 NE2 GLN A 120 -7.900 -15.768 5.171 1.00 61.30 N ATOM 0 H GLN A 120 -4.573 -15.719 7.816 1.00 30.33 H new ATOM 0 HA GLN A 120 -3.307 -18.090 6.634 1.00 23.31 H new ATOM 0 HB2 GLN A 120 -4.744 -17.612 4.728 1.00 23.11 H new ATOM 0 HB3 GLN A 120 -5.685 -17.627 6.207 1.00 23.11 H new ATOM 0 HG2 GLN A 120 -5.672 -15.139 6.243 1.00 54.34 H new ATOM 0 HG3 GLN A 120 -4.726 -15.121 4.768 1.00 54.34 H new ATOM 0 HE21 GLN A 120 -7.889 -15.747 6.191 1.00 61.30 H new ATOM 0 HE22 GLN A 120 -8.788 -15.815 4.672 1.00 61.30 H new ATOM 1887 N SER A 121 -2.161 -15.113 6.271 1.00 51.25 N ATOM 1888 CA SER A 121 -1.021 -14.284 5.834 1.00 64.52 C ATOM 1889 C SER A 121 0.061 -14.435 6.904 1.00 32.31 C ATOM 1890 O SER A 121 -0.267 -14.616 8.086 1.00 22.12 O ATOM 1891 CB SER A 121 -1.417 -12.789 5.698 1.00 30.32 C ATOM 1892 OG SER A 121 -2.547 -12.625 4.863 1.00 44.11 O ATOM 0 H SER A 121 -2.688 -14.692 7.037 1.00 51.25 H new ATOM 0 HA SER A 121 -0.675 -14.611 4.853 1.00 64.52 H new ATOM 0 HB2 SER A 121 -1.630 -12.377 6.684 1.00 30.32 H new ATOM 0 HB3 SER A 121 -0.578 -12.225 5.291 1.00 30.32 H new ATOM 0 HG SER A 121 -3.136 -11.939 5.241 1.00 44.11 H new ATOM 1898 N TYR A 122 1.335 -14.399 6.495 1.00 23.35 N ATOM 1899 CA TYR A 122 2.473 -14.418 7.431 1.00 11.24 C ATOM 1900 C TYR A 122 2.465 -13.134 8.308 1.00 21.44 C ATOM 1901 O TYR A 122 1.878 -12.113 7.915 1.00 3.51 O ATOM 1902 CB TYR A 122 3.799 -14.570 6.635 1.00 62.11 C ATOM 1903 CG TYR A 122 5.027 -14.873 7.499 1.00 33.25 C ATOM 1904 CD1 TYR A 122 5.123 -16.073 8.204 1.00 73.32 C ATOM 1905 CD2 TYR A 122 6.086 -13.974 7.616 1.00 3.21 C ATOM 1906 CE1 TYR A 122 6.220 -16.362 8.982 1.00 74.44 C ATOM 1907 CE2 TYR A 122 7.189 -14.269 8.395 1.00 30.21 C ATOM 1908 CZ TYR A 122 7.250 -15.461 9.071 1.00 5.11 C ATOM 1909 OH TYR A 122 8.352 -15.762 9.841 1.00 64.00 O ATOM 0 H TYR A 122 1.608 -14.356 5.513 1.00 23.35 H new ATOM 0 HA TYR A 122 2.386 -15.272 8.103 1.00 11.24 H new ATOM 0 HB2 TYR A 122 3.679 -15.369 5.903 1.00 62.11 H new ATOM 0 HB3 TYR A 122 3.981 -13.651 6.077 1.00 62.11 H new ATOM 0 HD1 TYR A 122 4.319 -16.791 8.138 1.00 73.32 H new ATOM 0 HD2 TYR A 122 6.044 -13.032 7.090 1.00 3.21 H new ATOM 0 HE1 TYR A 122 6.270 -17.296 9.521 1.00 74.44 H new ATOM 0 HE2 TYR A 122 8.002 -13.562 8.471 1.00 30.21 H new ATOM 0 HH TYR A 122 8.993 -15.022 9.799 1.00 64.00 H new ATOM 1919 N ASP A 123 3.116 -13.197 9.486 1.00 1.22 N ATOM 1920 CA ASP A 123 3.010 -12.140 10.517 1.00 73.51 C ATOM 1921 C ASP A 123 3.713 -10.841 10.078 1.00 53.11 C ATOM 1922 O ASP A 123 4.746 -10.872 9.399 1.00 31.15 O ATOM 1923 CB ASP A 123 3.546 -12.635 11.888 1.00 73.43 C ATOM 1924 CG ASP A 123 5.061 -12.917 11.918 1.00 74.03 C ATOM 1925 OD1 ASP A 123 5.485 -14.007 11.470 1.00 22.34 O ATOM 1926 OD2 ASP A 123 5.835 -12.060 12.413 1.00 24.22 O ATOM 0 H ASP A 123 3.724 -13.972 9.750 1.00 1.22 H new ATOM 0 HA ASP A 123 1.951 -11.910 10.637 1.00 73.51 H new ATOM 0 HB2 ASP A 123 3.313 -11.887 12.646 1.00 73.43 H new ATOM 0 HB3 ASP A 123 3.014 -13.545 12.164 1.00 73.43 H new ATOM 1931 N GLY A 124 3.135 -9.705 10.503 1.00 14.11 N ATOM 1932 CA GLY A 124 3.513 -8.380 10.005 1.00 32.02 C ATOM 1933 C GLY A 124 2.416 -7.830 9.109 1.00 61.24 C ATOM 1934 O GLY A 124 2.003 -8.513 8.160 1.00 43.12 O ATOM 0 H GLY A 124 2.392 -9.684 11.202 1.00 14.11 H new ATOM 0 HA2 GLY A 124 3.684 -7.703 10.842 1.00 32.02 H new ATOM 0 HA3 GLY A 124 4.449 -8.444 9.450 1.00 32.02 H new ATOM 1938 N GLY A 125 1.936 -6.602 9.408 1.00 13.13 N ATOM 1939 CA GLY A 125 0.835 -5.980 8.663 1.00 15.35 C ATOM 1940 C GLY A 125 1.238 -5.619 7.249 1.00 53.44 C ATOM 1941 O GLY A 125 2.440 -5.586 6.925 1.00 13.23 O ATOM 0 H GLY A 125 2.301 -6.025 10.166 1.00 13.13 H new ATOM 0 HA2 GLY A 125 -0.014 -6.663 8.635 1.00 15.35 H new ATOM 0 HA3 GLY A 125 0.505 -5.082 9.186 1.00 15.35 H new ATOM 1945 N ARG A 126 0.260 -5.281 6.399 1.00 32.21 N ATOM 1946 CA ARG A 126 0.487 -5.216 4.949 1.00 0.21 C ATOM 1947 C ARG A 126 0.376 -3.785 4.476 1.00 30.41 C ATOM 1948 O ARG A 126 -0.556 -3.088 4.832 1.00 10.21 O ATOM 1949 CB ARG A 126 -0.484 -6.143 4.150 1.00 5.45 C ATOM 1950 CG ARG A 126 -0.203 -7.665 4.289 1.00 25.44 C ATOM 1951 CD ARG A 126 1.306 -8.027 4.203 1.00 50.20 C ATOM 1952 NE ARG A 126 2.036 -7.300 3.120 1.00 21.21 N ATOM 1953 CZ ARG A 126 3.140 -6.544 3.300 1.00 44.12 C ATOM 1954 NH1 ARG A 126 3.660 -6.399 4.516 1.00 34.31 N ATOM 1955 NH2 ARG A 126 3.710 -5.943 2.267 1.00 30.51 N ATOM 0 H ARG A 126 -0.691 -5.050 6.688 1.00 32.21 H new ATOM 0 HA ARG A 126 1.495 -5.583 4.756 1.00 0.21 H new ATOM 0 HB2 ARG A 126 -1.504 -5.946 4.480 1.00 5.45 H new ATOM 0 HB3 ARG A 126 -0.433 -5.874 3.095 1.00 5.45 H new ATOM 0 HG2 ARG A 126 -0.598 -8.014 5.243 1.00 25.44 H new ATOM 0 HG3 ARG A 126 -0.742 -8.199 3.506 1.00 25.44 H new ATOM 0 HD2 ARG A 126 1.779 -7.806 5.160 1.00 50.20 H new ATOM 0 HD3 ARG A 126 1.405 -9.100 4.039 1.00 50.20 H new ATOM 0 HE ARG A 126 1.672 -7.381 2.171 1.00 21.21 H new ATOM 0 HH11 ARG A 126 3.225 -6.860 5.315 1.00 34.31 H new ATOM 0 HH12 ARG A 126 4.494 -5.827 4.649 1.00 34.31 H new ATOM 0 HH21 ARG A 126 3.315 -6.051 1.333 1.00 30.51 H new ATOM 0 HH22 ARG A 126 4.544 -5.372 2.406 1.00 30.51 H new ATOM 1969 N TYR A 127 1.352 -3.355 3.667 1.00 51.31 N ATOM 1970 CA TYR A 127 1.360 -2.013 3.097 1.00 23.33 C ATOM 1971 C TYR A 127 0.893 -2.049 1.637 1.00 54.23 C ATOM 1972 O TYR A 127 1.413 -2.811 0.808 1.00 41.21 O ATOM 1973 CB TYR A 127 2.759 -1.335 3.265 1.00 2.45 C ATOM 1974 CG TYR A 127 4.000 -2.244 3.119 1.00 34.40 C ATOM 1975 CD1 TYR A 127 4.400 -3.084 4.164 1.00 33.40 C ATOM 1976 CD2 TYR A 127 4.799 -2.224 1.974 1.00 61.22 C ATOM 1977 CE1 TYR A 127 5.534 -3.860 4.071 1.00 35.21 C ATOM 1978 CE2 TYR A 127 5.945 -3.003 1.883 1.00 71.33 C ATOM 1979 CZ TYR A 127 6.303 -3.815 2.939 1.00 22.50 C ATOM 1980 OH TYR A 127 7.426 -4.599 2.862 1.00 50.45 O ATOM 0 H TYR A 127 2.151 -3.927 3.394 1.00 51.31 H new ATOM 0 HA TYR A 127 0.651 -1.394 3.647 1.00 23.33 H new ATOM 0 HB2 TYR A 127 2.838 -0.534 2.530 1.00 2.45 H new ATOM 0 HB3 TYR A 127 2.794 -0.869 4.250 1.00 2.45 H new ATOM 0 HD1 TYR A 127 3.806 -3.125 5.065 1.00 33.40 H new ATOM 0 HD2 TYR A 127 4.521 -1.591 1.144 1.00 61.22 H new ATOM 0 HE1 TYR A 127 5.817 -4.504 4.891 1.00 35.21 H new ATOM 0 HE2 TYR A 127 6.552 -2.973 0.991 1.00 71.33 H new ATOM 0 HH TYR A 127 7.960 -4.486 3.676 1.00 50.45 H new ATOM 1990 N MET A 128 -0.118 -1.217 1.375 1.00 45.31 N ATOM 1991 CA MET A 128 -0.684 -0.964 0.046 1.00 30.45 C ATOM 1992 C MET A 128 -0.114 0.383 -0.442 1.00 4.14 C ATOM 1993 O MET A 128 0.417 1.164 0.366 1.00 12.14 O ATOM 1994 CB MET A 128 -2.254 -0.939 0.149 1.00 3.34 C ATOM 1995 CG MET A 128 -3.002 -1.537 -1.064 1.00 60.03 C ATOM 1996 SD MET A 128 -2.984 -0.482 -2.529 1.00 74.32 S ATOM 1997 CE MET A 128 -4.102 0.840 -2.051 1.00 64.21 C ATOM 0 H MET A 128 -0.582 -0.681 2.108 1.00 45.31 H new ATOM 0 HA MET A 128 -0.420 -1.745 -0.667 1.00 30.45 H new ATOM 0 HB2 MET A 128 -2.552 -1.484 1.044 1.00 3.34 H new ATOM 0 HB3 MET A 128 -2.577 0.093 0.282 1.00 3.34 H new ATOM 0 HG2 MET A 128 -2.555 -2.499 -1.316 1.00 60.03 H new ATOM 0 HG3 MET A 128 -4.037 -1.731 -0.781 1.00 60.03 H new ATOM 0 HE1 MET A 128 -4.336 1.452 -2.922 1.00 64.21 H new ATOM 0 HE2 MET A 128 -5.021 0.412 -1.651 1.00 64.21 H new ATOM 0 HE3 MET A 128 -3.628 1.459 -1.289 1.00 64.21 H new ATOM 2007 N GLU A 129 -0.194 0.656 -1.746 1.00 52.02 N ATOM 2008 CA GLU A 129 0.291 1.924 -2.319 1.00 3.01 C ATOM 2009 C GLU A 129 -0.639 2.388 -3.448 1.00 52.43 C ATOM 2010 O GLU A 129 -1.114 1.575 -4.245 1.00 20.11 O ATOM 2011 CB GLU A 129 1.732 1.721 -2.841 1.00 15.35 C ATOM 2012 CG GLU A 129 2.410 2.954 -3.473 1.00 22.20 C ATOM 2013 CD GLU A 129 3.808 2.615 -4.022 1.00 3.30 C ATOM 2014 OE1 GLU A 129 4.792 2.664 -3.252 1.00 33.20 O ATOM 2015 OE2 GLU A 129 3.923 2.263 -5.219 1.00 4.32 O ATOM 0 H GLU A 129 -0.592 0.015 -2.433 1.00 52.02 H new ATOM 0 HA GLU A 129 0.294 2.698 -1.551 1.00 3.01 H new ATOM 0 HB2 GLU A 129 2.351 1.378 -2.012 1.00 15.35 H new ATOM 0 HB3 GLU A 129 1.718 0.921 -3.581 1.00 15.35 H new ATOM 0 HG2 GLU A 129 1.786 3.339 -4.279 1.00 22.20 H new ATOM 0 HG3 GLU A 129 2.493 3.745 -2.728 1.00 22.20 H new ATOM 2022 N LEU A 130 -0.902 3.702 -3.486 1.00 20.51 N ATOM 2023 CA LEU A 130 -1.640 4.356 -4.576 1.00 41.33 C ATOM 2024 C LEU A 130 -0.921 5.644 -4.980 1.00 33.21 C ATOM 2025 O LEU A 130 -0.288 6.313 -4.154 1.00 45.53 O ATOM 2026 CB LEU A 130 -3.145 4.624 -4.212 1.00 11.40 C ATOM 2027 CG LEU A 130 -3.535 4.709 -2.697 1.00 73.13 C ATOM 2028 CD1 LEU A 130 -2.880 5.902 -1.971 1.00 53.35 C ATOM 2029 CD2 LEU A 130 -5.063 4.749 -2.549 1.00 42.31 C ATOM 0 H LEU A 130 -0.605 4.347 -2.754 1.00 20.51 H new ATOM 0 HA LEU A 130 -1.657 3.675 -5.427 1.00 41.33 H new ATOM 0 HB2 LEU A 130 -3.441 5.560 -4.685 1.00 11.40 H new ATOM 0 HB3 LEU A 130 -3.743 3.834 -4.666 1.00 11.40 H new ATOM 0 HG LEU A 130 -3.148 3.811 -2.215 1.00 73.13 H new ATOM 0 HD11 LEU A 130 -3.189 5.906 -0.926 1.00 53.35 H new ATOM 0 HD12 LEU A 130 -1.795 5.812 -2.028 1.00 53.35 H new ATOM 0 HD13 LEU A 130 -3.192 6.832 -2.445 1.00 53.35 H new ATOM 0 HD21 LEU A 130 -5.325 4.808 -1.493 1.00 42.31 H new ATOM 0 HD22 LEU A 130 -5.456 5.622 -3.070 1.00 42.31 H new ATOM 0 HD23 LEU A 130 -5.494 3.845 -2.980 1.00 42.31 H new ATOM 2041 N GLU A 131 -1.029 5.965 -6.273 1.00 72.22 N ATOM 2042 CA GLU A 131 -0.445 7.162 -6.873 1.00 23.23 C ATOM 2043 C GLU A 131 -1.555 7.915 -7.636 1.00 52.20 C ATOM 2044 O GLU A 131 -1.952 7.480 -8.724 1.00 24.22 O ATOM 2045 CB GLU A 131 0.751 6.794 -7.798 1.00 40.51 C ATOM 2046 CG GLU A 131 1.893 6.037 -7.077 1.00 72.23 C ATOM 2047 CD GLU A 131 3.159 5.880 -7.930 1.00 3.11 C ATOM 2048 OE1 GLU A 131 3.998 6.800 -7.924 1.00 72.45 O ATOM 2049 OE2 GLU A 131 3.315 4.846 -8.619 1.00 34.41 O ATOM 0 H GLU A 131 -1.536 5.386 -6.943 1.00 72.22 H new ATOM 0 HA GLU A 131 -0.043 7.813 -6.096 1.00 23.23 H new ATOM 0 HB2 GLU A 131 0.385 6.181 -8.621 1.00 40.51 H new ATOM 0 HB3 GLU A 131 1.154 7.708 -8.235 1.00 40.51 H new ATOM 0 HG2 GLU A 131 2.147 6.567 -6.159 1.00 72.23 H new ATOM 0 HG3 GLU A 131 1.536 5.049 -6.786 1.00 72.23 H new ATOM 2056 N PRO A 132 -2.122 9.022 -7.043 1.00 12.15 N ATOM 2057 CA PRO A 132 -3.178 9.853 -7.695 1.00 51.12 C ATOM 2058 C PRO A 132 -2.678 10.551 -8.976 1.00 25.44 C ATOM 2059 O PRO A 132 -1.464 10.686 -9.190 1.00 14.10 O ATOM 2060 CB PRO A 132 -3.517 10.901 -6.603 1.00 61.22 C ATOM 2061 CG PRO A 132 -2.276 10.980 -5.771 1.00 22.10 C ATOM 2062 CD PRO A 132 -1.787 9.560 -5.691 1.00 51.34 C ATOM 0 HA PRO A 132 -4.029 9.254 -8.020 1.00 51.12 H new ATOM 0 HB2 PRO A 132 -3.764 11.868 -7.042 1.00 61.22 H new ATOM 0 HB3 PRO A 132 -4.376 10.592 -6.008 1.00 61.22 H new ATOM 0 HG2 PRO A 132 -1.532 11.631 -6.229 1.00 22.10 H new ATOM 0 HG3 PRO A 132 -2.487 11.384 -4.781 1.00 22.10 H new ATOM 0 HD2 PRO A 132 -0.717 9.511 -5.489 1.00 51.34 H new ATOM 0 HD3 PRO A 132 -2.287 9.003 -4.898 1.00 51.34 H new ATOM 2070 N ASP A 133 -3.637 11.013 -9.799 1.00 71.24 N ATOM 2071 CA ASP A 133 -3.353 11.755 -11.040 1.00 73.01 C ATOM 2072 C ASP A 133 -2.623 13.066 -10.712 1.00 62.14 C ATOM 2073 O ASP A 133 -1.516 13.320 -11.199 1.00 25.03 O ATOM 2074 CB ASP A 133 -4.667 12.049 -11.816 1.00 2.42 C ATOM 2075 CG ASP A 133 -4.425 12.846 -13.118 1.00 53.31 C ATOM 2076 OD1 ASP A 133 -4.058 12.229 -14.139 1.00 24.05 O ATOM 2077 OD2 ASP A 133 -4.581 14.093 -13.121 1.00 52.10 O ATOM 0 H ASP A 133 -4.633 10.882 -9.621 1.00 71.24 H new ATOM 0 HA ASP A 133 -2.712 11.141 -11.673 1.00 73.01 H new ATOM 0 HB2 ASP A 133 -5.160 11.107 -12.058 1.00 2.42 H new ATOM 0 HB3 ASP A 133 -5.346 12.609 -11.173 1.00 2.42 H new ATOM 2082 N ARG A 134 -3.267 13.879 -9.867 1.00 23.43 N ATOM 2083 CA ARG A 134 -2.756 15.183 -9.423 1.00 31.41 C ATOM 2084 C ARG A 134 -2.438 15.147 -7.917 1.00 22.10 C ATOM 2085 O ARG A 134 -2.606 14.103 -7.265 1.00 13.13 O ATOM 2086 CB ARG A 134 -3.803 16.286 -9.805 1.00 41.50 C ATOM 2087 CG ARG A 134 -5.273 16.043 -9.332 1.00 33.02 C ATOM 2088 CD ARG A 134 -5.591 16.613 -7.930 1.00 10.22 C ATOM 2089 NE ARG A 134 -6.965 16.306 -7.467 1.00 2.32 N ATOM 2090 CZ ARG A 134 -8.088 16.944 -7.846 1.00 40.22 C ATOM 2091 NH1 ARG A 134 -8.057 17.952 -8.714 1.00 43.44 N ATOM 2092 NH2 ARG A 134 -9.250 16.564 -7.332 1.00 3.22 N ATOM 0 H ARG A 134 -4.175 13.646 -9.465 1.00 23.43 H new ATOM 0 HA ARG A 134 -1.818 15.423 -9.924 1.00 31.41 H new ATOM 0 HB2 ARG A 134 -3.464 17.236 -9.392 1.00 41.50 H new ATOM 0 HB3 ARG A 134 -3.806 16.393 -10.890 1.00 41.50 H new ATOM 0 HG2 ARG A 134 -5.954 16.490 -10.056 1.00 33.02 H new ATOM 0 HG3 ARG A 134 -5.469 14.971 -9.329 1.00 33.02 H new ATOM 0 HD2 ARG A 134 -4.876 16.212 -7.212 1.00 10.22 H new ATOM 0 HD3 ARG A 134 -5.454 17.694 -7.946 1.00 10.22 H new ATOM 0 HE ARG A 134 -7.069 15.541 -6.800 1.00 2.32 H new ATOM 0 HH11 ARG A 134 -7.168 18.258 -9.109 1.00 43.44 H new ATOM 0 HH12 ARG A 134 -8.923 18.419 -8.985 1.00 43.44 H new ATOM 0 HH21 ARG A 134 -9.284 15.798 -6.659 1.00 3.22 H new ATOM 0 HH22 ARG A 134 -10.110 17.038 -7.609 1.00 3.22 H new ATOM 2106 N ASP A 135 -1.980 16.288 -7.376 1.00 52.11 N ATOM 2107 CA ASP A 135 -1.621 16.416 -5.949 1.00 43.01 C ATOM 2108 C ASP A 135 -2.897 16.622 -5.116 1.00 31.31 C ATOM 2109 O ASP A 135 -3.731 17.461 -5.464 1.00 62.31 O ATOM 2110 CB ASP A 135 -0.630 17.589 -5.734 1.00 10.32 C ATOM 2111 CG ASP A 135 -0.304 17.837 -4.248 1.00 73.30 C ATOM 2112 OD1 ASP A 135 0.331 16.959 -3.621 1.00 42.01 O ATOM 2113 OD2 ASP A 135 -0.701 18.892 -3.694 1.00 52.14 O ATOM 0 H ASP A 135 -1.848 17.146 -7.911 1.00 52.11 H new ATOM 0 HA ASP A 135 -1.127 15.501 -5.624 1.00 43.01 H new ATOM 0 HB2 ASP A 135 0.294 17.380 -6.273 1.00 10.32 H new ATOM 0 HB3 ASP A 135 -1.052 18.497 -6.164 1.00 10.32 H new ATOM 2118 N LEU A 136 -3.025 15.874 -4.006 1.00 70.41 N ATOM 2119 CA LEU A 136 -4.270 15.816 -3.214 1.00 52.23 C ATOM 2120 C LEU A 136 -4.272 16.846 -2.065 1.00 35.22 C ATOM 2121 O LEU A 136 -3.219 17.211 -1.531 1.00 61.33 O ATOM 2122 CB LEU A 136 -4.473 14.383 -2.654 1.00 74.34 C ATOM 2123 CG LEU A 136 -4.546 13.239 -3.719 1.00 74.55 C ATOM 2124 CD1 LEU A 136 -4.752 11.866 -3.054 1.00 23.23 C ATOM 2125 CD2 LEU A 136 -5.640 13.512 -4.779 1.00 33.51 C ATOM 0 H LEU A 136 -2.273 15.295 -3.633 1.00 70.41 H new ATOM 0 HA LEU A 136 -5.098 16.068 -3.877 1.00 52.23 H new ATOM 0 HB2 LEU A 136 -3.656 14.163 -1.967 1.00 74.34 H new ATOM 0 HB3 LEU A 136 -5.393 14.369 -2.070 1.00 74.34 H new ATOM 0 HG LEU A 136 -3.586 13.220 -4.236 1.00 74.55 H new ATOM 0 HD11 LEU A 136 -4.798 11.093 -3.821 1.00 23.23 H new ATOM 0 HD12 LEU A 136 -3.920 11.659 -2.381 1.00 23.23 H new ATOM 0 HD13 LEU A 136 -5.684 11.872 -2.488 1.00 23.23 H new ATOM 0 HD21 LEU A 136 -5.659 12.695 -5.501 1.00 33.51 H new ATOM 0 HD22 LEU A 136 -6.611 13.586 -4.289 1.00 33.51 H new ATOM 0 HD23 LEU A 136 -5.421 14.447 -5.295 1.00 33.51 H new ATOM 2137 N SER A 137 -5.482 17.307 -1.717 1.00 71.55 N ATOM 2138 CA SER A 137 -5.739 18.230 -0.593 1.00 13.44 C ATOM 2139 C SER A 137 -6.750 17.598 0.391 1.00 23.00 C ATOM 2140 O SER A 137 -7.241 16.490 0.160 1.00 44.34 O ATOM 2141 CB SER A 137 -6.272 19.569 -1.155 1.00 63.50 C ATOM 2142 OG SER A 137 -7.380 19.359 -2.018 1.00 65.43 O ATOM 0 H SER A 137 -6.331 17.045 -2.218 1.00 71.55 H new ATOM 0 HA SER A 137 -4.815 18.418 -0.046 1.00 13.44 H new ATOM 0 HB2 SER A 137 -6.567 20.220 -0.332 1.00 63.50 H new ATOM 0 HB3 SER A 137 -5.477 20.081 -1.697 1.00 63.50 H new ATOM 0 HG SER A 137 -7.698 20.221 -2.358 1.00 65.43 H new ATOM 2148 N ASP A 138 -7.038 18.295 1.503 1.00 61.32 N ATOM 2149 CA ASP A 138 -8.050 17.852 2.478 1.00 62.21 C ATOM 2150 C ASP A 138 -9.461 18.144 1.920 1.00 62.41 C ATOM 2151 O ASP A 138 -9.812 19.296 1.634 1.00 64.04 O ATOM 2152 CB ASP A 138 -7.815 18.494 3.885 1.00 32.14 C ATOM 2153 CG ASP A 138 -7.737 20.032 3.899 1.00 35.54 C ATOM 2154 OD1 ASP A 138 -6.762 20.583 3.334 1.00 1.04 O ATOM 2155 OD2 ASP A 138 -8.627 20.692 4.483 1.00 24.41 O ATOM 0 H ASP A 138 -6.581 19.173 1.750 1.00 61.32 H new ATOM 0 HA ASP A 138 -7.959 16.776 2.626 1.00 62.21 H new ATOM 0 HB2 ASP A 138 -8.621 18.181 4.549 1.00 32.14 H new ATOM 0 HB3 ASP A 138 -6.889 18.095 4.298 1.00 32.14 H new ATOM 2160 N GLY A 139 -10.231 17.062 1.711 1.00 3.13 N ATOM 2161 CA GLY A 139 -11.547 17.117 1.063 1.00 65.21 C ATOM 2162 C GLY A 139 -11.482 16.661 -0.394 1.00 12.34 C ATOM 2163 O GLY A 139 -12.471 16.766 -1.123 1.00 4.03 O ATOM 0 H GLY A 139 -9.954 16.121 1.990 1.00 3.13 H new ATOM 0 HA2 GLY A 139 -12.248 16.487 1.610 1.00 65.21 H new ATOM 0 HA3 GLY A 139 -11.932 18.136 1.108 1.00 65.21 H new ATOM 2167 N ASP A 140 -10.296 16.175 -0.821 1.00 60.10 N ATOM 2168 CA ASP A 140 -10.075 15.613 -2.177 1.00 65.42 C ATOM 2169 C ASP A 140 -10.520 14.135 -2.177 1.00 72.52 C ATOM 2170 O ASP A 140 -10.690 13.550 -1.113 1.00 13.22 O ATOM 2171 CB ASP A 140 -8.564 15.748 -2.551 1.00 62.13 C ATOM 2172 CG ASP A 140 -8.257 15.827 -4.063 1.00 33.11 C ATOM 2173 OD1 ASP A 140 -8.782 15.012 -4.844 1.00 22.15 O ATOM 2174 OD2 ASP A 140 -7.470 16.716 -4.472 1.00 33.02 O ATOM 0 H ASP A 140 -9.461 16.160 -0.235 1.00 60.10 H new ATOM 0 HA ASP A 140 -10.659 16.156 -2.920 1.00 65.42 H new ATOM 0 HB2 ASP A 140 -8.167 16.642 -2.070 1.00 62.13 H new ATOM 0 HB3 ASP A 140 -8.027 14.897 -2.133 1.00 62.13 H new ATOM 2179 N GLU A 141 -10.765 13.551 -3.355 1.00 31.13 N ATOM 2180 CA GLU A 141 -11.147 12.124 -3.480 1.00 53.30 C ATOM 2181 C GLU A 141 -9.954 11.248 -3.934 1.00 73.32 C ATOM 2182 O GLU A 141 -9.017 11.736 -4.577 1.00 61.02 O ATOM 2183 CB GLU A 141 -12.337 12.029 -4.467 1.00 14.02 C ATOM 2184 CG GLU A 141 -13.566 12.858 -4.013 1.00 55.34 C ATOM 2185 CD GLU A 141 -14.666 12.984 -5.078 1.00 4.45 C ATOM 2186 OE1 GLU A 141 -14.475 13.748 -6.048 1.00 5.25 O ATOM 2187 OE2 GLU A 141 -15.729 12.336 -4.946 1.00 24.22 O ATOM 0 H GLU A 141 -10.707 14.042 -4.247 1.00 31.13 H new ATOM 0 HA GLU A 141 -11.446 11.738 -2.506 1.00 53.30 H new ATOM 0 HB2 GLU A 141 -12.016 12.374 -5.450 1.00 14.02 H new ATOM 0 HB3 GLU A 141 -12.630 10.985 -4.576 1.00 14.02 H new ATOM 0 HG2 GLU A 141 -13.991 12.399 -3.120 1.00 55.34 H new ATOM 0 HG3 GLU A 141 -13.233 13.857 -3.730 1.00 55.34 H new ATOM 2194 N ILE A 142 -10.020 9.943 -3.594 1.00 24.05 N ATOM 2195 CA ILE A 142 -8.974 8.939 -3.904 1.00 42.04 C ATOM 2196 C ILE A 142 -9.632 7.531 -3.963 1.00 65.54 C ATOM 2197 O ILE A 142 -10.641 7.289 -3.298 1.00 5.42 O ATOM 2198 CB ILE A 142 -7.811 8.988 -2.832 1.00 60.21 C ATOM 2199 CG1 ILE A 142 -6.597 8.071 -3.215 1.00 43.20 C ATOM 2200 CG2 ILE A 142 -8.341 8.658 -1.416 1.00 71.12 C ATOM 2201 CD1 ILE A 142 -5.858 8.466 -4.492 1.00 53.20 C ATOM 0 H ILE A 142 -10.813 9.549 -3.088 1.00 24.05 H new ATOM 0 HA ILE A 142 -8.525 9.164 -4.872 1.00 42.04 H new ATOM 0 HB ILE A 142 -7.436 10.011 -2.824 1.00 60.21 H new ATOM 0 HG12 ILE A 142 -5.887 8.073 -2.388 1.00 43.20 H new ATOM 0 HG13 ILE A 142 -6.956 7.048 -3.324 1.00 43.20 H new ATOM 0 HG21 ILE A 142 -7.519 8.699 -0.701 1.00 71.12 H new ATOM 0 HG22 ILE A 142 -9.104 9.384 -1.135 1.00 71.12 H new ATOM 0 HG23 ILE A 142 -8.774 7.658 -1.414 1.00 71.12 H new ATOM 0 HD11 ILE A 142 -5.038 7.770 -4.668 1.00 53.20 H new ATOM 0 HD12 ILE A 142 -6.547 8.435 -5.336 1.00 53.20 H new ATOM 0 HD13 ILE A 142 -5.461 9.476 -4.385 1.00 53.20 H new ATOM 2213 N THR A 143 -9.074 6.620 -4.783 1.00 52.52 N ATOM 2214 CA THR A 143 -9.666 5.284 -5.031 1.00 31.13 C ATOM 2215 C THR A 143 -8.747 4.182 -4.439 1.00 0.05 C ATOM 2216 O THR A 143 -7.545 4.165 -4.724 1.00 35.54 O ATOM 2217 CB THR A 143 -9.889 5.080 -6.578 1.00 25.41 C ATOM 2218 OG1 THR A 143 -10.197 6.349 -7.199 1.00 42.51 O ATOM 2219 CG2 THR A 143 -11.045 4.113 -6.872 1.00 71.32 C ATOM 0 H THR A 143 -8.205 6.784 -5.291 1.00 52.52 H new ATOM 0 HA THR A 143 -10.635 5.213 -4.538 1.00 31.13 H new ATOM 0 HB THR A 143 -8.968 4.659 -6.981 1.00 25.41 H new ATOM 0 HG1 THR A 143 -10.333 6.218 -8.161 1.00 42.51 H new ATOM 0 HG21 THR A 143 -11.162 4.003 -7.950 1.00 71.32 H new ATOM 0 HG22 THR A 143 -10.828 3.141 -6.429 1.00 71.32 H new ATOM 0 HG23 THR A 143 -11.967 4.508 -6.445 1.00 71.32 H new ATOM 2227 N LEU A 144 -9.330 3.258 -3.634 1.00 21.21 N ATOM 2228 CA LEU A 144 -8.602 2.282 -2.775 1.00 62.13 C ATOM 2229 C LEU A 144 -8.955 0.843 -3.213 1.00 15.22 C ATOM 2230 O LEU A 144 -10.069 0.389 -2.932 1.00 52.01 O ATOM 2231 CB LEU A 144 -9.035 2.455 -1.259 1.00 62.12 C ATOM 2232 CG LEU A 144 -8.281 3.486 -0.352 1.00 54.14 C ATOM 2233 CD1 LEU A 144 -6.850 3.001 -0.014 1.00 74.13 C ATOM 2234 CD2 LEU A 144 -8.284 4.903 -0.965 1.00 33.11 C ATOM 0 H LEU A 144 -10.343 3.167 -3.561 1.00 21.21 H new ATOM 0 HA LEU A 144 -7.532 2.463 -2.879 1.00 62.13 H new ATOM 0 HB2 LEU A 144 -10.091 2.724 -1.250 1.00 62.12 H new ATOM 0 HB3 LEU A 144 -8.951 1.478 -0.782 1.00 62.12 H new ATOM 0 HG LEU A 144 -8.828 3.552 0.588 1.00 54.14 H new ATOM 0 HD11 LEU A 144 -6.355 3.740 0.616 1.00 74.13 H new ATOM 0 HD12 LEU A 144 -6.904 2.050 0.515 1.00 74.13 H new ATOM 0 HD13 LEU A 144 -6.282 2.872 -0.936 1.00 74.13 H new ATOM 0 HD21 LEU A 144 -7.751 5.586 -0.304 1.00 33.11 H new ATOM 0 HD22 LEU A 144 -7.791 4.880 -1.937 1.00 33.11 H new ATOM 0 HD23 LEU A 144 -9.312 5.244 -1.087 1.00 33.11 H new ATOM 2246 N ASP A 145 -8.046 0.121 -3.903 1.00 72.25 N ATOM 2247 CA ASP A 145 -8.193 -1.347 -4.052 1.00 23.12 C ATOM 2248 C ASP A 145 -7.035 -2.069 -3.353 1.00 63.14 C ATOM 2249 O ASP A 145 -5.866 -1.976 -3.737 1.00 71.41 O ATOM 2250 CB ASP A 145 -8.393 -1.818 -5.520 1.00 42.25 C ATOM 2251 CG ASP A 145 -7.229 -1.631 -6.471 1.00 44.14 C ATOM 2252 OD1 ASP A 145 -6.763 -0.483 -6.637 1.00 72.23 O ATOM 2253 OD2 ASP A 145 -6.823 -2.624 -7.106 1.00 31.15 O ATOM 0 H ASP A 145 -7.222 0.516 -4.356 1.00 72.25 H new ATOM 0 HA ASP A 145 -9.123 -1.624 -3.555 1.00 23.12 H new ATOM 0 HB2 ASP A 145 -8.649 -2.877 -5.503 1.00 42.25 H new ATOM 0 HB3 ASP A 145 -9.253 -1.289 -5.930 1.00 42.25 H new ATOM 2258 N PHE A 146 -7.415 -2.754 -2.269 1.00 1.04 N ATOM 2259 CA PHE A 146 -6.503 -3.470 -1.348 1.00 34.01 C ATOM 2260 C PHE A 146 -5.933 -4.762 -1.970 1.00 71.43 C ATOM 2261 O PHE A 146 -5.129 -5.455 -1.341 1.00 4.23 O ATOM 2262 CB PHE A 146 -7.272 -3.768 -0.035 1.00 11.54 C ATOM 2263 CG PHE A 146 -8.120 -2.583 0.435 1.00 64.34 C ATOM 2264 CD1 PHE A 146 -7.512 -1.392 0.823 1.00 0.45 C ATOM 2265 CD2 PHE A 146 -9.521 -2.635 0.416 1.00 31.20 C ATOM 2266 CE1 PHE A 146 -8.270 -0.300 1.190 1.00 61.12 C ATOM 2267 CE2 PHE A 146 -10.274 -1.536 0.776 1.00 2.00 C ATOM 2268 CZ PHE A 146 -9.647 -0.370 1.162 1.00 52.34 C ATOM 0 H PHE A 146 -8.394 -2.832 -1.993 1.00 1.04 H new ATOM 0 HA PHE A 146 -5.641 -2.836 -1.141 1.00 34.01 H new ATOM 0 HB2 PHE A 146 -7.917 -4.634 -0.185 1.00 11.54 H new ATOM 0 HB3 PHE A 146 -6.560 -4.032 0.746 1.00 11.54 H new ATOM 0 HD1 PHE A 146 -6.434 -1.323 0.837 1.00 0.45 H new ATOM 0 HD2 PHE A 146 -10.017 -3.546 0.116 1.00 31.20 H new ATOM 0 HE1 PHE A 146 -7.784 0.613 1.500 1.00 61.12 H new ATOM 0 HE2 PHE A 146 -11.353 -1.589 0.755 1.00 2.00 H new ATOM 0 HZ PHE A 146 -10.236 0.491 1.443 1.00 52.34 H new ATOM 2278 N ASN A 147 -6.379 -5.044 -3.206 1.00 72.41 N ATOM 2279 CA ASN A 147 -5.897 -6.146 -4.056 1.00 1.24 C ATOM 2280 C ASN A 147 -4.367 -6.087 -4.204 1.00 20.11 C ATOM 2281 O ASN A 147 -3.665 -7.086 -4.054 1.00 44.01 O ATOM 2282 CB ASN A 147 -6.542 -6.046 -5.471 1.00 53.11 C ATOM 2283 CG ASN A 147 -8.053 -5.809 -5.451 1.00 12.21 C ATOM 2284 OD1 ASN A 147 -8.772 -6.298 -4.588 1.00 53.30 O ATOM 2285 ND2 ASN A 147 -8.534 -5.010 -6.383 1.00 20.42 N ATOM 0 H ASN A 147 -7.110 -4.492 -3.656 1.00 72.41 H new ATOM 0 HA ASN A 147 -6.177 -7.087 -3.583 1.00 1.24 H new ATOM 0 HB2 ASN A 147 -6.065 -5.234 -6.020 1.00 53.11 H new ATOM 0 HB3 ASN A 147 -6.336 -6.966 -6.019 1.00 53.11 H new ATOM 0 HD21 ASN A 147 -9.529 -4.785 -6.398 1.00 20.42 H new ATOM 0 HD22 ASN A 147 -7.911 -4.617 -7.089 1.00 20.42 H new ATOM 2292 N LEU A 148 -3.877 -4.856 -4.423 1.00 73.01 N ATOM 2293 CA LEU A 148 -2.491 -4.580 -4.832 1.00 20.32 C ATOM 2294 C LEU A 148 -1.564 -4.426 -3.598 1.00 53.23 C ATOM 2295 O LEU A 148 -0.547 -3.731 -3.663 1.00 2.35 O ATOM 2296 CB LEU A 148 -2.491 -3.290 -5.721 1.00 50.31 C ATOM 2297 CG LEU A 148 -3.696 -3.155 -6.710 1.00 1.41 C ATOM 2298 CD1 LEU A 148 -3.721 -1.784 -7.422 1.00 24.21 C ATOM 2299 CD2 LEU A 148 -3.775 -4.338 -7.715 1.00 33.41 C ATOM 0 H LEU A 148 -4.441 -4.013 -4.319 1.00 73.01 H new ATOM 0 HA LEU A 148 -2.099 -5.418 -5.409 1.00 20.32 H new ATOM 0 HB2 LEU A 148 -2.481 -2.418 -5.066 1.00 50.31 H new ATOM 0 HB3 LEU A 148 -1.566 -3.267 -6.297 1.00 50.31 H new ATOM 0 HG LEU A 148 -4.598 -3.206 -6.100 1.00 1.41 H new ATOM 0 HD11 LEU A 148 -4.576 -1.740 -8.097 1.00 24.21 H new ATOM 0 HD12 LEU A 148 -3.804 -0.990 -6.680 1.00 24.21 H new ATOM 0 HD13 LEU A 148 -2.801 -1.653 -7.992 1.00 24.21 H new ATOM 0 HD21 LEU A 148 -4.628 -4.196 -8.378 1.00 33.41 H new ATOM 0 HD22 LEU A 148 -2.859 -4.376 -8.305 1.00 33.41 H new ATOM 0 HD23 LEU A 148 -3.893 -5.273 -7.168 1.00 33.41 H new ATOM 2311 N ALA A 149 -1.927 -5.082 -2.472 1.00 53.14 N ATOM 2312 CA ALA A 149 -1.083 -5.138 -1.268 1.00 12.12 C ATOM 2313 C ALA A 149 0.078 -6.129 -1.500 1.00 43.20 C ATOM 2314 O ALA A 149 -0.147 -7.332 -1.637 1.00 51.42 O ATOM 2315 CB ALA A 149 -1.923 -5.529 -0.039 1.00 24.14 C ATOM 0 H ALA A 149 -2.810 -5.584 -2.378 1.00 53.14 H new ATOM 0 HA ALA A 149 -0.661 -4.152 -1.073 1.00 12.12 H new ATOM 0 HB1 ALA A 149 -1.283 -5.566 0.842 1.00 24.14 H new ATOM 0 HB2 ALA A 149 -2.710 -4.790 0.114 1.00 24.14 H new ATOM 0 HB3 ALA A 149 -2.372 -6.509 -0.202 1.00 24.14 H new ATOM 2321 N TYR A 150 1.316 -5.608 -1.475 1.00 43.11 N ATOM 2322 CA TYR A 150 2.513 -6.318 -1.997 1.00 51.54 C ATOM 2323 C TYR A 150 3.035 -7.343 -0.980 1.00 30.01 C ATOM 2324 O TYR A 150 2.634 -7.314 0.190 1.00 72.14 O ATOM 2325 CB TYR A 150 3.633 -5.286 -2.320 1.00 62.53 C ATOM 2326 CG TYR A 150 3.147 -4.063 -3.109 1.00 62.14 C ATOM 2327 CD1 TYR A 150 2.633 -4.192 -4.401 1.00 50.21 C ATOM 2328 CD2 TYR A 150 3.193 -2.777 -2.556 1.00 53.04 C ATOM 2329 CE1 TYR A 150 2.184 -3.090 -5.108 1.00 54.12 C ATOM 2330 CE2 TYR A 150 2.748 -1.677 -3.261 1.00 73.33 C ATOM 2331 CZ TYR A 150 2.245 -1.836 -4.534 1.00 64.43 C ATOM 2332 OH TYR A 150 1.797 -0.735 -5.241 1.00 24.23 O ATOM 0 H TYR A 150 1.523 -4.685 -1.095 1.00 43.11 H new ATOM 0 HA TYR A 150 2.227 -6.850 -2.904 1.00 51.54 H new ATOM 0 HB2 TYR A 150 4.082 -4.948 -1.386 1.00 62.53 H new ATOM 0 HB3 TYR A 150 4.418 -5.784 -2.889 1.00 62.53 H new ATOM 0 HD1 TYR A 150 2.585 -5.170 -4.857 1.00 50.21 H new ATOM 0 HD2 TYR A 150 3.584 -2.643 -1.558 1.00 53.04 H new ATOM 0 HE1 TYR A 150 1.787 -3.211 -6.105 1.00 54.12 H new ATOM 0 HE2 TYR A 150 2.794 -0.694 -2.816 1.00 73.33 H new ATOM 0 HH TYR A 150 0.844 -0.594 -5.058 1.00 24.23 H new ATOM 2342 N SER A 151 3.867 -8.294 -1.447 1.00 22.01 N ATOM 2343 CA SER A 151 4.687 -9.149 -0.565 1.00 13.34 C ATOM 2344 C SER A 151 5.584 -8.298 0.372 1.00 12.51 C ATOM 2345 O SER A 151 6.135 -7.281 -0.069 1.00 1.24 O ATOM 2346 CB SER A 151 5.564 -10.097 -1.419 1.00 0.31 C ATOM 2347 OG SER A 151 4.765 -10.868 -2.290 1.00 4.41 O ATOM 0 H SER A 151 3.990 -8.491 -2.440 1.00 22.01 H new ATOM 0 HA SER A 151 4.013 -9.738 0.058 1.00 13.34 H new ATOM 0 HB2 SER A 151 6.282 -9.514 -1.996 1.00 0.31 H new ATOM 0 HB3 SER A 151 6.138 -10.755 -0.767 1.00 0.31 H new ATOM 0 HG SER A 151 3.818 -10.696 -2.104 1.00 4.41 H new ATOM 2353 N PRO A 152 5.720 -8.680 1.685 1.00 63.33 N ATOM 2354 CA PRO A 152 6.547 -7.928 2.648 1.00 71.04 C ATOM 2355 C PRO A 152 8.052 -8.162 2.443 1.00 64.22 C ATOM 2356 O PRO A 152 8.505 -9.316 2.455 1.00 43.04 O ATOM 2357 CB PRO A 152 6.096 -8.470 4.044 1.00 42.32 C ATOM 2358 CG PRO A 152 5.010 -9.494 3.784 1.00 34.14 C ATOM 2359 CD PRO A 152 5.099 -9.870 2.322 1.00 33.24 C ATOM 0 HA PRO A 152 6.408 -6.853 2.534 1.00 71.04 H new ATOM 0 HB2 PRO A 152 6.935 -8.922 4.573 1.00 42.32 H new ATOM 0 HB3 PRO A 152 5.722 -7.660 4.671 1.00 42.32 H new ATOM 0 HG2 PRO A 152 5.147 -10.371 4.417 1.00 34.14 H new ATOM 0 HG3 PRO A 152 4.028 -9.083 4.017 1.00 34.14 H new ATOM 0 HD2 PRO A 152 5.705 -10.764 2.175 1.00 33.24 H new ATOM 0 HD3 PRO A 152 4.115 -10.080 1.903 1.00 33.24 H new ATOM 2367 N PHE A 153 8.813 -7.074 2.214 1.00 44.03 N ATOM 2368 CA PHE A 153 10.260 -7.074 2.457 1.00 53.25 C ATOM 2369 C PHE A 153 10.582 -7.563 3.900 1.00 4.13 C ATOM 2370 O PHE A 153 11.337 -8.519 4.087 1.00 1.53 O ATOM 2371 CB PHE A 153 10.858 -5.655 2.298 1.00 14.24 C ATOM 2372 CG PHE A 153 10.693 -4.900 0.963 1.00 75.33 C ATOM 2373 CD1 PHE A 153 11.537 -5.155 -0.114 1.00 53.31 C ATOM 2374 CD2 PHE A 153 9.762 -3.861 0.827 1.00 1.31 C ATOM 2375 CE1 PHE A 153 11.443 -4.418 -1.282 1.00 34.40 C ATOM 2376 CE2 PHE A 153 9.682 -3.115 -0.333 1.00 22.42 C ATOM 2377 CZ PHE A 153 10.520 -3.396 -1.388 1.00 14.35 C ATOM 0 H PHE A 153 8.447 -6.189 1.862 1.00 44.03 H new ATOM 0 HA PHE A 153 10.699 -7.748 1.721 1.00 53.25 H new ATOM 0 HB2 PHE A 153 10.427 -5.031 3.080 1.00 14.24 H new ATOM 0 HB3 PHE A 153 11.926 -5.728 2.501 1.00 14.24 H new ATOM 0 HD1 PHE A 153 12.276 -5.939 -0.037 1.00 53.31 H new ATOM 0 HD2 PHE A 153 9.094 -3.639 1.646 1.00 1.31 H new ATOM 0 HE1 PHE A 153 12.094 -4.643 -2.114 1.00 34.40 H new ATOM 0 HE2 PHE A 153 8.963 -2.313 -0.412 1.00 22.42 H new ATOM 0 HZ PHE A 153 10.456 -2.818 -2.298 1.00 14.35 H new ATOM 2387 N CYS A 154 9.959 -6.885 4.890 1.00 32.22 N ATOM 2388 CA CYS A 154 10.255 -7.034 6.334 1.00 44.22 C ATOM 2389 C CYS A 154 9.987 -8.441 6.895 1.00 74.21 C ATOM 2390 O CYS A 154 10.840 -9.007 7.586 1.00 42.41 O ATOM 2391 CB CYS A 154 9.433 -5.997 7.118 1.00 34.22 C ATOM 2392 SG CYS A 154 7.658 -6.054 6.764 1.00 10.03 S ATOM 0 H CYS A 154 9.222 -6.205 4.704 1.00 32.22 H new ATOM 0 HA CYS A 154 11.326 -6.869 6.452 1.00 44.22 H new ATOM 0 HB2 CYS A 154 9.587 -6.157 8.185 1.00 34.22 H new ATOM 0 HB3 CYS A 154 9.808 -5.000 6.888 1.00 34.22 H new ATOM 0 HG CYS A 154 7.003 -5.495 7.738 1.00 10.03 H new ATOM 2398 N ALA A 155 8.787 -8.975 6.642 1.00 63.35 N ATOM 2399 CA ALA A 155 8.385 -10.299 7.162 1.00 61.52 C ATOM 2400 C ALA A 155 9.212 -11.444 6.537 1.00 55.30 C ATOM 2401 O ALA A 155 9.374 -12.497 7.148 1.00 74.33 O ATOM 2402 CB ALA A 155 6.885 -10.511 6.948 1.00 20.42 C ATOM 0 H ALA A 155 8.072 -8.514 6.080 1.00 63.35 H new ATOM 0 HA ALA A 155 8.592 -10.318 8.232 1.00 61.52 H new ATOM 0 HB1 ALA A 155 6.597 -11.489 7.334 1.00 20.42 H new ATOM 0 HB2 ALA A 155 6.329 -9.735 7.474 1.00 20.42 H new ATOM 0 HB3 ALA A 155 6.659 -10.460 5.883 1.00 20.42 H new ATOM 2408 N TYR A 156 9.741 -11.219 5.324 1.00 33.05 N ATOM 2409 CA TYR A 156 10.577 -12.212 4.612 1.00 22.30 C ATOM 2410 C TYR A 156 12.084 -11.943 4.806 1.00 24.33 C ATOM 2411 O TYR A 156 12.908 -12.800 4.481 1.00 63.04 O ATOM 2412 CB TYR A 156 10.181 -12.248 3.110 1.00 33.41 C ATOM 2413 CG TYR A 156 8.868 -13.020 2.837 1.00 24.05 C ATOM 2414 CD1 TYR A 156 7.623 -12.499 3.202 1.00 51.54 C ATOM 2415 CD2 TYR A 156 8.879 -14.280 2.225 1.00 10.51 C ATOM 2416 CE1 TYR A 156 6.452 -13.203 2.967 1.00 65.20 C ATOM 2417 CE2 TYR A 156 7.713 -14.976 1.988 1.00 31.05 C ATOM 2418 CZ TYR A 156 6.505 -14.439 2.359 1.00 14.13 C ATOM 2419 OH TYR A 156 5.343 -15.141 2.128 1.00 33.21 O ATOM 0 H TYR A 156 9.605 -10.350 4.807 1.00 33.05 H new ATOM 0 HA TYR A 156 10.389 -13.195 5.043 1.00 22.30 H new ATOM 0 HB2 TYR A 156 10.075 -11.226 2.746 1.00 33.41 H new ATOM 0 HB3 TYR A 156 10.989 -12.707 2.540 1.00 33.41 H new ATOM 0 HD1 TYR A 156 7.573 -11.530 3.676 1.00 51.54 H new ATOM 0 HD2 TYR A 156 9.823 -14.716 1.932 1.00 10.51 H new ATOM 0 HE1 TYR A 156 5.501 -12.784 3.260 1.00 65.20 H new ATOM 0 HE2 TYR A 156 7.750 -15.944 1.510 1.00 31.05 H new ATOM 0 HH TYR A 156 5.556 -15.992 1.691 1.00 33.21 H new ATOM 2429 N SER A 157 12.437 -10.755 5.332 1.00 42.44 N ATOM 2430 CA SER A 157 13.825 -10.391 5.680 1.00 22.23 C ATOM 2431 C SER A 157 13.822 -9.417 6.873 1.00 61.30 C ATOM 2432 O SER A 157 13.392 -8.263 6.744 1.00 13.13 O ATOM 2433 CB SER A 157 14.560 -9.757 4.473 1.00 74.45 C ATOM 2434 OG SER A 157 14.843 -10.714 3.470 1.00 24.31 O ATOM 0 H SER A 157 11.763 -10.015 5.529 1.00 42.44 H new ATOM 0 HA SER A 157 14.360 -11.300 5.955 1.00 22.23 H new ATOM 0 HB2 SER A 157 13.948 -8.959 4.052 1.00 74.45 H new ATOM 0 HB3 SER A 157 15.490 -9.300 4.812 1.00 74.45 H new ATOM 0 HG SER A 157 14.025 -10.914 2.969 1.00 24.31 H new ATOM 2440 N ASP A 158 14.347 -9.892 8.019 1.00 34.22 N ATOM 2441 CA ASP A 158 14.335 -9.158 9.312 1.00 70.14 C ATOM 2442 C ASP A 158 15.233 -7.894 9.272 1.00 72.33 C ATOM 2443 O ASP A 158 15.152 -7.029 10.154 1.00 21.35 O ATOM 2444 CB ASP A 158 14.774 -10.124 10.449 1.00 73.22 C ATOM 2445 CG ASP A 158 14.518 -9.577 11.872 1.00 72.21 C ATOM 2446 OD1 ASP A 158 13.351 -9.618 12.329 1.00 63.43 O ATOM 2447 OD2 ASP A 158 15.467 -9.104 12.537 1.00 42.44 O ATOM 0 H ASP A 158 14.797 -10.805 8.080 1.00 34.22 H new ATOM 0 HA ASP A 158 13.321 -8.808 9.504 1.00 70.14 H new ATOM 0 HB2 ASP A 158 14.244 -11.069 10.333 1.00 73.22 H new ATOM 0 HB3 ASP A 158 15.837 -10.339 10.339 1.00 73.22 H new ATOM 2452 N THR A 159 16.055 -7.787 8.213 1.00 64.20 N ATOM 2453 CA THR A 159 16.953 -6.641 7.975 1.00 22.12 C ATOM 2454 C THR A 159 16.174 -5.371 7.523 1.00 52.33 C ATOM 2455 O THR A 159 16.768 -4.298 7.380 1.00 24.31 O ATOM 2456 CB THR A 159 18.058 -7.012 6.925 1.00 54.01 C ATOM 2457 OG1 THR A 159 19.033 -5.958 6.821 1.00 31.12 O ATOM 2458 CG2 THR A 159 17.456 -7.300 5.539 1.00 62.34 C ATOM 0 H THR A 159 16.116 -8.503 7.489 1.00 64.20 H new ATOM 0 HA THR A 159 17.434 -6.406 8.924 1.00 22.12 H new ATOM 0 HB THR A 159 18.545 -7.921 7.279 1.00 54.01 H new ATOM 0 HG1 THR A 159 18.591 -5.091 6.938 1.00 31.12 H new ATOM 0 HG21 THR A 159 18.254 -7.553 4.841 1.00 62.34 H new ATOM 0 HG22 THR A 159 16.759 -8.135 5.611 1.00 62.34 H new ATOM 0 HG23 THR A 159 16.927 -6.416 5.181 1.00 62.34 H new ATOM 2466 N PHE A 160 14.849 -5.500 7.300 1.00 51.30 N ATOM 2467 CA PHE A 160 13.947 -4.346 7.076 1.00 15.23 C ATOM 2468 C PHE A 160 13.110 -4.160 8.356 1.00 42.21 C ATOM 2469 O PHE A 160 12.756 -5.150 9.011 1.00 63.10 O ATOM 2470 CB PHE A 160 12.981 -4.575 5.880 1.00 2.21 C ATOM 2471 CG PHE A 160 13.618 -4.802 4.506 1.00 54.22 C ATOM 2472 CD1 PHE A 160 14.231 -6.016 4.188 1.00 62.21 C ATOM 2473 CD2 PHE A 160 13.559 -3.819 3.512 1.00 4.40 C ATOM 2474 CE1 PHE A 160 14.768 -6.238 2.930 1.00 34.34 C ATOM 2475 CE2 PHE A 160 14.088 -4.048 2.252 1.00 52.30 C ATOM 2476 CZ PHE A 160 14.695 -5.255 1.964 1.00 12.41 C ATOM 0 H PHE A 160 14.374 -6.402 7.270 1.00 51.30 H new ATOM 0 HA PHE A 160 14.552 -3.469 6.845 1.00 15.23 H new ATOM 0 HB2 PHE A 160 12.355 -5.437 6.110 1.00 2.21 H new ATOM 0 HB3 PHE A 160 12.320 -3.711 5.808 1.00 2.21 H new ATOM 0 HD1 PHE A 160 14.287 -6.794 4.935 1.00 62.21 H new ATOM 0 HD2 PHE A 160 13.095 -2.869 3.730 1.00 4.40 H new ATOM 0 HE1 PHE A 160 15.244 -7.181 2.705 1.00 34.34 H new ATOM 0 HE2 PHE A 160 14.026 -3.281 1.494 1.00 52.30 H new ATOM 0 HZ PHE A 160 15.112 -5.429 0.983 1.00 12.41 H new ATOM 2486 N SER A 161 12.804 -2.906 8.715 1.00 71.25 N ATOM 2487 CA SER A 161 11.922 -2.596 9.858 1.00 41.12 C ATOM 2488 C SER A 161 10.491 -2.383 9.342 1.00 50.20 C ATOM 2489 O SER A 161 10.263 -1.465 8.554 1.00 24.31 O ATOM 2490 CB SER A 161 12.433 -1.338 10.596 1.00 51.31 C ATOM 2491 OG SER A 161 13.745 -1.537 11.103 1.00 22.51 O ATOM 0 H SER A 161 13.155 -2.081 8.229 1.00 71.25 H new ATOM 0 HA SER A 161 11.926 -3.426 10.565 1.00 41.12 H new ATOM 0 HB2 SER A 161 12.429 -0.487 9.915 1.00 51.31 H new ATOM 0 HB3 SER A 161 11.757 -1.094 11.415 1.00 51.31 H new ATOM 0 HG SER A 161 14.044 -0.725 11.564 1.00 22.51 H new ATOM 2497 N CYS A 162 9.531 -3.214 9.814 1.00 20.52 N ATOM 2498 CA CYS A 162 8.132 -3.209 9.328 1.00 3.44 C ATOM 2499 C CYS A 162 7.486 -1.829 9.567 1.00 54.31 C ATOM 2500 O CYS A 162 7.724 -1.236 10.631 1.00 14.32 O ATOM 2501 CB CYS A 162 7.318 -4.318 10.051 1.00 23.43 C ATOM 2502 SG CYS A 162 5.577 -4.428 9.557 1.00 42.14 S ATOM 0 H CYS A 162 9.706 -3.906 10.542 1.00 20.52 H new ATOM 0 HA CYS A 162 8.130 -3.410 8.257 1.00 3.44 H new ATOM 0 HB2 CYS A 162 7.796 -5.280 9.864 1.00 23.43 H new ATOM 0 HB3 CYS A 162 7.366 -4.142 11.126 1.00 23.43 H new ATOM 0 HG CYS A 162 4.998 -5.385 10.219 1.00 42.14 H new ATOM 2508 N PRO A 163 6.684 -1.274 8.588 1.00 40.54 N ATOM 2509 CA PRO A 163 6.113 0.077 8.722 1.00 2.10 C ATOM 2510 C PRO A 163 5.202 0.174 9.952 1.00 25.03 C ATOM 2511 O PRO A 163 4.216 -0.564 10.037 1.00 64.44 O ATOM 2512 CB PRO A 163 5.315 0.277 7.395 1.00 61.45 C ATOM 2513 CG PRO A 163 5.918 -0.708 6.445 1.00 4.20 C ATOM 2514 CD PRO A 163 6.275 -1.901 7.301 1.00 0.14 C ATOM 0 HA PRO A 163 6.872 0.845 8.869 1.00 2.10 H new ATOM 0 HB2 PRO A 163 4.251 0.089 7.539 1.00 61.45 H new ATOM 0 HB3 PRO A 163 5.411 1.297 7.024 1.00 61.45 H new ATOM 0 HG2 PRO A 163 5.214 -0.982 5.659 1.00 4.20 H new ATOM 0 HG3 PRO A 163 6.799 -0.295 5.954 1.00 4.20 H new ATOM 0 HD2 PRO A 163 5.427 -2.574 7.430 1.00 0.14 H new ATOM 0 HD3 PRO A 163 7.083 -2.487 6.862 1.00 0.14 H new ATOM 2522 N LEU A 164 5.601 1.051 10.899 1.00 32.43 N ATOM 2523 CA LEU A 164 4.851 1.357 12.125 1.00 11.43 C ATOM 2524 C LEU A 164 3.370 1.720 11.812 1.00 52.33 C ATOM 2525 O LEU A 164 3.100 2.814 11.300 1.00 21.32 O ATOM 2526 CB LEU A 164 5.557 2.532 12.870 1.00 42.04 C ATOM 2527 CG LEU A 164 5.026 2.861 14.302 1.00 1.31 C ATOM 2528 CD1 LEU A 164 5.254 1.685 15.281 1.00 74.25 C ATOM 2529 CD2 LEU A 164 5.647 4.176 14.834 1.00 44.31 C ATOM 0 H LEU A 164 6.473 1.574 10.825 1.00 32.43 H new ATOM 0 HA LEU A 164 4.838 0.471 12.760 1.00 11.43 H new ATOM 0 HB2 LEU A 164 6.620 2.301 12.944 1.00 42.04 H new ATOM 0 HB3 LEU A 164 5.467 3.429 12.257 1.00 42.04 H new ATOM 0 HG LEU A 164 3.948 3.008 14.229 1.00 1.31 H new ATOM 0 HD11 LEU A 164 4.871 1.952 16.266 1.00 74.25 H new ATOM 0 HD12 LEU A 164 4.731 0.801 14.916 1.00 74.25 H new ATOM 0 HD13 LEU A 164 6.321 1.472 15.352 1.00 74.25 H new ATOM 0 HD21 LEU A 164 5.261 4.383 15.832 1.00 44.31 H new ATOM 0 HD22 LEU A 164 6.731 4.075 14.878 1.00 44.31 H new ATOM 0 HD23 LEU A 164 5.386 4.998 14.167 1.00 44.31 H new ATOM 2541 N PRO A 165 2.395 0.780 12.070 1.00 73.14 N ATOM 2542 CA PRO A 165 0.975 1.010 11.777 1.00 43.15 C ATOM 2543 C PRO A 165 0.236 1.643 12.985 1.00 52.13 C ATOM 2544 O PRO A 165 0.292 1.101 14.095 1.00 55.42 O ATOM 2545 CB PRO A 165 0.467 -0.426 11.465 1.00 31.41 C ATOM 2546 CG PRO A 165 1.338 -1.357 12.278 1.00 33.52 C ATOM 2547 CD PRO A 165 2.590 -0.571 12.681 1.00 45.44 C ATOM 0 HA PRO A 165 0.803 1.714 10.963 1.00 43.15 H new ATOM 0 HB2 PRO A 165 -0.583 -0.537 11.736 1.00 31.41 H new ATOM 0 HB3 PRO A 165 0.546 -0.646 10.400 1.00 31.41 H new ATOM 0 HG2 PRO A 165 0.805 -1.710 13.161 1.00 33.52 H new ATOM 0 HG3 PRO A 165 1.608 -2.238 11.695 1.00 33.52 H new ATOM 0 HD2 PRO A 165 2.687 -0.507 13.765 1.00 45.44 H new ATOM 0 HD3 PRO A 165 3.496 -1.049 12.308 1.00 45.44 H new ATOM 2555 N PRO A 166 -0.446 2.819 12.805 1.00 72.21 N ATOM 2556 CA PRO A 166 -1.330 3.383 13.853 1.00 41.23 C ATOM 2557 C PRO A 166 -2.556 2.474 14.083 1.00 24.12 C ATOM 2558 O PRO A 166 -2.995 1.791 13.164 1.00 11.43 O ATOM 2559 CB PRO A 166 -1.732 4.771 13.285 1.00 11.21 C ATOM 2560 CG PRO A 166 -1.551 4.654 11.801 1.00 62.51 C ATOM 2561 CD PRO A 166 -0.392 3.699 11.599 1.00 11.03 C ATOM 0 HA PRO A 166 -0.848 3.463 14.827 1.00 41.23 H new ATOM 0 HB2 PRO A 166 -2.763 5.017 13.538 1.00 11.21 H new ATOM 0 HB3 PRO A 166 -1.106 5.562 13.697 1.00 11.21 H new ATOM 0 HG2 PRO A 166 -2.456 4.276 11.326 1.00 62.51 H new ATOM 0 HG3 PRO A 166 -1.339 5.626 11.355 1.00 62.51 H new ATOM 0 HD2 PRO A 166 -0.501 3.125 10.679 1.00 11.03 H new ATOM 0 HD3 PRO A 166 0.558 4.230 11.532 1.00 11.03 H new ATOM 2569 N GLU A 167 -3.114 2.474 15.311 1.00 63.04 N ATOM 2570 CA GLU A 167 -4.335 1.685 15.638 1.00 62.34 C ATOM 2571 C GLU A 167 -5.535 2.113 14.758 1.00 63.20 C ATOM 2572 O GLU A 167 -6.496 1.354 14.584 1.00 72.05 O ATOM 2573 CB GLU A 167 -4.693 1.805 17.141 1.00 10.44 C ATOM 2574 CG GLU A 167 -3.607 1.284 18.103 1.00 30.41 C ATOM 2575 CD GLU A 167 -4.073 1.254 19.563 1.00 72.13 C ATOM 2576 OE1 GLU A 167 -4.660 0.228 19.993 1.00 71.32 O ATOM 2577 OE2 GLU A 167 -3.883 2.256 20.286 1.00 2.32 O ATOM 0 H GLU A 167 -2.744 3.009 16.097 1.00 63.04 H new ATOM 0 HA GLU A 167 -4.114 0.640 15.423 1.00 62.34 H new ATOM 0 HB2 GLU A 167 -4.892 2.852 17.371 1.00 10.44 H new ATOM 0 HB3 GLU A 167 -5.617 1.257 17.326 1.00 10.44 H new ATOM 0 HG2 GLU A 167 -3.311 0.280 17.800 1.00 30.41 H new ATOM 0 HG3 GLU A 167 -2.722 1.915 18.021 1.00 30.41 H new ATOM 2584 N SER A 168 -5.419 3.328 14.194 1.00 71.10 N ATOM 2585 CA SER A 168 -6.392 3.926 13.279 1.00 60.15 C ATOM 2586 C SER A 168 -6.520 3.145 11.945 1.00 11.22 C ATOM 2587 O SER A 168 -7.619 3.058 11.383 1.00 51.11 O ATOM 2588 CB SER A 168 -5.963 5.380 13.003 1.00 35.44 C ATOM 2589 OG SER A 168 -5.779 6.108 14.206 1.00 14.44 O ATOM 0 H SER A 168 -4.619 3.935 14.371 1.00 71.10 H new ATOM 0 HA SER A 168 -7.374 3.890 13.751 1.00 60.15 H new ATOM 0 HB2 SER A 168 -5.036 5.384 12.430 1.00 35.44 H new ATOM 0 HB3 SER A 168 -6.718 5.873 12.391 1.00 35.44 H new ATOM 0 HG SER A 168 -5.506 7.025 13.995 1.00 14.44 H new ATOM 2595 N ASN A 169 -5.399 2.546 11.469 1.00 61.11 N ATOM 2596 CA ASN A 169 -5.322 1.927 10.117 1.00 33.21 C ATOM 2597 C ASN A 169 -5.641 0.410 10.164 1.00 23.11 C ATOM 2598 O ASN A 169 -5.576 -0.280 9.134 1.00 62.20 O ATOM 2599 CB ASN A 169 -3.926 2.213 9.456 1.00 4.13 C ATOM 2600 CG ASN A 169 -2.755 1.283 9.874 1.00 51.43 C ATOM 2601 OD1 ASN A 169 -2.773 0.610 10.893 1.00 64.35 O ATOM 2602 ND2 ASN A 169 -1.697 1.275 9.090 1.00 12.14 N ATOM 0 H ASN A 169 -4.532 2.478 12.002 1.00 61.11 H new ATOM 0 HA ASN A 169 -6.086 2.387 9.491 1.00 33.21 H new ATOM 0 HB2 ASN A 169 -4.042 2.149 8.374 1.00 4.13 H new ATOM 0 HB3 ASN A 169 -3.644 3.240 9.686 1.00 4.13 H new ATOM 0 HD21 ASN A 169 -0.887 0.705 9.333 1.00 12.14 H new ATOM 0 HD22 ASN A 169 -1.688 1.839 8.240 1.00 12.14 H new ATOM 2609 N TRP A 170 -6.003 -0.087 11.361 1.00 43.55 N ATOM 2610 CA TRP A 170 -6.343 -1.500 11.575 1.00 4.30 C ATOM 2611 C TRP A 170 -7.758 -1.776 11.019 1.00 2.50 C ATOM 2612 O TRP A 170 -8.764 -1.352 11.604 1.00 73.33 O ATOM 2613 CB TRP A 170 -6.272 -1.875 13.085 1.00 13.43 C ATOM 2614 CG TRP A 170 -4.900 -1.783 13.736 1.00 3.23 C ATOM 2615 CD1 TRP A 170 -3.727 -1.343 13.186 1.00 24.31 C ATOM 2616 CD2 TRP A 170 -4.581 -2.155 15.089 1.00 71.12 C ATOM 2617 NE1 TRP A 170 -2.717 -1.397 14.112 1.00 5.54 N ATOM 2618 CE2 TRP A 170 -3.213 -1.896 15.285 1.00 3.15 C ATOM 2619 CE3 TRP A 170 -5.324 -2.679 16.150 1.00 54.22 C ATOM 2620 CZ2 TRP A 170 -2.575 -2.143 16.498 1.00 63.21 C ATOM 2621 CZ3 TRP A 170 -4.689 -2.922 17.357 1.00 14.30 C ATOM 2622 CH2 TRP A 170 -3.325 -2.652 17.521 1.00 43.43 C ATOM 0 H TRP A 170 -6.067 0.482 12.205 1.00 43.55 H new ATOM 0 HA TRP A 170 -5.616 -2.117 11.047 1.00 4.30 H new ATOM 0 HB2 TRP A 170 -6.955 -1.225 13.632 1.00 13.43 H new ATOM 0 HB3 TRP A 170 -6.639 -2.894 13.203 1.00 13.43 H new ATOM 0 HD1 TRP A 170 -3.613 -1.002 12.168 1.00 24.31 H new ATOM 0 HE1 TRP A 170 -1.751 -1.111 13.952 1.00 5.54 H new ATOM 0 HE3 TRP A 170 -6.376 -2.891 16.031 1.00 54.22 H new ATOM 0 HZ2 TRP A 170 -1.522 -1.939 16.626 1.00 63.21 H new ATOM 0 HZ3 TRP A 170 -5.255 -3.326 18.184 1.00 14.30 H new ATOM 0 HH2 TRP A 170 -2.857 -2.850 18.474 1.00 43.43 H new ATOM 2633 N LEU A 171 -7.819 -2.477 9.877 1.00 71.52 N ATOM 2634 CA LEU A 171 -9.070 -2.855 9.213 1.00 23.12 C ATOM 2635 C LEU A 171 -9.625 -4.116 9.902 1.00 45.41 C ATOM 2636 O LEU A 171 -8.975 -5.165 9.844 1.00 10.34 O ATOM 2637 CB LEU A 171 -8.803 -3.144 7.695 1.00 21.25 C ATOM 2638 CG LEU A 171 -8.020 -2.051 6.888 1.00 61.20 C ATOM 2639 CD1 LEU A 171 -7.748 -2.509 5.434 1.00 3.30 C ATOM 2640 CD2 LEU A 171 -8.753 -0.693 6.913 1.00 53.55 C ATOM 0 H LEU A 171 -6.987 -2.801 9.384 1.00 71.52 H new ATOM 0 HA LEU A 171 -9.793 -2.043 9.287 1.00 23.12 H new ATOM 0 HB2 LEU A 171 -8.250 -4.080 7.621 1.00 21.25 H new ATOM 0 HB3 LEU A 171 -9.764 -3.302 7.206 1.00 21.25 H new ATOM 0 HG LEU A 171 -7.057 -1.915 7.380 1.00 61.20 H new ATOM 0 HD11 LEU A 171 -7.204 -1.728 4.902 1.00 3.30 H new ATOM 0 HD12 LEU A 171 -7.153 -3.422 5.445 1.00 3.30 H new ATOM 0 HD13 LEU A 171 -8.695 -2.699 4.929 1.00 3.30 H new ATOM 0 HD21 LEU A 171 -8.181 0.040 6.344 1.00 53.55 H new ATOM 0 HD22 LEU A 171 -9.742 -0.805 6.469 1.00 53.55 H new ATOM 0 HD23 LEU A 171 -8.854 -0.353 7.944 1.00 53.55 H new ATOM 2652 N GLU A 172 -10.796 -4.032 10.579 1.00 10.44 N ATOM 2653 CA GLU A 172 -11.425 -5.226 11.186 1.00 43.55 C ATOM 2654 C GLU A 172 -12.280 -5.957 10.126 1.00 2.22 C ATOM 2655 O GLU A 172 -13.513 -5.976 10.166 1.00 32.05 O ATOM 2656 CB GLU A 172 -12.237 -4.878 12.470 1.00 14.31 C ATOM 2657 CG GLU A 172 -12.741 -6.117 13.254 1.00 4.10 C ATOM 2658 CD GLU A 172 -13.400 -5.772 14.596 1.00 51.13 C ATOM 2659 OE1 GLU A 172 -14.595 -5.406 14.605 1.00 73.11 O ATOM 2660 OE2 GLU A 172 -12.725 -5.869 15.650 1.00 75.11 O ATOM 0 H GLU A 172 -11.315 -3.165 10.716 1.00 10.44 H new ATOM 0 HA GLU A 172 -10.637 -5.903 11.516 1.00 43.55 H new ATOM 0 HB2 GLU A 172 -11.614 -4.273 13.129 1.00 14.31 H new ATOM 0 HB3 GLU A 172 -13.094 -4.265 12.190 1.00 14.31 H new ATOM 0 HG2 GLU A 172 -13.457 -6.660 12.637 1.00 4.10 H new ATOM 0 HG3 GLU A 172 -11.901 -6.788 13.434 1.00 4.10 H new ATOM 2667 N THR A 173 -11.560 -6.486 9.128 1.00 51.21 N ATOM 2668 CA THR A 173 -12.088 -7.337 8.058 1.00 1.11 C ATOM 2669 C THR A 173 -10.919 -8.111 7.448 1.00 21.24 C ATOM 2670 O THR A 173 -9.775 -7.628 7.454 1.00 21.24 O ATOM 2671 CB THR A 173 -12.805 -6.509 6.942 1.00 64.31 C ATOM 2672 OG1 THR A 173 -13.335 -7.385 5.937 1.00 52.01 O ATOM 2673 CG2 THR A 173 -11.877 -5.460 6.288 1.00 3.04 C ATOM 0 H THR A 173 -10.556 -6.326 9.042 1.00 51.21 H new ATOM 0 HA THR A 173 -12.831 -8.011 8.485 1.00 1.11 H new ATOM 0 HB THR A 173 -13.617 -5.965 7.425 1.00 64.31 H new ATOM 0 HG1 THR A 173 -13.783 -6.855 5.245 1.00 52.01 H new ATOM 0 HG21 THR A 173 -12.427 -4.915 5.521 1.00 3.04 H new ATOM 0 HG22 THR A 173 -11.525 -4.762 7.047 1.00 3.04 H new ATOM 0 HG23 THR A 173 -11.023 -5.963 5.834 1.00 3.04 H new ATOM 2681 N ALA A 174 -11.195 -9.311 6.943 1.00 75.51 N ATOM 2682 CA ALA A 174 -10.171 -10.148 6.324 1.00 74.44 C ATOM 2683 C ALA A 174 -10.053 -9.762 4.843 1.00 30.41 C ATOM 2684 O ALA A 174 -10.806 -10.271 4.000 1.00 42.41 O ATOM 2685 CB ALA A 174 -10.522 -11.631 6.506 1.00 24.33 C ATOM 0 H ALA A 174 -12.126 -9.728 6.951 1.00 75.51 H new ATOM 0 HA ALA A 174 -9.205 -9.988 6.802 1.00 74.44 H new ATOM 0 HB1 ALA A 174 -9.752 -12.247 6.041 1.00 24.33 H new ATOM 0 HB2 ALA A 174 -10.579 -11.863 7.569 1.00 24.33 H new ATOM 0 HB3 ALA A 174 -11.484 -11.837 6.037 1.00 24.33 H new ATOM 2691 N VAL A 175 -9.144 -8.807 4.564 1.00 1.55 N ATOM 2692 CA VAL A 175 -8.817 -8.368 3.201 1.00 23.03 C ATOM 2693 C VAL A 175 -8.239 -9.538 2.395 1.00 24.23 C ATOM 2694 O VAL A 175 -7.103 -9.957 2.620 1.00 64.15 O ATOM 2695 CB VAL A 175 -7.797 -7.157 3.181 1.00 22.00 C ATOM 2696 CG1 VAL A 175 -7.345 -6.822 1.730 1.00 55.42 C ATOM 2697 CG2 VAL A 175 -8.398 -5.915 3.894 1.00 73.22 C ATOM 0 H VAL A 175 -8.615 -8.318 5.286 1.00 1.55 H new ATOM 0 HA VAL A 175 -9.746 -8.023 2.747 1.00 23.03 H new ATOM 0 HB VAL A 175 -6.907 -7.458 3.734 1.00 22.00 H new ATOM 0 HG11 VAL A 175 -6.645 -5.986 1.751 1.00 55.42 H new ATOM 0 HG12 VAL A 175 -6.858 -7.692 1.291 1.00 55.42 H new ATOM 0 HG13 VAL A 175 -8.215 -6.552 1.131 1.00 55.42 H new ATOM 0 HG21 VAL A 175 -7.679 -5.097 3.867 1.00 73.22 H new ATOM 0 HG22 VAL A 175 -9.313 -5.611 3.386 1.00 73.22 H new ATOM 0 HG23 VAL A 175 -8.625 -6.165 4.930 1.00 73.22 H new ATOM 2707 N THR A 176 -9.078 -10.106 1.525 1.00 23.40 N ATOM 2708 CA THR A 176 -8.672 -11.061 0.489 1.00 3.55 C ATOM 2709 C THR A 176 -9.476 -10.783 -0.776 1.00 32.52 C ATOM 2710 O THR A 176 -10.652 -10.431 -0.702 1.00 72.21 O ATOM 2711 CB THR A 176 -8.903 -12.546 0.925 1.00 72.13 C ATOM 2712 OG1 THR A 176 -10.175 -12.666 1.578 1.00 74.42 O ATOM 2713 CG2 THR A 176 -7.794 -13.070 1.848 1.00 42.24 C ATOM 0 H THR A 176 -10.079 -9.911 1.520 1.00 23.40 H new ATOM 0 HA THR A 176 -7.604 -10.932 0.315 1.00 3.55 H new ATOM 0 HB THR A 176 -8.884 -13.155 0.021 1.00 72.13 H new ATOM 0 HG1 THR A 176 -10.815 -12.052 1.162 1.00 74.42 H new ATOM 0 HG21 THR A 176 -8.005 -14.104 2.119 1.00 42.24 H new ATOM 0 HG22 THR A 176 -6.836 -13.019 1.331 1.00 42.24 H new ATOM 0 HG23 THR A 176 -7.753 -12.459 2.750 1.00 42.24 H new ATOM 2721 N ALA A 177 -8.835 -10.962 -1.921 1.00 2.03 N ATOM 2722 CA ALA A 177 -9.454 -10.810 -3.238 1.00 22.31 C ATOM 2723 C ALA A 177 -8.863 -11.904 -4.131 1.00 63.41 C ATOM 2724 O ALA A 177 -7.643 -12.094 -4.120 1.00 23.22 O ATOM 2725 CB ALA A 177 -9.184 -9.392 -3.783 1.00 43.22 C ATOM 0 H ALA A 177 -7.850 -11.222 -1.966 1.00 2.03 H new ATOM 0 HA ALA A 177 -10.538 -10.921 -3.198 1.00 22.31 H new ATOM 0 HB1 ALA A 177 -9.647 -9.285 -4.764 1.00 43.22 H new ATOM 0 HB2 ALA A 177 -9.605 -8.654 -3.100 1.00 43.22 H new ATOM 0 HB3 ALA A 177 -8.109 -9.234 -3.870 1.00 43.22 H new ATOM 2731 N GLY A 178 -9.724 -12.643 -4.858 1.00 4.34 N ATOM 2732 CA GLY A 178 -9.272 -13.808 -5.625 1.00 62.33 C ATOM 2733 C GLY A 178 -8.702 -14.910 -4.742 1.00 13.35 C ATOM 2734 O GLY A 178 -9.235 -15.173 -3.650 1.00 35.44 O ATOM 0 H GLY A 178 -10.724 -12.453 -4.927 1.00 4.34 H new ATOM 0 HA2 GLY A 178 -10.108 -14.205 -6.200 1.00 62.33 H new ATOM 0 HA3 GLY A 178 -8.513 -13.494 -6.341 1.00 62.33 H new ATOM 2738 N GLU A 179 -7.651 -15.594 -5.244 1.00 14.21 N ATOM 2739 CA GLU A 179 -6.892 -16.586 -4.469 1.00 2.02 C ATOM 2740 C GLU A 179 -6.242 -15.919 -3.232 1.00 52.25 C ATOM 2741 O GLU A 179 -5.928 -14.720 -3.239 1.00 1.12 O ATOM 2742 CB GLU A 179 -5.822 -17.293 -5.357 1.00 2.00 C ATOM 2743 CG GLU A 179 -5.111 -18.507 -4.697 1.00 73.14 C ATOM 2744 CD GLU A 179 -6.074 -19.667 -4.341 1.00 42.31 C ATOM 2745 OE1 GLU A 179 -6.666 -19.655 -3.232 1.00 62.44 O ATOM 2746 OE2 GLU A 179 -6.255 -20.586 -5.175 1.00 33.03 O ATOM 0 H GLU A 179 -7.309 -15.471 -6.197 1.00 14.21 H new ATOM 0 HA GLU A 179 -7.584 -17.352 -4.120 1.00 2.02 H new ATOM 0 HB2 GLU A 179 -6.301 -17.629 -6.277 1.00 2.00 H new ATOM 0 HB3 GLU A 179 -5.067 -16.560 -5.640 1.00 2.00 H new ATOM 0 HG2 GLU A 179 -4.341 -18.879 -5.373 1.00 73.14 H new ATOM 0 HG3 GLU A 179 -4.606 -18.174 -3.791 1.00 73.14 H new ATOM 2753 N ARG A 180 -6.041 -16.721 -2.187 1.00 24.13 N ATOM 2754 CA ARG A 180 -5.675 -16.242 -0.849 1.00 10.40 C ATOM 2755 C ARG A 180 -4.141 -16.031 -0.724 1.00 62.14 C ATOM 2756 O ARG A 180 -3.399 -16.101 -1.713 1.00 73.14 O ATOM 2757 CB ARG A 180 -6.198 -17.271 0.196 1.00 33.13 C ATOM 2758 CG ARG A 180 -7.688 -17.673 0.037 1.00 1.21 C ATOM 2759 CD ARG A 180 -8.684 -16.511 0.251 1.00 23.34 C ATOM 2760 NE ARG A 180 -10.078 -16.924 -0.030 1.00 41.51 N ATOM 2761 CZ ARG A 180 -11.191 -16.283 0.388 1.00 42.33 C ATOM 2762 NH1 ARG A 180 -11.113 -15.173 1.103 1.00 52.35 N ATOM 2763 NH2 ARG A 180 -12.385 -16.763 0.074 1.00 35.10 N ATOM 0 H ARG A 180 -6.128 -17.736 -2.244 1.00 24.13 H new ATOM 0 HA ARG A 180 -6.134 -15.270 -0.666 1.00 10.40 H new ATOM 0 HB2 ARG A 180 -5.587 -18.171 0.134 1.00 33.13 H new ATOM 0 HB3 ARG A 180 -6.054 -16.857 1.194 1.00 33.13 H new ATOM 0 HG2 ARG A 180 -7.837 -18.085 -0.961 1.00 1.21 H new ATOM 0 HG3 ARG A 180 -7.916 -18.468 0.747 1.00 1.21 H new ATOM 0 HD2 ARG A 180 -8.611 -16.154 1.278 1.00 23.34 H new ATOM 0 HD3 ARG A 180 -8.414 -15.677 -0.397 1.00 23.34 H new ATOM 0 HE ARG A 180 -10.209 -17.767 -0.589 1.00 41.51 H new ATOM 0 HH11 ARG A 180 -10.201 -14.787 1.348 1.00 52.35 H new ATOM 0 HH12 ARG A 180 -11.965 -14.703 1.410 1.00 52.35 H new ATOM 0 HH21 ARG A 180 -12.462 -17.615 -0.482 1.00 35.10 H new ATOM 0 HH22 ARG A 180 -13.227 -16.281 0.388 1.00 35.10 H new