USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1052 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 5 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 138 SER OG : rot 30:sc= 0.835 USER MOD Set 2.1: A 35 THR OG1 : rot -57:sc= 1.17 USER MOD Set 2.2: A 122 TYR OH : rot -27:sc= 1.23 USER MOD Single : A 1 GLY N :NH3+ -106:sc= 0.0754 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.317 K(o=-0.32,f=-2.2!) USER MOD Single : A 19 TYR OH : rot 17:sc= 1.27 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= 0.71 K(o=0.71,f=-0.079) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 0:sc= -1.8 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -56:sc= 0.28 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS :FLIP no HE2:sc= -2.19 F(o=-2.9,f=-2.2) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.0769 X(o=-0.077,f=-0.21) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl -160:sc= 0 (180deg=-0.712) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 GLN : amide:sc= -0.128 K(o=-0.13,f=-1.9!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.080 -8.220 -1.794 1.00 32.31 N ATOM 2 CA GLY A 1 21.459 -6.859 -1.463 1.00 31.34 C ATOM 3 C GLY A 1 20.991 -5.858 -2.500 1.00 24.31 C ATOM 4 O GLY A 1 20.668 -6.229 -3.629 1.00 41.42 O ATOM 0 H1 GLY A 1 20.300 -8.523 -1.176 1.00 32.31 H new ATOM 0 H2 GLY A 1 20.772 -8.263 -2.786 1.00 32.31 H new ATOM 0 H3 GLY A 1 21.896 -8.851 -1.657 1.00 32.31 H new ATOM 0 HA2 GLY A 1 21.040 -6.594 -0.492 1.00 31.34 H new ATOM 0 HA3 GLY A 1 22.543 -6.800 -1.369 1.00 31.34 H new ATOM 8 N SER A 2 20.955 -4.585 -2.118 1.00 63.44 N ATOM 9 CA SER A 2 20.518 -3.528 -3.022 1.00 71.12 C ATOM 10 C SER A 2 20.953 -2.159 -2.508 1.00 32.20 C ATOM 11 O SER A 2 21.715 -1.451 -3.165 1.00 40.53 O ATOM 12 CB SER A 2 18.997 -3.565 -3.187 1.00 13.52 C ATOM 13 OG SER A 2 18.522 -2.377 -3.797 1.00 32.53 O ATOM 0 H SER A 2 21.223 -4.261 -1.189 1.00 63.44 H new ATOM 0 HA SER A 2 20.985 -3.697 -3.992 1.00 71.12 H new ATOM 0 HB2 SER A 2 18.714 -4.426 -3.792 1.00 13.52 H new ATOM 0 HB3 SER A 2 18.525 -3.691 -2.213 1.00 13.52 H new ATOM 0 HG SER A 2 17.548 -2.425 -3.893 1.00 32.53 H new ATOM 19 N SER A 3 20.463 -1.795 -1.328 1.00 2.41 N ATOM 20 CA SER A 3 20.797 -0.510 -0.725 1.00 52.10 C ATOM 21 C SER A 3 20.311 0.643 -1.599 1.00 35.03 C ATOM 22 O SER A 3 20.088 0.477 -2.797 1.00 62.13 O ATOM 23 CB SER A 3 22.308 -0.400 -0.512 1.00 20.03 C ATOM 24 OG SER A 3 22.724 -1.178 0.598 1.00 71.24 O ATOM 0 H SER A 3 19.833 -2.372 -0.770 1.00 2.41 H new ATOM 0 HA SER A 3 20.295 -0.449 0.241 1.00 52.10 H new ATOM 0 HB2 SER A 3 22.830 -0.732 -1.409 1.00 20.03 H new ATOM 0 HB3 SER A 3 22.581 0.643 -0.352 1.00 20.03 H new ATOM 0 HG SER A 3 23.694 -1.093 0.712 1.00 71.24 H new ATOM 30 N GLY A 4 20.148 1.812 -0.988 1.00 52.32 N ATOM 31 CA GLY A 4 19.688 2.975 -1.724 1.00 44.51 C ATOM 32 C GLY A 4 18.769 3.857 -0.901 1.00 43.22 C ATOM 33 O GLY A 4 18.315 3.460 0.171 1.00 34.12 O ATOM 0 H GLY A 4 20.326 1.975 0.003 1.00 52.32 H new ATOM 0 HA2 GLY A 4 20.549 3.558 -2.051 1.00 44.51 H new ATOM 0 HA3 GLY A 4 19.164 2.649 -2.623 1.00 44.51 H new ATOM 37 N SER A 5 18.497 5.057 -1.403 1.00 4.31 N ATOM 38 CA SER A 5 17.632 5.999 -0.704 1.00 12.42 C ATOM 39 C SER A 5 17.545 7.322 -1.460 1.00 74.43 C ATOM 40 O SER A 5 18.414 8.184 -1.328 1.00 51.13 O ATOM 41 CB SER A 5 18.149 6.244 0.715 1.00 74.30 C ATOM 42 OG SER A 5 17.108 6.108 1.667 1.00 34.03 O ATOM 0 H SER A 5 18.863 5.400 -2.291 1.00 4.31 H new ATOM 0 HA SER A 5 16.634 5.564 -0.650 1.00 12.42 H new ATOM 0 HB2 SER A 5 18.948 5.538 0.941 1.00 74.30 H new ATOM 0 HB3 SER A 5 18.579 7.244 0.781 1.00 74.30 H new ATOM 0 HG SER A 5 17.464 6.268 2.566 1.00 34.03 H new ATOM 48 N SER A 6 16.490 7.474 -2.254 1.00 62.21 N ATOM 49 CA SER A 6 16.290 8.688 -3.036 1.00 43.52 C ATOM 50 C SER A 6 14.833 8.823 -3.468 1.00 71.43 C ATOM 51 O SER A 6 14.137 7.827 -3.663 1.00 54.21 O ATOM 52 CB SER A 6 17.200 8.684 -4.266 1.00 42.31 C ATOM 53 OG SER A 6 18.083 9.794 -4.251 1.00 34.43 O ATOM 0 H SER A 6 15.760 6.771 -2.373 1.00 62.21 H new ATOM 0 HA SER A 6 16.545 9.541 -2.407 1.00 43.52 H new ATOM 0 HB2 SER A 6 17.775 7.758 -4.294 1.00 42.31 H new ATOM 0 HB3 SER A 6 16.593 8.710 -5.171 1.00 42.31 H new ATOM 0 HG SER A 6 18.655 9.768 -5.046 1.00 34.43 H new ATOM 59 N GLY A 7 14.378 10.064 -3.616 1.00 63.51 N ATOM 60 CA GLY A 7 13.006 10.307 -4.023 1.00 42.24 C ATOM 61 C GLY A 7 12.274 11.230 -3.070 1.00 54.10 C ATOM 62 O GLY A 7 12.483 11.175 -1.859 1.00 45.23 O ATOM 0 H GLY A 7 14.935 10.905 -3.461 1.00 63.51 H new ATOM 0 HA2 GLY A 7 12.998 10.741 -5.023 1.00 42.24 H new ATOM 0 HA3 GLY A 7 12.475 9.357 -4.084 1.00 42.24 H new ATOM 66 N MET A 8 11.412 12.081 -3.618 1.00 1.33 N ATOM 67 CA MET A 8 10.646 13.020 -2.807 1.00 43.32 C ATOM 68 C MET A 8 9.155 12.705 -2.873 1.00 62.14 C ATOM 69 O MET A 8 8.506 12.517 -1.845 1.00 22.14 O ATOM 70 CB MET A 8 10.898 14.454 -3.275 1.00 54.34 C ATOM 71 CG MET A 8 11.603 15.317 -2.242 1.00 75.20 C ATOM 72 SD MET A 8 13.353 14.916 -2.080 1.00 34.41 S ATOM 73 CE MET A 8 14.104 16.430 -2.671 1.00 50.53 C ATOM 0 H MET A 8 11.227 12.139 -4.619 1.00 1.33 H new ATOM 0 HA MET A 8 10.974 12.920 -1.772 1.00 43.32 H new ATOM 0 HB2 MET A 8 11.497 14.430 -4.186 1.00 54.34 H new ATOM 0 HB3 MET A 8 9.945 14.916 -3.532 1.00 54.34 H new ATOM 0 HG2 MET A 8 11.499 16.366 -2.519 1.00 75.20 H new ATOM 0 HG3 MET A 8 11.115 15.192 -1.276 1.00 75.20 H new ATOM 0 HE1 MET A 8 15.189 16.337 -2.632 1.00 50.53 H new ATOM 0 HE2 MET A 8 13.793 16.613 -3.699 1.00 50.53 H new ATOM 0 HE3 MET A 8 13.788 17.262 -2.042 1.00 50.53 H new ATOM 83 N GLU A 9 8.619 12.649 -4.088 1.00 43.54 N ATOM 84 CA GLU A 9 7.204 12.358 -4.286 1.00 63.23 C ATOM 85 C GLU A 9 6.858 10.965 -3.769 1.00 24.03 C ATOM 86 O GLU A 9 7.717 10.085 -3.698 1.00 54.53 O ATOM 87 CB GLU A 9 6.842 12.467 -5.769 1.00 15.33 C ATOM 88 CG GLU A 9 7.032 13.862 -6.341 1.00 5.42 C ATOM 89 CD GLU A 9 7.816 13.858 -7.640 1.00 0.12 C ATOM 90 OE1 GLU A 9 9.059 13.753 -7.581 1.00 32.34 O ATOM 91 OE2 GLU A 9 7.187 13.959 -8.713 1.00 11.31 O ATOM 0 H GLU A 9 9.143 12.801 -4.950 1.00 43.54 H new ATOM 0 HA GLU A 9 6.626 13.090 -3.722 1.00 63.23 H new ATOM 0 HB2 GLU A 9 7.453 11.765 -6.336 1.00 15.33 H new ATOM 0 HB3 GLU A 9 5.803 12.167 -5.904 1.00 15.33 H new ATOM 0 HG2 GLU A 9 6.056 14.317 -6.511 1.00 5.42 H new ATOM 0 HG3 GLU A 9 7.550 14.483 -5.610 1.00 5.42 H new ATOM 98 N LEU A 10 5.595 10.773 -3.406 1.00 20.11 N ATOM 99 CA LEU A 10 5.133 9.487 -2.892 1.00 43.34 C ATOM 100 C LEU A 10 4.201 8.807 -3.889 1.00 64.44 C ATOM 101 O LEU A 10 3.882 9.366 -4.939 1.00 70.12 O ATOM 102 CB LEU A 10 4.416 9.677 -1.555 1.00 2.44 C ATOM 103 CG LEU A 10 5.307 10.009 -0.357 1.00 40.24 C ATOM 104 CD1 LEU A 10 4.462 10.401 0.845 1.00 1.31 C ATOM 105 CD2 LEU A 10 6.204 8.828 -0.018 1.00 22.32 C ATOM 0 H LEU A 10 4.872 11.491 -3.458 1.00 20.11 H new ATOM 0 HA LEU A 10 6.004 8.849 -2.742 1.00 43.34 H new ATOM 0 HB2 LEU A 10 3.682 10.475 -1.669 1.00 2.44 H new ATOM 0 HB3 LEU A 10 3.863 8.765 -1.329 1.00 2.44 H new ATOM 0 HG LEU A 10 5.939 10.857 -0.622 1.00 40.24 H new ATOM 0 HD11 LEU A 10 5.113 10.634 1.687 1.00 1.31 H new ATOM 0 HD12 LEU A 10 3.862 11.277 0.598 1.00 1.31 H new ATOM 0 HD13 LEU A 10 3.804 9.574 1.113 1.00 1.31 H new ATOM 0 HD21 LEU A 10 6.831 9.081 0.837 1.00 22.32 H new ATOM 0 HD22 LEU A 10 5.589 7.962 0.227 1.00 22.32 H new ATOM 0 HD23 LEU A 10 6.836 8.593 -0.875 1.00 22.32 H new ATOM 117 N PHE A 11 3.766 7.597 -3.554 1.00 31.23 N ATOM 118 CA PHE A 11 2.869 6.839 -4.419 1.00 43.11 C ATOM 119 C PHE A 11 3.274 6.984 -5.883 1.00 43.21 C ATOM 120 O PHE A 11 2.426 7.015 -6.775 1.00 35.21 O ATOM 121 CB PHE A 11 1.426 7.309 -4.228 1.00 51.11 C ATOM 122 CG PHE A 11 0.875 7.014 -2.863 1.00 73.13 C ATOM 123 CD1 PHE A 11 1.142 7.856 -1.796 1.00 1.41 C ATOM 124 CD2 PHE A 11 0.089 5.893 -2.645 1.00 52.33 C ATOM 125 CE1 PHE A 11 0.636 7.588 -0.538 1.00 21.13 C ATOM 126 CE2 PHE A 11 -0.421 5.620 -1.390 1.00 20.13 C ATOM 127 CZ PHE A 11 -0.145 6.467 -0.335 1.00 50.53 C ATOM 0 H PHE A 11 4.020 7.120 -2.689 1.00 31.23 H new ATOM 0 HA PHE A 11 2.941 5.787 -4.143 1.00 43.11 H new ATOM 0 HB2 PHE A 11 1.376 8.383 -4.407 1.00 51.11 H new ATOM 0 HB3 PHE A 11 0.795 6.831 -4.977 1.00 51.11 H new ATOM 0 HD1 PHE A 11 1.753 8.733 -1.949 1.00 1.41 H new ATOM 0 HD2 PHE A 11 -0.127 5.225 -3.466 1.00 52.33 H new ATOM 0 HE1 PHE A 11 0.851 8.254 0.285 1.00 21.13 H new ATOM 0 HE2 PHE A 11 -1.035 4.745 -1.235 1.00 20.13 H new ATOM 0 HZ PHE A 11 -0.539 6.253 0.647 1.00 50.53 H new ATOM 137 N THR A 12 4.579 7.074 -6.124 1.00 1.32 N ATOM 138 CA THR A 12 5.098 7.219 -7.478 1.00 71.50 C ATOM 139 C THR A 12 5.683 5.905 -7.984 1.00 42.33 C ATOM 140 O THR A 12 6.103 5.058 -7.197 1.00 4.42 O ATOM 141 CB THR A 12 6.180 8.312 -7.551 1.00 50.33 C ATOM 142 OG1 THR A 12 7.143 8.120 -6.509 1.00 61.13 O ATOM 143 CG2 THR A 12 5.560 9.695 -7.427 1.00 45.21 C ATOM 0 H THR A 12 5.295 7.049 -5.398 1.00 1.32 H new ATOM 0 HA THR A 12 4.258 7.508 -8.110 1.00 71.50 H new ATOM 0 HB THR A 12 6.675 8.238 -8.519 1.00 50.33 H new ATOM 0 HG1 THR A 12 7.828 8.818 -6.564 1.00 61.13 H new ATOM 0 HG21 THR A 12 6.343 10.451 -7.481 1.00 45.21 H new ATOM 0 HG22 THR A 12 4.850 9.849 -8.239 1.00 45.21 H new ATOM 0 HG23 THR A 12 5.042 9.777 -6.471 1.00 45.21 H new ATOM 151 N GLU A 13 5.709 5.743 -9.304 1.00 13.54 N ATOM 152 CA GLU A 13 6.243 4.532 -9.914 1.00 41.24 C ATOM 153 C GLU A 13 7.475 4.041 -9.160 1.00 25.32 C ATOM 154 O GLU A 13 7.655 2.840 -8.960 1.00 24.05 O ATOM 155 CB GLU A 13 6.599 4.788 -11.380 1.00 74.24 C ATOM 156 CG GLU A 13 6.512 3.546 -12.253 1.00 2.51 C ATOM 157 CD GLU A 13 6.536 3.871 -13.734 1.00 2.15 C ATOM 158 OE1 GLU A 13 5.788 4.778 -14.155 1.00 61.31 O ATOM 159 OE2 GLU A 13 7.302 3.218 -14.472 1.00 33.43 O ATOM 0 H GLU A 13 5.366 6.435 -9.970 1.00 13.54 H new ATOM 0 HA GLU A 13 5.475 3.761 -9.862 1.00 41.24 H new ATOM 0 HB2 GLU A 13 5.931 5.551 -11.780 1.00 74.24 H new ATOM 0 HB3 GLU A 13 7.611 5.190 -11.435 1.00 74.24 H new ATOM 0 HG2 GLU A 13 7.343 2.882 -12.017 1.00 2.51 H new ATOM 0 HG3 GLU A 13 5.595 3.005 -12.018 1.00 2.51 H new ATOM 166 N ALA A 14 8.320 4.979 -8.744 1.00 64.14 N ATOM 167 CA ALA A 14 9.534 4.642 -8.010 1.00 64.34 C ATOM 168 C ALA A 14 9.205 3.969 -6.683 1.00 12.33 C ATOM 169 O ALA A 14 9.692 2.876 -6.392 1.00 14.53 O ATOM 170 CB ALA A 14 10.374 5.890 -7.779 1.00 0.22 C ATOM 0 H ALA A 14 8.186 5.978 -8.903 1.00 64.14 H new ATOM 0 HA ALA A 14 10.109 3.937 -8.611 1.00 64.34 H new ATOM 0 HB1 ALA A 14 11.277 5.624 -7.230 1.00 0.22 H new ATOM 0 HB2 ALA A 14 10.648 6.327 -8.739 1.00 0.22 H new ATOM 0 HB3 ALA A 14 9.799 6.614 -7.202 1.00 0.22 H new ATOM 176 N TRP A 15 8.377 4.629 -5.881 1.00 13.02 N ATOM 177 CA TRP A 15 7.984 4.094 -4.582 1.00 54.41 C ATOM 178 C TRP A 15 7.205 2.793 -4.742 1.00 41.43 C ATOM 179 O TRP A 15 7.295 1.898 -3.904 1.00 24.23 O ATOM 180 CB TRP A 15 7.139 5.117 -3.821 1.00 55.20 C ATOM 181 CG TRP A 15 6.874 4.728 -2.398 1.00 70.21 C ATOM 182 CD1 TRP A 15 7.581 5.117 -1.296 1.00 65.44 C ATOM 183 CD2 TRP A 15 5.828 3.872 -1.925 1.00 14.14 C ATOM 184 NE1 TRP A 15 7.039 4.553 -0.167 1.00 14.52 N ATOM 185 CE2 TRP A 15 5.961 3.787 -0.525 1.00 74.20 C ATOM 186 CE3 TRP A 15 4.790 3.172 -2.546 1.00 44.23 C ATOM 187 CZ2 TRP A 15 5.097 3.028 0.260 1.00 32.12 C ATOM 188 CZ3 TRP A 15 3.934 2.419 -1.766 1.00 41.33 C ATOM 189 CH2 TRP A 15 4.090 2.353 -0.376 1.00 22.54 C ATOM 0 H TRP A 15 7.965 5.534 -6.107 1.00 13.02 H new ATOM 0 HA TRP A 15 8.890 3.886 -4.014 1.00 54.41 H new ATOM 0 HB2 TRP A 15 7.647 6.081 -3.838 1.00 55.20 H new ATOM 0 HB3 TRP A 15 6.188 5.248 -4.337 1.00 55.20 H new ATOM 0 HD1 TRP A 15 8.440 5.772 -1.310 1.00 65.44 H new ATOM 0 HE1 TRP A 15 7.383 4.683 0.784 1.00 14.52 H new ATOM 0 HE3 TRP A 15 4.659 3.219 -3.617 1.00 44.23 H new ATOM 0 HZ2 TRP A 15 5.217 2.974 1.332 1.00 32.12 H new ATOM 0 HZ3 TRP A 15 3.131 1.872 -2.236 1.00 41.33 H new ATOM 0 HH2 TRP A 15 3.402 1.758 0.206 1.00 22.54 H new ATOM 200 N ALA A 16 6.441 2.696 -5.826 1.00 31.53 N ATOM 201 CA ALA A 16 5.648 1.502 -6.096 1.00 65.32 C ATOM 202 C ALA A 16 6.541 0.324 -6.470 1.00 12.22 C ATOM 203 O ALA A 16 6.326 -0.798 -6.013 1.00 62.45 O ATOM 204 CB ALA A 16 4.642 1.777 -7.203 1.00 42.35 C ATOM 0 H ALA A 16 6.355 3.429 -6.530 1.00 31.53 H new ATOM 0 HA ALA A 16 5.108 1.240 -5.186 1.00 65.32 H new ATOM 0 HB1 ALA A 16 4.057 0.878 -7.394 1.00 42.35 H new ATOM 0 HB2 ALA A 16 3.977 2.585 -6.898 1.00 42.35 H new ATOM 0 HB3 ALA A 16 5.171 2.066 -8.111 1.00 42.35 H new ATOM 210 N GLN A 17 7.542 0.587 -7.304 1.00 70.54 N ATOM 211 CA GLN A 17 8.465 -0.453 -7.740 1.00 64.31 C ATOM 212 C GLN A 17 9.439 -0.819 -6.625 1.00 33.32 C ATOM 213 O GLN A 17 9.576 -1.989 -6.267 1.00 33.42 O ATOM 214 CB GLN A 17 9.238 0.007 -8.977 1.00 11.33 C ATOM 215 CG GLN A 17 8.396 0.045 -10.242 1.00 45.41 C ATOM 216 CD GLN A 17 8.799 -1.018 -11.244 1.00 34.52 C ATOM 217 OE1 GLN A 17 9.930 -1.504 -11.229 1.00 23.42 O ATOM 218 NE2 GLN A 17 7.874 -1.387 -12.121 1.00 75.14 N ATOM 0 H GLN A 17 7.734 1.511 -7.691 1.00 70.54 H new ATOM 0 HA GLN A 17 7.881 -1.338 -7.993 1.00 64.31 H new ATOM 0 HB2 GLN A 17 9.645 1.001 -8.792 1.00 11.33 H new ATOM 0 HB3 GLN A 17 10.085 -0.660 -9.135 1.00 11.33 H new ATOM 0 HG2 GLN A 17 7.347 -0.088 -9.979 1.00 45.41 H new ATOM 0 HG3 GLN A 17 8.487 1.028 -10.705 1.00 45.41 H new ATOM 0 HE21 GLN A 17 6.949 -0.958 -12.098 1.00 75.14 H new ATOM 0 HE22 GLN A 17 8.088 -2.100 -12.819 1.00 75.14 H new ATOM 227 N ALA A 18 10.113 0.188 -6.080 1.00 13.13 N ATOM 228 CA ALA A 18 11.072 -0.028 -5.003 1.00 74.22 C ATOM 229 C ALA A 18 10.418 -0.729 -3.817 1.00 22.30 C ATOM 230 O ALA A 18 10.999 -1.636 -3.221 1.00 43.34 O ATOM 231 CB ALA A 18 11.682 1.295 -4.566 1.00 53.20 C ATOM 0 H ALA A 18 10.013 1.162 -6.366 1.00 13.13 H new ATOM 0 HA ALA A 18 11.865 -0.674 -5.381 1.00 74.22 H new ATOM 0 HB1 ALA A 18 12.396 1.118 -3.762 1.00 53.20 H new ATOM 0 HB2 ALA A 18 12.194 1.756 -5.411 1.00 53.20 H new ATOM 0 HB3 ALA A 18 10.894 1.960 -4.212 1.00 53.20 H new ATOM 237 N TYR A 19 9.206 -0.303 -3.480 1.00 52.11 N ATOM 238 CA TYR A 19 8.474 -0.889 -2.362 1.00 54.54 C ATOM 239 C TYR A 19 8.129 -2.348 -2.641 1.00 21.20 C ATOM 240 O TYR A 19 8.059 -3.167 -1.725 1.00 24.51 O ATOM 241 CB TYR A 19 7.195 -0.094 -2.091 1.00 43.23 C ATOM 242 CG TYR A 19 6.300 -0.725 -1.050 1.00 11.14 C ATOM 243 CD1 TYR A 19 6.836 -1.376 0.054 1.00 21.04 C ATOM 244 CD2 TYR A 19 4.917 -0.672 -1.169 1.00 54.05 C ATOM 245 CE1 TYR A 19 6.021 -1.956 1.008 1.00 4.31 C ATOM 246 CE2 TYR A 19 4.094 -1.247 -0.220 1.00 43.34 C ATOM 247 CZ TYR A 19 4.651 -1.888 0.866 1.00 4.05 C ATOM 248 OH TYR A 19 3.836 -2.463 1.814 1.00 52.24 O ATOM 0 H TYR A 19 8.709 0.445 -3.964 1.00 52.11 H new ATOM 0 HA TYR A 19 9.114 -0.848 -1.481 1.00 54.54 H new ATOM 0 HB2 TYR A 19 7.464 0.911 -1.766 1.00 43.23 H new ATOM 0 HB3 TYR A 19 6.638 0.010 -3.022 1.00 43.23 H new ATOM 0 HD1 TYR A 19 7.909 -1.430 0.169 1.00 21.04 H new ATOM 0 HD2 TYR A 19 4.477 -0.172 -2.019 1.00 54.05 H new ATOM 0 HE1 TYR A 19 6.455 -2.459 1.859 1.00 4.31 H new ATOM 0 HE2 TYR A 19 3.021 -1.195 -0.328 1.00 43.34 H new ATOM 0 HH TYR A 19 4.351 -2.630 2.631 1.00 52.24 H new ATOM 258 N CYS A 20 7.915 -2.666 -3.913 1.00 62.04 N ATOM 259 CA CYS A 20 7.578 -4.026 -4.317 1.00 12.03 C ATOM 260 C CYS A 20 8.783 -4.951 -4.172 1.00 33.05 C ATOM 261 O CYS A 20 8.661 -6.072 -3.678 1.00 62.32 O ATOM 262 CB CYS A 20 7.079 -4.043 -5.763 1.00 0.32 C ATOM 263 SG CYS A 20 6.462 -5.665 -6.318 1.00 4.03 S ATOM 0 H CYS A 20 7.969 -1.999 -4.683 1.00 62.04 H new ATOM 0 HA CYS A 20 6.785 -4.386 -3.662 1.00 12.03 H new ATOM 0 HB2 CYS A 20 6.282 -3.307 -5.870 1.00 0.32 H new ATOM 0 HB3 CYS A 20 7.891 -3.731 -6.420 1.00 0.32 H new ATOM 268 N ARG A 21 9.944 -4.472 -4.604 1.00 12.44 N ATOM 269 CA ARG A 21 11.171 -5.255 -4.522 1.00 44.23 C ATOM 270 C ARG A 21 11.677 -5.327 -3.085 1.00 33.21 C ATOM 271 O ARG A 21 12.077 -6.390 -2.608 1.00 45.43 O ATOM 272 CB ARG A 21 12.249 -4.648 -5.423 1.00 73.42 C ATOM 273 CG ARG A 21 12.444 -5.400 -6.730 1.00 52.14 C ATOM 274 CD ARG A 21 12.551 -4.447 -7.910 1.00 14.32 C ATOM 275 NE ARG A 21 13.299 -5.030 -9.020 1.00 23.03 N ATOM 276 CZ ARG A 21 13.872 -4.312 -9.979 1.00 54.32 C ATOM 277 NH1 ARG A 21 13.782 -2.989 -9.964 1.00 71.13 N ATOM 278 NH2 ARG A 21 14.537 -4.916 -10.956 1.00 31.51 N ATOM 0 H ARG A 21 10.061 -3.546 -5.014 1.00 12.44 H new ATOM 0 HA ARG A 21 10.949 -6.267 -4.861 1.00 44.23 H new ATOM 0 HB2 ARG A 21 11.986 -3.614 -5.644 1.00 73.42 H new ATOM 0 HB3 ARG A 21 13.194 -4.627 -4.881 1.00 73.42 H new ATOM 0 HG2 ARG A 21 13.346 -6.009 -6.670 1.00 52.14 H new ATOM 0 HG3 ARG A 21 11.609 -6.082 -6.887 1.00 52.14 H new ATOM 0 HD2 ARG A 21 11.551 -4.177 -8.249 1.00 14.32 H new ATOM 0 HD3 ARG A 21 13.038 -3.526 -7.589 1.00 14.32 H new ATOM 0 HE ARG A 21 13.386 -6.045 -9.061 1.00 23.03 H new ATOM 0 HH11 ARG A 21 13.272 -2.521 -9.215 1.00 71.13 H new ATOM 0 HH12 ARG A 21 14.223 -2.439 -10.702 1.00 71.13 H new ATOM 0 HH21 ARG A 21 14.609 -5.933 -10.971 1.00 31.51 H new ATOM 0 HH22 ARG A 21 14.976 -4.363 -11.692 1.00 31.51 H new ATOM 292 N LYS A 22 11.655 -4.190 -2.398 1.00 33.52 N ATOM 293 CA LYS A 22 12.111 -4.123 -1.014 1.00 60.15 C ATOM 294 C LYS A 22 11.514 -5.258 -0.189 1.00 33.20 C ATOM 295 O LYS A 22 12.179 -5.825 0.680 1.00 73.34 O ATOM 296 CB LYS A 22 11.732 -2.775 -0.396 1.00 33.22 C ATOM 297 CG LYS A 22 12.695 -2.308 0.681 1.00 14.33 C ATOM 298 CD LYS A 22 13.936 -1.669 0.080 1.00 71.22 C ATOM 299 CE LYS A 22 14.971 -1.350 1.147 1.00 11.23 C ATOM 300 NZ LYS A 22 16.289 -0.991 0.553 1.00 54.42 N ATOM 0 H LYS A 22 11.326 -3.302 -2.777 1.00 33.52 H new ATOM 0 HA LYS A 22 13.196 -4.226 -1.009 1.00 60.15 H new ATOM 0 HB2 LYS A 22 11.689 -2.023 -1.184 1.00 33.22 H new ATOM 0 HB3 LYS A 22 10.731 -2.849 0.030 1.00 33.22 H new ATOM 0 HG2 LYS A 22 12.194 -1.591 1.332 1.00 14.33 H new ATOM 0 HG3 LYS A 22 12.985 -3.155 1.303 1.00 14.33 H new ATOM 0 HD2 LYS A 22 14.370 -2.341 -0.660 1.00 71.22 H new ATOM 0 HD3 LYS A 22 13.658 -0.754 -0.444 1.00 71.22 H new ATOM 0 HE2 LYS A 22 14.614 -0.525 1.764 1.00 11.23 H new ATOM 0 HE3 LYS A 22 15.092 -2.211 1.805 1.00 11.23 H new ATOM 0 HZ1 LYS A 22 16.967 -0.781 1.313 1.00 54.42 H new ATOM 0 HZ2 LYS A 22 16.642 -1.787 -0.015 1.00 54.42 H new ATOM 0 HZ3 LYS A 22 16.180 -0.154 -0.055 1.00 54.42 H new ATOM 314 N LEU A 23 10.256 -5.588 -0.467 1.00 55.54 N ATOM 315 CA LEU A 23 9.569 -6.658 0.249 1.00 50.33 C ATOM 316 C LEU A 23 10.238 -8.004 -0.012 1.00 3.20 C ATOM 317 O LEU A 23 10.517 -8.759 0.917 1.00 41.00 O ATOM 318 CB LEU A 23 8.099 -6.717 -0.171 1.00 2.22 C ATOM 319 CG LEU A 23 7.237 -5.524 0.242 1.00 2.15 C ATOM 320 CD1 LEU A 23 5.859 -5.615 -0.397 1.00 42.40 C ATOM 321 CD2 LEU A 23 7.119 -5.449 1.758 1.00 43.22 C ATOM 0 H LEU A 23 9.692 -5.130 -1.183 1.00 55.54 H new ATOM 0 HA LEU A 23 9.628 -6.444 1.316 1.00 50.33 H new ATOM 0 HB2 LEU A 23 8.055 -6.814 -1.256 1.00 2.22 H new ATOM 0 HB3 LEU A 23 7.658 -7.621 0.248 1.00 2.22 H new ATOM 0 HG LEU A 23 7.720 -4.613 -0.110 1.00 2.15 H new ATOM 0 HD11 LEU A 23 5.259 -4.758 -0.092 1.00 42.40 H new ATOM 0 HD12 LEU A 23 5.961 -5.619 -1.482 1.00 42.40 H new ATOM 0 HD13 LEU A 23 5.369 -6.534 -0.075 1.00 42.40 H new ATOM 0 HD21 LEU A 23 6.502 -4.594 2.033 1.00 43.22 H new ATOM 0 HD22 LEU A 23 6.659 -6.364 2.133 1.00 43.22 H new ATOM 0 HD23 LEU A 23 8.111 -5.336 2.195 1.00 43.22 H new ATOM 333 N ASN A 24 10.493 -8.295 -1.284 1.00 25.25 N ATOM 334 CA ASN A 24 11.131 -9.550 -1.667 1.00 52.12 C ATOM 335 C ASN A 24 12.370 -9.813 -0.815 1.00 53.32 C ATOM 336 O ASN A 24 12.755 -10.962 -0.601 1.00 41.33 O ATOM 337 CB ASN A 24 11.515 -9.520 -3.148 1.00 15.42 C ATOM 338 CG ASN A 24 10.438 -10.115 -4.035 1.00 42.23 C ATOM 339 OD1 ASN A 24 10.144 -11.308 -3.959 1.00 44.31 O ATOM 340 ND2 ASN A 24 9.844 -9.283 -4.884 1.00 34.21 N ATOM 0 H ASN A 24 10.268 -7.680 -2.066 1.00 25.25 H new ATOM 0 HA ASN A 24 10.418 -10.357 -1.499 1.00 52.12 H new ATOM 0 HB2 ASN A 24 11.704 -8.490 -3.451 1.00 15.42 H new ATOM 0 HB3 ASN A 24 12.445 -10.070 -3.291 1.00 15.42 H new ATOM 0 HD21 ASN A 24 9.113 -9.626 -5.507 1.00 34.21 H new ATOM 0 HD22 ASN A 24 10.120 -8.301 -4.913 1.00 34.21 H new ATOM 347 N GLU A 25 12.987 -8.739 -0.332 1.00 31.35 N ATOM 348 CA GLU A 25 14.182 -8.855 0.496 1.00 21.05 C ATOM 349 C GLU A 25 13.821 -9.286 1.915 1.00 3.42 C ATOM 350 O GLU A 25 14.603 -9.955 2.590 1.00 71.34 O ATOM 351 CB GLU A 25 14.935 -7.524 0.532 1.00 4.10 C ATOM 352 CG GLU A 25 15.121 -6.893 -0.837 1.00 51.41 C ATOM 353 CD GLU A 25 16.550 -6.454 -1.088 1.00 44.34 C ATOM 354 OE1 GLU A 25 16.917 -5.345 -0.646 1.00 44.33 O ATOM 355 OE2 GLU A 25 17.302 -7.219 -1.727 1.00 44.34 O ATOM 0 H GLU A 25 12.680 -7.781 -0.499 1.00 31.35 H new ATOM 0 HA GLU A 25 14.825 -9.617 0.056 1.00 21.05 H new ATOM 0 HB2 GLU A 25 14.395 -6.828 1.173 1.00 4.10 H new ATOM 0 HB3 GLU A 25 15.913 -7.682 0.986 1.00 4.10 H new ATOM 0 HG2 GLU A 25 14.824 -7.607 -1.605 1.00 51.41 H new ATOM 0 HG3 GLU A 25 14.459 -6.032 -0.929 1.00 51.41 H new ATOM 362 N SER A 26 12.631 -8.897 2.361 1.00 0.40 N ATOM 363 CA SER A 26 12.167 -9.238 3.701 1.00 54.01 C ATOM 364 C SER A 26 11.560 -10.637 3.725 1.00 25.33 C ATOM 365 O SER A 26 10.344 -10.799 3.648 1.00 33.45 O ATOM 366 CB SER A 26 11.137 -8.216 4.183 1.00 42.52 C ATOM 367 OG SER A 26 11.467 -7.728 5.471 1.00 3.34 O ATOM 0 H SER A 26 11.970 -8.345 1.814 1.00 0.40 H new ATOM 0 HA SER A 26 13.026 -9.221 4.371 1.00 54.01 H new ATOM 0 HB2 SER A 26 11.086 -7.386 3.478 1.00 42.52 H new ATOM 0 HB3 SER A 26 10.149 -8.675 4.207 1.00 42.52 H new ATOM 0 HG SER A 26 10.794 -7.075 5.756 1.00 3.34 H new ATOM 373 N GLU A 27 12.420 -11.646 3.832 1.00 4.11 N ATOM 374 CA GLU A 27 11.970 -13.032 3.866 1.00 70.44 C ATOM 375 C GLU A 27 10.830 -13.211 4.864 1.00 2.24 C ATOM 376 O GLU A 27 9.887 -13.964 4.620 1.00 44.42 O ATOM 377 CB GLU A 27 13.130 -13.961 4.229 1.00 1.50 C ATOM 378 CG GLU A 27 13.217 -15.199 3.353 1.00 25.12 C ATOM 379 CD GLU A 27 14.641 -15.691 3.176 1.00 12.43 C ATOM 380 OE1 GLU A 27 15.373 -15.103 2.354 1.00 44.33 O ATOM 381 OE2 GLU A 27 15.023 -16.663 3.860 1.00 33.23 O ATOM 0 H GLU A 27 13.431 -11.529 3.897 1.00 4.11 H new ATOM 0 HA GLU A 27 11.604 -13.291 2.872 1.00 70.44 H new ATOM 0 HB2 GLU A 27 14.065 -13.407 4.153 1.00 1.50 H new ATOM 0 HB3 GLU A 27 13.025 -14.269 5.269 1.00 1.50 H new ATOM 0 HG2 GLU A 27 12.614 -15.994 3.793 1.00 25.12 H new ATOM 0 HG3 GLU A 27 12.789 -14.978 2.375 1.00 25.12 H new ATOM 388 N ALA A 28 10.924 -12.512 5.991 1.00 64.24 N ATOM 389 CA ALA A 28 9.902 -12.590 7.027 1.00 60.42 C ATOM 390 C ALA A 28 8.514 -12.332 6.449 1.00 2.30 C ATOM 391 O ALA A 28 7.568 -13.067 6.729 1.00 71.35 O ATOM 392 CB ALA A 28 10.204 -11.602 8.143 1.00 22.21 C ATOM 0 H ALA A 28 11.698 -11.885 6.209 1.00 64.24 H new ATOM 0 HA ALA A 28 9.914 -13.599 7.439 1.00 60.42 H new ATOM 0 HB1 ALA A 28 9.432 -11.672 8.909 1.00 22.21 H new ATOM 0 HB2 ALA A 28 11.174 -11.835 8.583 1.00 22.21 H new ATOM 0 HB3 ALA A 28 10.223 -10.590 7.738 1.00 22.21 H new ATOM 398 N TYR A 29 8.401 -11.281 5.643 1.00 35.25 N ATOM 399 CA TYR A 29 7.128 -10.923 5.029 1.00 52.44 C ATOM 400 C TYR A 29 6.625 -12.044 4.126 1.00 72.12 C ATOM 401 O TYR A 29 5.547 -12.598 4.346 1.00 44.11 O ATOM 402 CB TYR A 29 7.272 -9.630 4.224 1.00 64.40 C ATOM 403 CG TYR A 29 6.078 -9.325 3.349 1.00 74.43 C ATOM 404 CD1 TYR A 29 4.792 -9.305 3.877 1.00 42.45 C ATOM 405 CD2 TYR A 29 6.234 -9.057 1.995 1.00 73.03 C ATOM 406 CE1 TYR A 29 3.698 -9.027 3.081 1.00 71.23 C ATOM 407 CE2 TYR A 29 5.146 -8.777 1.192 1.00 55.12 C ATOM 408 CZ TYR A 29 3.880 -8.764 1.739 1.00 34.14 C ATOM 409 OH TYR A 29 2.791 -8.486 0.944 1.00 42.30 O ATOM 0 H TYR A 29 9.175 -10.663 5.400 1.00 35.25 H new ATOM 0 HA TYR A 29 6.400 -10.768 5.825 1.00 52.44 H new ATOM 0 HB2 TYR A 29 7.429 -8.799 4.912 1.00 64.40 H new ATOM 0 HB3 TYR A 29 8.162 -9.699 3.599 1.00 64.40 H new ATOM 0 HD1 TYR A 29 4.646 -9.510 4.927 1.00 42.45 H new ATOM 0 HD2 TYR A 29 7.224 -9.068 1.563 1.00 73.03 H new ATOM 0 HE1 TYR A 29 2.706 -9.016 3.507 1.00 71.23 H new ATOM 0 HE2 TYR A 29 5.286 -8.569 0.141 1.00 55.12 H new ATOM 0 HH TYR A 29 1.975 -8.517 1.485 1.00 42.30 H new ATOM 419 N ARG A 30 7.413 -12.375 3.108 1.00 40.22 N ATOM 420 CA ARG A 30 7.048 -13.430 2.170 1.00 4.25 C ATOM 421 C ARG A 30 6.631 -14.697 2.912 1.00 14.34 C ATOM 422 O ARG A 30 5.684 -15.377 2.517 1.00 50.33 O ATOM 423 CB ARG A 30 8.219 -13.737 1.235 1.00 11.20 C ATOM 424 CG ARG A 30 7.805 -14.433 -0.052 1.00 31.12 C ATOM 425 CD ARG A 30 8.738 -15.585 -0.388 1.00 34.45 C ATOM 426 NE ARG A 30 8.677 -15.945 -1.802 1.00 32.14 N ATOM 427 CZ ARG A 30 8.998 -17.146 -2.269 1.00 3.12 C ATOM 428 NH1 ARG A 30 9.401 -18.098 -1.439 1.00 20.21 N ATOM 429 NH2 ARG A 30 8.917 -17.397 -3.570 1.00 20.14 N ATOM 0 H ARG A 30 8.308 -11.928 2.912 1.00 40.22 H new ATOM 0 HA ARG A 30 6.201 -13.080 1.579 1.00 4.25 H new ATOM 0 HB2 ARG A 30 8.728 -12.806 0.987 1.00 11.20 H new ATOM 0 HB3 ARG A 30 8.939 -14.364 1.762 1.00 11.20 H new ATOM 0 HG2 ARG A 30 6.786 -14.806 0.047 1.00 31.12 H new ATOM 0 HG3 ARG A 30 7.803 -13.714 -0.871 1.00 31.12 H new ATOM 0 HD2 ARG A 30 9.760 -15.311 -0.128 1.00 34.45 H new ATOM 0 HD3 ARG A 30 8.476 -16.452 0.218 1.00 34.45 H new ATOM 0 HE ARG A 30 8.371 -15.235 -2.467 1.00 32.14 H new ATOM 0 HH11 ARG A 30 9.465 -17.909 -0.439 1.00 20.21 H new ATOM 0 HH12 ARG A 30 9.647 -19.019 -1.801 1.00 20.21 H new ATOM 0 HH21 ARG A 30 8.608 -16.667 -4.212 1.00 20.14 H new ATOM 0 HH22 ARG A 30 9.164 -18.320 -3.928 1.00 20.14 H new ATOM 443 N LYS A 31 7.343 -15.008 3.990 1.00 51.53 N ATOM 444 CA LYS A 31 7.047 -16.191 4.788 1.00 70.04 C ATOM 445 C LYS A 31 5.685 -16.065 5.463 1.00 62.21 C ATOM 446 O LYS A 31 4.911 -17.020 5.502 1.00 23.45 O ATOM 447 CB LYS A 31 8.134 -16.403 5.844 1.00 62.51 C ATOM 448 CG LYS A 31 9.433 -16.950 5.278 1.00 23.35 C ATOM 449 CD LYS A 31 10.357 -17.446 6.379 1.00 34.10 C ATOM 450 CE LYS A 31 9.991 -18.855 6.819 1.00 62.20 C ATOM 451 NZ LYS A 31 10.615 -19.207 8.125 1.00 21.51 N ATOM 0 H LYS A 31 8.130 -14.456 4.331 1.00 51.53 H new ATOM 0 HA LYS A 31 7.024 -17.053 4.121 1.00 70.04 H new ATOM 0 HB2 LYS A 31 8.335 -15.454 6.342 1.00 62.51 H new ATOM 0 HB3 LYS A 31 7.761 -17.089 6.604 1.00 62.51 H new ATOM 0 HG2 LYS A 31 9.215 -17.766 4.589 1.00 23.35 H new ATOM 0 HG3 LYS A 31 9.936 -16.173 4.703 1.00 23.35 H new ATOM 0 HD2 LYS A 31 11.388 -17.430 6.025 1.00 34.10 H new ATOM 0 HD3 LYS A 31 10.303 -16.771 7.233 1.00 34.10 H new ATOM 0 HE2 LYS A 31 8.907 -18.941 6.899 1.00 62.20 H new ATOM 0 HE3 LYS A 31 10.312 -19.568 6.059 1.00 62.20 H new ATOM 0 HZ1 LYS A 31 10.342 -20.175 8.391 1.00 21.51 H new ATOM 0 HZ2 LYS A 31 11.650 -19.150 8.042 1.00 21.51 H new ATOM 0 HZ3 LYS A 31 10.289 -18.542 8.856 1.00 21.51 H new ATOM 465 N ALA A 32 5.399 -14.879 5.992 1.00 64.23 N ATOM 466 CA ALA A 32 4.129 -14.628 6.661 1.00 23.45 C ATOM 467 C ALA A 32 2.965 -14.708 5.680 1.00 61.21 C ATOM 468 O ALA A 32 1.984 -15.411 5.921 1.00 44.41 O ATOM 469 CB ALA A 32 4.153 -13.270 7.346 1.00 4.11 C ATOM 0 H ALA A 32 6.030 -14.078 5.970 1.00 64.23 H new ATOM 0 HA ALA A 32 3.986 -15.401 7.416 1.00 23.45 H new ATOM 0 HB1 ALA A 32 3.198 -13.096 7.842 1.00 4.11 H new ATOM 0 HB2 ALA A 32 4.954 -13.249 8.085 1.00 4.11 H new ATOM 0 HB3 ALA A 32 4.324 -12.491 6.603 1.00 4.11 H new ATOM 475 N ALA A 33 3.081 -13.983 4.572 1.00 53.41 N ATOM 476 CA ALA A 33 2.039 -13.972 3.554 1.00 61.45 C ATOM 477 C ALA A 33 2.369 -14.938 2.420 1.00 72.10 C ATOM 478 O ALA A 33 2.174 -14.623 1.246 1.00 32.25 O ATOM 479 CB ALA A 33 1.846 -12.565 3.010 1.00 52.21 C ATOM 0 H ALA A 33 3.887 -13.396 4.357 1.00 53.41 H new ATOM 0 HA ALA A 33 1.109 -14.301 4.019 1.00 61.45 H new ATOM 0 HB1 ALA A 33 1.064 -12.573 2.250 1.00 52.21 H new ATOM 0 HB2 ALA A 33 1.557 -11.898 3.822 1.00 52.21 H new ATOM 0 HB3 ALA A 33 2.779 -12.215 2.567 1.00 52.21 H new ATOM 485 N SER A 34 2.871 -16.116 2.780 1.00 52.23 N ATOM 486 CA SER A 34 3.233 -17.126 1.792 1.00 13.22 C ATOM 487 C SER A 34 2.007 -17.925 1.358 1.00 41.01 C ATOM 488 O SER A 34 2.072 -19.144 1.195 1.00 34.11 O ATOM 489 CB SER A 34 4.294 -18.069 2.362 1.00 43.31 C ATOM 490 OG SER A 34 4.858 -18.877 1.343 1.00 21.25 O ATOM 0 H SER A 34 3.036 -16.394 3.747 1.00 52.23 H new ATOM 0 HA SER A 34 3.641 -16.616 0.919 1.00 13.22 H new ATOM 0 HB2 SER A 34 5.079 -17.488 2.846 1.00 43.31 H new ATOM 0 HB3 SER A 34 3.848 -18.703 3.128 1.00 43.31 H new ATOM 0 HG SER A 34 4.146 -19.374 0.888 1.00 21.25 H new ATOM 496 N THR A 35 0.890 -17.228 1.172 1.00 20.10 N ATOM 497 CA THR A 35 -0.351 -17.870 0.759 1.00 63.43 C ATOM 498 C THR A 35 -1.341 -16.851 0.207 1.00 34.34 C ATOM 499 O THR A 35 -2.553 -17.054 0.269 1.00 73.34 O ATOM 500 CB THR A 35 -1.008 -18.628 1.928 1.00 33.01 C ATOM 501 OG1 THR A 35 -2.253 -19.196 1.506 1.00 54.13 O ATOM 502 CG2 THR A 35 -1.244 -17.700 3.110 1.00 54.32 C ATOM 0 H THR A 35 0.820 -16.219 1.301 1.00 20.10 H new ATOM 0 HA THR A 35 -0.092 -18.581 -0.025 1.00 63.43 H new ATOM 0 HB THR A 35 -0.333 -19.425 2.240 1.00 33.01 H new ATOM 0 HG1 THR A 35 -2.836 -18.487 1.162 1.00 54.13 H new ATOM 0 HG21 THR A 35 -1.709 -18.258 3.923 1.00 54.32 H new ATOM 0 HG22 THR A 35 -0.292 -17.292 3.448 1.00 54.32 H new ATOM 0 HG23 THR A 35 -1.901 -16.885 2.807 1.00 54.32 H new ATOM 510 N TRP A 36 -0.817 -15.756 -0.329 1.00 3.41 N ATOM 511 CA TRP A 36 -1.656 -14.703 -0.892 1.00 73.33 C ATOM 512 C TRP A 36 -1.737 -14.825 -2.410 1.00 5.44 C ATOM 513 O TRP A 36 -0.737 -15.100 -3.072 1.00 71.42 O ATOM 514 CB TRP A 36 -1.111 -13.327 -0.507 1.00 35.22 C ATOM 515 CG TRP A 36 -1.722 -12.205 -1.290 1.00 74.24 C ATOM 516 CD1 TRP A 36 -1.499 -11.907 -2.604 1.00 54.02 C ATOM 517 CD2 TRP A 36 -2.656 -11.232 -0.808 1.00 61.44 C ATOM 518 NE1 TRP A 36 -2.238 -10.807 -2.969 1.00 52.10 N ATOM 519 CE2 TRP A 36 -2.956 -10.374 -1.885 1.00 70.54 C ATOM 520 CE3 TRP A 36 -3.268 -11.002 0.426 1.00 31.31 C ATOM 521 CZ2 TRP A 36 -3.841 -9.306 -1.761 1.00 23.41 C ATOM 522 CZ3 TRP A 36 -4.145 -9.942 0.547 1.00 34.45 C ATOM 523 CH2 TRP A 36 -4.425 -9.106 -0.540 1.00 52.54 C ATOM 0 H TRP A 36 0.185 -15.573 -0.386 1.00 3.41 H new ATOM 0 HA TRP A 36 -2.660 -14.815 -0.483 1.00 73.33 H new ATOM 0 HB2 TRP A 36 -1.289 -13.158 0.555 1.00 35.22 H new ATOM 0 HB3 TRP A 36 -0.031 -13.318 -0.655 1.00 35.22 H new ATOM 0 HD1 TRP A 36 -0.839 -12.455 -3.260 1.00 54.02 H new ATOM 0 HE1 TRP A 36 -2.250 -10.382 -3.896 1.00 52.10 H new ATOM 0 HE3 TRP A 36 -3.059 -11.642 1.271 1.00 31.31 H new ATOM 0 HZ2 TRP A 36 -4.058 -8.659 -2.598 1.00 23.41 H new ATOM 0 HZ3 TRP A 36 -4.623 -9.755 1.497 1.00 34.45 H new ATOM 0 HH2 TRP A 36 -5.116 -8.286 -0.412 1.00 52.54 H new ATOM 534 N GLU A 37 -2.932 -14.617 -2.954 1.00 23.13 N ATOM 535 CA GLU A 37 -3.141 -14.705 -4.394 1.00 4.13 C ATOM 536 C GLU A 37 -3.929 -13.502 -4.903 1.00 42.52 C ATOM 537 O GLU A 37 -5.111 -13.346 -4.599 1.00 1.44 O ATOM 538 CB GLU A 37 -3.878 -15.998 -4.747 1.00 30.33 C ATOM 539 CG GLU A 37 -2.985 -17.226 -4.751 1.00 61.32 C ATOM 540 CD GLU A 37 -3.732 -18.490 -5.133 1.00 43.02 C ATOM 541 OE1 GLU A 37 -4.744 -18.803 -4.474 1.00 11.52 O ATOM 542 OE2 GLU A 37 -3.303 -19.166 -6.092 1.00 51.43 O ATOM 0 H GLU A 37 -3.769 -14.387 -2.419 1.00 23.13 H new ATOM 0 HA GLU A 37 -2.164 -14.709 -4.878 1.00 4.13 H new ATOM 0 HB2 GLU A 37 -4.688 -16.151 -4.034 1.00 30.33 H new ATOM 0 HB3 GLU A 37 -4.335 -15.889 -5.730 1.00 30.33 H new ATOM 0 HG2 GLU A 37 -2.162 -17.070 -5.449 1.00 61.32 H new ATOM 0 HG3 GLU A 37 -2.545 -17.354 -3.762 1.00 61.32 H new ATOM 549 N GLY A 38 -3.264 -12.651 -5.680 1.00 71.32 N ATOM 550 CA GLY A 38 -3.917 -11.473 -6.219 1.00 11.21 C ATOM 551 C GLY A 38 -3.027 -10.246 -6.175 1.00 74.45 C ATOM 552 O GLY A 38 -1.830 -10.348 -5.906 1.00 14.01 O ATOM 0 H GLY A 38 -2.285 -12.757 -5.945 1.00 71.32 H new ATOM 0 HA2 GLY A 38 -4.214 -11.666 -7.250 1.00 11.21 H new ATOM 0 HA3 GLY A 38 -4.829 -11.277 -5.655 1.00 11.21 H new ATOM 556 N SER A 39 -3.613 -9.083 -6.441 1.00 4.31 N ATOM 557 CA SER A 39 -2.864 -7.832 -6.436 1.00 12.22 C ATOM 558 C SER A 39 -3.544 -6.795 -5.546 1.00 21.12 C ATOM 559 O SER A 39 -4.772 -6.713 -5.495 1.00 63.05 O ATOM 560 CB SER A 39 -2.729 -7.288 -7.860 1.00 2.41 C ATOM 561 OG SER A 39 -3.999 -7.021 -8.427 1.00 13.54 O ATOM 0 H SER A 39 -4.603 -8.981 -6.663 1.00 4.31 H new ATOM 0 HA SER A 39 -1.870 -8.034 -6.036 1.00 12.22 H new ATOM 0 HB2 SER A 39 -2.133 -6.375 -7.849 1.00 2.41 H new ATOM 0 HB3 SER A 39 -2.195 -8.009 -8.479 1.00 2.41 H new ATOM 0 HG SER A 39 -3.885 -6.673 -9.336 1.00 13.54 H new ATOM 567 N LEU A 40 -2.737 -6.007 -4.845 1.00 64.24 N ATOM 568 CA LEU A 40 -3.258 -4.975 -3.956 1.00 74.11 C ATOM 569 C LEU A 40 -2.964 -3.583 -4.505 1.00 3.40 C ATOM 570 O LEU A 40 -1.825 -3.268 -4.849 1.00 23.42 O ATOM 571 CB LEU A 40 -2.652 -5.123 -2.559 1.00 55.13 C ATOM 572 CG LEU A 40 -2.963 -3.999 -1.570 1.00 31.32 C ATOM 573 CD1 LEU A 40 -4.461 -3.898 -1.332 1.00 11.21 C ATOM 574 CD2 LEU A 40 -2.227 -4.226 -0.257 1.00 1.13 C ATOM 0 H LEU A 40 -1.719 -6.063 -4.875 1.00 64.24 H new ATOM 0 HA LEU A 40 -4.339 -5.099 -3.891 1.00 74.11 H new ATOM 0 HB2 LEU A 40 -3.001 -6.063 -2.131 1.00 55.13 H new ATOM 0 HB3 LEU A 40 -1.570 -5.201 -2.661 1.00 55.13 H new ATOM 0 HG LEU A 40 -2.619 -3.058 -1.999 1.00 31.32 H new ATOM 0 HD11 LEU A 40 -4.664 -3.093 -0.626 1.00 11.21 H new ATOM 0 HD12 LEU A 40 -4.966 -3.689 -2.275 1.00 11.21 H new ATOM 0 HD13 LEU A 40 -4.829 -4.840 -0.924 1.00 11.21 H new ATOM 0 HD21 LEU A 40 -2.460 -3.417 0.435 1.00 1.13 H new ATOM 0 HD22 LEU A 40 -2.541 -5.176 0.176 1.00 1.13 H new ATOM 0 HD23 LEU A 40 -1.153 -4.248 -0.441 1.00 1.13 H new ATOM 586 N ALA A 41 -3.998 -2.751 -4.583 1.00 34.34 N ATOM 587 CA ALA A 41 -3.849 -1.392 -5.086 1.00 5.03 C ATOM 588 C ALA A 41 -4.270 -0.369 -4.037 1.00 4.23 C ATOM 589 O ALA A 41 -5.377 -0.433 -3.501 1.00 43.01 O ATOM 590 CB ALA A 41 -4.660 -1.209 -6.360 1.00 55.20 C ATOM 0 H ALA A 41 -4.948 -2.995 -4.304 1.00 34.34 H new ATOM 0 HA ALA A 41 -2.795 -1.228 -5.312 1.00 5.03 H new ATOM 0 HB1 ALA A 41 -4.539 -0.189 -6.725 1.00 55.20 H new ATOM 0 HB2 ALA A 41 -4.310 -1.909 -7.118 1.00 55.20 H new ATOM 0 HB3 ALA A 41 -5.713 -1.397 -6.151 1.00 55.20 H new ATOM 596 N LEU A 42 -3.380 0.574 -3.745 1.00 5.22 N ATOM 597 CA LEU A 42 -3.659 1.611 -2.758 1.00 64.50 C ATOM 598 C LEU A 42 -4.053 2.918 -3.439 1.00 11.10 C ATOM 599 O LEU A 42 -3.197 3.679 -3.887 1.00 10.13 O ATOM 600 CB LEU A 42 -2.436 1.836 -1.866 1.00 53.02 C ATOM 601 CG LEU A 42 -1.820 0.582 -1.244 1.00 3.10 C ATOM 602 CD1 LEU A 42 -0.382 0.848 -0.824 1.00 23.44 C ATOM 603 CD2 LEU A 42 -2.647 0.114 -0.056 1.00 50.04 C ATOM 0 H LEU A 42 -2.459 0.641 -4.178 1.00 5.22 H new ATOM 0 HA LEU A 42 -4.494 1.277 -2.142 1.00 64.50 H new ATOM 0 HB2 LEU A 42 -1.669 2.340 -2.455 1.00 53.02 H new ATOM 0 HB3 LEU A 42 -2.718 2.516 -1.062 1.00 53.02 H new ATOM 0 HG LEU A 42 -1.819 -0.210 -1.993 1.00 3.10 H new ATOM 0 HD11 LEU A 42 0.041 -0.055 -0.383 1.00 23.44 H new ATOM 0 HD12 LEU A 42 0.205 1.135 -1.697 1.00 23.44 H new ATOM 0 HD13 LEU A 42 -0.360 1.654 -0.091 1.00 23.44 H new ATOM 0 HD21 LEU A 42 -2.194 -0.779 0.374 1.00 50.04 H new ATOM 0 HD22 LEU A 42 -2.681 0.902 0.697 1.00 50.04 H new ATOM 0 HD23 LEU A 42 -3.660 -0.116 -0.386 1.00 50.04 H new ATOM 615 N ALA A 43 -5.356 3.172 -3.510 1.00 2.31 N ATOM 616 CA ALA A 43 -5.864 4.389 -4.131 1.00 24.33 C ATOM 617 C ALA A 43 -5.982 5.518 -3.112 1.00 45.05 C ATOM 618 O ALA A 43 -6.221 5.277 -1.929 1.00 64.50 O ATOM 619 CB ALA A 43 -7.211 4.124 -4.786 1.00 54.24 C ATOM 0 H ALA A 43 -6.078 2.551 -3.145 1.00 2.31 H new ATOM 0 HA ALA A 43 -5.154 4.700 -4.898 1.00 24.33 H new ATOM 0 HB1 ALA A 43 -7.579 5.041 -5.246 1.00 54.24 H new ATOM 0 HB2 ALA A 43 -7.099 3.355 -5.550 1.00 54.24 H new ATOM 0 HB3 ALA A 43 -7.922 3.786 -4.032 1.00 54.24 H new ATOM 625 N VAL A 44 -5.811 6.750 -3.579 1.00 53.00 N ATOM 626 CA VAL A 44 -5.899 7.916 -2.709 1.00 5.54 C ATOM 627 C VAL A 44 -6.916 8.922 -3.238 1.00 1.23 C ATOM 628 O VAL A 44 -6.821 9.375 -4.378 1.00 22.02 O ATOM 629 CB VAL A 44 -4.532 8.613 -2.564 1.00 33.42 C ATOM 630 CG1 VAL A 44 -4.681 9.930 -1.818 1.00 63.00 C ATOM 631 CG2 VAL A 44 -3.542 7.699 -1.858 1.00 45.52 C ATOM 0 H VAL A 44 -5.611 6.967 -4.555 1.00 53.00 H new ATOM 0 HA VAL A 44 -6.222 7.557 -1.732 1.00 5.54 H new ATOM 0 HB VAL A 44 -4.145 8.830 -3.560 1.00 33.42 H new ATOM 0 HG11 VAL A 44 -3.706 10.408 -1.725 1.00 63.00 H new ATOM 0 HG12 VAL A 44 -5.355 10.586 -2.369 1.00 63.00 H new ATOM 0 HG13 VAL A 44 -5.089 9.741 -0.825 1.00 63.00 H new ATOM 0 HG21 VAL A 44 -2.582 8.206 -1.764 1.00 45.52 H new ATOM 0 HG22 VAL A 44 -3.920 7.450 -0.866 1.00 45.52 H new ATOM 0 HG23 VAL A 44 -3.414 6.785 -2.437 1.00 45.52 H new ATOM 641 N ARG A 45 -7.888 9.267 -2.400 1.00 75.51 N ATOM 642 CA ARG A 45 -8.925 10.218 -2.784 1.00 3.54 C ATOM 643 C ARG A 45 -8.317 11.432 -3.482 1.00 20.43 C ATOM 644 O ARG A 45 -7.220 11.881 -3.154 1.00 45.34 O ATOM 645 CB ARG A 45 -9.715 10.667 -1.553 1.00 53.12 C ATOM 646 CG ARG A 45 -10.954 9.828 -1.285 1.00 50.50 C ATOM 647 CD ARG A 45 -12.111 10.685 -0.794 1.00 72.12 C ATOM 648 NE ARG A 45 -13.388 9.981 -0.879 1.00 25.31 N ATOM 649 CZ ARG A 45 -14.541 10.498 -0.469 1.00 23.24 C ATOM 650 NH1 ARG A 45 -14.576 11.717 0.052 1.00 73.34 N ATOM 651 NH2 ARG A 45 -15.660 9.795 -0.579 1.00 15.21 N ATOM 0 H ARG A 45 -7.979 8.903 -1.452 1.00 75.51 H new ATOM 0 HA ARG A 45 -9.601 9.720 -3.480 1.00 3.54 H new ATOM 0 HB2 ARG A 45 -9.064 10.628 -0.680 1.00 53.12 H new ATOM 0 HB3 ARG A 45 -10.012 11.708 -1.682 1.00 53.12 H new ATOM 0 HG2 ARG A 45 -11.247 9.307 -2.197 1.00 50.50 H new ATOM 0 HG3 ARG A 45 -10.724 9.064 -0.542 1.00 50.50 H new ATOM 0 HD2 ARG A 45 -11.929 10.982 0.239 1.00 72.12 H new ATOM 0 HD3 ARG A 45 -12.161 11.599 -1.385 1.00 72.12 H new ATOM 0 HE ARG A 45 -13.395 9.041 -1.275 1.00 25.31 H new ATOM 0 HH11 ARG A 45 -13.717 12.260 0.139 1.00 73.34 H new ATOM 0 HH12 ARG A 45 -15.462 12.112 0.366 1.00 73.34 H new ATOM 0 HH21 ARG A 45 -15.636 8.857 -0.979 1.00 15.21 H new ATOM 0 HH22 ARG A 45 -16.545 10.192 -0.264 1.00 15.21 H new ATOM 665 N PRO A 46 -9.047 11.974 -4.468 1.00 60.22 N ATOM 666 CA PRO A 46 -8.600 13.142 -5.233 1.00 34.01 C ATOM 667 C PRO A 46 -8.602 14.417 -4.397 1.00 21.01 C ATOM 668 O PRO A 46 -9.597 14.747 -3.752 1.00 40.11 O ATOM 669 CB PRO A 46 -9.629 13.241 -6.362 1.00 12.40 C ATOM 670 CG PRO A 46 -10.852 12.585 -5.819 1.00 3.21 C ATOM 671 CD PRO A 46 -10.366 11.489 -4.911 1.00 43.12 C ATOM 0 HA PRO A 46 -7.573 13.033 -5.582 1.00 34.01 H new ATOM 0 HB2 PRO A 46 -9.823 14.279 -6.631 1.00 12.40 H new ATOM 0 HB3 PRO A 46 -9.277 12.739 -7.263 1.00 12.40 H new ATOM 0 HG2 PRO A 46 -11.468 13.299 -5.273 1.00 3.21 H new ATOM 0 HG3 PRO A 46 -11.468 12.181 -6.623 1.00 3.21 H new ATOM 0 HD2 PRO A 46 -11.041 11.335 -4.069 1.00 43.12 H new ATOM 0 HD3 PRO A 46 -10.289 10.537 -5.436 1.00 43.12 H new ATOM 679 N ASP A 47 -7.481 15.131 -4.414 1.00 74.21 N ATOM 680 CA ASP A 47 -7.354 16.372 -3.658 1.00 62.34 C ATOM 681 C ASP A 47 -6.220 17.230 -4.210 1.00 43.24 C ATOM 682 O ASP A 47 -5.120 16.748 -4.484 1.00 30.23 O ATOM 683 CB ASP A 47 -7.109 16.070 -2.180 1.00 5.14 C ATOM 684 CG ASP A 47 -7.953 16.935 -1.265 1.00 10.34 C ATOM 685 OD1 ASP A 47 -9.118 16.567 -1.006 1.00 74.52 O ATOM 686 OD2 ASP A 47 -7.448 17.981 -0.806 1.00 15.41 O ATOM 0 H ASP A 47 -6.648 14.872 -4.943 1.00 74.21 H new ATOM 0 HA ASP A 47 -8.287 16.927 -3.757 1.00 62.34 H new ATOM 0 HB2 ASP A 47 -7.327 15.020 -1.986 1.00 5.14 H new ATOM 0 HB3 ASP A 47 -6.055 16.224 -1.951 1.00 5.14 H new ATOM 691 N PRO A 48 -6.491 18.532 -4.380 1.00 0.14 N ATOM 692 CA PRO A 48 -5.506 19.485 -4.901 1.00 32.10 C ATOM 693 C PRO A 48 -4.375 19.749 -3.913 1.00 73.03 C ATOM 694 O PRO A 48 -3.242 20.021 -4.309 1.00 53.22 O ATOM 695 CB PRO A 48 -6.328 20.757 -5.126 1.00 32.43 C ATOM 696 CG PRO A 48 -7.469 20.643 -4.176 1.00 15.13 C ATOM 697 CD PRO A 48 -7.780 19.175 -4.075 1.00 0.42 C ATOM 0 HA PRO A 48 -5.016 19.113 -5.801 1.00 32.10 H new ATOM 0 HB2 PRO A 48 -5.736 21.651 -4.929 1.00 32.43 H new ATOM 0 HB3 PRO A 48 -6.676 20.826 -6.157 1.00 32.43 H new ATOM 0 HG2 PRO A 48 -7.207 21.054 -3.201 1.00 15.13 H new ATOM 0 HG3 PRO A 48 -8.333 21.201 -4.536 1.00 15.13 H new ATOM 0 HD2 PRO A 48 -8.137 18.907 -3.081 1.00 0.42 H new ATOM 0 HD3 PRO A 48 -8.554 18.879 -4.782 1.00 0.42 H new ATOM 705 N LYS A 49 -4.690 19.667 -2.625 1.00 60.51 N ATOM 706 CA LYS A 49 -3.701 19.894 -1.579 1.00 22.13 C ATOM 707 C LYS A 49 -2.408 19.142 -1.880 1.00 13.31 C ATOM 708 O LYS A 49 -1.321 19.586 -1.510 1.00 62.01 O ATOM 709 CB LYS A 49 -4.253 19.455 -0.220 1.00 53.41 C ATOM 710 CG LYS A 49 -4.134 20.520 0.857 1.00 71.23 C ATOM 711 CD LYS A 49 -4.146 19.908 2.248 1.00 32.30 C ATOM 712 CE LYS A 49 -3.830 20.944 3.315 1.00 1.44 C ATOM 713 NZ LYS A 49 -2.616 20.582 4.098 1.00 44.11 N ATOM 0 H LYS A 49 -5.624 19.445 -2.280 1.00 60.51 H new ATOM 0 HA LYS A 49 -3.482 20.961 -1.548 1.00 22.13 H new ATOM 0 HB2 LYS A 49 -5.302 19.181 -0.334 1.00 53.41 H new ATOM 0 HB3 LYS A 49 -3.724 18.560 0.106 1.00 53.41 H new ATOM 0 HG2 LYS A 49 -3.211 21.083 0.714 1.00 71.23 H new ATOM 0 HG3 LYS A 49 -4.957 21.228 0.763 1.00 71.23 H new ATOM 0 HD2 LYS A 49 -5.124 19.468 2.445 1.00 32.30 H new ATOM 0 HD3 LYS A 49 -3.417 19.099 2.297 1.00 32.30 H new ATOM 0 HE2 LYS A 49 -3.682 21.916 2.845 1.00 1.44 H new ATOM 0 HE3 LYS A 49 -4.681 21.042 3.989 1.00 1.44 H new ATOM 0 HZ1 LYS A 49 -2.434 21.313 4.815 1.00 44.11 H new ATOM 0 HZ2 LYS A 49 -2.766 19.666 4.568 1.00 44.11 H new ATOM 0 HZ3 LYS A 49 -1.798 20.513 3.459 1.00 44.11 H new ATOM 727 N ALA A 50 -2.534 18.004 -2.553 1.00 41.05 N ATOM 728 CA ALA A 50 -1.375 17.194 -2.907 1.00 33.41 C ATOM 729 C ALA A 50 -1.033 17.340 -4.386 1.00 2.05 C ATOM 730 O ALA A 50 0.125 17.213 -4.780 1.00 30.31 O ATOM 731 CB ALA A 50 -1.629 15.732 -2.564 1.00 45.31 C ATOM 0 H ALA A 50 -3.427 17.622 -2.864 1.00 41.05 H new ATOM 0 HA ALA A 50 -0.523 17.550 -2.328 1.00 33.41 H new ATOM 0 HB1 ALA A 50 -0.756 15.138 -2.833 1.00 45.31 H new ATOM 0 HB2 ALA A 50 -1.817 15.637 -1.495 1.00 45.31 H new ATOM 0 HB3 ALA A 50 -2.496 15.374 -3.118 1.00 45.31 H new ATOM 737 N GLY A 51 -2.050 17.607 -5.199 1.00 71.34 N ATOM 738 CA GLY A 51 -1.836 17.766 -6.627 1.00 30.55 C ATOM 739 C GLY A 51 -2.415 16.619 -7.430 1.00 74.33 C ATOM 740 O GLY A 51 -1.815 16.170 -8.407 1.00 41.32 O ATOM 0 H GLY A 51 -3.018 17.716 -4.896 1.00 71.34 H new ATOM 0 HA2 GLY A 51 -2.288 18.701 -6.957 1.00 30.55 H new ATOM 0 HA3 GLY A 51 -0.767 17.841 -6.825 1.00 30.55 H new ATOM 744 N PHE A 52 -3.584 16.141 -7.018 1.00 31.41 N ATOM 745 CA PHE A 52 -4.244 15.036 -7.706 1.00 21.41 C ATOM 746 C PHE A 52 -5.761 15.193 -7.656 1.00 54.24 C ATOM 747 O PHE A 52 -6.442 14.626 -6.802 1.00 41.20 O ATOM 748 CB PHE A 52 -3.838 13.701 -7.077 1.00 51.33 C ATOM 749 CG PHE A 52 -2.356 13.459 -7.090 1.00 5.03 C ATOM 750 CD1 PHE A 52 -1.754 12.816 -8.159 1.00 71.33 C ATOM 751 CD2 PHE A 52 -1.564 13.874 -6.031 1.00 63.34 C ATOM 752 CE1 PHE A 52 -0.390 12.592 -8.174 1.00 52.25 C ATOM 753 CE2 PHE A 52 -0.200 13.652 -6.040 1.00 43.32 C ATOM 754 CZ PHE A 52 0.388 13.010 -7.113 1.00 33.32 C ATOM 0 H PHE A 52 -4.094 16.501 -6.211 1.00 31.41 H new ATOM 0 HA PHE A 52 -3.929 15.050 -8.749 1.00 21.41 H new ATOM 0 HB2 PHE A 52 -4.194 13.670 -6.047 1.00 51.33 H new ATOM 0 HB3 PHE A 52 -4.335 12.891 -7.611 1.00 51.33 H new ATOM 0 HD1 PHE A 52 -2.358 12.486 -8.991 1.00 71.33 H new ATOM 0 HD2 PHE A 52 -2.018 14.376 -5.190 1.00 63.34 H new ATOM 0 HE1 PHE A 52 0.066 12.091 -9.015 1.00 52.25 H new ATOM 0 HE2 PHE A 52 0.406 13.980 -5.209 1.00 43.32 H new ATOM 0 HZ PHE A 52 1.454 12.836 -7.122 1.00 33.32 H new ATOM 764 N PRO A 53 -6.304 15.983 -8.595 1.00 63.22 N ATOM 765 CA PRO A 53 -7.746 16.234 -8.681 1.00 44.15 C ATOM 766 C PRO A 53 -8.523 15.002 -9.129 1.00 34.40 C ATOM 767 O PRO A 53 -9.748 15.035 -9.242 1.00 33.43 O ATOM 768 CB PRO A 53 -7.850 17.343 -9.731 1.00 74.12 C ATOM 769 CG PRO A 53 -6.629 17.188 -10.570 1.00 22.50 C ATOM 770 CD PRO A 53 -5.552 16.691 -9.645 1.00 60.02 C ATOM 0 HA PRO A 53 -8.172 16.502 -7.714 1.00 44.15 H new ATOM 0 HB2 PRO A 53 -8.756 17.239 -10.328 1.00 74.12 H new ATOM 0 HB3 PRO A 53 -7.887 18.327 -9.264 1.00 74.12 H new ATOM 0 HG2 PRO A 53 -6.801 16.483 -11.383 1.00 22.50 H new ATOM 0 HG3 PRO A 53 -6.345 18.137 -11.025 1.00 22.50 H new ATOM 0 HD2 PRO A 53 -4.856 16.027 -10.158 1.00 60.02 H new ATOM 0 HD3 PRO A 53 -4.965 17.512 -9.234 1.00 60.02 H new ATOM 778 N LYS A 54 -7.804 13.914 -9.384 1.00 43.33 N ATOM 779 CA LYS A 54 -8.425 12.669 -9.818 1.00 73.11 C ATOM 780 C LYS A 54 -8.065 11.524 -8.876 1.00 62.13 C ATOM 781 O LYS A 54 -8.801 10.544 -8.765 1.00 52.30 O ATOM 782 CB LYS A 54 -7.989 12.327 -11.244 1.00 62.22 C ATOM 783 CG LYS A 54 -6.483 12.369 -11.446 1.00 53.31 C ATOM 784 CD LYS A 54 -6.123 12.592 -12.905 1.00 53.34 C ATOM 785 CE LYS A 54 -6.523 11.404 -13.766 1.00 41.33 C ATOM 786 NZ LYS A 54 -6.312 11.674 -15.216 1.00 11.13 N ATOM 0 H LYS A 54 -6.789 13.870 -9.297 1.00 43.33 H new ATOM 0 HA LYS A 54 -9.506 12.806 -9.799 1.00 73.11 H new ATOM 0 HB2 LYS A 54 -8.354 11.332 -11.498 1.00 62.22 H new ATOM 0 HB3 LYS A 54 -8.460 13.025 -11.936 1.00 62.22 H new ATOM 0 HG2 LYS A 54 -6.055 13.167 -10.839 1.00 53.31 H new ATOM 0 HG3 LYS A 54 -6.042 11.434 -11.100 1.00 53.31 H new ATOM 0 HD2 LYS A 54 -6.620 13.491 -13.270 1.00 53.34 H new ATOM 0 HD3 LYS A 54 -5.050 12.762 -12.994 1.00 53.34 H new ATOM 0 HE2 LYS A 54 -5.943 10.530 -13.471 1.00 41.33 H new ATOM 0 HE3 LYS A 54 -7.572 11.164 -13.590 1.00 41.33 H new ATOM 0 HZ1 LYS A 54 -6.596 10.841 -15.769 1.00 11.13 H new ATOM 0 HZ2 LYS A 54 -6.885 12.493 -15.504 1.00 11.13 H new ATOM 0 HZ3 LYS A 54 -5.307 11.878 -15.389 1.00 11.13 H new ATOM 800 N GLY A 55 -6.928 11.655 -8.200 1.00 35.13 N ATOM 801 CA GLY A 55 -6.492 10.624 -7.275 1.00 51.53 C ATOM 802 C GLY A 55 -5.454 9.703 -7.884 1.00 30.23 C ATOM 803 O GLY A 55 -5.413 9.518 -9.099 1.00 71.34 O ATOM 0 H GLY A 55 -6.301 12.456 -8.276 1.00 35.13 H new ATOM 0 HA2 GLY A 55 -6.079 11.092 -6.382 1.00 51.53 H new ATOM 0 HA3 GLY A 55 -7.354 10.037 -6.958 1.00 51.53 H new ATOM 807 N VAL A 56 -4.610 9.124 -7.035 1.00 22.04 N ATOM 808 CA VAL A 56 -3.566 8.216 -7.496 1.00 2.53 C ATOM 809 C VAL A 56 -3.857 6.782 -7.071 1.00 71.04 C ATOM 810 O VAL A 56 -4.549 6.545 -6.081 1.00 54.35 O ATOM 811 CB VAL A 56 -2.184 8.630 -6.953 1.00 73.41 C ATOM 812 CG1 VAL A 56 -2.007 8.149 -5.522 1.00 21.15 C ATOM 813 CG2 VAL A 56 -1.078 8.088 -7.847 1.00 63.41 C ATOM 0 H VAL A 56 -4.629 9.268 -6.025 1.00 22.04 H new ATOM 0 HA VAL A 56 -3.554 8.273 -8.584 1.00 2.53 H new ATOM 0 HB VAL A 56 -2.122 9.718 -6.955 1.00 73.41 H new ATOM 0 HG11 VAL A 56 -1.026 8.450 -5.156 1.00 21.15 H new ATOM 0 HG12 VAL A 56 -2.780 8.589 -4.892 1.00 21.15 H new ATOM 0 HG13 VAL A 56 -2.088 7.062 -5.491 1.00 21.15 H new ATOM 0 HG21 VAL A 56 -0.109 8.389 -7.450 1.00 63.41 H new ATOM 0 HG22 VAL A 56 -1.135 7.000 -7.878 1.00 63.41 H new ATOM 0 HG23 VAL A 56 -1.197 8.486 -8.855 1.00 63.41 H new ATOM 823 N ALA A 57 -3.325 5.827 -7.827 1.00 62.21 N ATOM 824 CA ALA A 57 -3.527 4.414 -7.528 1.00 45.10 C ATOM 825 C ALA A 57 -2.237 3.624 -7.717 1.00 64.32 C ATOM 826 O ALA A 57 -1.752 3.467 -8.839 1.00 32.33 O ATOM 827 CB ALA A 57 -4.633 3.843 -8.402 1.00 25.41 C ATOM 0 H ALA A 57 -2.751 6.006 -8.651 1.00 62.21 H new ATOM 0 HA ALA A 57 -3.825 4.327 -6.483 1.00 45.10 H new ATOM 0 HB1 ALA A 57 -4.773 2.788 -8.168 1.00 25.41 H new ATOM 0 HB2 ALA A 57 -5.561 4.383 -8.213 1.00 25.41 H new ATOM 0 HB3 ALA A 57 -4.359 3.949 -9.452 1.00 25.41 H new ATOM 833 N VAL A 58 -1.684 3.128 -6.615 1.00 51.42 N ATOM 834 CA VAL A 58 -0.450 2.353 -6.660 1.00 21.55 C ATOM 835 C VAL A 58 -0.737 0.858 -6.586 1.00 22.23 C ATOM 836 O VAL A 58 -1.295 0.369 -5.603 1.00 2.43 O ATOM 837 CB VAL A 58 0.499 2.740 -5.510 1.00 11.14 C ATOM 838 CG1 VAL A 58 1.556 1.666 -5.305 1.00 45.33 C ATOM 839 CG2 VAL A 58 1.143 4.091 -5.783 1.00 21.51 C ATOM 0 H VAL A 58 -2.071 3.249 -5.679 1.00 51.42 H new ATOM 0 HA VAL A 58 0.032 2.581 -7.611 1.00 21.55 H new ATOM 0 HB VAL A 58 -0.084 2.821 -4.592 1.00 11.14 H new ATOM 0 HG11 VAL A 58 2.217 1.957 -4.489 1.00 45.33 H new ATOM 0 HG12 VAL A 58 1.072 0.721 -5.060 1.00 45.33 H new ATOM 0 HG13 VAL A 58 2.138 1.549 -6.219 1.00 45.33 H new ATOM 0 HG21 VAL A 58 1.810 4.349 -4.961 1.00 21.51 H new ATOM 0 HG22 VAL A 58 1.713 4.042 -6.711 1.00 21.51 H new ATOM 0 HG23 VAL A 58 0.368 4.852 -5.873 1.00 21.51 H new ATOM 849 N VAL A 59 -0.352 0.134 -7.632 1.00 71.23 N ATOM 850 CA VAL A 59 -0.567 -1.307 -7.686 1.00 12.00 C ATOM 851 C VAL A 59 0.572 -2.057 -7.005 1.00 72.42 C ATOM 852 O VAL A 59 1.652 -1.506 -6.789 1.00 62.23 O ATOM 853 CB VAL A 59 -0.697 -1.802 -9.138 1.00 50.44 C ATOM 854 CG1 VAL A 59 -1.084 -3.273 -9.169 1.00 51.42 C ATOM 855 CG2 VAL A 59 -1.710 -0.959 -9.900 1.00 1.34 C ATOM 0 H VAL A 59 0.111 0.522 -8.454 1.00 71.23 H new ATOM 0 HA VAL A 59 -1.499 -1.508 -7.158 1.00 12.00 H new ATOM 0 HB VAL A 59 0.271 -1.696 -9.627 1.00 50.44 H new ATOM 0 HG11 VAL A 59 -1.171 -3.605 -10.204 1.00 51.42 H new ATOM 0 HG12 VAL A 59 -0.319 -3.861 -8.663 1.00 51.42 H new ATOM 0 HG13 VAL A 59 -2.040 -3.408 -8.663 1.00 51.42 H new ATOM 0 HG21 VAL A 59 -1.789 -1.323 -10.924 1.00 1.34 H new ATOM 0 HG22 VAL A 59 -2.683 -1.031 -9.413 1.00 1.34 H new ATOM 0 HG23 VAL A 59 -1.385 0.081 -9.909 1.00 1.34 H new ATOM 865 N LEU A 60 0.324 -3.319 -6.669 1.00 31.21 N ATOM 866 CA LEU A 60 1.330 -4.147 -6.012 1.00 32.30 C ATOM 867 C LEU A 60 1.072 -5.628 -6.275 1.00 43.24 C ATOM 868 O LEU A 60 0.481 -6.322 -5.449 1.00 1.23 O ATOM 869 CB LEU A 60 1.335 -3.880 -4.506 1.00 54.52 C ATOM 870 CG LEU A 60 1.662 -2.447 -4.081 1.00 15.32 C ATOM 871 CD1 LEU A 60 1.327 -2.237 -2.612 1.00 74.14 C ATOM 872 CD2 LEU A 60 3.126 -2.132 -4.345 1.00 44.05 C ATOM 0 H LEU A 60 -0.564 -3.791 -6.841 1.00 31.21 H new ATOM 0 HA LEU A 60 2.305 -3.887 -6.425 1.00 32.30 H new ATOM 0 HB2 LEU A 60 0.355 -4.142 -4.107 1.00 54.52 H new ATOM 0 HB3 LEU A 60 2.058 -4.550 -4.040 1.00 54.52 H new ATOM 0 HG LEU A 60 1.052 -1.765 -4.674 1.00 15.32 H new ATOM 0 HD11 LEU A 60 1.566 -1.212 -2.327 1.00 74.14 H new ATOM 0 HD12 LEU A 60 0.265 -2.420 -2.451 1.00 74.14 H new ATOM 0 HD13 LEU A 60 1.910 -2.928 -2.003 1.00 74.14 H new ATOM 0 HD21 LEU A 60 3.339 -1.109 -4.036 1.00 44.05 H new ATOM 0 HD22 LEU A 60 3.754 -2.820 -3.779 1.00 44.05 H new ATOM 0 HD23 LEU A 60 3.336 -2.241 -5.409 1.00 44.05 H new ATOM 884 N ASP A 61 1.522 -6.104 -7.431 1.00 74.04 N ATOM 885 CA ASP A 61 1.342 -7.502 -7.803 1.00 63.24 C ATOM 886 C ASP A 61 2.143 -8.417 -6.880 1.00 53.23 C ATOM 887 O ASP A 61 3.370 -8.476 -6.960 1.00 70.31 O ATOM 888 CB ASP A 61 1.768 -7.725 -9.255 1.00 62.04 C ATOM 889 CG ASP A 61 1.825 -9.194 -9.623 1.00 71.30 C ATOM 890 OD1 ASP A 61 1.506 -10.037 -8.757 1.00 53.43 O ATOM 891 OD2 ASP A 61 2.188 -9.503 -10.778 1.00 21.25 O ATOM 0 H ASP A 61 2.014 -5.542 -8.126 1.00 74.04 H new ATOM 0 HA ASP A 61 0.285 -7.746 -7.701 1.00 63.24 H new ATOM 0 HB2 ASP A 61 1.069 -7.214 -9.918 1.00 62.04 H new ATOM 0 HB3 ASP A 61 2.748 -7.275 -9.416 1.00 62.04 H new ATOM 896 N LEU A 62 1.440 -9.125 -6.004 1.00 33.44 N ATOM 897 CA LEU A 62 2.084 -10.036 -5.065 1.00 20.24 C ATOM 898 C LEU A 62 1.739 -11.486 -5.387 1.00 70.31 C ATOM 899 O LEU A 62 0.742 -11.763 -6.054 1.00 10.13 O ATOM 900 CB LEU A 62 1.661 -9.705 -3.632 1.00 22.43 C ATOM 901 CG LEU A 62 1.563 -8.220 -3.287 1.00 40.50 C ATOM 902 CD1 LEU A 62 1.304 -8.032 -1.800 1.00 32.32 C ATOM 903 CD2 LEU A 62 2.832 -7.490 -3.705 1.00 12.40 C ATOM 0 H LEU A 62 0.424 -9.086 -5.924 1.00 33.44 H new ATOM 0 HA LEU A 62 3.163 -9.910 -5.158 1.00 20.24 H new ATOM 0 HB2 LEU A 62 0.691 -10.165 -3.445 1.00 22.43 H new ATOM 0 HB3 LEU A 62 2.371 -10.170 -2.948 1.00 22.43 H new ATOM 0 HG LEU A 62 0.724 -7.794 -3.837 1.00 40.50 H new ATOM 0 HD11 LEU A 62 1.237 -6.968 -1.574 1.00 32.32 H new ATOM 0 HD12 LEU A 62 0.368 -8.520 -1.529 1.00 32.32 H new ATOM 0 HD13 LEU A 62 2.121 -8.474 -1.230 1.00 32.32 H new ATOM 0 HD21 LEU A 62 2.744 -6.434 -3.452 1.00 12.40 H new ATOM 0 HD22 LEU A 62 3.687 -7.919 -3.183 1.00 12.40 H new ATOM 0 HD23 LEU A 62 2.974 -7.594 -4.781 1.00 12.40 H new ATOM 915 N TRP A 63 2.567 -12.407 -4.908 1.00 70.14 N ATOM 916 CA TRP A 63 2.347 -13.830 -5.144 1.00 3.24 C ATOM 917 C TRP A 63 2.989 -14.669 -4.045 1.00 22.13 C ATOM 918 O TRP A 63 4.214 -14.759 -3.953 1.00 53.32 O ATOM 919 CB TRP A 63 2.912 -14.235 -6.506 1.00 50.14 C ATOM 920 CG TRP A 63 2.856 -15.711 -6.758 1.00 63.11 C ATOM 921 CD1 TRP A 63 3.876 -16.608 -6.605 1.00 54.44 C ATOM 922 CD2 TRP A 63 1.723 -16.462 -7.207 1.00 12.25 C ATOM 923 NE1 TRP A 63 3.444 -17.870 -6.933 1.00 50.12 N ATOM 924 CE2 TRP A 63 2.128 -17.808 -7.304 1.00 14.00 C ATOM 925 CE3 TRP A 63 0.406 -16.129 -7.534 1.00 52.14 C ATOM 926 CZ2 TRP A 63 1.261 -18.817 -7.717 1.00 22.15 C ATOM 927 CZ3 TRP A 63 -0.452 -17.131 -7.943 1.00 31.44 C ATOM 928 CH2 TRP A 63 -0.023 -18.463 -8.031 1.00 43.21 C ATOM 0 H TRP A 63 3.397 -12.195 -4.354 1.00 70.14 H new ATOM 0 HA TRP A 63 1.272 -14.013 -5.135 1.00 3.24 H new ATOM 0 HB2 TRP A 63 2.357 -13.719 -7.289 1.00 50.14 H new ATOM 0 HB3 TRP A 63 3.947 -13.901 -6.576 1.00 50.14 H new ATOM 0 HD1 TRP A 63 4.874 -16.361 -6.275 1.00 54.44 H new ATOM 0 HE1 TRP A 63 4.012 -18.717 -6.905 1.00 50.12 H new ATOM 0 HE3 TRP A 63 0.065 -15.106 -7.468 1.00 52.14 H new ATOM 0 HZ2 TRP A 63 1.591 -19.843 -7.787 1.00 22.15 H new ATOM 0 HZ3 TRP A 63 -1.472 -16.884 -8.200 1.00 31.44 H new ATOM 0 HH2 TRP A 63 -0.719 -19.224 -8.353 1.00 43.21 H new ATOM 939 N HIS A 64 2.155 -15.284 -3.212 1.00 10.43 N ATOM 940 CA HIS A 64 2.642 -16.116 -2.119 1.00 32.54 C ATOM 941 C HIS A 64 3.640 -15.351 -1.255 1.00 72.33 C ATOM 942 O HIS A 64 4.679 -15.886 -0.869 1.00 13.12 O ATOM 943 CB HIS A 64 3.292 -17.386 -2.668 1.00 22.52 C ATOM 944 CG HIS A 64 2.336 -18.286 -3.390 1.00 3.24 C ATOM 945 ND1 HIS A 64 1.397 -18.011 -4.325 1.00 55.31 N flip ATOM 946 CD2 HIS A 64 2.279 -19.647 -3.179 1.00 51.31 C flip ATOM 947 CE1 HIS A 64 0.795 -19.198 -4.658 1.00 31.55 C flip ATOM 948 NE2 HIS A 64 1.345 -20.170 -3.954 1.00 73.10 N flip ATOM 0 H HIS A 64 1.139 -15.221 -3.274 1.00 10.43 H new ATOM 0 HA HIS A 64 1.790 -16.392 -1.498 1.00 32.54 H new ATOM 0 HB2 HIS A 64 4.098 -17.107 -3.347 1.00 22.52 H new ATOM 0 HB3 HIS A 64 3.745 -17.937 -1.844 1.00 22.52 H new ATOM 0 HD1 HIS A 64 1.178 -17.092 -4.710 1.00 55.31 H new ATOM 0 HD2 HIS A 64 2.900 -20.199 -2.489 1.00 51.31 H new ATOM 0 HE1 HIS A 64 0.000 -19.318 -5.379 1.00 31.55 H new ATOM 957 N GLY A 65 3.317 -14.096 -0.957 1.00 23.14 N ATOM 958 CA GLY A 65 4.197 -13.278 -0.143 1.00 31.44 C ATOM 959 C GLY A 65 5.237 -12.546 -0.967 1.00 34.21 C ATOM 960 O GLY A 65 5.811 -11.556 -0.517 1.00 3.32 O ATOM 0 H GLY A 65 2.462 -13.632 -1.264 1.00 23.14 H new ATOM 0 HA2 GLY A 65 3.603 -12.553 0.413 1.00 31.44 H new ATOM 0 HA3 GLY A 65 4.698 -13.909 0.591 1.00 31.44 H new ATOM 964 N ALA A 66 5.481 -13.035 -2.178 1.00 61.34 N ATOM 965 CA ALA A 66 6.459 -12.421 -3.068 1.00 33.43 C ATOM 966 C ALA A 66 5.869 -11.205 -3.774 1.00 51.10 C ATOM 967 O ALA A 66 4.665 -10.957 -3.706 1.00 62.25 O ATOM 968 CB ALA A 66 6.956 -13.436 -4.086 1.00 51.05 C ATOM 0 H ALA A 66 5.015 -13.855 -2.566 1.00 61.34 H new ATOM 0 HA ALA A 66 7.303 -12.085 -2.466 1.00 33.43 H new ATOM 0 HB1 ALA A 66 7.686 -12.964 -4.744 1.00 51.05 H new ATOM 0 HB2 ALA A 66 7.423 -14.273 -3.567 1.00 51.05 H new ATOM 0 HB3 ALA A 66 6.116 -13.799 -4.677 1.00 51.05 H new ATOM 974 N CYS A 67 6.726 -10.448 -4.452 1.00 0.43 N ATOM 975 CA CYS A 67 6.290 -9.255 -5.170 1.00 25.30 C ATOM 976 C CYS A 67 6.804 -9.269 -6.608 1.00 5.23 C ATOM 977 O CYS A 67 7.984 -9.024 -6.859 1.00 2.13 O ATOM 978 CB CYS A 67 6.782 -7.995 -4.454 1.00 74.32 C ATOM 979 SG CYS A 67 5.701 -6.546 -4.677 1.00 62.12 S ATOM 0 H CYS A 67 7.726 -10.639 -4.519 1.00 0.43 H new ATOM 0 HA CYS A 67 5.200 -9.251 -5.191 1.00 25.30 H new ATOM 0 HB2 CYS A 67 6.873 -8.207 -3.389 1.00 74.32 H new ATOM 0 HB3 CYS A 67 7.780 -7.750 -4.817 1.00 74.32 H new ATOM 984 N ARG A 68 5.909 -9.557 -7.547 1.00 32.31 N ATOM 985 CA ARG A 68 6.270 -9.604 -8.958 1.00 25.03 C ATOM 986 C ARG A 68 6.622 -8.212 -9.476 1.00 60.01 C ATOM 987 O ARG A 68 7.719 -7.986 -9.983 1.00 62.35 O ATOM 988 CB ARG A 68 5.124 -10.192 -9.781 1.00 53.43 C ATOM 989 CG ARG A 68 4.744 -11.606 -9.376 1.00 2.23 C ATOM 990 CD ARG A 68 4.386 -12.456 -10.586 1.00 10.32 C ATOM 991 NE ARG A 68 5.206 -13.660 -10.671 1.00 63.22 N ATOM 992 CZ ARG A 68 6.523 -13.642 -10.853 1.00 33.13 C ATOM 993 NH1 ARG A 68 7.163 -12.487 -10.968 1.00 41.31 N ATOM 994 NH2 ARG A 68 7.199 -14.781 -10.920 1.00 44.44 N ATOM 0 H ARG A 68 4.928 -9.761 -7.356 1.00 32.31 H new ATOM 0 HA ARG A 68 7.147 -10.244 -9.061 1.00 25.03 H new ATOM 0 HB2 ARG A 68 4.250 -9.548 -9.682 1.00 53.43 H new ATOM 0 HB3 ARG A 68 5.406 -10.188 -10.834 1.00 53.43 H new ATOM 0 HG2 ARG A 68 5.573 -12.067 -8.839 1.00 2.23 H new ATOM 0 HG3 ARG A 68 3.898 -11.574 -8.690 1.00 2.23 H new ATOM 0 HD2 ARG A 68 3.334 -12.737 -10.533 1.00 10.32 H new ATOM 0 HD3 ARG A 68 4.513 -11.866 -11.494 1.00 10.32 H new ATOM 0 HE ARG A 68 4.743 -14.565 -10.586 1.00 63.22 H new ATOM 0 HH11 ARG A 68 6.645 -11.610 -10.917 1.00 41.31 H new ATOM 0 HH12 ARG A 68 8.173 -12.475 -11.108 1.00 41.31 H new ATOM 0 HH21 ARG A 68 6.709 -15.671 -10.832 1.00 44.44 H new ATOM 0 HH22 ARG A 68 8.209 -14.767 -11.060 1.00 44.44 H new ATOM 1008 N GLY A 69 5.681 -7.282 -9.343 1.00 2.41 N ATOM 1009 CA GLY A 69 5.910 -5.924 -9.802 1.00 70.34 C ATOM 1010 C GLY A 69 4.828 -4.967 -9.343 1.00 0.21 C ATOM 1011 O GLY A 69 3.905 -5.359 -8.629 1.00 52.34 O ATOM 0 H GLY A 69 4.765 -7.445 -8.926 1.00 2.41 H new ATOM 0 HA2 GLY A 69 6.876 -5.578 -9.435 1.00 70.34 H new ATOM 0 HA3 GLY A 69 5.960 -5.915 -10.891 1.00 70.34 H new ATOM 1015 N ALA A 70 4.941 -3.708 -9.753 1.00 4.14 N ATOM 1016 CA ALA A 70 3.965 -2.692 -9.380 1.00 61.20 C ATOM 1017 C ALA A 70 3.912 -1.574 -10.415 1.00 42.04 C ATOM 1018 O ALA A 70 4.843 -1.398 -11.203 1.00 33.45 O ATOM 1019 CB ALA A 70 4.292 -2.126 -8.006 1.00 13.31 C ATOM 0 H ALA A 70 5.699 -3.367 -10.344 1.00 4.14 H new ATOM 0 HA ALA A 70 2.983 -3.164 -9.343 1.00 61.20 H new ATOM 0 HB1 ALA A 70 3.555 -1.368 -7.740 1.00 13.31 H new ATOM 0 HB2 ALA A 70 4.271 -2.928 -7.268 1.00 13.31 H new ATOM 0 HB3 ALA A 70 5.285 -1.676 -8.025 1.00 13.31 H new ATOM 1025 N LYS A 71 2.818 -0.821 -10.412 1.00 34.21 N ATOM 1026 CA LYS A 71 2.643 0.281 -11.351 1.00 31.13 C ATOM 1027 C LYS A 71 1.754 1.367 -10.754 1.00 72.14 C ATOM 1028 O LYS A 71 0.742 1.074 -10.118 1.00 20.32 O ATOM 1029 CB LYS A 71 2.036 -0.229 -12.660 1.00 23.21 C ATOM 1030 CG LYS A 71 0.753 -1.021 -12.468 1.00 44.13 C ATOM 1031 CD LYS A 71 0.349 -1.743 -13.743 1.00 3.13 C ATOM 1032 CE LYS A 71 -0.535 -2.944 -13.446 1.00 62.41 C ATOM 1033 NZ LYS A 71 -1.675 -3.042 -14.399 1.00 74.40 N ATOM 0 H LYS A 71 2.038 -0.954 -9.769 1.00 34.21 H new ATOM 0 HA LYS A 71 3.623 0.711 -11.556 1.00 31.13 H new ATOM 0 HB2 LYS A 71 1.834 0.621 -13.313 1.00 23.21 H new ATOM 0 HB3 LYS A 71 2.767 -0.856 -13.170 1.00 23.21 H new ATOM 0 HG2 LYS A 71 0.888 -1.746 -11.665 1.00 44.13 H new ATOM 0 HG3 LYS A 71 -0.048 -0.349 -12.159 1.00 44.13 H new ATOM 0 HD2 LYS A 71 -0.181 -1.054 -14.401 1.00 3.13 H new ATOM 0 HD3 LYS A 71 1.242 -2.070 -14.276 1.00 3.13 H new ATOM 0 HE2 LYS A 71 0.061 -3.855 -13.497 1.00 62.41 H new ATOM 0 HE3 LYS A 71 -0.918 -2.871 -12.428 1.00 62.41 H new ATOM 0 HZ1 LYS A 71 -2.254 -3.873 -14.163 1.00 74.40 H new ATOM 0 HZ2 LYS A 71 -2.258 -2.184 -14.332 1.00 74.40 H new ATOM 0 HZ3 LYS A 71 -1.310 -3.138 -15.368 1.00 74.40 H new ATOM 1047 N ALA A 72 2.136 2.622 -10.968 1.00 72.51 N ATOM 1048 CA ALA A 72 1.370 3.751 -10.455 1.00 54.12 C ATOM 1049 C ALA A 72 0.496 4.361 -11.545 1.00 51.12 C ATOM 1050 O ALA A 72 0.991 4.776 -12.594 1.00 32.43 O ATOM 1051 CB ALA A 72 2.304 4.802 -9.875 1.00 23.43 C ATOM 0 H ALA A 72 2.971 2.882 -11.493 1.00 72.51 H new ATOM 0 HA ALA A 72 0.716 3.385 -9.663 1.00 54.12 H new ATOM 0 HB1 ALA A 72 1.719 5.639 -9.496 1.00 23.43 H new ATOM 0 HB2 ALA A 72 2.882 4.365 -9.061 1.00 23.43 H new ATOM 0 HB3 ALA A 72 2.981 5.156 -10.652 1.00 23.43 H new ATOM 1057 N VAL A 73 -0.808 4.414 -11.292 1.00 61.12 N ATOM 1058 CA VAL A 73 -1.752 4.974 -12.251 1.00 52.21 C ATOM 1059 C VAL A 73 -2.735 5.918 -11.568 1.00 30.40 C ATOM 1060 O VAL A 73 -3.318 5.582 -10.539 1.00 0.24 O ATOM 1061 CB VAL A 73 -2.539 3.866 -12.976 1.00 53.12 C ATOM 1062 CG1 VAL A 73 -2.987 2.797 -11.991 1.00 52.12 C ATOM 1063 CG2 VAL A 73 -3.732 4.457 -13.713 1.00 20.31 C ATOM 0 H VAL A 73 -1.235 4.075 -10.430 1.00 61.12 H new ATOM 0 HA VAL A 73 -1.167 5.532 -12.982 1.00 52.21 H new ATOM 0 HB VAL A 73 -1.882 3.398 -13.709 1.00 53.12 H new ATOM 0 HG11 VAL A 73 -3.541 2.023 -12.521 1.00 52.12 H new ATOM 0 HG12 VAL A 73 -2.114 2.354 -11.512 1.00 52.12 H new ATOM 0 HG13 VAL A 73 -3.628 3.247 -11.232 1.00 52.12 H new ATOM 0 HG21 VAL A 73 -4.277 3.661 -14.220 1.00 20.31 H new ATOM 0 HG22 VAL A 73 -4.392 4.952 -13.000 1.00 20.31 H new ATOM 0 HG23 VAL A 73 -3.383 5.182 -14.448 1.00 20.31 H new ATOM 1073 N GLU A 74 -2.914 7.100 -12.151 1.00 22.55 N ATOM 1074 CA GLU A 74 -3.827 8.093 -11.597 1.00 33.44 C ATOM 1075 C GLU A 74 -5.142 8.113 -12.370 1.00 42.30 C ATOM 1076 O GLU A 74 -5.162 8.354 -13.576 1.00 14.41 O ATOM 1077 CB GLU A 74 -3.184 9.481 -11.624 1.00 52.41 C ATOM 1078 CG GLU A 74 -1.912 9.580 -10.799 1.00 12.13 C ATOM 1079 CD GLU A 74 -0.904 10.543 -11.393 1.00 45.33 C ATOM 1080 OE1 GLU A 74 -1.265 11.719 -11.612 1.00 32.24 O ATOM 1081 OE2 GLU A 74 0.245 10.122 -11.641 1.00 11.42 O ATOM 0 H GLU A 74 -2.440 7.392 -13.005 1.00 22.55 H new ATOM 0 HA GLU A 74 -4.038 7.819 -10.563 1.00 33.44 H new ATOM 0 HB2 GLU A 74 -2.959 9.747 -12.657 1.00 52.41 H new ATOM 0 HB3 GLU A 74 -3.903 10.212 -11.256 1.00 52.41 H new ATOM 0 HG2 GLU A 74 -2.163 9.901 -9.788 1.00 12.13 H new ATOM 0 HG3 GLU A 74 -1.459 8.592 -10.716 1.00 12.13 H new ATOM 1088 N GLY A 75 -6.241 7.859 -11.665 1.00 50.10 N ATOM 1089 CA GLY A 75 -7.545 7.852 -12.301 1.00 51.14 C ATOM 1090 C GLY A 75 -8.247 6.515 -12.171 1.00 64.55 C ATOM 1091 O GLY A 75 -9.086 6.329 -11.291 1.00 12.52 O ATOM 0 H GLY A 75 -6.251 7.658 -10.665 1.00 50.10 H new ATOM 0 HA2 GLY A 75 -8.166 8.630 -11.857 1.00 51.14 H new ATOM 0 HA3 GLY A 75 -7.432 8.098 -13.357 1.00 51.14 H new ATOM 1095 N GLU A 76 -7.902 5.580 -13.052 1.00 73.24 N ATOM 1096 CA GLU A 76 -8.507 4.253 -13.033 1.00 74.13 C ATOM 1097 C GLU A 76 -7.437 3.167 -13.022 1.00 64.24 C ATOM 1098 O GLU A 76 -6.632 3.065 -13.948 1.00 50.40 O ATOM 1099 CB GLU A 76 -9.425 4.069 -14.244 1.00 51.22 C ATOM 1100 CG GLU A 76 -10.709 4.878 -14.163 1.00 5.32 C ATOM 1101 CD GLU A 76 -10.985 5.661 -15.431 1.00 52.53 C ATOM 1102 OE1 GLU A 76 -11.363 5.037 -16.445 1.00 53.13 O ATOM 1103 OE2 GLU A 76 -10.825 6.900 -15.410 1.00 53.02 O ATOM 0 H GLU A 76 -7.208 5.717 -13.787 1.00 73.24 H new ATOM 0 HA GLU A 76 -9.098 4.165 -12.122 1.00 74.13 H new ATOM 0 HB2 GLU A 76 -8.883 4.352 -15.146 1.00 51.22 H new ATOM 0 HB3 GLU A 76 -9.676 3.013 -14.342 1.00 51.22 H new ATOM 0 HG2 GLU A 76 -11.545 4.207 -13.965 1.00 5.32 H new ATOM 0 HG3 GLU A 76 -10.647 5.567 -13.321 1.00 5.32 H new ATOM 1110 N ALA A 77 -7.434 2.356 -11.969 1.00 55.31 N ATOM 1111 CA ALA A 77 -6.465 1.277 -11.838 1.00 71.42 C ATOM 1112 C ALA A 77 -7.137 -0.086 -11.977 1.00 11.11 C ATOM 1113 O ALA A 77 -8.363 -0.188 -11.945 1.00 3.00 O ATOM 1114 CB ALA A 77 -5.739 1.377 -10.505 1.00 22.54 C ATOM 0 H ALA A 77 -8.093 2.427 -11.194 1.00 55.31 H new ATOM 0 HA ALA A 77 -5.737 1.377 -12.643 1.00 71.42 H new ATOM 0 HB1 ALA A 77 -5.018 0.564 -10.421 1.00 22.54 H new ATOM 0 HB2 ALA A 77 -5.217 2.332 -10.446 1.00 22.54 H new ATOM 0 HB3 ALA A 77 -6.461 1.307 -9.691 1.00 22.54 H new ATOM 1120 N GLU A 78 -6.326 -1.128 -12.130 1.00 34.40 N ATOM 1121 CA GLU A 78 -6.846 -2.483 -12.274 1.00 64.12 C ATOM 1122 C GLU A 78 -6.229 -3.415 -11.235 1.00 41.32 C ATOM 1123 O GLU A 78 -5.032 -3.699 -11.273 1.00 11.33 O ATOM 1124 CB GLU A 78 -6.564 -3.014 -13.682 1.00 0.32 C ATOM 1125 CG GLU A 78 -7.669 -3.902 -14.229 1.00 44.21 C ATOM 1126 CD GLU A 78 -8.583 -3.168 -15.192 1.00 70.43 C ATOM 1127 OE1 GLU A 78 -8.067 -2.554 -16.148 1.00 41.34 O ATOM 1128 OE2 GLU A 78 -9.814 -3.211 -14.988 1.00 43.42 O ATOM 0 H GLU A 78 -5.309 -1.060 -12.157 1.00 34.40 H new ATOM 0 HA GLU A 78 -7.924 -2.450 -12.114 1.00 64.12 H new ATOM 0 HB2 GLU A 78 -6.419 -2.171 -14.357 1.00 0.32 H new ATOM 0 HB3 GLU A 78 -5.630 -3.576 -13.669 1.00 0.32 H new ATOM 0 HG2 GLU A 78 -7.225 -4.758 -14.737 1.00 44.21 H new ATOM 0 HG3 GLU A 78 -8.259 -4.294 -13.401 1.00 44.21 H new ATOM 1135 N ALA A 79 -7.055 -3.888 -10.308 1.00 14.33 N ATOM 1136 CA ALA A 79 -6.592 -4.787 -9.259 1.00 61.33 C ATOM 1137 C ALA A 79 -7.766 -5.465 -8.560 1.00 71.51 C ATOM 1138 O ALA A 79 -8.866 -4.917 -8.500 1.00 40.34 O ATOM 1139 CB ALA A 79 -5.741 -4.031 -8.251 1.00 13.34 C ATOM 0 H ALA A 79 -8.049 -3.663 -10.262 1.00 14.33 H new ATOM 0 HA ALA A 79 -5.982 -5.562 -9.723 1.00 61.33 H new ATOM 0 HB1 ALA A 79 -5.403 -4.716 -7.474 1.00 13.34 H new ATOM 0 HB2 ALA A 79 -4.877 -3.599 -8.756 1.00 13.34 H new ATOM 0 HB3 ALA A 79 -6.333 -3.234 -7.800 1.00 13.34 H new ATOM 1145 N ASP A 80 -7.525 -6.661 -8.034 1.00 62.52 N ATOM 1146 CA ASP A 80 -8.562 -7.414 -7.338 1.00 44.12 C ATOM 1147 C ASP A 80 -8.968 -6.714 -6.047 1.00 1.34 C ATOM 1148 O ASP A 80 -10.135 -6.738 -5.655 1.00 54.51 O ATOM 1149 CB ASP A 80 -8.075 -8.832 -7.033 1.00 74.45 C ATOM 1150 CG ASP A 80 -8.844 -9.886 -7.805 1.00 73.22 C ATOM 1151 OD1 ASP A 80 -10.072 -9.991 -7.603 1.00 14.21 O ATOM 1152 OD2 ASP A 80 -8.218 -10.608 -8.610 1.00 1.25 O ATOM 0 H ASP A 80 -6.620 -7.130 -8.076 1.00 62.52 H new ATOM 0 HA ASP A 80 -9.434 -7.470 -7.989 1.00 44.12 H new ATOM 0 HB2 ASP A 80 -7.015 -8.909 -7.275 1.00 74.45 H new ATOM 0 HB3 ASP A 80 -8.173 -9.025 -5.965 1.00 74.45 H new ATOM 1157 N PHE A 81 -7.997 -6.091 -5.386 1.00 73.51 N ATOM 1158 CA PHE A 81 -8.254 -5.385 -4.136 1.00 63.03 C ATOM 1159 C PHE A 81 -7.900 -3.906 -4.264 1.00 60.03 C ATOM 1160 O PHE A 81 -6.733 -3.525 -4.178 1.00 2.01 O ATOM 1161 CB PHE A 81 -7.451 -6.016 -2.996 1.00 45.23 C ATOM 1162 CG PHE A 81 -7.821 -7.445 -2.721 1.00 73.52 C ATOM 1163 CD1 PHE A 81 -9.003 -7.755 -2.068 1.00 21.14 C ATOM 1164 CD2 PHE A 81 -6.987 -8.479 -3.117 1.00 35.23 C ATOM 1165 CE1 PHE A 81 -9.345 -9.069 -1.813 1.00 33.23 C ATOM 1166 CE2 PHE A 81 -7.326 -9.795 -2.866 1.00 23.13 C ATOM 1167 CZ PHE A 81 -8.507 -10.091 -2.214 1.00 22.53 C ATOM 0 H PHE A 81 -7.025 -6.061 -5.695 1.00 73.51 H new ATOM 0 HA PHE A 81 -9.318 -5.468 -3.912 1.00 63.03 H new ATOM 0 HB2 PHE A 81 -6.389 -5.964 -3.238 1.00 45.23 H new ATOM 0 HB3 PHE A 81 -7.600 -5.430 -2.089 1.00 45.23 H new ATOM 0 HD1 PHE A 81 -9.664 -6.961 -1.755 1.00 21.14 H new ATOM 0 HD2 PHE A 81 -6.062 -8.254 -3.627 1.00 35.23 H new ATOM 0 HE1 PHE A 81 -10.268 -9.297 -1.300 1.00 33.23 H new ATOM 0 HE2 PHE A 81 -6.668 -10.592 -3.180 1.00 23.13 H new ATOM 0 HZ PHE A 81 -8.775 -11.119 -2.018 1.00 22.53 H new ATOM 1177 N VAL A 82 -8.918 -3.077 -4.473 1.00 34.24 N ATOM 1178 CA VAL A 82 -8.715 -1.639 -4.613 1.00 35.32 C ATOM 1179 C VAL A 82 -9.277 -0.886 -3.412 1.00 72.33 C ATOM 1180 O VAL A 82 -10.460 -1.005 -3.090 1.00 54.15 O ATOM 1181 CB VAL A 82 -9.376 -1.103 -5.896 1.00 3.52 C ATOM 1182 CG1 VAL A 82 -9.268 0.413 -5.959 1.00 64.32 C ATOM 1183 CG2 VAL A 82 -8.748 -1.741 -7.125 1.00 72.43 C ATOM 0 H VAL A 82 -9.890 -3.376 -4.549 1.00 34.24 H new ATOM 0 HA VAL A 82 -7.639 -1.474 -4.671 1.00 35.32 H new ATOM 0 HB VAL A 82 -10.433 -1.368 -5.877 1.00 3.52 H new ATOM 0 HG11 VAL A 82 -9.741 0.774 -6.873 1.00 64.32 H new ATOM 0 HG12 VAL A 82 -9.768 0.850 -5.095 1.00 64.32 H new ATOM 0 HG13 VAL A 82 -8.217 0.703 -5.955 1.00 64.32 H new ATOM 0 HG21 VAL A 82 -9.227 -1.351 -8.023 1.00 72.43 H new ATOM 0 HG22 VAL A 82 -7.683 -1.509 -7.152 1.00 72.43 H new ATOM 0 HG23 VAL A 82 -8.882 -2.822 -7.083 1.00 72.43 H new ATOM 1193 N ILE A 83 -8.422 -0.112 -2.753 1.00 31.50 N ATOM 1194 CA ILE A 83 -8.834 0.663 -1.589 1.00 21.51 C ATOM 1195 C ILE A 83 -8.618 2.155 -1.816 1.00 63.24 C ATOM 1196 O ILE A 83 -7.536 2.581 -2.217 1.00 22.42 O ATOM 1197 CB ILE A 83 -8.065 0.231 -0.325 1.00 43.33 C ATOM 1198 CG1 ILE A 83 -8.269 -1.263 -0.063 1.00 52.35 C ATOM 1199 CG2 ILE A 83 -8.514 1.052 0.874 1.00 34.20 C ATOM 1200 CD1 ILE A 83 -7.386 -1.809 1.037 1.00 62.25 C ATOM 0 H ILE A 83 -7.439 -0.005 -3.005 1.00 31.50 H new ATOM 0 HA ILE A 83 -9.897 0.471 -1.442 1.00 21.51 H new ATOM 0 HB ILE A 83 -7.002 0.410 -0.485 1.00 43.33 H new ATOM 0 HG12 ILE A 83 -9.312 -1.439 0.199 1.00 52.35 H new ATOM 0 HG13 ILE A 83 -8.074 -1.815 -0.982 1.00 52.35 H new ATOM 0 HG21 ILE A 83 -7.962 0.735 1.759 1.00 34.20 H new ATOM 0 HG22 ILE A 83 -8.321 2.108 0.685 1.00 34.20 H new ATOM 0 HG23 ILE A 83 -9.581 0.902 1.039 1.00 34.20 H new ATOM 0 HD11 ILE A 83 -7.584 -2.873 1.168 1.00 62.25 H new ATOM 0 HD12 ILE A 83 -6.339 -1.665 0.769 1.00 62.25 H new ATOM 0 HD13 ILE A 83 -7.597 -1.283 1.968 1.00 62.25 H new ATOM 1212 N GLU A 84 -9.656 2.943 -1.557 1.00 52.50 N ATOM 1213 CA GLU A 84 -9.579 4.388 -1.733 1.00 13.12 C ATOM 1214 C GLU A 84 -9.890 5.113 -0.426 1.00 73.30 C ATOM 1215 O GLU A 84 -10.862 4.793 0.258 1.00 71.40 O ATOM 1216 CB GLU A 84 -10.551 4.844 -2.824 1.00 44.24 C ATOM 1217 CG GLU A 84 -10.777 6.346 -2.850 1.00 12.42 C ATOM 1218 CD GLU A 84 -11.206 6.848 -4.214 1.00 53.41 C ATOM 1219 OE1 GLU A 84 -10.427 6.692 -5.177 1.00 21.31 O ATOM 1220 OE2 GLU A 84 -12.323 7.399 -4.318 1.00 44.21 O ATOM 0 H GLU A 84 -10.559 2.606 -1.225 1.00 52.50 H new ATOM 0 HA GLU A 84 -8.562 4.637 -2.034 1.00 13.12 H new ATOM 0 HB2 GLU A 84 -10.170 4.526 -3.794 1.00 44.24 H new ATOM 0 HB3 GLU A 84 -11.508 4.344 -2.678 1.00 44.24 H new ATOM 0 HG2 GLU A 84 -11.538 6.608 -2.115 1.00 12.42 H new ATOM 0 HG3 GLU A 84 -9.859 6.853 -2.553 1.00 12.42 H new ATOM 1227 N ALA A 85 -9.057 6.091 -0.086 1.00 30.32 N ATOM 1228 CA ALA A 85 -9.243 6.862 1.137 1.00 42.23 C ATOM 1229 C ALA A 85 -8.466 8.174 1.082 1.00 71.12 C ATOM 1230 O ALA A 85 -7.615 8.366 0.214 1.00 10.23 O ATOM 1231 CB ALA A 85 -8.815 6.044 2.346 1.00 14.43 C ATOM 0 H ALA A 85 -8.247 6.368 -0.640 1.00 30.32 H new ATOM 0 HA ALA A 85 -10.303 7.101 1.230 1.00 42.23 H new ATOM 0 HB1 ALA A 85 -8.959 6.632 3.253 1.00 14.43 H new ATOM 0 HB2 ALA A 85 -9.416 5.136 2.403 1.00 14.43 H new ATOM 0 HB3 ALA A 85 -7.763 5.777 2.250 1.00 14.43 H new ATOM 1237 N ASP A 86 -8.767 9.072 2.013 1.00 41.31 N ATOM 1238 CA ASP A 86 -8.097 10.367 2.071 1.00 63.22 C ATOM 1239 C ASP A 86 -6.588 10.192 2.208 1.00 21.53 C ATOM 1240 O ASP A 86 -6.118 9.283 2.895 1.00 65.22 O ATOM 1241 CB ASP A 86 -8.635 11.192 3.240 1.00 73.32 C ATOM 1242 CG ASP A 86 -10.129 11.432 3.139 1.00 41.53 C ATOM 1243 OD1 ASP A 86 -10.632 11.575 2.005 1.00 60.22 O ATOM 1244 OD2 ASP A 86 -10.796 11.479 4.194 1.00 22.22 O ATOM 0 H ASP A 86 -9.470 8.928 2.738 1.00 41.31 H new ATOM 0 HA ASP A 86 -8.301 10.896 1.140 1.00 63.22 H new ATOM 0 HB2 ASP A 86 -8.415 10.678 4.176 1.00 73.32 H new ATOM 0 HB3 ASP A 86 -8.117 12.151 3.273 1.00 73.32 H new ATOM 1249 N LEU A 87 -5.834 11.064 1.551 1.00 42.43 N ATOM 1250 CA LEU A 87 -4.377 11.006 1.599 1.00 45.33 C ATOM 1251 C LEU A 87 -3.874 11.113 3.035 1.00 51.15 C ATOM 1252 O LEU A 87 -2.901 10.462 3.413 1.00 41.12 O ATOM 1253 CB LEU A 87 -3.774 12.127 0.750 1.00 22.11 C ATOM 1254 CG LEU A 87 -2.247 12.220 0.747 1.00 32.33 C ATOM 1255 CD1 LEU A 87 -1.639 10.991 0.091 1.00 63.52 C ATOM 1256 CD2 LEU A 87 -1.791 13.487 0.038 1.00 4.25 C ATOM 0 H LEU A 87 -6.207 11.821 0.978 1.00 42.43 H new ATOM 0 HA LEU A 87 -4.063 10.044 1.195 1.00 45.33 H new ATOM 0 HB2 LEU A 87 -4.112 11.999 -0.278 1.00 22.11 H new ATOM 0 HB3 LEU A 87 -4.175 13.078 1.101 1.00 22.11 H new ATOM 0 HG LEU A 87 -1.903 12.262 1.780 1.00 32.33 H new ATOM 0 HD11 LEU A 87 -0.552 11.075 0.098 1.00 63.52 H new ATOM 0 HD12 LEU A 87 -1.938 10.099 0.642 1.00 63.52 H new ATOM 0 HD13 LEU A 87 -1.990 10.916 -0.938 1.00 63.52 H new ATOM 0 HD21 LEU A 87 -0.702 13.536 0.046 1.00 4.25 H new ATOM 0 HD22 LEU A 87 -2.147 13.475 -0.992 1.00 4.25 H new ATOM 0 HD23 LEU A 87 -2.197 14.358 0.552 1.00 4.25 H new ATOM 1268 N ALA A 88 -4.546 11.939 3.831 1.00 22.31 N ATOM 1269 CA ALA A 88 -4.171 12.128 5.226 1.00 25.45 C ATOM 1270 C ALA A 88 -4.183 10.803 5.983 1.00 42.41 C ATOM 1271 O ALA A 88 -3.324 10.551 6.829 1.00 74.33 O ATOM 1272 CB ALA A 88 -5.104 13.127 5.894 1.00 61.55 C ATOM 0 H ALA A 88 -5.353 12.487 3.533 1.00 22.31 H new ATOM 0 HA ALA A 88 -3.155 12.523 5.252 1.00 25.45 H new ATOM 0 HB1 ALA A 88 -4.811 13.258 6.936 1.00 61.55 H new ATOM 0 HB2 ALA A 88 -5.042 14.084 5.377 1.00 61.55 H new ATOM 0 HB3 ALA A 88 -6.128 12.755 5.849 1.00 61.55 H new ATOM 1278 N THR A 89 -5.162 9.959 5.673 1.00 61.12 N ATOM 1279 CA THR A 89 -5.286 8.661 6.324 1.00 70.43 C ATOM 1280 C THR A 89 -4.234 7.684 5.810 1.00 51.20 C ATOM 1281 O THR A 89 -3.748 6.833 6.555 1.00 62.04 O ATOM 1282 CB THR A 89 -6.685 8.054 6.104 1.00 64.25 C ATOM 1283 OG1 THR A 89 -7.681 8.891 6.700 1.00 33.32 O ATOM 1284 CG2 THR A 89 -6.767 6.655 6.697 1.00 14.31 C ATOM 0 H THR A 89 -5.881 10.151 4.975 1.00 61.12 H new ATOM 0 HA THR A 89 -5.133 8.827 7.390 1.00 70.43 H new ATOM 0 HB THR A 89 -6.864 7.987 5.031 1.00 64.25 H new ATOM 0 HG1 THR A 89 -8.567 8.499 6.554 1.00 33.32 H new ATOM 0 HG21 THR A 89 -7.764 6.247 6.530 1.00 14.31 H new ATOM 0 HG22 THR A 89 -6.027 6.013 6.219 1.00 14.31 H new ATOM 0 HG23 THR A 89 -6.569 6.702 7.768 1.00 14.31 H new ATOM 1292 N TRP A 90 -3.887 7.814 4.535 1.00 72.21 N ATOM 1293 CA TRP A 90 -2.891 6.942 3.922 1.00 3.14 C ATOM 1294 C TRP A 90 -1.507 7.202 4.506 1.00 2.02 C ATOM 1295 O TRP A 90 -0.827 6.277 4.947 1.00 41.22 O ATOM 1296 CB TRP A 90 -2.866 7.148 2.407 1.00 40.22 C ATOM 1297 CG TRP A 90 -3.965 6.422 1.691 1.00 2.30 C ATOM 1298 CD1 TRP A 90 -4.934 6.975 0.903 1.00 12.31 C ATOM 1299 CD2 TRP A 90 -4.207 5.012 1.698 1.00 14.00 C ATOM 1300 NE1 TRP A 90 -5.765 5.992 0.421 1.00 54.32 N ATOM 1301 CE2 TRP A 90 -5.340 4.779 0.893 1.00 23.42 C ATOM 1302 CE3 TRP A 90 -3.577 3.922 2.305 1.00 35.01 C ATOM 1303 CZ2 TRP A 90 -5.853 3.502 0.682 1.00 10.22 C ATOM 1304 CZ3 TRP A 90 -4.088 2.655 2.095 1.00 63.10 C ATOM 1305 CH2 TRP A 90 -5.217 2.454 1.288 1.00 24.51 C ATOM 0 H TRP A 90 -4.280 8.514 3.906 1.00 72.21 H new ATOM 0 HA TRP A 90 -3.167 5.910 4.136 1.00 3.14 H new ATOM 0 HB2 TRP A 90 -2.943 8.214 2.191 1.00 40.22 H new ATOM 0 HB3 TRP A 90 -1.905 6.813 2.018 1.00 40.22 H new ATOM 0 HD1 TRP A 90 -5.033 8.029 0.690 1.00 12.31 H new ATOM 0 HE1 TRP A 90 -6.568 6.142 -0.189 1.00 54.32 H new ATOM 0 HE3 TRP A 90 -2.706 4.067 2.927 1.00 35.01 H new ATOM 0 HZ2 TRP A 90 -6.723 3.345 0.061 1.00 10.22 H new ATOM 0 HZ3 TRP A 90 -3.610 1.806 2.560 1.00 63.10 H new ATOM 0 HH2 TRP A 90 -5.592 1.452 1.142 1.00 24.51 H new ATOM 1316 N GLN A 91 -1.097 8.467 4.505 1.00 73.51 N ATOM 1317 CA GLN A 91 0.207 8.847 5.035 1.00 73.22 C ATOM 1318 C GLN A 91 0.496 8.121 6.345 1.00 71.14 C ATOM 1319 O GLN A 91 1.620 7.685 6.588 1.00 64.03 O ATOM 1320 CB GLN A 91 0.271 10.359 5.252 1.00 14.33 C ATOM 1321 CG GLN A 91 0.091 11.166 3.976 1.00 11.05 C ATOM 1322 CD GLN A 91 1.360 11.879 3.552 1.00 14.12 C ATOM 1323 OE1 GLN A 91 2.028 12.517 4.367 1.00 41.43 O ATOM 1324 NE2 GLN A 91 1.698 11.776 2.272 1.00 30.22 N ATOM 0 H GLN A 91 -1.649 9.245 4.143 1.00 73.51 H new ATOM 0 HA GLN A 91 0.965 8.559 4.307 1.00 73.22 H new ATOM 0 HB2 GLN A 91 -0.500 10.648 5.966 1.00 14.33 H new ATOM 0 HB3 GLN A 91 1.232 10.613 5.700 1.00 14.33 H new ATOM 0 HG2 GLN A 91 -0.234 10.503 3.174 1.00 11.05 H new ATOM 0 HG3 GLN A 91 -0.701 11.900 4.124 1.00 11.05 H new ATOM 0 HE21 GLN A 91 1.115 11.237 1.632 1.00 30.22 H new ATOM 0 HE22 GLN A 91 2.541 12.236 1.929 1.00 30.22 H new ATOM 1333 N GLU A 92 -0.528 7.994 7.184 1.00 60.23 N ATOM 1334 CA GLU A 92 -0.382 7.321 8.469 1.00 51.42 C ATOM 1335 C GLU A 92 0.216 5.929 8.289 1.00 13.23 C ATOM 1336 O GLU A 92 1.298 5.636 8.797 1.00 10.15 O ATOM 1337 CB GLU A 92 -1.738 7.219 9.173 1.00 63.34 C ATOM 1338 CG GLU A 92 -2.534 8.513 9.148 1.00 75.42 C ATOM 1339 CD GLU A 92 -2.908 8.993 10.537 1.00 53.45 C ATOM 1340 OE1 GLU A 92 -2.083 9.688 11.165 1.00 54.03 O ATOM 1341 OE2 GLU A 92 -4.025 8.675 10.994 1.00 34.15 O ATOM 0 H GLU A 92 -1.466 8.348 6.997 1.00 60.23 H new ATOM 0 HA GLU A 92 0.296 7.912 9.085 1.00 51.42 H new ATOM 0 HB2 GLU A 92 -2.325 6.432 8.700 1.00 63.34 H new ATOM 0 HB3 GLU A 92 -1.579 6.920 10.209 1.00 63.34 H new ATOM 0 HG2 GLU A 92 -1.951 9.285 8.645 1.00 75.42 H new ATOM 0 HG3 GLU A 92 -3.441 8.366 8.562 1.00 75.42 H new ATOM 1348 N VAL A 93 -0.497 5.074 7.563 1.00 64.41 N ATOM 1349 CA VAL A 93 -0.037 3.712 7.315 1.00 53.21 C ATOM 1350 C VAL A 93 1.415 3.699 6.851 1.00 10.33 C ATOM 1351 O VAL A 93 2.178 2.793 7.190 1.00 42.20 O ATOM 1352 CB VAL A 93 -0.909 3.009 6.257 1.00 1.25 C ATOM 1353 CG1 VAL A 93 -0.389 1.607 5.984 1.00 62.10 C ATOM 1354 CG2 VAL A 93 -2.362 2.970 6.706 1.00 22.33 C ATOM 0 H VAL A 93 -1.395 5.300 7.136 1.00 64.41 H new ATOM 0 HA VAL A 93 -0.119 3.173 8.259 1.00 53.21 H new ATOM 0 HB VAL A 93 -0.855 3.578 5.329 1.00 1.25 H new ATOM 0 HG11 VAL A 93 -1.017 1.126 5.234 1.00 62.10 H new ATOM 0 HG12 VAL A 93 0.636 1.664 5.617 1.00 62.10 H new ATOM 0 HG13 VAL A 93 -0.412 1.025 6.905 1.00 62.10 H new ATOM 0 HG21 VAL A 93 -2.964 2.470 5.947 1.00 22.33 H new ATOM 0 HG22 VAL A 93 -2.438 2.424 7.647 1.00 22.33 H new ATOM 0 HG23 VAL A 93 -2.727 3.987 6.846 1.00 22.33 H new ATOM 1364 N LEU A 94 1.791 4.709 6.075 1.00 65.54 N ATOM 1365 CA LEU A 94 3.154 4.814 5.564 1.00 52.15 C ATOM 1366 C LEU A 94 4.090 5.386 6.624 1.00 42.35 C ATOM 1367 O LEU A 94 5.306 5.211 6.550 1.00 5.43 O ATOM 1368 CB LEU A 94 3.184 5.692 4.312 1.00 14.32 C ATOM 1369 CG LEU A 94 3.850 5.081 3.079 1.00 52.31 C ATOM 1370 CD1 LEU A 94 5.333 4.859 3.328 1.00 23.32 C ATOM 1371 CD2 LEU A 94 3.169 3.775 2.697 1.00 15.41 C ATOM 0 H LEU A 94 1.172 5.467 5.786 1.00 65.54 H new ATOM 0 HA LEU A 94 3.497 3.812 5.305 1.00 52.15 H new ATOM 0 HB2 LEU A 94 2.159 5.956 4.053 1.00 14.32 H new ATOM 0 HB3 LEU A 94 3.700 6.621 4.556 1.00 14.32 H new ATOM 0 HG LEU A 94 3.743 5.779 2.249 1.00 52.31 H new ATOM 0 HD11 LEU A 94 5.790 4.424 2.439 1.00 23.32 H new ATOM 0 HD12 LEU A 94 5.811 5.813 3.552 1.00 23.32 H new ATOM 0 HD13 LEU A 94 5.463 4.181 4.172 1.00 23.32 H new ATOM 0 HD21 LEU A 94 3.656 3.354 1.817 1.00 15.41 H new ATOM 0 HD22 LEU A 94 3.243 3.070 3.525 1.00 15.41 H new ATOM 0 HD23 LEU A 94 2.119 3.964 2.475 1.00 15.41 H new ATOM 1383 N GLU A 95 3.515 6.069 7.608 1.00 20.21 N ATOM 1384 CA GLU A 95 4.298 6.666 8.683 1.00 60.11 C ATOM 1385 C GLU A 95 4.704 5.612 9.709 1.00 22.44 C ATOM 1386 O GLU A 95 5.603 5.833 10.520 1.00 2.04 O ATOM 1387 CB GLU A 95 3.503 7.780 9.366 1.00 32.43 C ATOM 1388 CG GLU A 95 3.499 9.088 8.594 1.00 51.03 C ATOM 1389 CD GLU A 95 3.997 10.256 9.421 1.00 40.42 C ATOM 1390 OE1 GLU A 95 3.235 10.740 10.285 1.00 65.40 O ATOM 1391 OE2 GLU A 95 5.149 10.688 9.205 1.00 71.34 O ATOM 0 H GLU A 95 2.509 6.223 7.683 1.00 20.21 H new ATOM 0 HA GLU A 95 5.202 7.091 8.247 1.00 60.11 H new ATOM 0 HB2 GLU A 95 2.474 7.447 9.505 1.00 32.43 H new ATOM 0 HB3 GLU A 95 3.919 7.955 10.358 1.00 32.43 H new ATOM 0 HG2 GLU A 95 4.124 8.984 7.707 1.00 51.03 H new ATOM 0 HG3 GLU A 95 2.487 9.298 8.248 1.00 51.03 H new ATOM 1398 N GLY A 96 4.034 4.465 9.669 1.00 74.45 N ATOM 1399 CA GLY A 96 4.338 3.394 10.599 1.00 14.23 C ATOM 1400 C GLY A 96 3.497 3.465 11.859 1.00 62.41 C ATOM 1401 O GLY A 96 3.714 2.703 12.802 1.00 54.41 O ATOM 0 H GLY A 96 3.285 4.258 9.008 1.00 74.45 H new ATOM 0 HA2 GLY A 96 4.174 2.434 10.110 1.00 14.23 H new ATOM 0 HA3 GLY A 96 5.394 3.438 10.867 1.00 14.23 H new ATOM 1405 N ARG A 97 2.537 4.384 11.876 1.00 34.33 N ATOM 1406 CA ARG A 97 1.664 4.553 13.031 1.00 13.53 C ATOM 1407 C ARG A 97 0.322 3.862 12.804 1.00 31.25 C ATOM 1408 O ARG A 97 -0.311 3.387 13.749 1.00 63.43 O ATOM 1409 CB ARG A 97 1.441 6.040 13.316 1.00 64.04 C ATOM 1410 CG ARG A 97 2.722 6.800 13.618 1.00 54.04 C ATOM 1411 CD ARG A 97 2.931 6.968 15.115 1.00 75.13 C ATOM 1412 NE ARG A 97 3.051 8.372 15.497 1.00 51.02 N ATOM 1413 CZ ARG A 97 3.485 8.776 16.685 1.00 22.52 C ATOM 1414 NH1 ARG A 97 3.840 7.886 17.602 1.00 12.55 N ATOM 1415 NH2 ARG A 97 3.567 10.072 16.959 1.00 71.12 N ATOM 0 H ARG A 97 2.344 5.022 11.104 1.00 34.33 H new ATOM 0 HA ARG A 97 2.150 4.093 13.892 1.00 13.53 H new ATOM 0 HB2 ARG A 97 0.951 6.497 12.456 1.00 64.04 H new ATOM 0 HB3 ARG A 97 0.760 6.141 14.161 1.00 64.04 H new ATOM 0 HG2 ARG A 97 3.571 6.269 13.188 1.00 54.04 H new ATOM 0 HG3 ARG A 97 2.685 7.780 13.142 1.00 54.04 H new ATOM 0 HD2 ARG A 97 2.096 6.517 15.650 1.00 75.13 H new ATOM 0 HD3 ARG A 97 3.830 6.432 15.418 1.00 75.13 H new ATOM 0 HE ARG A 97 2.787 9.082 14.814 1.00 51.02 H new ATOM 0 HH11 ARG A 97 3.780 6.889 17.395 1.00 12.55 H new ATOM 0 HH12 ARG A 97 4.173 8.199 18.514 1.00 12.55 H new ATOM 0 HH21 ARG A 97 3.296 10.760 16.256 1.00 71.12 H new ATOM 0 HH22 ARG A 97 3.901 10.380 17.872 1.00 71.12 H new ATOM 1429 N LEU A 98 -0.106 3.810 11.548 1.00 1.24 N ATOM 1430 CA LEU A 98 -1.372 3.178 11.197 1.00 32.01 C ATOM 1431 C LEU A 98 -1.140 1.906 10.387 1.00 22.30 C ATOM 1432 O LEU A 98 -0.022 1.633 9.951 1.00 33.11 O ATOM 1433 CB LEU A 98 -2.248 4.149 10.402 1.00 2.30 C ATOM 1434 CG LEU A 98 -3.306 4.908 11.204 1.00 44.25 C ATOM 1435 CD1 LEU A 98 -4.484 4.002 11.526 1.00 62.41 C ATOM 1436 CD2 LEU A 98 -2.702 5.475 12.481 1.00 53.42 C ATOM 0 H LEU A 98 0.405 4.198 10.755 1.00 1.24 H new ATOM 0 HA LEU A 98 -1.884 2.910 12.122 1.00 32.01 H new ATOM 0 HB2 LEU A 98 -1.599 4.877 9.914 1.00 2.30 H new ATOM 0 HB3 LEU A 98 -2.751 3.590 9.612 1.00 2.30 H new ATOM 0 HG LEU A 98 -3.668 5.738 10.597 1.00 44.25 H new ATOM 0 HD11 LEU A 98 -5.226 4.560 12.097 1.00 62.41 H new ATOM 0 HD12 LEU A 98 -4.932 3.645 10.599 1.00 62.41 H new ATOM 0 HD13 LEU A 98 -4.139 3.151 12.113 1.00 62.41 H new ATOM 0 HD21 LEU A 98 -3.469 6.012 13.039 1.00 53.42 H new ATOM 0 HD22 LEU A 98 -2.312 4.661 13.092 1.00 53.42 H new ATOM 0 HD23 LEU A 98 -1.892 6.159 12.228 1.00 53.42 H new ATOM 1448 N GLU A 99 -2.204 1.135 10.187 1.00 23.22 N ATOM 1449 CA GLU A 99 -2.115 -0.107 9.428 1.00 4.32 C ATOM 1450 C GLU A 99 -3.091 -0.100 8.256 1.00 51.44 C ATOM 1451 O GLU A 99 -4.179 0.473 8.325 1.00 14.32 O ATOM 1452 CB GLU A 99 -2.397 -1.307 10.335 1.00 53.33 C ATOM 1453 CG GLU A 99 -1.149 -2.075 10.736 1.00 72.00 C ATOM 1454 CD GLU A 99 -0.662 -1.712 12.125 1.00 11.13 C ATOM 1455 OE1 GLU A 99 -1.442 -1.870 13.088 1.00 41.32 O ATOM 1456 OE2 GLU A 99 0.499 -1.270 12.249 1.00 13.34 O ATOM 0 H GLU A 99 -3.137 1.348 10.540 1.00 23.22 H new ATOM 0 HA GLU A 99 -1.102 -0.190 9.034 1.00 4.32 H new ATOM 0 HB2 GLU A 99 -2.904 -0.960 11.235 1.00 53.33 H new ATOM 0 HB3 GLU A 99 -3.082 -1.984 9.824 1.00 53.33 H new ATOM 0 HG2 GLU A 99 -1.356 -3.144 10.696 1.00 72.00 H new ATOM 0 HG3 GLU A 99 -0.357 -1.876 10.014 1.00 72.00 H new ATOM 1463 N PRO A 100 -2.695 -0.751 7.152 1.00 40.42 N ATOM 1464 CA PRO A 100 -3.521 -0.834 5.943 1.00 63.12 C ATOM 1465 C PRO A 100 -4.750 -1.715 6.140 1.00 52.32 C ATOM 1466 O PRO A 100 -5.811 -1.452 5.573 1.00 72.02 O ATOM 1467 CB PRO A 100 -2.576 -1.456 4.911 1.00 33.04 C ATOM 1468 CG PRO A 100 -1.586 -2.223 5.718 1.00 34.42 C ATOM 1469 CD PRO A 100 -1.411 -1.456 6.999 1.00 55.42 C ATOM 0 HA PRO A 100 -3.914 0.139 5.649 1.00 63.12 H new ATOM 0 HB2 PRO A 100 -3.115 -2.107 4.222 1.00 33.04 H new ATOM 0 HB3 PRO A 100 -2.088 -0.690 4.309 1.00 33.04 H new ATOM 0 HG2 PRO A 100 -1.943 -3.234 5.914 1.00 34.42 H new ATOM 0 HG3 PRO A 100 -0.639 -2.317 5.187 1.00 34.42 H new ATOM 0 HD2 PRO A 100 -1.214 -2.120 7.841 1.00 55.42 H new ATOM 0 HD3 PRO A 100 -0.575 -0.760 6.939 1.00 55.42 H new ATOM 1477 N LEU A 101 -4.601 -2.759 6.946 1.00 5.34 N ATOM 1478 CA LEU A 101 -5.699 -3.679 7.219 1.00 53.42 C ATOM 1479 C LEU A 101 -6.536 -3.193 8.399 1.00 72.31 C ATOM 1480 O LEU A 101 -7.753 -3.376 8.425 1.00 3.34 O ATOM 1481 CB LEU A 101 -5.158 -5.081 7.505 1.00 11.24 C ATOM 1482 CG LEU A 101 -4.888 -5.959 6.284 1.00 42.34 C ATOM 1483 CD1 LEU A 101 -6.187 -6.533 5.740 1.00 10.45 C ATOM 1484 CD2 LEU A 101 -4.162 -5.164 5.206 1.00 24.43 C ATOM 0 H LEU A 101 -3.729 -2.990 7.423 1.00 5.34 H new ATOM 0 HA LEU A 101 -6.337 -3.717 6.336 1.00 53.42 H new ATOM 0 HB2 LEU A 101 -4.230 -4.982 8.069 1.00 11.24 H new ATOM 0 HB3 LEU A 101 -5.869 -5.598 8.149 1.00 11.24 H new ATOM 0 HG LEU A 101 -4.249 -6.787 6.591 1.00 42.34 H new ATOM 0 HD11 LEU A 101 -5.974 -7.155 4.871 1.00 10.45 H new ATOM 0 HD12 LEU A 101 -6.668 -7.137 6.509 1.00 10.45 H new ATOM 0 HD13 LEU A 101 -6.851 -5.719 5.449 1.00 10.45 H new ATOM 0 HD21 LEU A 101 -3.978 -5.805 4.344 1.00 24.43 H new ATOM 0 HD22 LEU A 101 -4.776 -4.316 4.903 1.00 24.43 H new ATOM 0 HD23 LEU A 101 -3.212 -4.802 5.599 1.00 24.43 H new ATOM 1496 N SER A 102 -5.875 -2.573 9.370 1.00 33.14 N ATOM 1497 CA SER A 102 -6.558 -2.062 10.554 1.00 72.11 C ATOM 1498 C SER A 102 -7.381 -0.824 10.214 1.00 74.42 C ATOM 1499 O SER A 102 -8.556 -0.729 10.569 1.00 62.32 O ATOM 1500 CB SER A 102 -5.544 -1.730 11.650 1.00 42.53 C ATOM 1501 OG SER A 102 -6.134 -1.817 12.935 1.00 74.34 O ATOM 0 H SER A 102 -4.868 -2.412 9.361 1.00 33.14 H new ATOM 0 HA SER A 102 -7.233 -2.837 10.917 1.00 72.11 H new ATOM 0 HB2 SER A 102 -4.699 -2.416 11.587 1.00 42.53 H new ATOM 0 HB3 SER A 102 -5.151 -0.725 11.494 1.00 42.53 H new ATOM 0 HG SER A 102 -5.465 -1.602 13.618 1.00 74.34 H new ATOM 1507 N ALA A 103 -6.757 0.124 9.523 1.00 24.22 N ATOM 1508 CA ALA A 103 -7.430 1.355 9.133 1.00 51.25 C ATOM 1509 C ALA A 103 -8.696 1.060 8.334 1.00 22.32 C ATOM 1510 O ALA A 103 -9.719 1.723 8.506 1.00 14.14 O ATOM 1511 CB ALA A 103 -6.490 2.239 8.325 1.00 30.14 C ATOM 0 H ALA A 103 -5.785 0.062 9.222 1.00 24.22 H new ATOM 0 HA ALA A 103 -7.719 1.884 10.041 1.00 51.25 H new ATOM 0 HB1 ALA A 103 -7.007 3.155 8.041 1.00 30.14 H new ATOM 0 HB2 ALA A 103 -5.616 2.487 8.928 1.00 30.14 H new ATOM 0 HB3 ALA A 103 -6.173 1.708 7.428 1.00 30.14 H new ATOM 1517 N LEU A 104 -8.619 0.060 7.462 1.00 53.54 N ATOM 1518 CA LEU A 104 -9.759 -0.323 6.636 1.00 20.34 C ATOM 1519 C LEU A 104 -10.818 -1.039 7.468 1.00 13.14 C ATOM 1520 O LEU A 104 -12.004 -1.009 7.141 1.00 23.42 O ATOM 1521 CB LEU A 104 -9.302 -1.224 5.488 1.00 43.43 C ATOM 1522 CG LEU A 104 -9.420 -2.729 5.728 1.00 72.35 C ATOM 1523 CD1 LEU A 104 -10.856 -3.190 5.531 1.00 54.20 C ATOM 1524 CD2 LEU A 104 -8.482 -3.492 4.804 1.00 61.43 C ATOM 0 H LEU A 104 -7.780 -0.500 7.309 1.00 53.54 H new ATOM 0 HA LEU A 104 -10.199 0.585 6.224 1.00 20.34 H new ATOM 0 HB2 LEU A 104 -9.883 -0.971 4.601 1.00 43.43 H new ATOM 0 HB3 LEU A 104 -8.261 -0.993 5.264 1.00 43.43 H new ATOM 0 HG LEU A 104 -9.131 -2.937 6.758 1.00 72.35 H new ATOM 0 HD11 LEU A 104 -10.921 -4.264 5.706 1.00 54.20 H new ATOM 0 HD12 LEU A 104 -11.505 -2.668 6.234 1.00 54.20 H new ATOM 0 HD13 LEU A 104 -11.173 -2.969 4.512 1.00 54.20 H new ATOM 0 HD21 LEU A 104 -8.580 -4.562 4.989 1.00 61.43 H new ATOM 0 HD22 LEU A 104 -8.740 -3.278 3.767 1.00 61.43 H new ATOM 0 HD23 LEU A 104 -7.454 -3.183 4.994 1.00 61.43 H new ATOM 1536 N MET A 105 -10.381 -1.680 8.548 1.00 12.22 N ATOM 1537 CA MET A 105 -11.292 -2.401 9.430 1.00 53.31 C ATOM 1538 C MET A 105 -11.891 -1.465 10.476 1.00 43.05 C ATOM 1539 O MET A 105 -12.993 -1.697 10.971 1.00 73.42 O ATOM 1540 CB MET A 105 -10.563 -3.556 10.118 1.00 10.53 C ATOM 1541 CG MET A 105 -10.517 -4.827 9.288 1.00 44.30 C ATOM 1542 SD MET A 105 -11.191 -6.253 10.162 1.00 1.32 S ATOM 1543 CE MET A 105 -12.874 -6.258 9.552 1.00 34.12 C ATOM 0 H MET A 105 -9.402 -1.715 8.833 1.00 12.22 H new ATOM 0 HA MET A 105 -12.103 -2.804 8.823 1.00 53.31 H new ATOM 0 HB2 MET A 105 -9.544 -3.245 10.348 1.00 10.53 H new ATOM 0 HB3 MET A 105 -11.053 -3.770 11.068 1.00 10.53 H new ATOM 0 HG2 MET A 105 -11.076 -4.674 8.365 1.00 44.30 H new ATOM 0 HG3 MET A 105 -9.485 -5.034 9.005 1.00 44.30 H new ATOM 0 HE1 MET A 105 -13.506 -6.827 10.233 1.00 34.12 H new ATOM 0 HE2 MET A 105 -13.241 -5.234 9.487 1.00 34.12 H new ATOM 0 HE3 MET A 105 -12.901 -6.716 8.563 1.00 34.12 H new ATOM 1553 N ARG A 106 -11.156 -0.407 10.805 1.00 33.35 N ATOM 1554 CA ARG A 106 -11.615 0.562 11.794 1.00 52.05 C ATOM 1555 C ARG A 106 -12.642 1.513 11.187 1.00 73.40 C ATOM 1556 O ARG A 106 -13.409 2.154 11.904 1.00 60.03 O ATOM 1557 CB ARG A 106 -10.431 1.358 12.345 1.00 1.11 C ATOM 1558 CG ARG A 106 -9.554 0.565 13.300 1.00 33.25 C ATOM 1559 CD ARG A 106 -8.497 1.445 13.948 1.00 2.02 C ATOM 1560 NE ARG A 106 -9.089 2.531 14.724 1.00 52.55 N ATOM 1561 CZ ARG A 106 -9.446 3.699 14.199 1.00 44.12 C ATOM 1562 NH1 ARG A 106 -9.271 3.929 12.905 1.00 12.21 N ATOM 1563 NH2 ARG A 106 -9.978 4.638 14.970 1.00 53.24 N ATOM 0 H ARG A 106 -10.242 -0.199 10.402 1.00 33.35 H new ATOM 0 HA ARG A 106 -12.089 0.016 12.610 1.00 52.05 H new ATOM 0 HB2 ARG A 106 -9.821 1.709 11.512 1.00 1.11 H new ATOM 0 HB3 ARG A 106 -10.807 2.242 12.860 1.00 1.11 H new ATOM 0 HG2 ARG A 106 -10.174 0.111 14.073 1.00 33.25 H new ATOM 0 HG3 ARG A 106 -9.070 -0.249 12.760 1.00 33.25 H new ATOM 0 HD2 ARG A 106 -7.868 0.837 14.598 1.00 2.02 H new ATOM 0 HD3 ARG A 106 -7.850 1.862 13.176 1.00 2.02 H new ATOM 0 HE ARG A 106 -9.237 2.386 15.723 1.00 52.55 H new ATOM 0 HH11 ARG A 106 -8.862 3.209 12.310 1.00 12.21 H new ATOM 0 HH12 ARG A 106 -9.546 4.826 12.505 1.00 12.21 H new ATOM 0 HH21 ARG A 106 -10.113 4.464 15.966 1.00 53.24 H new ATOM 0 HH22 ARG A 106 -10.252 5.534 14.567 1.00 53.24 H new ATOM 1577 N GLY A 107 -12.652 1.597 9.860 1.00 45.34 N ATOM 1578 CA GLY A 107 -13.588 2.472 9.180 1.00 52.44 C ATOM 1579 C GLY A 107 -12.907 3.665 8.539 1.00 61.22 C ATOM 1580 O GLY A 107 -13.571 4.591 8.070 1.00 61.12 O ATOM 0 H GLY A 107 -12.029 1.075 9.244 1.00 45.34 H new ATOM 0 HA2 GLY A 107 -14.119 1.906 8.414 1.00 52.44 H new ATOM 0 HA3 GLY A 107 -14.335 2.823 9.892 1.00 52.44 H new ATOM 1584 N LEU A 108 -11.579 3.647 8.520 1.00 33.55 N ATOM 1585 CA LEU A 108 -10.806 4.736 7.934 1.00 14.32 C ATOM 1586 C LEU A 108 -10.763 4.616 6.414 1.00 23.42 C ATOM 1587 O LEU A 108 -11.113 5.553 5.696 1.00 72.24 O ATOM 1588 CB LEU A 108 -9.385 4.741 8.498 1.00 30.24 C ATOM 1589 CG LEU A 108 -9.262 4.964 10.006 1.00 30.13 C ATOM 1590 CD1 LEU A 108 -7.811 4.849 10.446 1.00 13.22 C ATOM 1591 CD2 LEU A 108 -9.833 6.321 10.393 1.00 34.32 C ATOM 0 H LEU A 108 -11.015 2.889 8.904 1.00 33.55 H new ATOM 0 HA LEU A 108 -11.295 5.676 8.192 1.00 14.32 H new ATOM 0 HB2 LEU A 108 -8.915 3.789 8.252 1.00 30.24 H new ATOM 0 HB3 LEU A 108 -8.816 5.519 7.988 1.00 30.24 H new ATOM 0 HG LEU A 108 -9.837 4.191 10.516 1.00 30.13 H new ATOM 0 HD11 LEU A 108 -7.743 5.011 11.522 1.00 13.22 H new ATOM 0 HD12 LEU A 108 -7.435 3.855 10.204 1.00 13.22 H new ATOM 0 HD13 LEU A 108 -7.213 5.599 9.928 1.00 13.22 H new ATOM 0 HD21 LEU A 108 -9.737 6.463 11.470 1.00 34.32 H new ATOM 0 HD22 LEU A 108 -9.286 7.108 9.873 1.00 34.32 H new ATOM 0 HD23 LEU A 108 -10.886 6.366 10.114 1.00 34.32 H new ATOM 1603 N LEU A 109 -10.331 3.457 5.930 1.00 22.42 N ATOM 1604 CA LEU A 109 -10.243 3.212 4.494 1.00 2.10 C ATOM 1605 C LEU A 109 -11.531 2.587 3.968 1.00 31.24 C ATOM 1606 O LEU A 109 -12.539 2.535 4.673 1.00 44.32 O ATOM 1607 CB LEU A 109 -9.056 2.298 4.185 1.00 62.50 C ATOM 1608 CG LEU A 109 -7.699 2.753 4.725 1.00 15.23 C ATOM 1609 CD1 LEU A 109 -6.830 1.553 5.066 1.00 31.51 C ATOM 1610 CD2 LEU A 109 -6.999 3.652 3.717 1.00 3.32 C ATOM 0 H LEU A 109 -10.036 2.672 6.510 1.00 22.42 H new ATOM 0 HA LEU A 109 -10.096 4.170 3.995 1.00 2.10 H new ATOM 0 HB2 LEU A 109 -9.271 1.308 4.587 1.00 62.50 H new ATOM 0 HB3 LEU A 109 -8.977 2.192 3.103 1.00 62.50 H new ATOM 0 HG LEU A 109 -7.866 3.325 5.638 1.00 15.23 H new ATOM 0 HD11 LEU A 109 -5.869 1.897 5.448 1.00 31.51 H new ATOM 0 HD12 LEU A 109 -7.327 0.948 5.824 1.00 31.51 H new ATOM 0 HD13 LEU A 109 -6.670 0.953 4.170 1.00 31.51 H new ATOM 0 HD21 LEU A 109 -6.035 3.966 4.118 1.00 3.32 H new ATOM 0 HD22 LEU A 109 -6.844 3.105 2.787 1.00 3.32 H new ATOM 0 HD23 LEU A 109 -7.615 4.530 3.523 1.00 3.32 H new ATOM 1622 N GLU A 110 -11.489 2.112 2.727 1.00 1.13 N ATOM 1623 CA GLU A 110 -12.653 1.489 2.108 1.00 12.14 C ATOM 1624 C GLU A 110 -12.247 0.671 0.886 1.00 10.20 C ATOM 1625 O GLU A 110 -11.547 1.164 0.000 1.00 53.43 O ATOM 1626 CB GLU A 110 -13.675 2.554 1.706 1.00 35.34 C ATOM 1627 CG GLU A 110 -15.105 2.041 1.670 1.00 34.10 C ATOM 1628 CD GLU A 110 -16.124 3.160 1.563 1.00 3.02 C ATOM 1629 OE1 GLU A 110 -15.881 4.241 2.138 1.00 25.00 O ATOM 1630 OE2 GLU A 110 -17.163 2.954 0.902 1.00 63.33 O ATOM 0 H GLU A 110 -10.662 2.147 2.131 1.00 1.13 H new ATOM 0 HA GLU A 110 -13.106 0.818 2.838 1.00 12.14 H new ATOM 0 HB2 GLU A 110 -13.614 3.387 2.406 1.00 35.34 H new ATOM 0 HB3 GLU A 110 -13.413 2.945 0.723 1.00 35.34 H new ATOM 0 HG2 GLU A 110 -15.223 1.365 0.823 1.00 34.10 H new ATOM 0 HG3 GLU A 110 -15.302 1.461 2.571 1.00 34.10 H new ATOM 1637 N LEU A 111 -12.689 -0.581 0.846 1.00 45.13 N ATOM 1638 CA LEU A 111 -12.371 -1.469 -0.268 1.00 32.20 C ATOM 1639 C LEU A 111 -13.475 -1.438 -1.320 1.00 32.54 C ATOM 1640 O LEU A 111 -14.566 -1.969 -1.107 1.00 22.00 O ATOM 1641 CB LEU A 111 -12.171 -2.899 0.237 1.00 73.14 C ATOM 1642 CG LEU A 111 -11.608 -3.896 -0.778 1.00 2.52 C ATOM 1643 CD1 LEU A 111 -10.116 -3.674 -0.971 1.00 72.31 C ATOM 1644 CD2 LEU A 111 -11.885 -5.324 -0.333 1.00 24.23 C ATOM 0 H LEU A 111 -13.268 -1.004 1.571 1.00 45.13 H new ATOM 0 HA LEU A 111 -11.447 -1.120 -0.728 1.00 32.20 H new ATOM 0 HB2 LEU A 111 -11.502 -2.869 1.097 1.00 73.14 H new ATOM 0 HB3 LEU A 111 -13.130 -3.275 0.592 1.00 73.14 H new ATOM 0 HG LEU A 111 -12.105 -3.733 -1.734 1.00 2.52 H new ATOM 0 HD11 LEU A 111 -9.732 -4.392 -1.696 1.00 72.31 H new ATOM 0 HD12 LEU A 111 -9.943 -2.662 -1.336 1.00 72.31 H new ATOM 0 HD13 LEU A 111 -9.602 -3.809 -0.019 1.00 72.31 H new ATOM 0 HD21 LEU A 111 -11.478 -6.019 -1.067 1.00 24.23 H new ATOM 0 HD22 LEU A 111 -11.415 -5.501 0.635 1.00 24.23 H new ATOM 0 HD23 LEU A 111 -12.961 -5.476 -0.247 1.00 24.23 H new ATOM 1656 N LYS A 112 -13.184 -0.816 -2.457 1.00 14.51 N ATOM 1657 CA LYS A 112 -14.150 -0.718 -3.546 1.00 24.15 C ATOM 1658 C LYS A 112 -14.271 -2.046 -4.286 1.00 11.04 C ATOM 1659 O LYS A 112 -15.374 -2.529 -4.541 1.00 54.41 O ATOM 1660 CB LYS A 112 -13.739 0.386 -4.522 1.00 2.34 C ATOM 1661 CG LYS A 112 -14.011 1.788 -4.003 1.00 64.02 C ATOM 1662 CD LYS A 112 -15.061 2.498 -4.841 1.00 40.32 C ATOM 1663 CE LYS A 112 -14.432 3.251 -6.003 1.00 43.41 C ATOM 1664 NZ LYS A 112 -15.186 4.491 -6.334 1.00 51.41 N ATOM 0 H LYS A 112 -12.286 -0.372 -2.649 1.00 14.51 H new ATOM 0 HA LYS A 112 -15.121 -0.471 -3.116 1.00 24.15 H new ATOM 0 HB2 LYS A 112 -12.676 0.289 -4.741 1.00 2.34 H new ATOM 0 HB3 LYS A 112 -14.272 0.246 -5.462 1.00 2.34 H new ATOM 0 HG2 LYS A 112 -14.346 1.735 -2.967 1.00 64.02 H new ATOM 0 HG3 LYS A 112 -13.087 2.366 -4.010 1.00 64.02 H new ATOM 0 HD2 LYS A 112 -15.777 1.770 -5.223 1.00 40.32 H new ATOM 0 HD3 LYS A 112 -15.618 3.194 -4.214 1.00 40.32 H new ATOM 0 HE2 LYS A 112 -13.402 3.508 -5.754 1.00 43.41 H new ATOM 0 HE3 LYS A 112 -14.396 2.603 -6.879 1.00 43.41 H new ATOM 0 HZ1 LYS A 112 -14.725 4.975 -7.131 1.00 51.41 H new ATOM 0 HZ2 LYS A 112 -16.162 4.244 -6.596 1.00 51.41 H new ATOM 0 HZ3 LYS A 112 -15.198 5.121 -5.507 1.00 51.41 H new ATOM 1678 N LYS A 113 -13.129 -2.634 -4.627 1.00 74.45 N ATOM 1679 CA LYS A 113 -13.108 -3.908 -5.336 1.00 31.15 C ATOM 1680 C LYS A 113 -12.920 -5.069 -4.363 1.00 72.13 C ATOM 1681 O LYS A 113 -13.230 -4.954 -3.177 1.00 44.14 O ATOM 1682 CB LYS A 113 -11.987 -3.917 -6.377 1.00 4.11 C ATOM 1683 CG LYS A 113 -12.336 -4.682 -7.641 1.00 2.30 C ATOM 1684 CD LYS A 113 -12.010 -3.877 -8.888 1.00 71.01 C ATOM 1685 CE LYS A 113 -13.100 -4.013 -9.940 1.00 40.00 C ATOM 1686 NZ LYS A 113 -13.217 -2.788 -10.778 1.00 53.41 N ATOM 0 H LYS A 113 -12.207 -2.249 -4.424 1.00 74.45 H new ATOM 0 HA LYS A 113 -14.066 -4.030 -5.841 1.00 31.15 H new ATOM 0 HB2 LYS A 113 -11.740 -2.889 -6.641 1.00 4.11 H new ATOM 0 HB3 LYS A 113 -11.093 -4.355 -5.932 1.00 4.11 H new ATOM 0 HG2 LYS A 113 -11.787 -5.623 -7.661 1.00 2.30 H new ATOM 0 HG3 LYS A 113 -13.397 -4.932 -7.635 1.00 2.30 H new ATOM 0 HD2 LYS A 113 -11.888 -2.827 -8.623 1.00 71.01 H new ATOM 0 HD3 LYS A 113 -11.060 -4.214 -9.302 1.00 71.01 H new ATOM 0 HE2 LYS A 113 -12.884 -4.870 -10.578 1.00 40.00 H new ATOM 0 HE3 LYS A 113 -14.054 -4.211 -9.451 1.00 40.00 H new ATOM 0 HZ1 LYS A 113 -13.970 -2.920 -11.483 1.00 53.41 H new ATOM 0 HZ2 LYS A 113 -13.448 -1.974 -10.173 1.00 53.41 H new ATOM 0 HZ3 LYS A 113 -12.315 -2.613 -11.265 1.00 53.41 H new ATOM 1700 N GLY A 114 -12.412 -6.186 -4.873 1.00 23.24 N ATOM 1701 CA GLY A 114 -12.191 -7.351 -4.034 1.00 52.43 C ATOM 1702 C GLY A 114 -13.246 -7.497 -2.957 1.00 20.24 C ATOM 1703 O GLY A 114 -14.409 -7.148 -3.163 1.00 60.31 O ATOM 0 H GLY A 114 -12.149 -6.306 -5.851 1.00 23.24 H new ATOM 0 HA2 GLY A 114 -12.184 -8.247 -4.655 1.00 52.43 H new ATOM 0 HA3 GLY A 114 -11.208 -7.279 -3.568 1.00 52.43 H new ATOM 1707 N THR A 115 -12.842 -8.016 -1.801 1.00 11.45 N ATOM 1708 CA THR A 115 -13.761 -8.211 -0.687 1.00 14.51 C ATOM 1709 C THR A 115 -13.018 -8.224 0.644 1.00 41.44 C ATOM 1710 O THR A 115 -11.905 -8.743 0.739 1.00 55.23 O ATOM 1711 CB THR A 115 -14.551 -9.525 -0.834 1.00 2.21 C ATOM 1712 OG1 THR A 115 -15.404 -9.713 0.301 1.00 31.22 O ATOM 1713 CG2 THR A 115 -13.608 -10.711 -0.967 1.00 61.25 C ATOM 0 H THR A 115 -11.883 -8.309 -1.612 1.00 11.45 H new ATOM 0 HA THR A 115 -14.458 -7.373 -0.702 1.00 14.51 H new ATOM 0 HB THR A 115 -15.157 -9.460 -1.737 1.00 2.21 H new ATOM 0 HG1 THR A 115 -15.904 -10.550 0.199 1.00 31.22 H new ATOM 0 HG21 THR A 115 -14.189 -11.628 -1.070 1.00 61.25 H new ATOM 0 HG22 THR A 115 -12.979 -10.579 -1.848 1.00 61.25 H new ATOM 0 HG23 THR A 115 -12.979 -10.777 -0.079 1.00 61.25 H new ATOM 1721 N ILE A 116 -13.639 -7.651 1.669 1.00 12.01 N ATOM 1722 CA ILE A 116 -13.036 -7.599 2.995 1.00 5.13 C ATOM 1723 C ILE A 116 -12.895 -8.996 3.590 1.00 44.02 C ATOM 1724 O ILE A 116 -11.949 -9.276 4.326 1.00 1.53 O ATOM 1725 CB ILE A 116 -13.862 -6.726 3.957 1.00 54.24 C ATOM 1726 CG1 ILE A 116 -13.106 -6.517 5.270 1.00 61.30 C ATOM 1727 CG2 ILE A 116 -15.219 -7.362 4.215 1.00 74.20 C ATOM 1728 CD1 ILE A 116 -13.411 -5.196 5.939 1.00 20.04 C ATOM 0 H ILE A 116 -14.560 -7.216 1.607 1.00 12.01 H new ATOM 0 HA ILE A 116 -12.048 -7.156 2.874 1.00 5.13 H new ATOM 0 HB ILE A 116 -14.021 -5.752 3.494 1.00 54.24 H new ATOM 0 HG12 ILE A 116 -13.353 -7.328 5.955 1.00 61.30 H new ATOM 0 HG13 ILE A 116 -12.035 -6.579 5.077 1.00 61.30 H new ATOM 0 HG21 ILE A 116 -15.792 -6.733 4.897 1.00 74.20 H new ATOM 0 HG22 ILE A 116 -15.759 -7.462 3.273 1.00 74.20 H new ATOM 0 HG23 ILE A 116 -15.080 -8.347 4.660 1.00 74.20 H new ATOM 0 HD11 ILE A 116 -12.840 -5.116 6.864 1.00 20.04 H new ATOM 0 HD12 ILE A 116 -13.137 -4.379 5.272 1.00 20.04 H new ATOM 0 HD13 ILE A 116 -14.476 -5.139 6.164 1.00 20.04 H new ATOM 1740 N ALA A 117 -13.839 -9.871 3.262 1.00 15.10 N ATOM 1741 CA ALA A 117 -13.818 -11.240 3.761 1.00 72.21 C ATOM 1742 C ALA A 117 -12.545 -11.962 3.331 1.00 12.25 C ATOM 1743 O ALA A 117 -12.234 -13.041 3.833 1.00 65.22 O ATOM 1744 CB ALA A 117 -15.045 -11.998 3.275 1.00 74.15 C ATOM 0 H ALA A 117 -14.628 -9.656 2.653 1.00 15.10 H new ATOM 0 HA ALA A 117 -13.834 -11.203 4.850 1.00 72.21 H new ATOM 0 HB1 ALA A 117 -15.016 -13.019 3.655 1.00 74.15 H new ATOM 0 HB2 ALA A 117 -15.946 -11.502 3.636 1.00 74.15 H new ATOM 0 HB3 ALA A 117 -15.053 -12.017 2.185 1.00 74.15 H new ATOM 1750 N ALA A 118 -11.814 -11.358 2.401 1.00 53.41 N ATOM 1751 CA ALA A 118 -10.574 -11.942 1.905 1.00 14.44 C ATOM 1752 C ALA A 118 -9.363 -11.338 2.609 1.00 22.42 C ATOM 1753 O ALA A 118 -8.219 -11.638 2.265 1.00 54.20 O ATOM 1754 CB ALA A 118 -10.463 -11.747 0.400 1.00 11.21 C ATOM 0 H ALA A 118 -12.059 -10.464 1.975 1.00 53.41 H new ATOM 0 HA ALA A 118 -10.593 -13.010 2.121 1.00 14.44 H new ATOM 0 HB1 ALA A 118 -9.532 -12.188 0.044 1.00 11.21 H new ATOM 0 HB2 ALA A 118 -11.306 -12.231 -0.093 1.00 11.21 H new ATOM 0 HB3 ALA A 118 -10.471 -10.682 0.170 1.00 11.21 H new ATOM 1760 N LEU A 119 -9.622 -10.485 3.594 1.00 30.41 N ATOM 1761 CA LEU A 119 -8.553 -9.839 4.347 1.00 0.31 C ATOM 1762 C LEU A 119 -8.533 -10.325 5.793 1.00 41.31 C ATOM 1763 O LEU A 119 -7.665 -9.938 6.576 1.00 12.20 O ATOM 1764 CB LEU A 119 -8.724 -8.320 4.310 1.00 1.53 C ATOM 1765 CG LEU A 119 -9.225 -7.732 2.990 1.00 10.34 C ATOM 1766 CD1 LEU A 119 -9.750 -6.321 3.200 1.00 13.42 C ATOM 1767 CD2 LEU A 119 -8.116 -7.740 1.948 1.00 12.24 C ATOM 0 H LEU A 119 -10.563 -10.225 3.890 1.00 30.41 H new ATOM 0 HA LEU A 119 -7.603 -10.104 3.882 1.00 0.31 H new ATOM 0 HB2 LEU A 119 -9.419 -8.034 5.099 1.00 1.53 H new ATOM 0 HB3 LEU A 119 -7.765 -7.861 4.548 1.00 1.53 H new ATOM 0 HG LEU A 119 -10.044 -8.352 2.625 1.00 10.34 H new ATOM 0 HD11 LEU A 119 -10.102 -5.919 2.250 1.00 13.42 H new ATOM 0 HD12 LEU A 119 -10.574 -6.342 3.913 1.00 13.42 H new ATOM 0 HD13 LEU A 119 -8.951 -5.689 3.588 1.00 13.42 H new ATOM 0 HD21 LEU A 119 -8.490 -7.318 1.015 1.00 12.24 H new ATOM 0 HD22 LEU A 119 -7.277 -7.143 2.305 1.00 12.24 H new ATOM 0 HD23 LEU A 119 -7.786 -8.764 1.776 1.00 12.24 H new ATOM 1779 N ALA A 120 -9.492 -11.178 6.138 1.00 0.41 N ATOM 1780 CA ALA A 120 -9.582 -11.720 7.488 1.00 62.44 C ATOM 1781 C ALA A 120 -8.288 -12.424 7.884 1.00 42.32 C ATOM 1782 O ALA A 120 -7.627 -12.059 8.857 1.00 41.54 O ATOM 1783 CB ALA A 120 -10.758 -12.679 7.594 1.00 54.22 C ATOM 0 H ALA A 120 -10.217 -11.508 5.501 1.00 0.41 H new ATOM 0 HA ALA A 120 -9.740 -10.890 8.176 1.00 62.44 H new ATOM 0 HB1 ALA A 120 -10.813 -13.076 8.608 1.00 54.22 H new ATOM 0 HB2 ALA A 120 -11.682 -12.149 7.361 1.00 54.22 H new ATOM 0 HB3 ALA A 120 -10.623 -13.500 6.889 1.00 54.22 H new ATOM 1789 N PRO A 121 -7.916 -13.458 7.115 1.00 43.53 N ATOM 1790 CA PRO A 121 -6.698 -14.234 7.367 1.00 71.34 C ATOM 1791 C PRO A 121 -5.431 -13.435 7.077 1.00 62.34 C ATOM 1792 O PRO A 121 -4.455 -13.511 7.822 1.00 4.55 O ATOM 1793 CB PRO A 121 -6.821 -15.412 6.397 1.00 43.20 C ATOM 1794 CG PRO A 121 -7.691 -14.909 5.298 1.00 10.22 C ATOM 1795 CD PRO A 121 -8.655 -13.949 5.939 1.00 5.44 C ATOM 0 HA PRO A 121 -6.613 -14.532 8.412 1.00 71.34 H new ATOM 0 HB2 PRO A 121 -5.845 -15.718 6.021 1.00 43.20 H new ATOM 0 HB3 PRO A 121 -7.262 -16.282 6.884 1.00 43.20 H new ATOM 0 HG2 PRO A 121 -7.100 -14.413 4.528 1.00 10.22 H new ATOM 0 HG3 PRO A 121 -8.221 -15.729 4.814 1.00 10.22 H new ATOM 0 HD2 PRO A 121 -8.921 -13.136 5.264 1.00 5.44 H new ATOM 0 HD3 PRO A 121 -9.584 -14.443 6.225 1.00 5.44 H new ATOM 1803 N TYR A 122 -5.455 -12.673 5.990 1.00 11.50 N ATOM 1804 CA TYR A 122 -4.307 -11.862 5.600 1.00 15.54 C ATOM 1805 C TYR A 122 -4.382 -10.473 6.228 1.00 75.22 C ATOM 1806 O TYR A 122 -4.035 -9.475 5.598 1.00 25.32 O ATOM 1807 CB TYR A 122 -4.234 -11.741 4.078 1.00 63.44 C ATOM 1808 CG TYR A 122 -4.442 -13.054 3.356 1.00 13.15 C ATOM 1809 CD1 TYR A 122 -3.376 -13.910 3.109 1.00 62.04 C ATOM 1810 CD2 TYR A 122 -5.705 -13.439 2.923 1.00 4.02 C ATOM 1811 CE1 TYR A 122 -3.562 -15.110 2.449 1.00 1.10 C ATOM 1812 CE2 TYR A 122 -5.900 -14.637 2.265 1.00 74.13 C ATOM 1813 CZ TYR A 122 -4.825 -15.469 2.030 1.00 52.33 C ATOM 1814 OH TYR A 122 -5.014 -16.664 1.373 1.00 13.04 O ATOM 0 H TYR A 122 -6.256 -12.599 5.363 1.00 11.50 H new ATOM 0 HA TYR A 122 -3.406 -12.357 5.962 1.00 15.54 H new ATOM 0 HB2 TYR A 122 -4.987 -11.028 3.742 1.00 63.44 H new ATOM 0 HB3 TYR A 122 -3.262 -11.333 3.800 1.00 63.44 H new ATOM 0 HD1 TYR A 122 -2.385 -13.633 3.438 1.00 62.04 H new ATOM 0 HD2 TYR A 122 -6.549 -12.790 3.104 1.00 4.02 H new ATOM 0 HE1 TYR A 122 -2.722 -15.763 2.263 1.00 1.10 H new ATOM 0 HE2 TYR A 122 -6.889 -14.921 1.936 1.00 74.13 H new ATOM 0 HH TYR A 122 -4.189 -16.916 0.908 1.00 13.04 H new ATOM 1824 N ALA A 123 -4.840 -10.419 7.474 1.00 1.44 N ATOM 1825 CA ALA A 123 -4.960 -9.154 8.190 1.00 70.42 C ATOM 1826 C ALA A 123 -3.703 -8.862 9.003 1.00 21.24 C ATOM 1827 O ALA A 123 -3.293 -7.709 9.136 1.00 32.03 O ATOM 1828 CB ALA A 123 -6.183 -9.173 9.093 1.00 0.43 C ATOM 0 H ALA A 123 -5.134 -11.236 8.009 1.00 1.44 H new ATOM 0 HA ALA A 123 -5.078 -8.358 7.455 1.00 70.42 H new ATOM 0 HB1 ALA A 123 -6.260 -8.223 9.621 1.00 0.43 H new ATOM 0 HB2 ALA A 123 -7.078 -9.327 8.490 1.00 0.43 H new ATOM 0 HB3 ALA A 123 -6.089 -9.983 9.816 1.00 0.43 H new ATOM 1834 N GLN A 124 -3.098 -9.914 9.546 1.00 44.21 N ATOM 1835 CA GLN A 124 -1.888 -9.769 10.347 1.00 0.32 C ATOM 1836 C GLN A 124 -0.670 -9.543 9.459 1.00 43.12 C ATOM 1837 O GLN A 124 0.315 -8.938 9.880 1.00 20.55 O ATOM 1838 CB GLN A 124 -1.677 -11.009 11.218 1.00 3.43 C ATOM 1839 CG GLN A 124 -1.912 -10.758 12.699 1.00 24.14 C ATOM 1840 CD GLN A 124 -3.384 -10.674 13.050 1.00 1.41 C ATOM 1841 OE1 GLN A 124 -3.994 -9.608 12.962 1.00 54.31 O ATOM 1842 NE2 GLN A 124 -3.964 -11.799 13.451 1.00 62.13 N ATOM 0 H GLN A 124 -3.426 -10.875 9.446 1.00 44.21 H new ATOM 0 HA GLN A 124 -2.011 -8.898 10.990 1.00 0.32 H new ATOM 0 HB2 GLN A 124 -2.348 -11.799 10.881 1.00 3.43 H new ATOM 0 HB3 GLN A 124 -0.660 -11.374 11.077 1.00 3.43 H new ATOM 0 HG2 GLN A 124 -1.450 -11.558 13.277 1.00 24.14 H new ATOM 0 HG3 GLN A 124 -1.420 -9.830 12.989 1.00 24.14 H new ATOM 0 HE21 GLN A 124 -3.421 -12.660 13.509 1.00 62.13 H new ATOM 0 HE22 GLN A 124 -4.953 -11.802 13.701 1.00 62.13 H new ATOM 1851 N ALA A 125 -0.744 -10.033 8.226 1.00 63.53 N ATOM 1852 CA ALA A 125 0.353 -9.884 7.277 1.00 24.32 C ATOM 1853 C ALA A 125 0.692 -8.413 7.057 1.00 22.41 C ATOM 1854 O ALA A 125 1.797 -8.078 6.632 1.00 65.23 O ATOM 1855 CB ALA A 125 0.000 -10.550 5.955 1.00 21.32 C ATOM 0 H ALA A 125 -1.552 -10.537 7.861 1.00 63.53 H new ATOM 0 HA ALA A 125 1.232 -10.374 7.695 1.00 24.32 H new ATOM 0 HB1 ALA A 125 0.827 -10.431 5.255 1.00 21.32 H new ATOM 0 HB2 ALA A 125 -0.186 -11.611 6.120 1.00 21.32 H new ATOM 0 HB3 ALA A 125 -0.895 -10.085 5.541 1.00 21.32 H new ATOM 1861 N ALA A 126 -0.266 -7.541 7.348 1.00 15.22 N ATOM 1862 CA ALA A 126 -0.069 -6.106 7.183 1.00 42.50 C ATOM 1863 C ALA A 126 1.137 -5.622 7.982 1.00 34.44 C ATOM 1864 O ALA A 126 1.955 -4.852 7.482 1.00 33.21 O ATOM 1865 CB ALA A 126 -1.321 -5.349 7.602 1.00 64.20 C ATOM 0 H ALA A 126 -1.187 -7.803 7.699 1.00 15.22 H new ATOM 0 HA ALA A 126 0.124 -5.910 6.128 1.00 42.50 H new ATOM 0 HB1 ALA A 126 -1.159 -4.279 7.473 1.00 64.20 H new ATOM 0 HB2 ALA A 126 -2.161 -5.666 6.984 1.00 64.20 H new ATOM 0 HB3 ALA A 126 -1.540 -5.560 8.649 1.00 64.20 H new ATOM 1871 N GLN A 127 1.238 -6.080 9.226 1.00 1.52 N ATOM 1872 CA GLN A 127 2.343 -5.691 10.094 1.00 22.44 C ATOM 1873 C GLN A 127 3.674 -5.782 9.355 1.00 33.02 C ATOM 1874 O GLN A 127 4.621 -5.064 9.673 1.00 22.01 O ATOM 1875 CB GLN A 127 2.377 -6.580 11.340 1.00 3.33 C ATOM 1876 CG GLN A 127 1.613 -6.001 12.520 1.00 23.40 C ATOM 1877 CD GLN A 127 2.517 -5.292 13.509 1.00 14.03 C ATOM 1878 OE1 GLN A 127 3.708 -5.107 13.258 1.00 21.14 O ATOM 1879 NE2 GLN A 127 1.954 -4.891 14.643 1.00 14.42 N ATOM 0 H GLN A 127 0.569 -6.720 9.655 1.00 1.52 H new ATOM 0 HA GLN A 127 2.187 -4.656 10.398 1.00 22.44 H new ATOM 0 HB2 GLN A 127 1.960 -7.556 11.091 1.00 3.33 H new ATOM 0 HB3 GLN A 127 3.414 -6.741 11.633 1.00 3.33 H new ATOM 0 HG2 GLN A 127 0.862 -5.301 12.154 1.00 23.40 H new ATOM 0 HG3 GLN A 127 1.079 -6.802 13.031 1.00 23.40 H new ATOM 0 HE21 GLN A 127 0.963 -5.065 14.810 1.00 14.42 H new ATOM 0 HE22 GLN A 127 2.513 -4.409 15.347 1.00 14.42 H new ATOM 1888 N GLU A 128 3.737 -6.669 8.367 1.00 31.21 N ATOM 1889 CA GLU A 128 4.953 -6.853 7.583 1.00 3.12 C ATOM 1890 C GLU A 128 4.995 -5.883 6.407 1.00 54.43 C ATOM 1891 O GLU A 128 6.034 -5.292 6.110 1.00 63.42 O ATOM 1892 CB GLU A 128 5.045 -8.293 7.074 1.00 24.13 C ATOM 1893 CG GLU A 128 5.319 -9.310 8.170 1.00 42.41 C ATOM 1894 CD GLU A 128 6.583 -9.001 8.950 1.00 43.23 C ATOM 1895 OE1 GLU A 128 7.660 -8.911 8.322 1.00 74.33 O ATOM 1896 OE2 GLU A 128 6.496 -8.848 10.185 1.00 32.23 O ATOM 0 H GLU A 128 2.961 -7.271 8.091 1.00 31.21 H new ATOM 0 HA GLU A 128 5.806 -6.648 8.230 1.00 3.12 H new ATOM 0 HB2 GLU A 128 4.112 -8.553 6.574 1.00 24.13 H new ATOM 0 HB3 GLU A 128 5.836 -8.355 6.326 1.00 24.13 H new ATOM 0 HG2 GLU A 128 4.472 -9.338 8.855 1.00 42.41 H new ATOM 0 HG3 GLU A 128 5.403 -10.302 7.727 1.00 42.41 H new ATOM 1903 N LEU A 129 3.857 -5.724 5.738 1.00 23.24 N ATOM 1904 CA LEU A 129 3.762 -4.826 4.593 1.00 11.24 C ATOM 1905 C LEU A 129 4.125 -3.398 4.989 1.00 43.44 C ATOM 1906 O LEU A 129 4.887 -2.725 4.294 1.00 22.12 O ATOM 1907 CB LEU A 129 2.349 -4.860 4.009 1.00 73.21 C ATOM 1908 CG LEU A 129 2.052 -6.004 3.038 1.00 50.33 C ATOM 1909 CD1 LEU A 129 0.627 -6.503 3.221 1.00 63.11 C ATOM 1910 CD2 LEU A 129 2.281 -5.557 1.601 1.00 1.34 C ATOM 0 H LEU A 129 2.988 -6.206 5.969 1.00 23.24 H new ATOM 0 HA LEU A 129 4.470 -5.166 3.837 1.00 11.24 H new ATOM 0 HB2 LEU A 129 1.638 -4.916 4.833 1.00 73.21 H new ATOM 0 HB3 LEU A 129 2.167 -3.917 3.494 1.00 73.21 H new ATOM 0 HG LEU A 129 2.734 -6.826 3.256 1.00 50.33 H new ATOM 0 HD11 LEU A 129 0.434 -7.317 2.522 1.00 63.11 H new ATOM 0 HD12 LEU A 129 0.496 -6.863 4.242 1.00 63.11 H new ATOM 0 HD13 LEU A 129 -0.071 -5.688 3.031 1.00 63.11 H new ATOM 0 HD21 LEU A 129 2.065 -6.384 0.924 1.00 1.34 H new ATOM 0 HD22 LEU A 129 1.623 -4.719 1.372 1.00 1.34 H new ATOM 0 HD23 LEU A 129 3.319 -5.248 1.477 1.00 1.34 H new ATOM 1922 N VAL A 130 3.577 -2.942 6.110 1.00 12.23 N ATOM 1923 CA VAL A 130 3.846 -1.596 6.601 1.00 32.22 C ATOM 1924 C VAL A 130 5.298 -1.452 7.043 1.00 30.30 C ATOM 1925 O VAL A 130 5.913 -0.401 6.862 1.00 44.53 O ATOM 1926 CB VAL A 130 2.924 -1.233 7.780 1.00 51.24 C ATOM 1927 CG1 VAL A 130 3.154 -2.179 8.949 1.00 73.22 C ATOM 1928 CG2 VAL A 130 3.143 0.212 8.202 1.00 71.23 C ATOM 0 H VAL A 130 2.943 -3.485 6.696 1.00 12.23 H new ATOM 0 HA VAL A 130 3.651 -0.913 5.774 1.00 32.22 H new ATOM 0 HB VAL A 130 1.889 -1.340 7.455 1.00 51.24 H new ATOM 0 HG11 VAL A 130 2.494 -1.907 9.773 1.00 73.22 H new ATOM 0 HG12 VAL A 130 2.942 -3.202 8.637 1.00 73.22 H new ATOM 0 HG13 VAL A 130 4.191 -2.107 9.277 1.00 73.22 H new ATOM 0 HG21 VAL A 130 2.483 0.451 9.036 1.00 71.23 H new ATOM 0 HG22 VAL A 130 4.180 0.348 8.509 1.00 71.23 H new ATOM 0 HG23 VAL A 130 2.923 0.873 7.364 1.00 71.23 H new ATOM 1938 N LYS A 131 5.842 -2.516 7.623 1.00 22.14 N ATOM 1939 CA LYS A 131 7.223 -2.511 8.091 1.00 44.23 C ATOM 1940 C LYS A 131 8.168 -2.035 6.992 1.00 3.11 C ATOM 1941 O LYS A 131 8.854 -1.024 7.144 1.00 44.11 O ATOM 1942 CB LYS A 131 7.631 -3.910 8.557 1.00 32.00 C ATOM 1943 CG LYS A 131 8.997 -3.958 9.219 1.00 10.53 C ATOM 1944 CD LYS A 131 8.929 -3.513 10.671 1.00 52.44 C ATOM 1945 CE LYS A 131 10.271 -2.984 11.155 1.00 13.32 C ATOM 1946 NZ LYS A 131 10.280 -2.761 12.628 1.00 51.54 N ATOM 0 H LYS A 131 5.347 -3.394 7.780 1.00 22.14 H new ATOM 0 HA LYS A 131 7.293 -1.820 8.931 1.00 44.23 H new ATOM 0 HB2 LYS A 131 6.884 -4.282 9.258 1.00 32.00 H new ATOM 0 HB3 LYS A 131 7.628 -4.584 7.700 1.00 32.00 H new ATOM 0 HG2 LYS A 131 9.392 -4.972 9.167 1.00 10.53 H new ATOM 0 HG3 LYS A 131 9.690 -3.317 8.673 1.00 10.53 H new ATOM 0 HD2 LYS A 131 8.170 -2.738 10.780 1.00 52.44 H new ATOM 0 HD3 LYS A 131 8.620 -4.351 11.296 1.00 52.44 H new ATOM 0 HE2 LYS A 131 11.057 -3.691 10.890 1.00 13.32 H new ATOM 0 HE3 LYS A 131 10.498 -2.048 10.644 1.00 13.32 H new ATOM 0 HZ1 LYS A 131 11.211 -2.401 12.919 1.00 51.54 H new ATOM 0 HZ2 LYS A 131 9.547 -2.067 12.879 1.00 51.54 H new ATOM 0 HZ3 LYS A 131 10.088 -3.659 13.116 1.00 51.54 H new ATOM 1960 N VAL A 132 8.196 -2.768 5.884 1.00 24.42 N ATOM 1961 CA VAL A 132 9.055 -2.420 4.759 1.00 70.05 C ATOM 1962 C VAL A 132 8.602 -1.120 4.104 1.00 2.51 C ATOM 1963 O VAL A 132 9.422 -0.323 3.650 1.00 2.34 O ATOM 1964 CB VAL A 132 9.071 -3.536 3.698 1.00 60.52 C ATOM 1965 CG1 VAL A 132 9.983 -3.160 2.539 1.00 51.02 C ATOM 1966 CG2 VAL A 132 9.505 -4.855 4.320 1.00 74.13 C ATOM 0 H VAL A 132 7.633 -3.607 5.741 1.00 24.42 H new ATOM 0 HA VAL A 132 10.062 -2.293 5.157 1.00 70.05 H new ATOM 0 HB VAL A 132 8.060 -3.657 3.309 1.00 60.52 H new ATOM 0 HG11 VAL A 132 9.981 -3.961 1.800 1.00 51.02 H new ATOM 0 HG12 VAL A 132 9.625 -2.240 2.078 1.00 51.02 H new ATOM 0 HG13 VAL A 132 10.997 -3.010 2.908 1.00 51.02 H new ATOM 0 HG21 VAL A 132 9.511 -5.633 3.556 1.00 74.13 H new ATOM 0 HG22 VAL A 132 10.506 -4.749 4.737 1.00 74.13 H new ATOM 0 HG23 VAL A 132 8.809 -5.130 5.113 1.00 74.13 H new ATOM 1976 N ALA A 133 7.290 -0.912 4.060 1.00 42.14 N ATOM 1977 CA ALA A 133 6.727 0.293 3.463 1.00 0.44 C ATOM 1978 C ALA A 133 7.521 1.530 3.873 1.00 70.14 C ATOM 1979 O ALA A 133 7.763 2.421 3.058 1.00 43.25 O ATOM 1980 CB ALA A 133 5.266 0.447 3.860 1.00 21.42 C ATOM 0 H ALA A 133 6.597 -1.562 4.431 1.00 42.14 H new ATOM 0 HA ALA A 133 6.789 0.195 2.379 1.00 0.44 H new ATOM 0 HB1 ALA A 133 4.859 1.351 3.407 1.00 21.42 H new ATOM 0 HB2 ALA A 133 4.702 -0.418 3.513 1.00 21.42 H new ATOM 0 HB3 ALA A 133 5.189 0.519 4.945 1.00 21.42 H new ATOM 1986 N ARG A 134 7.921 1.579 5.138 1.00 24.52 N ATOM 1987 CA ARG A 134 8.686 2.708 5.656 1.00 73.24 C ATOM 1988 C ARG A 134 10.107 2.701 5.101 1.00 42.42 C ATOM 1989 O ARG A 134 10.599 3.720 4.617 1.00 70.35 O ATOM 1990 CB ARG A 134 8.723 2.668 7.185 1.00 40.13 C ATOM 1991 CG ARG A 134 7.351 2.771 7.830 1.00 1.22 C ATOM 1992 CD ARG A 134 7.419 2.507 9.326 1.00 72.22 C ATOM 1993 NE ARG A 134 7.559 3.741 10.094 1.00 42.44 N ATOM 1994 CZ ARG A 134 7.842 3.772 11.391 1.00 22.33 C ATOM 1995 NH1 ARG A 134 8.014 2.641 12.062 1.00 20.02 N ATOM 1996 NH2 ARG A 134 7.954 4.935 12.020 1.00 22.24 N ATOM 0 H ARG A 134 7.728 0.850 5.825 1.00 24.52 H new ATOM 0 HA ARG A 134 8.194 3.626 5.336 1.00 73.24 H new ATOM 0 HB2 ARG A 134 9.197 1.740 7.504 1.00 40.13 H new ATOM 0 HB3 ARG A 134 9.347 3.485 7.546 1.00 40.13 H new ATOM 0 HG2 ARG A 134 6.938 3.764 7.653 1.00 1.22 H new ATOM 0 HG3 ARG A 134 6.673 2.056 7.363 1.00 1.22 H new ATOM 0 HD2 ARG A 134 6.517 1.983 9.643 1.00 72.22 H new ATOM 0 HD3 ARG A 134 8.261 1.849 9.540 1.00 72.22 H new ATOM 0 HE ARG A 134 7.432 4.628 9.607 1.00 42.44 H new ATOM 0 HH11 ARG A 134 7.929 1.745 11.582 1.00 20.02 H new ATOM 0 HH12 ARG A 134 8.231 2.667 13.058 1.00 20.02 H new ATOM 0 HH21 ARG A 134 7.823 5.807 11.507 1.00 22.24 H new ATOM 0 HH22 ARG A 134 8.171 4.957 13.016 1.00 22.24 H new ATOM 2010 N GLU A 135 10.762 1.547 5.176 1.00 35.32 N ATOM 2011 CA GLU A 135 12.127 1.409 4.683 1.00 72.24 C ATOM 2012 C GLU A 135 12.328 2.219 3.404 1.00 34.02 C ATOM 2013 O GLU A 135 13.254 3.023 3.305 1.00 15.35 O ATOM 2014 CB GLU A 135 12.453 -0.063 4.422 1.00 33.20 C ATOM 2015 CG GLU A 135 12.550 -0.897 5.688 1.00 23.43 C ATOM 2016 CD GLU A 135 13.913 -0.802 6.347 1.00 43.31 C ATOM 2017 OE1 GLU A 135 14.292 0.310 6.769 1.00 64.13 O ATOM 2018 OE2 GLU A 135 14.601 -1.840 6.439 1.00 70.14 O ATOM 0 H GLU A 135 10.369 0.694 5.574 1.00 35.32 H new ATOM 0 HA GLU A 135 12.802 1.794 5.447 1.00 72.24 H new ATOM 0 HB2 GLU A 135 11.685 -0.487 3.775 1.00 33.20 H new ATOM 0 HB3 GLU A 135 13.397 -0.127 3.881 1.00 33.20 H new ATOM 0 HG2 GLU A 135 11.786 -0.570 6.393 1.00 23.43 H new ATOM 0 HG3 GLU A 135 12.338 -1.939 5.449 1.00 23.43 H new ATOM 2025 N VAL A 136 11.453 2.000 2.429 1.00 74.44 N ATOM 2026 CA VAL A 136 11.532 2.708 1.156 1.00 1.43 C ATOM 2027 C VAL A 136 11.360 4.210 1.353 1.00 10.43 C ATOM 2028 O VAL A 136 12.119 5.009 0.805 1.00 53.21 O ATOM 2029 CB VAL A 136 10.465 2.205 0.166 1.00 43.33 C ATOM 2030 CG1 VAL A 136 10.670 2.835 -1.204 1.00 32.23 C ATOM 2031 CG2 VAL A 136 10.497 0.687 0.074 1.00 1.43 C ATOM 0 H VAL A 136 10.680 1.338 2.495 1.00 74.44 H new ATOM 0 HA VAL A 136 12.521 2.509 0.743 1.00 1.43 H new ATOM 0 HB VAL A 136 9.483 2.503 0.534 1.00 43.33 H new ATOM 0 HG11 VAL A 136 9.907 2.468 -1.891 1.00 32.23 H new ATOM 0 HG12 VAL A 136 10.593 3.919 -1.121 1.00 32.23 H new ATOM 0 HG13 VAL A 136 11.657 2.569 -1.583 1.00 32.23 H new ATOM 0 HG21 VAL A 136 9.737 0.349 -0.630 1.00 1.43 H new ATOM 0 HG22 VAL A 136 11.479 0.364 -0.270 1.00 1.43 H new ATOM 0 HG23 VAL A 136 10.298 0.259 1.056 1.00 1.43 H new ATOM 2041 N ALA A 137 10.357 4.588 2.139 1.00 34.15 N ATOM 2042 CA ALA A 137 10.085 5.994 2.410 1.00 24.42 C ATOM 2043 C ALA A 137 11.231 6.633 3.189 1.00 72.14 C ATOM 2044 O ALA A 137 11.869 5.984 4.017 1.00 51.21 O ATOM 2045 CB ALA A 137 8.778 6.141 3.174 1.00 4.34 C ATOM 0 H ALA A 137 9.719 3.939 2.600 1.00 34.15 H new ATOM 0 HA ALA A 137 9.995 6.513 1.456 1.00 24.42 H new ATOM 0 HB1 ALA A 137 8.588 7.196 3.370 1.00 4.34 H new ATOM 0 HB2 ALA A 137 7.962 5.729 2.581 1.00 4.34 H new ATOM 0 HB3 ALA A 137 8.847 5.603 4.120 1.00 4.34 H new ATOM 2051 N SER A 138 11.485 7.909 2.918 1.00 63.14 N ATOM 2052 CA SER A 138 12.557 8.634 3.589 1.00 12.31 C ATOM 2053 C SER A 138 12.516 10.118 3.232 1.00 34.55 C ATOM 2054 O SER A 138 12.732 10.497 2.083 1.00 5.51 O ATOM 2055 CB SER A 138 13.916 8.046 3.210 1.00 23.54 C ATOM 2056 OG SER A 138 14.197 8.252 1.837 1.00 61.10 O ATOM 0 H SER A 138 10.963 8.462 2.238 1.00 63.14 H new ATOM 0 HA SER A 138 12.412 8.531 4.664 1.00 12.31 H new ATOM 0 HB2 SER A 138 14.696 8.506 3.817 1.00 23.54 H new ATOM 0 HB3 SER A 138 13.928 6.979 3.430 1.00 23.54 H new ATOM 0 HG SER A 138 13.757 9.073 1.533 1.00 61.10 H new ATOM 2062 N GLY A 139 12.234 10.952 4.229 1.00 13.12 N ATOM 2063 CA GLY A 139 12.168 12.384 4.002 1.00 63.14 C ATOM 2064 C GLY A 139 10.745 12.883 3.854 1.00 43.22 C ATOM 2065 O GLY A 139 9.787 12.109 3.875 1.00 62.41 O ATOM 0 H GLY A 139 12.050 10.661 5.189 1.00 13.12 H new ATOM 0 HA2 GLY A 139 12.647 12.903 4.832 1.00 63.14 H new ATOM 0 HA3 GLY A 139 12.732 12.633 3.103 1.00 63.14 H new ATOM 2069 N PRO A 140 10.591 14.207 3.701 1.00 33.33 N ATOM 2070 CA PRO A 140 9.277 14.838 3.548 1.00 14.32 C ATOM 2071 C PRO A 140 8.629 14.510 2.207 1.00 33.41 C ATOM 2072 O PRO A 140 9.180 13.750 1.410 1.00 13.13 O ATOM 2073 CB PRO A 140 9.589 16.333 3.640 1.00 43.54 C ATOM 2074 CG PRO A 140 11.011 16.451 3.208 1.00 34.34 C ATOM 2075 CD PRO A 140 11.687 15.188 3.667 1.00 14.54 C ATOM 0 HA PRO A 140 8.568 14.490 4.299 1.00 14.32 H new ATOM 0 HB2 PRO A 140 8.930 16.915 2.996 1.00 43.54 H new ATOM 0 HB3 PRO A 140 9.452 16.704 4.656 1.00 43.54 H new ATOM 0 HG2 PRO A 140 11.083 16.561 2.126 1.00 34.34 H new ATOM 0 HG3 PRO A 140 11.482 17.329 3.650 1.00 34.34 H new ATOM 0 HD2 PRO A 140 12.478 14.883 2.981 1.00 14.54 H new ATOM 0 HD3 PRO A 140 12.146 15.312 4.648 1.00 14.54 H new ATOM 2083 N SER A 141 7.457 15.087 1.965 1.00 15.13 N ATOM 2084 CA SER A 141 6.732 14.854 0.721 1.00 21.55 C ATOM 2085 C SER A 141 6.571 16.150 -0.066 1.00 14.52 C ATOM 2086 O SER A 141 6.926 17.228 0.412 1.00 22.42 O ATOM 2087 CB SER A 141 5.358 14.246 1.013 1.00 25.41 C ATOM 2088 OG SER A 141 4.543 15.152 1.737 1.00 64.30 O ATOM 0 H SER A 141 6.989 15.720 2.614 1.00 15.13 H new ATOM 0 HA SER A 141 7.311 14.154 0.118 1.00 21.55 H new ATOM 0 HB2 SER A 141 4.868 13.980 0.076 1.00 25.41 H new ATOM 0 HB3 SER A 141 5.478 13.325 1.583 1.00 25.41 H new ATOM 0 HG SER A 141 3.670 14.741 1.910 1.00 64.30 H new ATOM 2094 N SER A 142 6.031 16.038 -1.276 1.00 23.21 N ATOM 2095 CA SER A 142 5.825 17.200 -2.132 1.00 25.41 C ATOM 2096 C SER A 142 4.733 18.103 -1.568 1.00 13.10 C ATOM 2097 O SER A 142 4.947 19.295 -1.352 1.00 13.21 O ATOM 2098 CB SER A 142 5.457 16.757 -3.549 1.00 75.23 C ATOM 2099 OG SER A 142 5.814 17.742 -4.501 1.00 41.54 O ATOM 0 H SER A 142 5.728 15.154 -1.685 1.00 23.21 H new ATOM 0 HA SER A 142 6.756 17.765 -2.167 1.00 25.41 H new ATOM 0 HB2 SER A 142 5.963 15.820 -3.783 1.00 75.23 H new ATOM 0 HB3 SER A 142 4.386 16.563 -3.606 1.00 75.23 H new ATOM 0 HG SER A 142 5.570 17.433 -5.398 1.00 41.54 H new ATOM 2105 N GLY A 143 3.559 17.525 -1.333 1.00 20.33 N ATOM 2106 CA GLY A 143 2.448 18.292 -0.797 1.00 23.45 C ATOM 2107 C GLY A 143 2.158 17.955 0.652 1.00 31.35 C ATOM 2108 O GLY A 143 1.910 18.846 1.465 1.00 32.43 O ATOM 0 H GLY A 143 3.357 16.540 -1.504 1.00 20.33 H new ATOM 0 HA2 GLY A 143 2.670 19.356 -0.882 1.00 23.45 H new ATOM 0 HA3 GLY A 143 1.557 18.103 -1.396 1.00 23.45 H new TER 2112 GLY A 143