USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 983 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 98 ASN : amide:sc= -1.63 X(o=-4.4,f=-4.9) USER MOD Set 1.2: A 100 LYS NZ :NH3+ 143:sc= -2.81! (180deg=-2.74!) USER MOD Set 2.1: A 87 ASN : amide:sc= -0.319 K(o=-0.32,f=-4!) USER MOD Set 2.2: A 88 LYS NZ :NH3+ 151:sc= 0.00385 (180deg=0) USER MOD Set 3.1: A 14 TYR OH : rot 180:sc= 0.489 USER MOD Set 3.2: A 18 MET CE :methyl 147:sc= -0.412 (180deg=-3.47!) USER MOD Set 3.3: A 117 TYR OH : rot 122:sc= 0.92 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -81:sc= -9.65! USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.641 K(o=-0.64,f=-2.4!) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 16 LYS NZ :NH3+ 161:sc= -0.0207 (180deg=-0.383) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -175:sc= -13.7! (180deg=-14.5!) USER MOD Single : A 24 ASN : amide:sc= -0.0145 X(o=-0.015,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.211) USER MOD Single : A 37 LYS NZ :NH3+ -107:sc= -0.02 (180deg=-1.46) USER MOD Single : A 39 THR OG1 : rot 80:sc= -8.31! USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.11 K(o=-0.11,f=-1.3!) USER MOD Single : A 45 ASN : amide:sc= -0.597 K(o=-0.6,f=-3.7!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -135:sc= -0.0369 (180deg=-0.226) USER MOD Single : A 52 SER OG : rot 180:sc= -0.0256 USER MOD Single : A 53 SER OG : rot 180:sc= 0.0618 USER MOD Single : A 54 ASN : amide:sc= -0.257 K(o=-0.26,f=-2!) USER MOD Single : A 57 ASN : amide:sc= -0.58 X(o=-0.58,f=-0.43) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -140:sc= 1.11 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 52:sc= 0.594! USER MOD Single : A 81 THR OG1 : rot 57:sc= 1.16 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN :FLIP amide:sc=-0.000692 F(o=-0.58,f=-0.00069) USER MOD Single : A 115 GLN : amide:sc= -8.08! C(o=-8.1!,f=-9.6!) USER MOD Single : A 116 THR OG1 : rot 180:sc= -1.97 USER MOD Single : A 118 THR OG1 : rot 180:sc= -1.2 USER MOD Single : A 119 TYR OH : rot 165:sc= -3.29! USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.422 8.351 3.449 1.00 0.00 N ATOM 2 CA ALA A 1 3.691 9.619 4.057 1.00 0.00 C ATOM 3 C ALA A 1 5.100 10.000 3.541 1.00 0.00 C ATOM 4 O ALA A 1 5.173 10.862 2.698 1.00 0.00 O ATOM 5 CB ALA A 1 3.750 9.378 5.559 1.00 0.00 C ATOM 0 H1 ALA A 1 2.483 8.016 3.745 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.444 8.451 2.414 1.00 0.00 H new ATOM 0 H3 ALA A 1 4.144 7.664 3.746 1.00 0.00 H new ATOM 0 HA ALA A 1 2.954 10.391 3.836 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.954 10.319 6.071 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.795 8.978 5.901 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.543 8.664 5.782 1.00 0.00 H new ATOM 13 N PHE A 2 6.169 9.353 4.073 1.00 0.00 N ATOM 14 CA PHE A 2 7.533 9.700 3.642 1.00 0.00 C ATOM 15 C PHE A 2 7.785 9.726 2.110 1.00 0.00 C ATOM 16 O PHE A 2 7.973 10.785 1.507 1.00 0.00 O ATOM 17 CB PHE A 2 8.700 8.885 4.289 1.00 0.00 C ATOM 18 CG PHE A 2 8.347 8.110 5.516 1.00 0.00 C ATOM 19 CD1 PHE A 2 7.634 6.938 5.480 1.00 0.00 C ATOM 20 CD2 PHE A 2 8.778 8.593 6.761 1.00 0.00 C ATOM 21 CE1 PHE A 2 7.341 6.236 6.641 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.506 7.930 7.928 1.00 0.00 C ATOM 23 CZ PHE A 2 7.789 6.754 7.851 1.00 0.00 C ATOM 0 H PHE A 2 6.111 8.616 4.775 1.00 0.00 H new ATOM 0 HA PHE A 2 7.558 10.719 4.028 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.091 8.192 3.544 1.00 0.00 H new ATOM 0 HB3 PHE A 2 9.506 9.575 4.537 1.00 0.00 H new ATOM 0 HD1 PHE A 2 7.294 6.554 4.529 1.00 0.00 H new ATOM 0 HD2 PHE A 2 9.340 9.514 6.800 1.00 0.00 H new ATOM 0 HE1 PHE A 2 6.781 5.313 6.605 1.00 0.00 H new ATOM 0 HE2 PHE A 2 8.842 8.316 8.879 1.00 0.00 H new ATOM 0 HZ PHE A 2 7.568 6.217 8.762 1.00 0.00 H new ATOM 33 N ASP A 3 7.824 8.563 1.494 1.00 0.00 N ATOM 34 CA ASP A 3 8.116 8.300 0.069 1.00 0.00 C ATOM 35 C ASP A 3 8.201 9.509 -0.831 1.00 0.00 C ATOM 36 O ASP A 3 7.278 9.798 -1.590 1.00 0.00 O ATOM 37 CB ASP A 3 7.247 7.204 -0.573 1.00 0.00 C ATOM 38 CG ASP A 3 5.974 7.062 0.223 1.00 0.00 C ATOM 39 OD1 ASP A 3 5.153 8.078 0.110 1.00 0.00 O ATOM 40 OD2 ASP A 3 5.699 6.098 0.932 1.00 0.00 O ATOM 0 H ASP A 3 7.640 7.698 2.002 1.00 0.00 H new ATOM 0 HA ASP A 3 9.134 7.916 0.140 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.018 7.462 -1.607 1.00 0.00 H new ATOM 0 HB3 ASP A 3 7.787 6.257 -0.592 1.00 0.00 H new ATOM 45 N GLY A 4 9.341 10.162 -0.705 1.00 0.00 N ATOM 46 CA GLY A 4 9.638 11.319 -1.487 1.00 0.00 C ATOM 47 C GLY A 4 11.045 11.948 -1.384 1.00 0.00 C ATOM 48 O GLY A 4 11.895 11.466 -2.094 1.00 0.00 O ATOM 0 H GLY A 4 10.079 9.895 -0.054 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.467 11.063 -2.533 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.913 12.089 -1.225 1.00 0.00 H new ATOM 52 N THR A 5 11.084 12.945 -0.540 1.00 0.00 N ATOM 53 CA THR A 5 12.180 13.813 -0.212 1.00 0.00 C ATOM 54 C THR A 5 11.862 14.400 1.131 1.00 0.00 C ATOM 55 O THR A 5 10.689 14.525 1.393 1.00 0.00 O ATOM 56 CB THR A 5 12.489 14.906 -1.262 1.00 0.00 C ATOM 57 OG1 THR A 5 11.264 15.590 -1.273 1.00 0.00 O ATOM 58 CG2 THR A 5 12.678 14.312 -2.670 1.00 0.00 C ATOM 0 H THR A 5 10.252 13.195 -0.006 1.00 0.00 H new ATOM 0 HA THR A 5 13.099 13.228 -0.198 1.00 0.00 H new ATOM 0 HB THR A 5 13.388 15.478 -1.032 1.00 0.00 H new ATOM 0 HG1 THR A 5 10.626 15.108 -1.839 1.00 0.00 H new ATOM 0 HG21 THR A 5 12.893 15.113 -3.377 1.00 0.00 H new ATOM 0 HG22 THR A 5 13.508 13.606 -2.658 1.00 0.00 H new ATOM 0 HG23 THR A 5 11.767 13.796 -2.973 1.00 0.00 H new ATOM 66 N TRP A 6 12.952 14.689 1.769 1.00 0.00 N ATOM 67 CA TRP A 6 13.011 15.164 3.121 1.00 0.00 C ATOM 68 C TRP A 6 14.432 15.596 3.492 1.00 0.00 C ATOM 69 O TRP A 6 15.257 14.881 2.961 1.00 0.00 O ATOM 70 CB TRP A 6 12.965 13.743 3.788 1.00 0.00 C ATOM 71 CG TRP A 6 11.638 13.129 3.620 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.382 11.849 3.278 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.296 13.583 3.678 1.00 0.00 C ATOM 74 NE1 TRP A 6 10.065 11.508 3.129 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.331 12.617 3.370 1.00 0.00 C ATOM 76 CE3 TRP A 6 9.807 14.863 3.979 1.00 0.00 C ATOM 77 CZ2 TRP A 6 7.974 12.912 3.350 1.00 0.00 C ATOM 78 CZ3 TRP A 6 8.480 15.148 3.963 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.556 14.176 3.649 1.00 0.00 C ATOM 0 H TRP A 6 13.873 14.596 1.342 1.00 0.00 H new ATOM 0 HA TRP A 6 12.298 15.956 3.350 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.726 13.102 3.342 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.200 13.827 4.849 1.00 0.00 H new ATOM 0 HD1 TRP A 6 12.175 11.131 3.130 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.704 10.587 2.882 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.508 15.645 4.231 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.255 12.146 3.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.145 16.147 4.199 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.503 14.414 3.639 1.00 0.00 H new ATOM 90 N LYS A 7 14.643 16.609 4.334 1.00 0.00 N ATOM 91 CA LYS A 7 16.010 17.029 4.545 1.00 0.00 C ATOM 92 C LYS A 7 16.340 17.531 5.901 1.00 0.00 C ATOM 93 O LYS A 7 16.073 18.678 6.206 1.00 0.00 O ATOM 94 CB LYS A 7 16.163 18.236 3.588 1.00 0.00 C ATOM 95 CG LYS A 7 15.446 17.967 2.311 1.00 0.00 C ATOM 96 CD LYS A 7 15.783 18.868 1.151 1.00 0.00 C ATOM 97 CE LYS A 7 17.227 18.716 0.606 1.00 0.00 C ATOM 98 NZ LYS A 7 17.777 19.958 0.021 1.00 0.00 N ATOM 0 H LYS A 7 13.927 17.121 4.849 1.00 0.00 H new ATOM 0 HA LYS A 7 16.660 16.168 4.389 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.763 19.135 4.057 1.00 0.00 H new ATOM 0 HB3 LYS A 7 17.219 18.422 3.390 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.650 16.938 2.015 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.375 18.038 2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.081 18.671 0.340 1.00 0.00 H new ATOM 0 HD3 LYS A 7 15.633 19.903 1.458 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.878 18.387 1.416 1.00 0.00 H new ATOM 0 HE3 LYS A 7 17.239 17.932 -0.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.743 19.782 -0.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.178 20.263 -0.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.797 20.704 0.746 1.00 0.00 H new ATOM 112 N VAL A 8 16.968 16.764 6.784 1.00 0.00 N ATOM 113 CA VAL A 8 17.229 17.292 8.070 1.00 0.00 C ATOM 114 C VAL A 8 17.506 18.811 8.097 1.00 0.00 C ATOM 115 O VAL A 8 18.651 19.211 8.038 1.00 0.00 O ATOM 116 CB VAL A 8 18.253 16.599 8.955 1.00 0.00 C ATOM 117 CG1 VAL A 8 18.345 17.344 10.306 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.886 15.135 9.178 1.00 0.00 C ATOM 0 H VAL A 8 17.287 15.809 6.620 1.00 0.00 H new ATOM 0 HA VAL A 8 16.261 17.068 8.518 1.00 0.00 H new ATOM 0 HB VAL A 8 19.223 16.624 8.458 1.00 0.00 H new ATOM 0 HG11 VAL A 8 19.078 16.851 10.944 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.651 18.376 10.132 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.371 17.332 10.795 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.636 14.665 9.814 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.911 15.074 9.661 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.849 14.619 8.219 1.00 0.00 H new ATOM 128 N ASP A 9 16.398 19.549 8.145 1.00 0.00 N ATOM 129 CA ASP A 9 16.293 20.974 8.081 1.00 0.00 C ATOM 130 C ASP A 9 16.823 21.747 9.305 1.00 0.00 C ATOM 131 O ASP A 9 17.536 22.726 9.171 1.00 0.00 O ATOM 132 CB ASP A 9 14.792 21.333 8.033 1.00 0.00 C ATOM 133 CG ASP A 9 14.401 22.708 7.632 1.00 0.00 C ATOM 134 OD1 ASP A 9 15.366 23.587 7.638 1.00 0.00 O ATOM 135 OD2 ASP A 9 13.277 23.017 7.322 1.00 0.00 O ATOM 0 H ASP A 9 15.482 19.110 8.238 1.00 0.00 H new ATOM 0 HA ASP A 9 16.889 21.256 7.213 1.00 0.00 H new ATOM 0 HB2 ASP A 9 14.308 20.638 7.347 1.00 0.00 H new ATOM 0 HB3 ASP A 9 14.375 21.146 9.023 1.00 0.00 H new ATOM 140 N ARG A 10 16.387 21.244 10.429 1.00 0.00 N ATOM 141 CA ARG A 10 16.717 21.860 11.651 1.00 0.00 C ATOM 142 C ARG A 10 17.244 20.810 12.582 1.00 0.00 C ATOM 143 O ARG A 10 17.216 19.612 12.211 1.00 0.00 O ATOM 144 CB ARG A 10 15.443 22.542 12.158 1.00 0.00 C ATOM 145 CG ARG A 10 14.145 22.188 11.470 1.00 0.00 C ATOM 146 CD ARG A 10 13.724 23.273 10.468 1.00 0.00 C ATOM 147 NE ARG A 10 13.387 24.470 11.240 1.00 0.00 N ATOM 148 CZ ARG A 10 13.489 25.745 10.834 1.00 0.00 C ATOM 149 NH1 ARG A 10 13.923 26.082 9.629 1.00 0.00 N ATOM 150 NH2 ARG A 10 13.147 26.729 11.654 1.00 0.00 N ATOM 0 H ARG A 10 15.804 20.410 10.506 1.00 0.00 H new ATOM 0 HA ARG A 10 17.497 22.616 11.559 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.336 22.312 13.218 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.583 23.620 12.079 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.255 21.236 10.951 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.361 22.056 12.216 1.00 0.00 H new ATOM 0 HD2 ARG A 10 14.532 23.483 9.767 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.869 22.942 9.879 1.00 0.00 H new ATOM 0 HE ARG A 10 13.038 24.319 12.186 1.00 0.00 H new ATOM 0 HH11 ARG A 10 14.197 25.358 8.965 1.00 0.00 H new ATOM 0 HH12 ARG A 10 13.983 27.065 9.365 1.00 0.00 H new ATOM 0 HH21 ARG A 10 12.807 26.516 12.592 1.00 0.00 H new ATOM 0 HH22 ARG A 10 13.224 27.699 11.347 1.00 0.00 H new ATOM 164 N ASN A 11 17.719 21.181 13.737 1.00 0.00 N ATOM 165 CA ASN A 11 18.241 20.163 14.631 1.00 0.00 C ATOM 166 C ASN A 11 18.123 20.583 16.079 1.00 0.00 C ATOM 167 O ASN A 11 18.883 21.389 16.636 1.00 0.00 O ATOM 168 CB ASN A 11 19.688 19.826 14.278 1.00 0.00 C ATOM 169 CG ASN A 11 20.788 20.758 14.751 1.00 0.00 C ATOM 170 OD1 ASN A 11 21.500 20.414 15.694 1.00 0.00 O ATOM 171 ND2 ASN A 11 20.929 21.906 14.128 1.00 0.00 N ATOM 0 H ASN A 11 17.760 22.140 14.081 1.00 0.00 H new ATOM 0 HA ASN A 11 17.637 19.265 14.500 1.00 0.00 H new ATOM 0 HB2 ASN A 11 19.902 18.833 14.674 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.756 19.758 13.192 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.655 22.559 14.421 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.312 22.144 13.351 1.00 0.00 H new ATOM 178 N GLU A 12 17.125 20.025 16.754 1.00 0.00 N ATOM 179 CA GLU A 12 16.856 20.308 18.153 1.00 0.00 C ATOM 180 C GLU A 12 17.975 19.762 19.037 1.00 0.00 C ATOM 181 O GLU A 12 18.988 20.421 19.181 1.00 0.00 O ATOM 182 CB GLU A 12 15.457 19.856 18.695 1.00 0.00 C ATOM 183 CG GLU A 12 14.343 20.894 18.731 1.00 0.00 C ATOM 184 CD GLU A 12 14.127 21.591 20.076 1.00 0.00 C ATOM 185 OE1 GLU A 12 13.906 21.009 21.111 1.00 0.00 O ATOM 186 OE2 GLU A 12 14.201 22.890 20.020 1.00 0.00 O ATOM 0 H GLU A 12 16.475 19.357 16.339 1.00 0.00 H new ATOM 0 HA GLU A 12 16.823 21.396 18.203 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.116 19.019 18.086 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.596 19.478 19.708 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.555 21.654 17.979 1.00 0.00 H new ATOM 0 HG3 GLU A 12 13.411 20.410 18.440 1.00 0.00 H new ATOM 193 N ASN A 13 17.777 18.581 19.607 1.00 0.00 N ATOM 194 CA ASN A 13 18.720 17.890 20.497 1.00 0.00 C ATOM 195 C ASN A 13 19.850 17.152 19.824 1.00 0.00 C ATOM 196 O ASN A 13 20.562 16.435 20.512 1.00 0.00 O ATOM 197 CB ASN A 13 17.899 16.929 21.417 1.00 0.00 C ATOM 198 CG ASN A 13 17.855 17.341 22.859 1.00 0.00 C ATOM 199 OD1 ASN A 13 18.619 16.866 23.702 1.00 0.00 O ATOM 200 ND2 ASN A 13 16.936 18.250 23.142 1.00 0.00 N ATOM 0 H ASN A 13 16.919 18.049 19.460 1.00 0.00 H new ATOM 0 HA ASN A 13 19.232 18.667 21.065 1.00 0.00 H new ATOM 0 HB2 ASN A 13 16.879 16.866 21.038 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.326 15.928 21.350 1.00 0.00 H new ATOM 0 HD21 ASN A 13 16.834 18.592 24.098 1.00 0.00 H new ATOM 0 HD22 ASN A 13 16.330 18.609 22.404 1.00 0.00 H new ATOM 207 N TYR A 14 19.974 17.345 18.507 1.00 0.00 N ATOM 208 CA TYR A 14 20.990 16.718 17.696 1.00 0.00 C ATOM 209 C TYR A 14 22.448 17.014 17.952 1.00 0.00 C ATOM 210 O TYR A 14 23.273 16.136 17.680 1.00 0.00 O ATOM 211 CB TYR A 14 20.605 16.935 16.223 1.00 0.00 C ATOM 212 CG TYR A 14 21.125 15.846 15.358 1.00 0.00 C ATOM 213 CD1 TYR A 14 20.695 14.531 15.612 1.00 0.00 C ATOM 214 CD2 TYR A 14 22.018 16.096 14.319 1.00 0.00 C ATOM 215 CE1 TYR A 14 21.156 13.475 14.828 1.00 0.00 C ATOM 216 CE2 TYR A 14 22.485 15.052 13.535 1.00 0.00 C ATOM 217 CZ TYR A 14 22.047 13.753 13.798 1.00 0.00 C ATOM 218 OH TYR A 14 22.506 12.693 13.015 1.00 0.00 O ATOM 0 H TYR A 14 19.353 17.956 17.977 1.00 0.00 H new ATOM 0 HA TYR A 14 20.974 15.672 18.003 1.00 0.00 H new ATOM 0 HB2 TYR A 14 19.520 16.985 16.133 1.00 0.00 H new ATOM 0 HB3 TYR A 14 20.998 17.892 15.880 1.00 0.00 H new ATOM 0 HD1 TYR A 14 20.004 14.339 16.419 1.00 0.00 H new ATOM 0 HD2 TYR A 14 22.348 17.106 14.123 1.00 0.00 H new ATOM 0 HE1 TYR A 14 20.828 12.463 15.017 1.00 0.00 H new ATOM 0 HE2 TYR A 14 23.180 15.242 12.730 1.00 0.00 H new ATOM 0 HH TYR A 14 23.122 13.033 12.333 1.00 0.00 H new ATOM 228 N GLU A 15 22.849 18.166 18.447 1.00 0.00 N ATOM 229 CA GLU A 15 24.289 18.346 18.652 1.00 0.00 C ATOM 230 C GLU A 15 24.766 17.563 19.892 1.00 0.00 C ATOM 231 O GLU A 15 25.813 16.964 19.971 1.00 0.00 O ATOM 232 CB GLU A 15 24.660 19.812 18.841 1.00 0.00 C ATOM 233 CG GLU A 15 26.142 20.036 18.495 1.00 0.00 C ATOM 234 CD GLU A 15 26.455 21.492 18.360 1.00 0.00 C ATOM 235 OE1 GLU A 15 25.802 22.225 17.671 1.00 0.00 O ATOM 236 OE2 GLU A 15 27.495 21.784 19.086 1.00 0.00 O ATOM 0 H GLU A 15 22.251 18.952 18.704 1.00 0.00 H new ATOM 0 HA GLU A 15 24.779 17.969 17.754 1.00 0.00 H new ATOM 0 HB2 GLU A 15 24.033 20.438 18.206 1.00 0.00 H new ATOM 0 HB3 GLU A 15 24.471 20.112 19.872 1.00 0.00 H new ATOM 0 HG2 GLU A 15 26.769 19.598 19.271 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.382 19.523 17.564 1.00 0.00 H new ATOM 243 N LYS A 16 23.916 17.577 20.925 1.00 0.00 N ATOM 244 CA LYS A 16 24.217 16.881 22.165 1.00 0.00 C ATOM 245 C LYS A 16 23.954 15.377 22.091 1.00 0.00 C ATOM 246 O LYS A 16 24.567 14.562 22.763 1.00 0.00 O ATOM 247 CB LYS A 16 23.481 17.512 23.329 1.00 0.00 C ATOM 248 CG LYS A 16 24.482 17.881 24.436 1.00 0.00 C ATOM 249 CD LYS A 16 24.684 16.749 25.412 1.00 0.00 C ATOM 250 CE LYS A 16 25.793 16.985 26.430 1.00 0.00 C ATOM 251 NZ LYS A 16 25.809 18.395 26.829 1.00 0.00 N ATOM 0 H LYS A 16 23.019 18.063 20.920 1.00 0.00 H new ATOM 0 HA LYS A 16 25.289 16.991 22.330 1.00 0.00 H new ATOM 0 HB2 LYS A 16 22.948 18.403 22.995 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.733 16.820 23.717 1.00 0.00 H new ATOM 0 HG2 LYS A 16 25.438 18.148 23.986 1.00 0.00 H new ATOM 0 HG3 LYS A 16 24.124 18.761 24.970 1.00 0.00 H new ATOM 0 HD2 LYS A 16 23.749 16.574 25.945 1.00 0.00 H new ATOM 0 HD3 LYS A 16 24.907 15.840 24.854 1.00 0.00 H new ATOM 0 HE2 LYS A 16 25.638 16.352 27.304 1.00 0.00 H new ATOM 0 HE3 LYS A 16 26.757 16.708 26.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 26.322 18.496 27.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 26.283 18.958 26.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 24.833 18.733 26.948 1.00 0.00 H new ATOM 265 N PHE A 17 23.005 14.877 21.252 1.00 0.00 N ATOM 266 CA PHE A 17 22.623 13.492 21.049 1.00 0.00 C ATOM 267 C PHE A 17 23.807 12.700 20.429 1.00 0.00 C ATOM 268 O PHE A 17 24.017 11.489 20.521 1.00 0.00 O ATOM 269 CB PHE A 17 21.407 13.422 20.099 1.00 0.00 C ATOM 270 CG PHE A 17 21.546 12.449 18.938 1.00 0.00 C ATOM 271 CD1 PHE A 17 22.413 12.823 17.908 1.00 0.00 C ATOM 272 CD2 PHE A 17 20.845 11.249 18.910 1.00 0.00 C ATOM 273 CE1 PHE A 17 22.550 11.955 16.853 1.00 0.00 C ATOM 274 CE2 PHE A 17 21.000 10.376 17.820 1.00 0.00 C ATOM 275 CZ PHE A 17 21.863 10.742 16.789 1.00 0.00 C ATOM 0 H PHE A 17 22.455 15.502 20.662 1.00 0.00 H new ATOM 0 HA PHE A 17 22.361 13.052 22.011 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.528 13.145 20.681 1.00 0.00 H new ATOM 0 HB3 PHE A 17 21.223 14.418 19.697 1.00 0.00 H new ATOM 0 HD1 PHE A 17 22.954 13.757 17.940 1.00 0.00 H new ATOM 0 HD2 PHE A 17 20.184 10.989 19.723 1.00 0.00 H new ATOM 0 HE1 PHE A 17 23.214 12.221 16.043 1.00 0.00 H new ATOM 0 HE2 PHE A 17 20.461 9.441 17.782 1.00 0.00 H new ATOM 0 HZ PHE A 17 22.000 10.087 15.941 1.00 0.00 H new ATOM 285 N MET A 18 24.623 13.506 19.759 1.00 0.00 N ATOM 286 CA MET A 18 25.799 13.030 19.092 1.00 0.00 C ATOM 287 C MET A 18 26.894 12.861 20.157 1.00 0.00 C ATOM 288 O MET A 18 27.408 11.786 20.348 1.00 0.00 O ATOM 289 CB MET A 18 26.293 14.085 18.080 1.00 0.00 C ATOM 290 CG MET A 18 25.659 13.854 16.732 1.00 0.00 C ATOM 291 SD MET A 18 26.173 15.024 15.479 1.00 0.00 S ATOM 292 CE MET A 18 25.623 14.106 14.033 1.00 0.00 C ATOM 0 H MET A 18 24.474 14.511 19.671 1.00 0.00 H new ATOM 0 HA MET A 18 25.580 12.096 18.574 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.048 15.085 18.438 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.378 14.035 17.992 1.00 0.00 H new ATOM 0 HG2 MET A 18 25.901 12.846 16.395 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.575 13.903 16.838 1.00 0.00 H new ATOM 0 HE1 MET A 18 25.300 14.804 13.260 1.00 0.00 H new ATOM 0 HE2 MET A 18 26.445 13.499 13.653 1.00 0.00 H new ATOM 0 HE3 MET A 18 24.790 13.459 14.308 1.00 0.00 H new ATOM 302 N GLU A 19 27.146 14.002 20.773 1.00 0.00 N ATOM 303 CA GLU A 19 28.149 14.171 21.799 1.00 0.00 C ATOM 304 C GLU A 19 28.215 13.056 22.843 1.00 0.00 C ATOM 305 O GLU A 19 29.262 12.615 23.310 1.00 0.00 O ATOM 306 CB GLU A 19 27.745 15.414 22.629 1.00 0.00 C ATOM 307 CG GLU A 19 28.907 16.333 23.047 1.00 0.00 C ATOM 308 CD GLU A 19 29.197 17.461 22.089 1.00 0.00 C ATOM 309 OE1 GLU A 19 29.718 17.086 20.969 1.00 0.00 O ATOM 310 OE2 GLU A 19 28.958 18.606 22.351 1.00 0.00 O ATOM 0 H GLU A 19 26.639 14.862 20.563 1.00 0.00 H new ATOM 0 HA GLU A 19 29.100 14.216 21.268 1.00 0.00 H new ATOM 0 HB2 GLU A 19 27.030 16.000 22.051 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.228 15.078 23.528 1.00 0.00 H new ATOM 0 HG2 GLU A 19 28.683 16.755 24.027 1.00 0.00 H new ATOM 0 HG3 GLU A 19 29.807 15.729 23.158 1.00 0.00 H new ATOM 317 N LYS A 20 27.007 12.635 23.215 1.00 0.00 N ATOM 318 CA LYS A 20 26.947 11.610 24.271 1.00 0.00 C ATOM 319 C LYS A 20 27.281 10.207 23.847 1.00 0.00 C ATOM 320 O LYS A 20 27.713 9.408 24.698 1.00 0.00 O ATOM 321 CB LYS A 20 25.572 11.796 24.922 1.00 0.00 C ATOM 322 CG LYS A 20 25.205 13.207 25.254 1.00 0.00 C ATOM 323 CD LYS A 20 25.493 13.394 26.716 1.00 0.00 C ATOM 324 CE LYS A 20 26.888 13.865 26.994 1.00 0.00 C ATOM 325 NZ LYS A 20 27.618 12.820 27.722 1.00 0.00 N ATOM 0 H LYS A 20 26.114 12.954 22.838 1.00 0.00 H new ATOM 0 HA LYS A 20 27.748 11.756 24.996 1.00 0.00 H new ATOM 0 HB2 LYS A 20 24.814 11.389 24.253 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.539 11.205 25.837 1.00 0.00 H new ATOM 0 HG2 LYS A 20 25.783 13.909 24.653 1.00 0.00 H new ATOM 0 HG3 LYS A 20 24.153 13.394 25.040 1.00 0.00 H new ATOM 0 HD2 LYS A 20 24.786 14.114 27.129 1.00 0.00 H new ATOM 0 HD3 LYS A 20 25.326 12.450 27.235 1.00 0.00 H new ATOM 0 HE2 LYS A 20 27.399 14.097 26.059 1.00 0.00 H new ATOM 0 HE3 LYS A 20 26.864 14.783 27.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 28.587 13.144 27.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 27.133 12.619 28.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 27.652 11.955 27.146 1.00 0.00 H new ATOM 339 N MET A 21 27.107 9.834 22.564 1.00 0.00 N ATOM 340 CA MET A 21 27.418 8.491 22.139 1.00 0.00 C ATOM 341 C MET A 21 28.942 8.241 22.006 1.00 0.00 C ATOM 342 O MET A 21 29.342 7.133 21.668 1.00 0.00 O ATOM 343 CB MET A 21 26.752 8.027 20.834 1.00 0.00 C ATOM 344 CG MET A 21 25.449 8.779 20.520 1.00 0.00 C ATOM 345 SD MET A 21 24.052 7.749 20.109 1.00 0.00 S ATOM 346 CE MET A 21 22.856 9.067 19.887 1.00 0.00 C ATOM 0 H MET A 21 26.757 10.447 21.827 1.00 0.00 H new ATOM 0 HA MET A 21 26.995 7.898 22.950 1.00 0.00 H new ATOM 0 HB2 MET A 21 27.451 8.163 20.009 1.00 0.00 H new ATOM 0 HB3 MET A 21 26.541 6.960 20.901 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.186 9.392 21.382 1.00 0.00 H new ATOM 0 HG3 MET A 21 25.634 9.460 19.689 1.00 0.00 H new ATOM 0 HE1 MET A 21 21.870 8.638 19.707 1.00 0.00 H new ATOM 0 HE2 MET A 21 22.824 9.685 20.785 1.00 0.00 H new ATOM 0 HE3 MET A 21 23.145 9.681 19.034 1.00 0.00 H new ATOM 356 N GLY A 22 29.667 9.315 22.286 1.00 0.00 N ATOM 357 CA GLY A 22 31.150 9.381 22.247 1.00 0.00 C ATOM 358 C GLY A 22 31.617 10.298 21.127 1.00 0.00 C ATOM 359 O GLY A 22 32.669 10.106 20.533 1.00 0.00 O ATOM 0 H GLY A 22 29.241 10.201 22.557 1.00 0.00 H new ATOM 0 HA2 GLY A 22 31.528 9.744 23.203 1.00 0.00 H new ATOM 0 HA3 GLY A 22 31.560 8.382 22.101 1.00 0.00 H new ATOM 363 N ILE A 23 30.818 11.325 20.822 1.00 0.00 N ATOM 364 CA ILE A 23 31.173 12.257 19.758 1.00 0.00 C ATOM 365 C ILE A 23 32.014 13.360 20.358 1.00 0.00 C ATOM 366 O ILE A 23 31.513 14.090 21.204 1.00 0.00 O ATOM 367 CB ILE A 23 29.932 12.794 19.096 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.267 11.771 18.205 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.225 14.093 18.310 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.332 10.364 18.740 1.00 0.00 C ATOM 0 H ILE A 23 29.935 11.527 21.291 1.00 0.00 H new ATOM 0 HA ILE A 23 31.750 11.752 18.983 1.00 0.00 H new ATOM 0 HB ILE A 23 29.233 13.030 19.898 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.222 12.049 18.066 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.738 11.798 17.222 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.307 14.452 17.845 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.608 14.852 18.992 1.00 0.00 H new ATOM 0 HG23 ILE A 23 30.967 13.891 17.538 1.00 0.00 H new ATOM 0 HD11 ILE A 23 28.834 9.687 18.046 1.00 0.00 H new ATOM 0 HD12 ILE A 23 30.374 10.065 18.853 1.00 0.00 H new ATOM 0 HD13 ILE A 23 28.835 10.320 19.709 1.00 0.00 H new ATOM 382 N ASN A 24 33.285 13.520 19.963 1.00 0.00 N ATOM 383 CA ASN A 24 34.127 14.555 20.505 1.00 0.00 C ATOM 384 C ASN A 24 33.963 15.918 19.903 1.00 0.00 C ATOM 385 O ASN A 24 32.996 16.155 19.200 1.00 0.00 O ATOM 386 CB ASN A 24 35.612 14.092 20.619 1.00 0.00 C ATOM 387 CG ASN A 24 35.818 12.664 21.072 1.00 0.00 C ATOM 388 OD1 ASN A 24 35.624 12.331 22.233 1.00 0.00 O ATOM 389 ND2 ASN A 24 36.213 11.844 20.124 1.00 0.00 N ATOM 0 H ASN A 24 33.740 12.933 19.264 1.00 0.00 H new ATOM 0 HA ASN A 24 33.756 14.708 21.518 1.00 0.00 H new ATOM 0 HB2 ASN A 24 36.089 14.218 19.647 1.00 0.00 H new ATOM 0 HB3 ASN A 24 36.128 14.753 21.315 1.00 0.00 H new ATOM 0 HD21 ASN A 24 36.377 10.860 20.337 1.00 0.00 H new ATOM 0 HD22 ASN A 24 36.355 12.192 19.176 1.00 0.00 H new ATOM 396 N VAL A 25 34.936 16.768 20.209 1.00 0.00 N ATOM 397 CA VAL A 25 34.961 18.145 19.718 1.00 0.00 C ATOM 398 C VAL A 25 35.272 18.381 18.241 1.00 0.00 C ATOM 399 O VAL A 25 34.935 19.446 17.741 1.00 0.00 O ATOM 400 CB VAL A 25 35.527 19.184 20.668 1.00 0.00 C ATOM 401 CG1 VAL A 25 34.954 18.945 22.065 1.00 0.00 C ATOM 402 CG2 VAL A 25 37.026 19.015 20.726 1.00 0.00 C ATOM 0 H VAL A 25 35.729 16.525 20.803 1.00 0.00 H new ATOM 0 HA VAL A 25 33.889 18.342 19.727 1.00 0.00 H new ATOM 0 HB VAL A 25 35.269 20.186 20.325 1.00 0.00 H new ATOM 0 HG11 VAL A 25 35.355 19.687 22.755 1.00 0.00 H new ATOM 0 HG12 VAL A 25 33.868 19.030 22.032 1.00 0.00 H new ATOM 0 HG13 VAL A 25 35.230 17.947 22.405 1.00 0.00 H new ATOM 0 HG21 VAL A 25 37.450 19.755 21.405 1.00 0.00 H new ATOM 0 HG22 VAL A 25 37.266 18.014 21.085 1.00 0.00 H new ATOM 0 HG23 VAL A 25 37.447 19.154 19.730 1.00 0.00 H new ATOM 412 N VAL A 26 35.885 17.460 17.525 1.00 0.00 N ATOM 413 CA VAL A 26 36.209 17.576 16.103 1.00 0.00 C ATOM 414 C VAL A 26 34.962 17.767 15.262 1.00 0.00 C ATOM 415 O VAL A 26 34.969 18.274 14.140 1.00 0.00 O ATOM 416 CB VAL A 26 37.064 16.426 15.635 1.00 0.00 C ATOM 417 CG1 VAL A 26 36.392 15.091 15.915 1.00 0.00 C ATOM 418 CG2 VAL A 26 37.195 16.572 14.140 1.00 0.00 C ATOM 0 H VAL A 26 36.186 16.572 17.927 1.00 0.00 H new ATOM 0 HA VAL A 26 36.808 18.476 15.969 1.00 0.00 H new ATOM 0 HB VAL A 26 38.023 16.445 16.152 1.00 0.00 H new ATOM 0 HG11 VAL A 26 37.033 14.281 15.566 1.00 0.00 H new ATOM 0 HG12 VAL A 26 36.225 14.986 16.987 1.00 0.00 H new ATOM 0 HG13 VAL A 26 35.436 15.048 15.393 1.00 0.00 H new ATOM 0 HG21 VAL A 26 37.808 15.761 13.748 1.00 0.00 H new ATOM 0 HG22 VAL A 26 36.206 16.534 13.683 1.00 0.00 H new ATOM 0 HG23 VAL A 26 37.666 17.527 13.908 1.00 0.00 H new ATOM 428 N LYS A 27 33.865 17.323 15.891 1.00 0.00 N ATOM 429 CA LYS A 27 32.539 17.400 15.378 1.00 0.00 C ATOM 430 C LYS A 27 31.999 18.813 15.606 1.00 0.00 C ATOM 431 O LYS A 27 31.064 19.269 14.945 1.00 0.00 O ATOM 432 CB LYS A 27 31.685 16.269 15.948 1.00 0.00 C ATOM 433 CG LYS A 27 30.169 16.524 15.926 1.00 0.00 C ATOM 434 CD LYS A 27 29.523 16.881 17.262 1.00 0.00 C ATOM 435 CE LYS A 27 29.096 18.348 17.442 1.00 0.00 C ATOM 436 NZ LYS A 27 29.964 19.184 18.288 1.00 0.00 N ATOM 0 H LYS A 27 33.907 16.885 16.811 1.00 0.00 H new ATOM 0 HA LYS A 27 32.516 17.242 14.300 1.00 0.00 H new ATOM 0 HB2 LYS A 27 31.893 15.358 15.386 1.00 0.00 H new ATOM 0 HB3 LYS A 27 31.992 16.086 16.978 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.968 17.332 15.222 1.00 0.00 H new ATOM 0 HG3 LYS A 27 29.678 15.632 15.536 1.00 0.00 H new ATOM 0 HD2 LYS A 27 28.645 16.250 17.397 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.222 16.628 18.059 1.00 0.00 H new ATOM 0 HE2 LYS A 27 29.034 18.809 16.456 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.091 18.362 17.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 29.769 20.188 18.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 29.776 18.977 19.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.961 18.978 18.073 1.00 0.00 H new ATOM 595 N LYS A 37 18.739 16.317 2.587 1.00 0.00 N ATOM 596 CA LYS A 37 17.906 15.323 2.017 1.00 0.00 C ATOM 597 C LYS A 37 18.138 13.907 2.425 1.00 0.00 C ATOM 598 O LYS A 37 18.745 13.133 1.706 1.00 0.00 O ATOM 599 CB LYS A 37 17.704 15.466 0.496 1.00 0.00 C ATOM 600 CG LYS A 37 16.246 15.585 0.042 1.00 0.00 C ATOM 601 CD LYS A 37 16.093 15.205 -1.401 1.00 0.00 C ATOM 602 CE LYS A 37 17.018 15.966 -2.346 1.00 0.00 C ATOM 603 NZ LYS A 37 16.387 16.350 -3.600 1.00 0.00 N ATOM 0 HA LYS A 37 16.958 15.563 2.499 1.00 0.00 H new ATOM 0 HB2 LYS A 37 18.248 16.347 0.154 1.00 0.00 H new ATOM 0 HB3 LYS A 37 18.152 14.603 0.003 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.617 14.943 0.658 1.00 0.00 H new ATOM 0 HG3 LYS A 37 15.899 16.608 0.190 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.282 14.137 -1.506 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.060 15.377 -1.704 1.00 0.00 H new ATOM 0 HE2 LYS A 37 17.380 16.862 -1.842 1.00 0.00 H new ATOM 0 HE3 LYS A 37 17.890 15.348 -2.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 16.754 15.754 -4.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 15.358 16.223 -3.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.598 17.348 -3.804 1.00 0.00 H new ATOM 617 N LEU A 38 17.561 13.611 3.612 1.00 0.00 N ATOM 618 CA LEU A 38 17.583 12.242 4.115 1.00 0.00 C ATOM 619 C LEU A 38 16.916 11.564 2.915 1.00 0.00 C ATOM 620 O LEU A 38 17.460 10.548 2.497 1.00 0.00 O ATOM 621 CB LEU A 38 16.519 12.044 5.173 1.00 0.00 C ATOM 622 CG LEU A 38 16.555 10.871 6.155 1.00 0.00 C ATOM 623 CD1 LEU A 38 16.425 9.560 5.428 1.00 0.00 C ATOM 624 CD2 LEU A 38 17.877 10.959 6.895 1.00 0.00 C ATOM 0 H LEU A 38 17.091 14.287 4.215 1.00 0.00 H new ATOM 0 HA LEU A 38 18.562 11.932 4.480 1.00 0.00 H new ATOM 0 HB2 LEU A 38 16.500 12.954 5.772 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.564 11.986 4.650 1.00 0.00 H new ATOM 0 HG LEU A 38 15.720 10.922 6.854 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.453 8.741 6.147 1.00 0.00 H new ATOM 0 HD12 LEU A 38 15.479 9.536 4.887 1.00 0.00 H new ATOM 0 HD13 LEU A 38 17.249 9.452 4.722 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.949 10.139 7.610 1.00 0.00 H new ATOM 0 HD22 LEU A 38 18.698 10.892 6.182 1.00 0.00 H new ATOM 0 HD23 LEU A 38 17.934 11.909 7.426 1.00 0.00 H new ATOM 636 N THR A 39 15.863 12.224 2.506 1.00 0.00 N ATOM 637 CA THR A 39 14.971 11.899 1.383 1.00 0.00 C ATOM 638 C THR A 39 14.414 10.529 1.580 1.00 0.00 C ATOM 639 O THR A 39 15.101 9.734 2.205 1.00 0.00 O ATOM 640 CB THR A 39 15.737 11.953 0.020 1.00 0.00 C ATOM 641 OG1 THR A 39 16.744 12.899 0.215 1.00 0.00 O ATOM 642 CG2 THR A 39 14.838 12.259 -1.178 1.00 0.00 C ATOM 0 H THR A 39 15.568 13.078 2.979 1.00 0.00 H new ATOM 0 HA THR A 39 14.168 12.635 1.356 1.00 0.00 H new ATOM 0 HB THR A 39 16.148 10.978 -0.243 1.00 0.00 H new ATOM 0 HG1 THR A 39 17.486 12.490 0.708 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.438 12.280 -2.087 1.00 0.00 H new ATOM 0 HG22 THR A 39 14.074 11.487 -1.266 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.360 13.228 -1.036 1.00 0.00 H new ATOM 650 N ILE A 40 13.248 10.142 1.089 1.00 0.00 N ATOM 651 CA ILE A 40 12.811 8.756 1.313 1.00 0.00 C ATOM 652 C ILE A 40 12.111 8.118 0.121 1.00 0.00 C ATOM 653 O ILE A 40 11.266 8.730 -0.482 1.00 0.00 O ATOM 654 CB ILE A 40 12.058 8.618 2.630 1.00 0.00 C ATOM 655 CG1 ILE A 40 12.902 9.016 3.874 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.577 7.163 2.845 1.00 0.00 C ATOM 657 CD1 ILE A 40 12.152 9.197 5.219 1.00 0.00 C ATOM 0 H ILE A 40 12.606 10.729 0.556 1.00 0.00 H new ATOM 0 HA ILE A 40 13.717 8.159 1.411 1.00 0.00 H new ATOM 0 HB ILE A 40 11.217 9.306 2.544 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.670 8.256 4.017 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.416 9.950 3.647 1.00 0.00 H new ATOM 0 HG21 ILE A 40 11.043 7.093 3.792 1.00 0.00 H new ATOM 0 HG22 ILE A 40 10.912 6.876 2.031 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.438 6.494 2.863 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.863 9.473 5.998 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.404 9.983 5.115 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.662 8.262 5.491 1.00 0.00 H new ATOM 669 N THR A 41 12.451 6.882 -0.254 1.00 0.00 N ATOM 670 CA THR A 41 11.782 6.273 -1.393 1.00 0.00 C ATOM 671 C THR A 41 11.522 4.817 -1.184 1.00 0.00 C ATOM 672 O THR A 41 12.411 4.005 -1.468 1.00 0.00 O ATOM 673 CB THR A 41 12.554 6.447 -2.706 1.00 0.00 C ATOM 674 OG1 THR A 41 12.870 7.806 -2.865 1.00 0.00 O ATOM 675 CG2 THR A 41 11.730 6.073 -3.906 1.00 0.00 C ATOM 0 H THR A 41 13.160 6.305 0.199 1.00 0.00 H new ATOM 0 HA THR A 41 10.834 6.805 -1.473 1.00 0.00 H new ATOM 0 HB THR A 41 13.432 5.804 -2.647 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.366 7.931 -3.701 1.00 0.00 H new ATOM 0 HG21 THR A 41 12.321 6.213 -4.811 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.427 5.029 -3.828 1.00 0.00 H new ATOM 0 HG23 THR A 41 10.843 6.705 -3.950 1.00 0.00 H new ATOM 683 N GLN A 42 10.342 4.523 -0.706 1.00 0.00 N ATOM 684 CA GLN A 42 9.891 3.188 -0.431 1.00 0.00 C ATOM 685 C GLN A 42 10.225 2.277 -1.549 1.00 0.00 C ATOM 686 O GLN A 42 10.247 2.683 -2.716 1.00 0.00 O ATOM 687 CB GLN A 42 8.347 3.241 -0.313 1.00 0.00 C ATOM 688 CG GLN A 42 7.735 2.813 1.027 1.00 0.00 C ATOM 689 CD GLN A 42 7.510 1.319 1.166 1.00 0.00 C ATOM 690 OE1 GLN A 42 8.031 0.646 2.098 1.00 0.00 O ATOM 691 NE2 GLN A 42 6.718 0.806 0.220 1.00 0.00 N ATOM 0 H GLN A 42 9.644 5.235 -0.490 1.00 0.00 H new ATOM 0 HA GLN A 42 10.368 2.824 0.479 1.00 0.00 H new ATOM 0 HB2 GLN A 42 8.026 4.262 -0.521 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.926 2.609 -1.095 1.00 0.00 H new ATOM 0 HG2 GLN A 42 8.388 3.146 1.833 1.00 0.00 H new ATOM 0 HG3 GLN A 42 6.782 3.325 1.157 1.00 0.00 H new ATOM 0 HE21 GLN A 42 6.331 1.411 -0.504 1.00 0.00 H new ATOM 0 HE22 GLN A 42 6.500 -0.191 0.222 1.00 0.00 H new ATOM 700 N GLU A 43 10.504 1.027 -1.303 1.00 0.00 N ATOM 701 CA GLU A 43 10.856 0.053 -2.325 1.00 0.00 C ATOM 702 C GLU A 43 10.323 -1.271 -1.854 1.00 0.00 C ATOM 703 O GLU A 43 11.071 -2.244 -1.960 1.00 0.00 O ATOM 704 CB GLU A 43 12.378 0.129 -2.482 1.00 0.00 C ATOM 705 CG GLU A 43 12.880 0.624 -3.832 1.00 0.00 C ATOM 706 CD GLU A 43 13.833 -0.400 -4.310 1.00 0.00 C ATOM 707 OE1 GLU A 43 13.468 -1.486 -4.735 1.00 0.00 O ATOM 708 OE2 GLU A 43 15.077 -0.026 -4.228 1.00 0.00 O ATOM 0 H GLU A 43 10.495 0.636 -0.361 1.00 0.00 H new ATOM 0 HA GLU A 43 10.427 0.228 -3.312 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.772 0.785 -1.706 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.793 -0.863 -2.302 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.055 0.748 -4.534 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.366 1.595 -3.736 1.00 0.00 H new ATOM 715 N GLY A 44 9.094 -1.346 -1.355 1.00 0.00 N ATOM 716 CA GLY A 44 8.555 -2.620 -0.889 1.00 0.00 C ATOM 717 C GLY A 44 9.450 -3.005 0.289 1.00 0.00 C ATOM 718 O GLY A 44 10.253 -3.927 0.152 1.00 0.00 O ATOM 0 H GLY A 44 8.459 -0.553 -1.263 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.514 -2.522 -0.581 1.00 0.00 H new ATOM 0 HA3 GLY A 44 8.586 -3.375 -1.674 1.00 0.00 H new ATOM 722 N ASN A 45 9.245 -2.250 1.372 1.00 0.00 N ATOM 723 CA ASN A 45 9.937 -2.362 2.633 1.00 0.00 C ATOM 724 C ASN A 45 11.224 -1.506 2.460 1.00 0.00 C ATOM 725 O ASN A 45 11.148 -0.348 2.856 1.00 0.00 O ATOM 726 CB ASN A 45 10.240 -3.808 3.059 1.00 0.00 C ATOM 727 CG ASN A 45 8.976 -4.654 3.117 1.00 0.00 C ATOM 728 OD1 ASN A 45 8.340 -4.967 2.077 1.00 0.00 O ATOM 729 ND2 ASN A 45 8.587 -5.037 4.312 1.00 0.00 N ATOM 0 H ASN A 45 8.549 -1.505 1.379 1.00 0.00 H new ATOM 0 HA ASN A 45 9.310 -2.002 3.448 1.00 0.00 H new ATOM 0 HB2 ASN A 45 10.945 -4.254 2.357 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.722 -3.806 4.037 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.747 -5.605 4.417 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.125 -4.766 5.135 1.00 0.00 H new ATOM 736 N LYS A 46 12.303 -2.021 1.920 1.00 0.00 N ATOM 737 CA LYS A 46 13.519 -1.267 1.718 1.00 0.00 C ATOM 738 C LYS A 46 13.144 0.043 1.071 1.00 0.00 C ATOM 739 O LYS A 46 12.096 0.238 0.454 1.00 0.00 O ATOM 740 CB LYS A 46 14.500 -1.884 0.699 1.00 0.00 C ATOM 741 CG LYS A 46 15.069 -0.979 -0.368 1.00 0.00 C ATOM 742 CD LYS A 46 15.754 -1.815 -1.472 1.00 0.00 C ATOM 743 CE LYS A 46 15.562 -3.308 -1.372 1.00 0.00 C ATOM 744 NZ LYS A 46 16.355 -4.115 -2.334 1.00 0.00 N ATOM 0 H LYS A 46 12.363 -2.989 1.604 1.00 0.00 H new ATOM 0 HA LYS A 46 13.989 -1.212 2.700 1.00 0.00 H new ATOM 0 HB2 LYS A 46 15.334 -2.312 1.254 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.991 -2.709 0.201 1.00 0.00 H new ATOM 0 HG2 LYS A 46 14.274 -0.373 -0.802 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.789 -0.291 0.075 1.00 0.00 H new ATOM 0 HD2 LYS A 46 15.379 -1.482 -2.440 1.00 0.00 H new ATOM 0 HD3 LYS A 46 16.823 -1.602 -1.454 1.00 0.00 H new ATOM 0 HE2 LYS A 46 15.818 -3.624 -0.361 1.00 0.00 H new ATOM 0 HE3 LYS A 46 14.506 -3.533 -1.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 16.155 -5.125 -2.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 16.097 -3.849 -3.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.369 -3.937 -2.184 1.00 0.00 H new ATOM 758 N PHE A 47 14.098 0.972 1.214 1.00 0.00 N ATOM 759 CA PHE A 47 13.864 2.249 0.590 1.00 0.00 C ATOM 760 C PHE A 47 15.117 3.040 0.283 1.00 0.00 C ATOM 761 O PHE A 47 16.044 3.290 1.012 1.00 0.00 O ATOM 762 CB PHE A 47 12.896 3.115 1.461 1.00 0.00 C ATOM 763 CG PHE A 47 13.375 3.510 2.813 1.00 0.00 C ATOM 764 CD1 PHE A 47 14.539 3.097 3.435 1.00 0.00 C ATOM 765 CD2 PHE A 47 12.571 4.384 3.543 1.00 0.00 C ATOM 766 CE1 PHE A 47 14.943 3.492 4.698 1.00 0.00 C ATOM 767 CE2 PHE A 47 12.960 4.808 4.829 1.00 0.00 C ATOM 768 CZ PHE A 47 14.143 4.364 5.407 1.00 0.00 C ATOM 0 H PHE A 47 14.976 0.865 1.722 1.00 0.00 H new ATOM 0 HA PHE A 47 13.410 2.017 -0.373 1.00 0.00 H new ATOM 0 HB2 PHE A 47 12.662 4.023 0.906 1.00 0.00 H new ATOM 0 HB3 PHE A 47 11.963 2.564 1.580 1.00 0.00 H new ATOM 0 HD1 PHE A 47 15.180 2.416 2.895 1.00 0.00 H new ATOM 0 HD2 PHE A 47 11.643 4.739 3.120 1.00 0.00 H new ATOM 0 HE1 PHE A 47 15.867 3.125 5.121 1.00 0.00 H new ATOM 0 HE2 PHE A 47 12.327 5.491 5.376 1.00 0.00 H new ATOM 0 HZ PHE A 47 14.431 4.696 6.394 1.00 0.00 H new ATOM 778 N THR A 48 15.139 3.486 -0.967 1.00 0.00 N ATOM 779 CA THR A 48 16.172 4.252 -1.556 1.00 0.00 C ATOM 780 C THR A 48 16.056 5.583 -0.939 1.00 0.00 C ATOM 781 O THR A 48 15.522 6.535 -1.525 1.00 0.00 O ATOM 782 CB THR A 48 16.048 4.382 -3.106 1.00 0.00 C ATOM 783 OG1 THR A 48 15.703 3.137 -3.660 1.00 0.00 O ATOM 784 CG2 THR A 48 17.329 4.941 -3.750 1.00 0.00 C ATOM 0 H THR A 48 14.376 3.297 -1.618 1.00 0.00 H new ATOM 0 HA THR A 48 17.134 3.769 -1.385 1.00 0.00 H new ATOM 0 HB THR A 48 15.257 5.101 -3.320 1.00 0.00 H new ATOM 0 HG1 THR A 48 15.624 3.222 -4.633 1.00 0.00 H new ATOM 0 HG21 THR A 48 17.192 5.012 -4.829 1.00 0.00 H new ATOM 0 HG22 THR A 48 17.538 5.931 -3.344 1.00 0.00 H new ATOM 0 HG23 THR A 48 18.165 4.276 -3.533 1.00 0.00 H new ATOM 792 N VAL A 49 16.557 5.693 0.269 1.00 0.00 N ATOM 793 CA VAL A 49 16.500 7.004 0.978 1.00 0.00 C ATOM 794 C VAL A 49 17.738 7.682 0.427 1.00 0.00 C ATOM 795 O VAL A 49 18.659 6.932 0.111 1.00 0.00 O ATOM 796 CB VAL A 49 16.555 6.921 2.470 1.00 0.00 C ATOM 797 CG1 VAL A 49 15.695 5.760 3.005 1.00 0.00 C ATOM 798 CG2 VAL A 49 17.977 6.787 3.038 1.00 0.00 C ATOM 0 H VAL A 49 16.999 4.935 0.789 1.00 0.00 H new ATOM 0 HA VAL A 49 15.555 7.520 0.810 1.00 0.00 H new ATOM 0 HB VAL A 49 16.154 7.875 2.811 1.00 0.00 H new ATOM 0 HG11 VAL A 49 15.759 5.731 4.093 1.00 0.00 H new ATOM 0 HG12 VAL A 49 14.657 5.909 2.707 1.00 0.00 H new ATOM 0 HG13 VAL A 49 16.059 4.818 2.595 1.00 0.00 H new ATOM 0 HG21 VAL A 49 17.931 6.733 4.126 1.00 0.00 H new ATOM 0 HG22 VAL A 49 18.440 5.880 2.649 1.00 0.00 H new ATOM 0 HG23 VAL A 49 18.570 7.653 2.743 1.00 0.00 H new ATOM 808 N LYS A 50 17.788 8.974 0.315 1.00 0.00 N ATOM 809 CA LYS A 50 19.005 9.580 -0.219 1.00 0.00 C ATOM 810 C LYS A 50 19.825 9.801 1.017 1.00 0.00 C ATOM 811 O LYS A 50 20.102 8.736 1.615 1.00 0.00 O ATOM 812 CB LYS A 50 18.843 10.859 -0.961 1.00 0.00 C ATOM 813 CG LYS A 50 18.186 10.769 -2.298 1.00 0.00 C ATOM 814 CD LYS A 50 17.778 12.163 -2.711 1.00 0.00 C ATOM 815 CE LYS A 50 18.826 12.678 -3.660 1.00 0.00 C ATOM 816 NZ LYS A 50 18.585 12.070 -4.956 1.00 0.00 N ATOM 0 H LYS A 50 17.042 9.621 0.570 1.00 0.00 H new ATOM 0 HA LYS A 50 19.439 8.929 -0.978 1.00 0.00 H new ATOM 0 HB2 LYS A 50 18.264 11.543 -0.341 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.829 11.305 -1.093 1.00 0.00 H new ATOM 0 HG2 LYS A 50 18.869 10.339 -3.030 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.315 10.115 -2.252 1.00 0.00 H new ATOM 0 HD2 LYS A 50 16.799 12.150 -3.191 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.697 12.813 -1.840 1.00 0.00 H new ATOM 0 HE2 LYS A 50 18.776 13.764 -3.732 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.824 12.428 -3.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 19.485 11.738 -5.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 17.936 11.264 -4.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 18.160 12.772 -5.595 1.00 0.00 H new ATOM 830 N GLU A 51 20.138 11.032 1.337 1.00 0.00 N ATOM 831 CA GLU A 51 20.921 11.461 2.465 1.00 0.00 C ATOM 832 C GLU A 51 22.169 12.088 1.867 1.00 0.00 C ATOM 833 O GLU A 51 23.294 11.736 2.194 1.00 0.00 O ATOM 834 CB GLU A 51 21.504 10.342 3.274 1.00 0.00 C ATOM 835 CG GLU A 51 22.056 10.761 4.636 1.00 0.00 C ATOM 836 CD GLU A 51 22.037 9.660 5.636 1.00 0.00 C ATOM 837 OE1 GLU A 51 22.663 8.507 5.286 1.00 0.00 O ATOM 838 OE2 GLU A 51 21.478 9.853 6.671 1.00 0.00 O ATOM 0 H GLU A 51 19.826 11.820 0.770 1.00 0.00 H new ATOM 0 HA GLU A 51 20.272 12.077 3.087 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.737 9.583 3.426 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.305 9.875 2.700 1.00 0.00 H new ATOM 0 HG2 GLU A 51 23.080 11.115 4.513 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.472 11.599 5.016 1.00 0.00 H new ATOM 845 N SER A 52 21.932 13.016 0.992 1.00 0.00 N ATOM 846 CA SER A 52 23.094 13.648 0.370 1.00 0.00 C ATOM 847 C SER A 52 23.275 14.919 1.214 1.00 0.00 C ATOM 848 O SER A 52 23.011 15.985 0.688 1.00 0.00 O ATOM 849 CB SER A 52 22.925 13.972 -1.069 1.00 0.00 C ATOM 850 OG SER A 52 23.515 12.925 -1.804 1.00 0.00 O ATOM 0 H SER A 52 21.015 13.349 0.695 1.00 0.00 H new ATOM 0 HA SER A 52 23.955 12.980 0.364 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.869 14.070 -1.320 1.00 0.00 H new ATOM 0 HB3 SER A 52 23.399 14.924 -1.307 1.00 0.00 H new ATOM 0 HG SER A 52 23.421 13.105 -2.763 1.00 0.00 H new ATOM 856 N SER A 53 23.691 14.696 2.438 1.00 0.00 N ATOM 857 CA SER A 53 23.889 15.799 3.383 1.00 0.00 C ATOM 858 C SER A 53 24.949 16.743 2.903 1.00 0.00 C ATOM 859 O SER A 53 25.397 16.656 1.759 1.00 0.00 O ATOM 860 CB SER A 53 24.180 15.339 4.824 1.00 0.00 C ATOM 861 OG SER A 53 24.553 13.989 4.892 1.00 0.00 O ATOM 0 H SER A 53 23.901 13.771 2.813 1.00 0.00 H new ATOM 0 HA SER A 53 22.936 16.326 3.420 1.00 0.00 H new ATOM 0 HB2 SER A 53 24.976 15.954 5.245 1.00 0.00 H new ATOM 0 HB3 SER A 53 23.294 15.499 5.439 1.00 0.00 H new ATOM 0 HG SER A 53 24.729 13.745 5.825 1.00 0.00 H new ATOM 867 N ASN A 54 25.414 17.684 3.714 1.00 0.00 N ATOM 868 CA ASN A 54 26.463 18.621 3.259 1.00 0.00 C ATOM 869 C ASN A 54 27.765 17.974 2.915 1.00 0.00 C ATOM 870 O ASN A 54 28.761 18.705 2.733 1.00 0.00 O ATOM 871 CB ASN A 54 26.776 19.636 4.390 1.00 0.00 C ATOM 872 CG ASN A 54 27.305 20.956 3.904 1.00 0.00 C ATOM 873 OD1 ASN A 54 27.096 21.281 2.731 1.00 0.00 O ATOM 874 ND2 ASN A 54 27.986 21.746 4.732 1.00 0.00 N ATOM 0 H ASN A 54 25.097 17.827 4.673 1.00 0.00 H new ATOM 0 HA ASN A 54 26.057 19.082 2.358 1.00 0.00 H new ATOM 0 HB2 ASN A 54 25.868 19.811 4.967 1.00 0.00 H new ATOM 0 HB3 ASN A 54 27.505 19.193 5.069 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.347 22.641 4.401 1.00 0.00 H new ATOM 0 HD22 ASN A 54 28.146 21.456 5.697 1.00 0.00 H new ATOM 881 N PHE A 55 27.900 16.683 2.797 1.00 0.00 N ATOM 882 CA PHE A 55 29.180 16.064 2.458 1.00 0.00 C ATOM 883 C PHE A 55 29.121 14.610 2.213 1.00 0.00 C ATOM 884 O PHE A 55 29.850 14.118 1.362 1.00 0.00 O ATOM 885 CB PHE A 55 30.236 16.239 3.532 1.00 0.00 C ATOM 886 CG PHE A 55 29.665 16.519 4.869 1.00 0.00 C ATOM 887 CD1 PHE A 55 29.218 15.495 5.706 1.00 0.00 C ATOM 888 CD2 PHE A 55 29.564 17.834 5.315 1.00 0.00 C ATOM 889 CE1 PHE A 55 28.679 15.770 6.965 1.00 0.00 C ATOM 890 CE2 PHE A 55 29.026 18.094 6.572 1.00 0.00 C ATOM 891 CZ PHE A 55 28.583 17.078 7.397 1.00 0.00 C ATOM 0 H PHE A 55 27.137 16.019 2.930 1.00 0.00 H new ATOM 0 HA PHE A 55 29.440 16.593 1.541 1.00 0.00 H new ATOM 0 HB2 PHE A 55 30.844 15.336 3.585 1.00 0.00 H new ATOM 0 HB3 PHE A 55 30.901 17.055 3.250 1.00 0.00 H new ATOM 0 HD1 PHE A 55 29.290 14.470 5.374 1.00 0.00 H new ATOM 0 HD2 PHE A 55 29.901 18.647 4.689 1.00 0.00 H new ATOM 0 HE1 PHE A 55 28.339 14.963 7.598 1.00 0.00 H new ATOM 0 HE2 PHE A 55 28.953 19.117 6.911 1.00 0.00 H new ATOM 0 HZ PHE A 55 28.167 17.304 8.368 1.00 0.00 H new ATOM 901 N ARG A 56 28.251 13.941 2.953 1.00 0.00 N ATOM 902 CA ARG A 56 28.064 12.501 2.820 1.00 0.00 C ATOM 903 C ARG A 56 27.080 12.271 1.697 1.00 0.00 C ATOM 904 O ARG A 56 26.013 11.698 1.896 1.00 0.00 O ATOM 905 CB ARG A 56 27.401 11.853 4.023 1.00 0.00 C ATOM 906 CG ARG A 56 28.308 11.735 5.251 1.00 0.00 C ATOM 907 CD ARG A 56 29.538 10.920 4.934 1.00 0.00 C ATOM 908 NE ARG A 56 29.918 10.086 6.078 1.00 0.00 N ATOM 909 CZ ARG A 56 29.119 9.159 6.615 1.00 0.00 C ATOM 910 NH1 ARG A 56 27.906 8.949 6.120 1.00 0.00 N ATOM 911 NH2 ARG A 56 29.527 8.451 7.634 1.00 0.00 N ATOM 0 H ARG A 56 27.657 14.376 3.659 1.00 0.00 H new ATOM 0 HA ARG A 56 29.058 12.078 2.675 1.00 0.00 H new ATOM 0 HB2 ARG A 56 26.517 12.431 4.292 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.057 10.858 3.742 1.00 0.00 H new ATOM 0 HG2 ARG A 56 28.602 12.729 5.588 1.00 0.00 H new ATOM 0 HG3 ARG A 56 27.760 11.270 6.070 1.00 0.00 H new ATOM 0 HD2 ARG A 56 29.348 10.289 4.065 1.00 0.00 H new ATOM 0 HD3 ARG A 56 30.362 11.584 4.672 1.00 0.00 H new ATOM 0 HE ARG A 56 30.843 10.221 6.487 1.00 0.00 H new ATOM 0 HH11 ARG A 56 27.578 9.497 5.325 1.00 0.00 H new ATOM 0 HH12 ARG A 56 27.302 8.240 6.535 1.00 0.00 H new ATOM 0 HH21 ARG A 56 30.458 8.605 8.022 1.00 0.00 H new ATOM 0 HH22 ARG A 56 28.915 7.744 8.042 1.00 0.00 H new ATOM 925 N ASN A 57 27.511 12.743 0.577 1.00 0.00 N ATOM 926 CA ASN A 57 26.687 12.620 -0.601 1.00 0.00 C ATOM 927 C ASN A 57 26.586 11.131 -0.795 1.00 0.00 C ATOM 928 O ASN A 57 27.484 10.398 -1.164 1.00 0.00 O ATOM 929 CB ASN A 57 27.316 13.412 -1.758 1.00 0.00 C ATOM 930 CG ASN A 57 28.406 12.643 -2.465 1.00 0.00 C ATOM 931 OD1 ASN A 57 29.602 12.749 -2.116 1.00 0.00 O ATOM 932 ND2 ASN A 57 28.000 11.872 -3.448 1.00 0.00 N ATOM 0 H ASN A 57 28.408 13.210 0.441 1.00 0.00 H new ATOM 0 HA ASN A 57 25.686 13.046 -0.529 1.00 0.00 H new ATOM 0 HB2 ASN A 57 26.540 13.677 -2.476 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.727 14.346 -1.373 1.00 0.00 H new ATOM 0 HD21 ASN A 57 28.676 11.317 -3.974 1.00 0.00 H new ATOM 0 HD22 ASN A 57 27.009 11.828 -3.686 1.00 0.00 H new ATOM 939 N ILE A 58 25.385 10.623 -0.522 1.00 0.00 N ATOM 940 CA ILE A 58 25.138 9.235 -0.657 1.00 0.00 C ATOM 941 C ILE A 58 23.653 8.983 -0.367 1.00 0.00 C ATOM 942 O ILE A 58 23.016 9.808 0.296 1.00 0.00 O ATOM 943 CB ILE A 58 25.889 8.363 0.313 1.00 0.00 C ATOM 944 CG1 ILE A 58 26.389 7.071 -0.333 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.069 7.990 1.524 1.00 0.00 C ATOM 946 CD1 ILE A 58 27.698 7.296 -1.069 1.00 0.00 C ATOM 0 H ILE A 58 24.585 11.172 -0.208 1.00 0.00 H new ATOM 0 HA ILE A 58 25.458 8.978 -1.667 1.00 0.00 H new ATOM 0 HB ILE A 58 26.737 8.971 0.627 1.00 0.00 H new ATOM 0 HG12 ILE A 58 26.526 6.308 0.433 1.00 0.00 H new ATOM 0 HG13 ILE A 58 25.638 6.694 -1.028 1.00 0.00 H new ATOM 0 HG21 ILE A 58 25.664 7.361 2.186 1.00 0.00 H new ATOM 0 HG22 ILE A 58 24.770 8.895 2.054 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.180 7.445 1.207 1.00 0.00 H new ATOM 0 HD11 ILE A 58 28.029 6.359 -1.518 1.00 0.00 H new ATOM 0 HD12 ILE A 58 27.552 8.042 -1.851 1.00 0.00 H new ATOM 0 HD13 ILE A 58 28.454 7.649 -0.367 1.00 0.00 H new ATOM 958 N ASP A 59 23.246 7.864 -0.896 1.00 0.00 N ATOM 959 CA ASP A 59 21.844 7.493 -0.711 1.00 0.00 C ATOM 960 C ASP A 59 21.880 6.123 -0.133 1.00 0.00 C ATOM 961 O ASP A 59 22.775 5.355 -0.512 1.00 0.00 O ATOM 962 CB ASP A 59 21.228 7.429 -2.127 1.00 0.00 C ATOM 963 CG ASP A 59 19.911 6.780 -2.330 1.00 0.00 C ATOM 964 OD1 ASP A 59 19.901 5.489 -2.169 1.00 0.00 O ATOM 965 OD2 ASP A 59 18.937 7.461 -2.629 1.00 0.00 O ATOM 0 H ASP A 59 23.818 7.213 -1.434 1.00 0.00 H new ATOM 0 HA ASP A 59 21.279 8.178 -0.079 1.00 0.00 H new ATOM 0 HB2 ASP A 59 21.145 8.453 -2.492 1.00 0.00 H new ATOM 0 HB3 ASP A 59 21.945 6.918 -2.770 1.00 0.00 H new ATOM 970 N VAL A 60 20.980 5.774 0.747 1.00 0.00 N ATOM 971 CA VAL A 60 20.988 4.474 1.333 1.00 0.00 C ATOM 972 C VAL A 60 19.733 3.733 0.982 1.00 0.00 C ATOM 973 O VAL A 60 18.639 4.291 0.878 1.00 0.00 O ATOM 974 CB VAL A 60 21.164 4.635 2.854 1.00 0.00 C ATOM 975 CG1 VAL A 60 20.928 3.362 3.613 1.00 0.00 C ATOM 976 CG2 VAL A 60 22.560 5.122 3.177 1.00 0.00 C ATOM 0 H VAL A 60 20.229 6.383 1.072 1.00 0.00 H new ATOM 0 HA VAL A 60 21.816 3.881 0.944 1.00 0.00 H new ATOM 0 HB VAL A 60 20.414 5.362 3.164 1.00 0.00 H new ATOM 0 HG11 VAL A 60 21.068 3.543 4.679 1.00 0.00 H new ATOM 0 HG12 VAL A 60 19.910 3.015 3.434 1.00 0.00 H new ATOM 0 HG13 VAL A 60 21.634 2.602 3.278 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.667 5.230 4.256 1.00 0.00 H new ATOM 0 HG22 VAL A 60 23.291 4.401 2.810 1.00 0.00 H new ATOM 0 HG23 VAL A 60 22.729 6.086 2.697 1.00 0.00 H new ATOM 986 N VAL A 61 19.905 2.424 0.793 1.00 0.00 N ATOM 987 CA VAL A 61 18.835 1.503 0.451 1.00 0.00 C ATOM 988 C VAL A 61 18.983 0.174 1.135 1.00 0.00 C ATOM 989 O VAL A 61 19.867 -0.617 0.837 1.00 0.00 O ATOM 990 CB VAL A 61 18.748 1.239 -1.035 1.00 0.00 C ATOM 991 CG1 VAL A 61 17.297 1.185 -1.543 1.00 0.00 C ATOM 992 CG2 VAL A 61 19.492 2.317 -1.854 1.00 0.00 C ATOM 0 H VAL A 61 20.815 1.970 0.877 1.00 0.00 H new ATOM 0 HA VAL A 61 17.927 2.000 0.792 1.00 0.00 H new ATOM 0 HB VAL A 61 19.218 0.266 -1.177 1.00 0.00 H new ATOM 0 HG11 VAL A 61 17.294 0.993 -2.616 1.00 0.00 H new ATOM 0 HG12 VAL A 61 16.761 0.386 -1.030 1.00 0.00 H new ATOM 0 HG13 VAL A 61 16.806 2.138 -1.344 1.00 0.00 H new ATOM 0 HG21 VAL A 61 19.406 2.091 -2.917 1.00 0.00 H new ATOM 0 HG22 VAL A 61 19.052 3.294 -1.654 1.00 0.00 H new ATOM 0 HG23 VAL A 61 20.544 2.328 -1.570 1.00 0.00 H new ATOM 1002 N PHE A 62 18.087 -0.057 2.074 1.00 0.00 N ATOM 1003 CA PHE A 62 18.165 -1.314 2.771 1.00 0.00 C ATOM 1004 C PHE A 62 16.786 -1.724 3.290 1.00 0.00 C ATOM 1005 O PHE A 62 16.081 -0.857 3.813 1.00 0.00 O ATOM 1006 CB PHE A 62 19.222 -1.379 3.878 1.00 0.00 C ATOM 1007 CG PHE A 62 19.445 -0.161 4.756 1.00 0.00 C ATOM 1008 CD1 PHE A 62 18.462 0.522 5.403 1.00 0.00 C ATOM 1009 CD2 PHE A 62 20.745 0.323 4.940 1.00 0.00 C ATOM 1010 CE1 PHE A 62 18.699 1.637 6.206 1.00 0.00 C ATOM 1011 CE2 PHE A 62 21.049 1.414 5.722 1.00 0.00 C ATOM 1012 CZ PHE A 62 19.997 2.082 6.366 1.00 0.00 C ATOM 0 H PHE A 62 17.337 0.573 2.358 1.00 0.00 H new ATOM 0 HA PHE A 62 18.506 -2.036 2.029 1.00 0.00 H new ATOM 0 HB2 PHE A 62 18.963 -2.212 4.531 1.00 0.00 H new ATOM 0 HB3 PHE A 62 20.175 -1.625 3.409 1.00 0.00 H new ATOM 0 HD1 PHE A 62 17.443 0.182 5.288 1.00 0.00 H new ATOM 0 HD2 PHE A 62 21.555 -0.188 4.441 1.00 0.00 H new ATOM 0 HE1 PHE A 62 17.881 2.145 6.695 1.00 0.00 H new ATOM 0 HE2 PHE A 62 22.070 1.747 5.837 1.00 0.00 H new ATOM 0 HZ PHE A 62 20.201 2.943 6.986 1.00 0.00 H new ATOM 1022 N GLU A 63 16.491 -2.998 3.115 1.00 0.00 N ATOM 1023 CA GLU A 63 15.242 -3.632 3.517 1.00 0.00 C ATOM 1024 C GLU A 63 15.065 -3.217 4.974 1.00 0.00 C ATOM 1025 O GLU A 63 15.559 -3.874 5.920 1.00 0.00 O ATOM 1026 CB GLU A 63 15.165 -5.157 3.436 1.00 0.00 C ATOM 1027 CG GLU A 63 15.192 -5.596 1.949 1.00 0.00 C ATOM 1028 CD GLU A 63 14.864 -7.040 1.761 1.00 0.00 C ATOM 1029 OE1 GLU A 63 14.979 -7.733 2.859 1.00 0.00 O ATOM 1030 OE2 GLU A 63 14.528 -7.482 0.674 1.00 0.00 O ATOM 0 H GLU A 63 17.139 -3.649 2.671 1.00 0.00 H new ATOM 0 HA GLU A 63 14.471 -3.308 2.818 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.002 -5.603 3.974 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.252 -5.512 3.915 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.482 -4.991 1.385 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.180 -5.397 1.535 1.00 0.00 H new ATOM 1037 N LEU A 64 14.350 -2.100 5.189 1.00 0.00 N ATOM 1038 CA LEU A 64 14.075 -1.535 6.483 1.00 0.00 C ATOM 1039 C LEU A 64 15.364 -1.376 7.290 1.00 0.00 C ATOM 1040 O LEU A 64 16.078 -0.422 7.009 1.00 0.00 O ATOM 1041 CB LEU A 64 13.038 -2.381 7.236 1.00 0.00 C ATOM 1042 CG LEU A 64 11.574 -2.337 6.706 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.779 -1.452 7.661 1.00 0.00 C ATOM 1044 CD2 LEU A 64 11.475 -1.735 5.314 1.00 0.00 C ATOM 0 H LEU A 64 13.941 -1.560 4.426 1.00 0.00 H new ATOM 0 HA LEU A 64 13.650 -0.541 6.343 1.00 0.00 H new ATOM 0 HB2 LEU A 64 13.372 -3.418 7.223 1.00 0.00 H new ATOM 0 HB3 LEU A 64 13.031 -2.061 8.278 1.00 0.00 H new ATOM 0 HG LEU A 64 11.193 -3.357 6.652 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.743 -1.393 7.326 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.812 -1.877 8.664 1.00 0.00 H new ATOM 0 HD13 LEU A 64 11.213 -0.452 7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.433 -1.729 4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 64 11.855 -0.714 5.331 1.00 0.00 H new ATOM 0 HD23 LEU A 64 12.065 -2.330 4.617 1.00 0.00 H new ATOM 1056 N GLY A 65 15.580 -2.278 8.221 1.00 0.00 N ATOM 1057 CA GLY A 65 16.800 -2.150 9.044 1.00 0.00 C ATOM 1058 C GLY A 65 17.998 -3.024 8.688 1.00 0.00 C ATOM 1059 O GLY A 65 18.873 -2.477 7.993 1.00 0.00 O ATOM 0 H GLY A 65 14.976 -3.072 8.434 1.00 0.00 H new ATOM 0 HA2 GLY A 65 17.122 -1.109 9.004 1.00 0.00 H new ATOM 0 HA3 GLY A 65 16.529 -2.360 10.079 1.00 0.00 H new ATOM 1063 N VAL A 66 18.076 -4.274 9.103 1.00 0.00 N ATOM 1064 CA VAL A 66 19.190 -5.184 8.820 1.00 0.00 C ATOM 1065 C VAL A 66 20.419 -4.654 9.575 1.00 0.00 C ATOM 1066 O VAL A 66 20.795 -3.493 9.550 1.00 0.00 O ATOM 1067 CB VAL A 66 19.421 -5.449 7.364 1.00 0.00 C ATOM 1068 CG1 VAL A 66 18.080 -5.493 6.610 1.00 0.00 C ATOM 1069 CG2 VAL A 66 20.286 -4.437 6.638 1.00 0.00 C ATOM 0 H VAL A 66 17.344 -4.707 9.667 1.00 0.00 H new ATOM 0 HA VAL A 66 18.944 -6.182 9.184 1.00 0.00 H new ATOM 0 HB VAL A 66 19.952 -6.401 7.360 1.00 0.00 H new ATOM 0 HG11 VAL A 66 18.263 -5.686 5.553 1.00 0.00 H new ATOM 0 HG12 VAL A 66 17.457 -6.287 7.022 1.00 0.00 H new ATOM 0 HG13 VAL A 66 17.569 -4.537 6.721 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.386 -4.728 5.592 1.00 0.00 H new ATOM 0 HG22 VAL A 66 19.822 -3.452 6.698 1.00 0.00 H new ATOM 0 HG23 VAL A 66 21.272 -4.403 7.101 1.00 0.00 H new ATOM 1079 N ASP A 67 21.098 -5.521 10.304 1.00 0.00 N ATOM 1080 CA ASP A 67 22.267 -5.115 11.067 1.00 0.00 C ATOM 1081 C ASP A 67 23.304 -4.356 10.340 1.00 0.00 C ATOM 1082 O ASP A 67 23.393 -4.402 9.098 1.00 0.00 O ATOM 1083 CB ASP A 67 22.731 -6.264 12.014 1.00 0.00 C ATOM 1084 CG ASP A 67 22.938 -7.577 11.345 1.00 0.00 C ATOM 1085 OD1 ASP A 67 23.936 -7.645 10.500 1.00 0.00 O ATOM 1086 OD2 ASP A 67 22.210 -8.518 11.588 1.00 0.00 O ATOM 0 H ASP A 67 20.861 -6.510 10.385 1.00 0.00 H new ATOM 0 HA ASP A 67 21.952 -4.307 11.727 1.00 0.00 H new ATOM 0 HB2 ASP A 67 23.663 -5.966 12.495 1.00 0.00 H new ATOM 0 HB3 ASP A 67 21.990 -6.387 12.804 1.00 0.00 H new ATOM 1091 N PHE A 68 24.123 -3.626 11.108 1.00 0.00 N ATOM 1092 CA PHE A 68 25.166 -2.845 10.466 1.00 0.00 C ATOM 1093 C PHE A 68 26.479 -2.843 11.211 1.00 0.00 C ATOM 1094 O PHE A 68 27.292 -3.735 10.920 1.00 0.00 O ATOM 1095 CB PHE A 68 24.693 -1.393 10.095 1.00 0.00 C ATOM 1096 CG PHE A 68 23.650 -1.444 9.026 1.00 0.00 C ATOM 1097 CD1 PHE A 68 24.007 -1.949 7.751 1.00 0.00 C ATOM 1098 CD2 PHE A 68 22.360 -1.008 9.279 1.00 0.00 C ATOM 1099 CE1 PHE A 68 23.041 -2.006 6.748 1.00 0.00 C ATOM 1100 CE2 PHE A 68 21.392 -1.055 8.293 1.00 0.00 C ATOM 1101 CZ PHE A 68 21.779 -1.561 7.053 1.00 0.00 C ATOM 0 H PHE A 68 24.083 -3.565 12.125 1.00 0.00 H new ATOM 0 HA PHE A 68 25.366 -3.364 9.529 1.00 0.00 H new ATOM 0 HB2 PHE A 68 24.293 -0.897 10.979 1.00 0.00 H new ATOM 0 HB3 PHE A 68 25.543 -0.802 9.755 1.00 0.00 H new ATOM 0 HD1 PHE A 68 25.015 -2.286 7.559 1.00 0.00 H new ATOM 0 HD2 PHE A 68 22.107 -0.627 10.257 1.00 0.00 H new ATOM 0 HE1 PHE A 68 23.277 -2.387 5.765 1.00 0.00 H new ATOM 0 HE2 PHE A 68 20.383 -0.716 8.475 1.00 0.00 H new ATOM 0 HZ PHE A 68 21.031 -1.606 6.275 1.00 0.00 H new ATOM 1111 N ALA A 69 26.617 -1.883 12.088 1.00 0.00 N ATOM 1112 CA ALA A 69 27.768 -1.606 12.928 1.00 0.00 C ATOM 1113 C ALA A 69 28.559 -0.477 12.248 1.00 0.00 C ATOM 1114 O ALA A 69 29.768 -0.461 12.098 1.00 0.00 O ATOM 1115 CB ALA A 69 28.666 -2.791 13.112 1.00 0.00 C ATOM 0 H ALA A 69 25.865 -1.213 12.252 1.00 0.00 H new ATOM 0 HA ALA A 69 27.413 -1.332 13.922 1.00 0.00 H new ATOM 0 HB1 ALA A 69 29.506 -2.515 13.750 1.00 0.00 H new ATOM 0 HB2 ALA A 69 28.107 -3.602 13.579 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.039 -3.119 12.142 1.00 0.00 H new ATOM 1121 N TYR A 70 27.747 0.504 11.830 1.00 0.00 N ATOM 1122 CA TYR A 70 28.223 1.686 11.153 1.00 0.00 C ATOM 1123 C TYR A 70 27.798 2.857 11.997 1.00 0.00 C ATOM 1124 O TYR A 70 26.644 3.096 12.197 1.00 0.00 O ATOM 1125 CB TYR A 70 27.543 1.768 9.769 1.00 0.00 C ATOM 1126 CG TYR A 70 26.866 3.104 9.448 1.00 0.00 C ATOM 1127 CD1 TYR A 70 27.663 4.183 9.149 1.00 0.00 C ATOM 1128 CD2 TYR A 70 25.483 3.299 9.441 1.00 0.00 C ATOM 1129 CE1 TYR A 70 27.098 5.439 8.846 1.00 0.00 C ATOM 1130 CE2 TYR A 70 24.921 4.554 9.139 1.00 0.00 C ATOM 1131 CZ TYR A 70 25.725 5.643 8.838 1.00 0.00 C ATOM 1132 OH TYR A 70 25.136 6.856 8.549 1.00 0.00 O ATOM 0 H TYR A 70 26.736 0.485 11.960 1.00 0.00 H new ATOM 0 HA TYR A 70 29.304 1.674 11.016 1.00 0.00 H new ATOM 0 HB2 TYR A 70 28.291 1.566 9.003 1.00 0.00 H new ATOM 0 HB3 TYR A 70 26.797 0.976 9.702 1.00 0.00 H new ATOM 0 HD1 TYR A 70 28.737 4.067 9.146 1.00 0.00 H new ATOM 0 HD2 TYR A 70 24.831 2.470 9.672 1.00 0.00 H new ATOM 0 HE1 TYR A 70 27.752 6.266 8.613 1.00 0.00 H new ATOM 0 HE2 TYR A 70 23.847 4.670 9.142 1.00 0.00 H new ATOM 0 HH TYR A 70 24.161 6.767 8.601 1.00 0.00 H new ATOM 1142 N SER A 71 28.784 3.601 12.505 1.00 0.00 N ATOM 1143 CA SER A 71 28.583 4.741 13.327 1.00 0.00 C ATOM 1144 C SER A 71 27.530 5.712 12.803 1.00 0.00 C ATOM 1145 O SER A 71 27.071 5.734 11.670 1.00 0.00 O ATOM 1146 CB SER A 71 29.851 5.557 13.452 1.00 0.00 C ATOM 1147 OG SER A 71 29.887 6.729 12.671 1.00 0.00 O ATOM 0 H SER A 71 29.769 3.398 12.335 1.00 0.00 H new ATOM 0 HA SER A 71 28.256 4.319 14.277 1.00 0.00 H new ATOM 0 HB2 SER A 71 29.986 5.832 14.498 1.00 0.00 H new ATOM 0 HB3 SER A 71 30.698 4.929 13.176 1.00 0.00 H new ATOM 0 HG SER A 71 30.783 6.842 12.291 1.00 0.00 H new ATOM 1153 N LEU A 72 27.145 6.556 13.711 1.00 0.00 N ATOM 1154 CA LEU A 72 26.157 7.597 13.521 1.00 0.00 C ATOM 1155 C LEU A 72 27.025 8.789 13.066 1.00 0.00 C ATOM 1156 O LEU A 72 27.394 9.628 13.900 1.00 0.00 O ATOM 1157 CB LEU A 72 25.481 7.904 14.849 1.00 0.00 C ATOM 1158 CG LEU A 72 24.771 9.256 14.941 1.00 0.00 C ATOM 1159 CD1 LEU A 72 25.495 10.275 15.789 1.00 0.00 C ATOM 1160 CD2 LEU A 72 24.401 9.793 13.555 1.00 0.00 C ATOM 0 H LEU A 72 27.526 6.544 14.657 1.00 0.00 H new ATOM 0 HA LEU A 72 25.363 7.344 12.818 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.753 7.119 15.054 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.233 7.856 15.637 1.00 0.00 H new ATOM 0 HG LEU A 72 23.840 9.068 15.476 1.00 0.00 H new ATOM 0 HD11 LEU A 72 24.927 11.205 15.804 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.596 9.896 16.806 1.00 0.00 H new ATOM 0 HD13 LEU A 72 26.484 10.460 15.370 1.00 0.00 H new ATOM 0 HD21 LEU A 72 23.898 10.755 13.660 1.00 0.00 H new ATOM 0 HD22 LEU A 72 25.306 9.919 12.960 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.735 9.088 13.057 1.00 0.00 H new ATOM 1172 N ALA A 73 27.336 8.836 11.767 1.00 0.00 N ATOM 1173 CA ALA A 73 28.147 9.866 11.118 1.00 0.00 C ATOM 1174 C ALA A 73 29.242 10.430 12.013 1.00 0.00 C ATOM 1175 O ALA A 73 29.249 11.633 12.213 1.00 0.00 O ATOM 1176 CB ALA A 73 27.251 10.961 10.560 1.00 0.00 C ATOM 0 H ALA A 73 27.014 8.124 11.111 1.00 0.00 H new ATOM 0 HA ALA A 73 28.674 9.386 10.293 1.00 0.00 H new ATOM 0 HB1 ALA A 73 27.864 11.723 10.079 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.565 10.533 9.829 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.681 11.413 11.371 1.00 0.00 H new ATOM 1182 N ASP A 74 30.102 9.543 12.505 1.00 0.00 N ATOM 1183 CA ASP A 74 31.242 9.791 13.382 1.00 0.00 C ATOM 1184 C ASP A 74 30.925 9.538 14.855 1.00 0.00 C ATOM 1185 O ASP A 74 31.397 10.223 15.748 1.00 0.00 O ATOM 1186 CB ASP A 74 32.011 11.057 13.250 1.00 0.00 C ATOM 1187 CG ASP A 74 32.789 11.110 11.932 1.00 0.00 C ATOM 1188 OD1 ASP A 74 32.267 11.601 10.872 1.00 0.00 O ATOM 1189 OD2 ASP A 74 33.992 10.647 11.883 1.00 0.00 O ATOM 0 H ASP A 74 30.012 8.552 12.282 1.00 0.00 H new ATOM 0 HA ASP A 74 31.926 9.042 12.983 1.00 0.00 H new ATOM 0 HB2 ASP A 74 31.329 11.905 13.304 1.00 0.00 H new ATOM 0 HB3 ASP A 74 32.704 11.151 14.086 1.00 0.00 H new ATOM 1194 N GLY A 75 30.102 8.517 15.095 1.00 0.00 N ATOM 1195 CA GLY A 75 29.680 8.119 16.443 1.00 0.00 C ATOM 1196 C GLY A 75 30.118 6.681 16.805 1.00 0.00 C ATOM 1197 O GLY A 75 29.413 5.948 17.501 1.00 0.00 O ATOM 0 H GLY A 75 29.705 7.937 14.356 1.00 0.00 H new ATOM 0 HA2 GLY A 75 30.097 8.815 17.170 1.00 0.00 H new ATOM 0 HA3 GLY A 75 28.595 8.193 16.516 1.00 0.00 H new ATOM 1201 N THR A 76 31.273 6.298 16.331 1.00 0.00 N ATOM 1202 CA THR A 76 31.779 4.982 16.606 1.00 0.00 C ATOM 1203 C THR A 76 30.988 3.847 15.971 1.00 0.00 C ATOM 1204 O THR A 76 31.628 3.086 15.228 1.00 0.00 O ATOM 1205 CB THR A 76 31.894 4.800 18.145 1.00 0.00 C ATOM 1206 OG1 THR A 76 33.215 4.393 18.355 1.00 0.00 O ATOM 1207 CG2 THR A 76 30.947 3.784 18.747 1.00 0.00 C ATOM 0 H THR A 76 31.880 6.879 15.753 1.00 0.00 H new ATOM 0 HA THR A 76 32.760 4.916 16.136 1.00 0.00 H new ATOM 0 HB THR A 76 31.623 5.735 18.635 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.367 4.258 19.314 1.00 0.00 H new ATOM 0 HG21 THR A 76 31.106 3.732 19.824 1.00 0.00 H new ATOM 0 HG22 THR A 76 29.918 4.082 18.546 1.00 0.00 H new ATOM 0 HG23 THR A 76 31.134 2.806 18.305 1.00 0.00 H new ATOM 1215 N GLU A 77 29.705 3.701 16.219 1.00 0.00 N ATOM 1216 CA GLU A 77 28.975 2.575 15.619 1.00 0.00 C ATOM 1217 C GLU A 77 27.498 2.488 16.057 1.00 0.00 C ATOM 1218 O GLU A 77 27.246 2.852 17.190 1.00 0.00 O ATOM 1219 CB GLU A 77 29.500 1.271 16.286 1.00 0.00 C ATOM 1220 CG GLU A 77 30.651 0.518 15.622 1.00 0.00 C ATOM 1221 CD GLU A 77 31.954 0.563 16.376 1.00 0.00 C ATOM 1222 OE1 GLU A 77 32.099 1.051 17.451 1.00 0.00 O ATOM 1223 OE2 GLU A 77 32.974 0.005 15.753 1.00 0.00 O ATOM 0 H GLU A 77 29.149 4.318 16.810 1.00 0.00 H new ATOM 0 HA GLU A 77 29.093 2.698 14.542 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.811 1.521 17.300 1.00 0.00 H new ATOM 0 HB3 GLU A 77 28.660 0.582 16.371 1.00 0.00 H new ATOM 0 HG2 GLU A 77 30.358 -0.524 15.493 1.00 0.00 H new ATOM 0 HG3 GLU A 77 30.810 0.931 14.626 1.00 0.00 H new ATOM 1230 N LEU A 78 26.657 1.960 15.192 1.00 0.00 N ATOM 1231 CA LEU A 78 25.247 1.673 15.383 1.00 0.00 C ATOM 1232 C LEU A 78 25.062 0.225 14.813 1.00 0.00 C ATOM 1233 O LEU A 78 25.013 0.119 13.567 1.00 0.00 O ATOM 1234 CB LEU A 78 24.319 2.480 14.457 1.00 0.00 C ATOM 1235 CG LEU A 78 23.631 3.749 14.969 1.00 0.00 C ATOM 1236 CD1 LEU A 78 24.267 4.918 14.196 1.00 0.00 C ATOM 1237 CD2 LEU A 78 22.154 3.715 14.646 1.00 0.00 C ATOM 0 H LEU A 78 26.968 1.698 14.257 1.00 0.00 H new ATOM 0 HA LEU A 78 25.008 1.866 16.429 1.00 0.00 H new ATOM 0 HB2 LEU A 78 24.902 2.760 13.580 1.00 0.00 H new ATOM 0 HB3 LEU A 78 23.536 1.803 14.116 1.00 0.00 H new ATOM 0 HG LEU A 78 23.748 3.843 16.049 1.00 0.00 H new ATOM 0 HD11 LEU A 78 23.815 5.856 14.519 1.00 0.00 H new ATOM 0 HD12 LEU A 78 25.339 4.944 14.393 1.00 0.00 H new ATOM 0 HD13 LEU A 78 24.098 4.783 13.128 1.00 0.00 H new ATOM 0 HD21 LEU A 78 21.680 4.624 15.016 1.00 0.00 H new ATOM 0 HD22 LEU A 78 22.019 3.649 13.566 1.00 0.00 H new ATOM 0 HD23 LEU A 78 21.697 2.847 15.122 1.00 0.00 H new ATOM 1249 N THR A 79 24.974 -0.742 15.654 1.00 0.00 N ATOM 1250 CA THR A 79 24.804 -2.122 15.136 1.00 0.00 C ATOM 1251 C THR A 79 23.340 -2.518 15.109 1.00 0.00 C ATOM 1252 O THR A 79 22.852 -3.640 15.201 1.00 0.00 O ATOM 1253 CB THR A 79 25.654 -3.188 15.841 1.00 0.00 C ATOM 1254 OG1 THR A 79 24.873 -4.010 16.646 1.00 0.00 O ATOM 1255 CG2 THR A 79 26.882 -2.641 16.607 1.00 0.00 C ATOM 0 H THR A 79 25.011 -0.649 16.669 1.00 0.00 H new ATOM 0 HA THR A 79 25.187 -2.089 14.116 1.00 0.00 H new ATOM 0 HB THR A 79 26.076 -3.788 15.035 1.00 0.00 H new ATOM 0 HG1 THR A 79 24.120 -4.358 16.125 1.00 0.00 H new ATOM 0 HG21 THR A 79 27.419 -3.468 17.071 1.00 0.00 H new ATOM 0 HG22 THR A 79 27.543 -2.123 15.912 1.00 0.00 H new ATOM 0 HG23 THR A 79 26.550 -1.946 17.378 1.00 0.00 H new ATOM 1263 N GLY A 80 22.517 -1.478 14.960 1.00 0.00 N ATOM 1264 CA GLY A 80 21.098 -1.665 14.913 1.00 0.00 C ATOM 1265 C GLY A 80 20.572 -1.898 13.494 1.00 0.00 C ATOM 1266 O GLY A 80 21.286 -2.011 12.506 1.00 0.00 O ATOM 0 H GLY A 80 22.824 -0.509 14.872 1.00 0.00 H new ATOM 0 HA2 GLY A 80 20.828 -2.516 15.539 1.00 0.00 H new ATOM 0 HA3 GLY A 80 20.607 -0.789 15.337 1.00 0.00 H new ATOM 1270 N THR A 81 19.267 -1.960 13.467 1.00 0.00 N ATOM 1271 CA THR A 81 18.477 -2.175 12.255 1.00 0.00 C ATOM 1272 C THR A 81 17.277 -1.216 12.197 1.00 0.00 C ATOM 1273 O THR A 81 16.176 -1.451 12.641 1.00 0.00 O ATOM 1274 CB THR A 81 17.857 -3.582 12.395 1.00 0.00 C ATOM 1275 OG1 THR A 81 16.957 -3.708 13.496 1.00 0.00 O ATOM 1276 CG2 THR A 81 18.925 -4.675 12.545 1.00 0.00 C ATOM 0 H THR A 81 18.695 -1.861 14.306 1.00 0.00 H new ATOM 0 HA THR A 81 19.113 -2.036 11.381 1.00 0.00 H new ATOM 0 HB THR A 81 17.301 -3.715 11.467 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.242 -3.043 13.412 1.00 0.00 H new ATOM 0 HG21 THR A 81 18.440 -5.647 12.640 1.00 0.00 H new ATOM 0 HG22 THR A 81 19.570 -4.676 11.667 1.00 0.00 H new ATOM 0 HG23 THR A 81 19.523 -4.479 13.435 1.00 0.00 H new ATOM 1284 N TRP A 82 17.664 -0.113 11.606 1.00 0.00 N ATOM 1285 CA TRP A 82 16.739 0.976 11.453 1.00 0.00 C ATOM 1286 C TRP A 82 15.479 0.447 10.749 1.00 0.00 C ATOM 1287 O TRP A 82 15.487 0.323 9.502 1.00 0.00 O ATOM 1288 CB TRP A 82 17.167 2.152 10.547 1.00 0.00 C ATOM 1289 CG TRP A 82 18.390 2.904 10.861 1.00 0.00 C ATOM 1290 CD1 TRP A 82 19.560 2.473 11.363 1.00 0.00 C ATOM 1291 CD2 TRP A 82 18.525 4.315 10.667 1.00 0.00 C ATOM 1292 NE1 TRP A 82 20.379 3.564 11.483 1.00 0.00 N ATOM 1293 CE2 TRP A 82 19.814 4.731 11.076 1.00 0.00 C ATOM 1294 CE3 TRP A 82 17.680 5.331 10.180 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 20.222 6.049 11.005 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 18.104 6.630 10.124 1.00 0.00 C ATOM 1297 CH2 TRP A 82 19.379 7.014 10.532 1.00 0.00 C ATOM 0 H TRP A 82 18.598 0.051 11.229 1.00 0.00 H new ATOM 0 HA TRP A 82 16.629 1.346 12.472 1.00 0.00 H new ATOM 0 HB2 TRP A 82 17.275 1.761 9.535 1.00 0.00 H new ATOM 0 HB3 TRP A 82 16.342 2.865 10.527 1.00 0.00 H new ATOM 0 HD1 TRP A 82 19.808 1.455 11.624 1.00 0.00 H new ATOM 0 HE1 TRP A 82 21.330 3.506 11.846 1.00 0.00 H new ATOM 0 HE3 TRP A 82 16.684 5.081 9.846 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 21.217 6.319 11.327 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 17.427 7.384 9.751 1.00 0.00 H new ATOM 0 HH2 TRP A 82 19.692 8.046 10.476 1.00 0.00 H new ATOM 1308 N THR A 83 14.401 0.142 11.436 1.00 0.00 N ATOM 1309 CA THR A 83 13.182 -0.345 10.764 1.00 0.00 C ATOM 1310 C THR A 83 12.209 0.828 10.901 1.00 0.00 C ATOM 1311 O THR A 83 12.576 1.907 11.324 1.00 0.00 O ATOM 1312 CB THR A 83 12.542 -1.583 11.381 1.00 0.00 C ATOM 1313 OG1 THR A 83 12.959 -1.709 12.700 1.00 0.00 O ATOM 1314 CG2 THR A 83 13.026 -2.854 10.649 1.00 0.00 C ATOM 0 H THR A 83 14.327 0.216 12.451 1.00 0.00 H new ATOM 0 HA THR A 83 13.427 -0.650 9.747 1.00 0.00 H new ATOM 0 HB THR A 83 11.460 -1.477 11.307 1.00 0.00 H new ATOM 0 HG1 THR A 83 12.547 -2.504 13.099 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.562 -3.732 11.099 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.748 -2.796 9.597 1.00 0.00 H new ATOM 0 HG23 THR A 83 14.110 -2.933 10.734 1.00 0.00 H new ATOM 1322 N MET A 84 10.954 0.693 10.569 1.00 0.00 N ATOM 1323 CA MET A 84 10.046 1.847 10.728 1.00 0.00 C ATOM 1324 C MET A 84 8.749 1.166 11.158 1.00 0.00 C ATOM 1325 O MET A 84 8.803 0.219 11.927 1.00 0.00 O ATOM 1326 CB MET A 84 9.898 2.488 9.357 1.00 0.00 C ATOM 1327 CG MET A 84 9.224 1.640 8.265 1.00 0.00 C ATOM 1328 SD MET A 84 8.180 2.598 7.151 1.00 0.00 S ATOM 1329 CE MET A 84 8.514 1.744 5.606 1.00 0.00 C ATOM 0 H MET A 84 10.529 -0.158 10.200 1.00 0.00 H new ATOM 0 HA MET A 84 10.365 2.621 11.427 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.327 3.409 9.472 1.00 0.00 H new ATOM 0 HB3 MET A 84 10.890 2.770 9.005 1.00 0.00 H new ATOM 0 HG2 MET A 84 9.994 1.134 7.683 1.00 0.00 H new ATOM 0 HG3 MET A 84 8.621 0.865 8.738 1.00 0.00 H new ATOM 0 HE1 MET A 84 7.944 2.210 4.802 1.00 0.00 H new ATOM 0 HE2 MET A 84 9.578 1.805 5.379 1.00 0.00 H new ATOM 0 HE3 MET A 84 8.222 0.698 5.698 1.00 0.00 H new ATOM 1339 N GLU A 85 7.592 1.595 10.696 1.00 0.00 N ATOM 1340 CA GLU A 85 6.323 0.974 11.067 1.00 0.00 C ATOM 1341 C GLU A 85 5.303 1.329 10.015 1.00 0.00 C ATOM 1342 O GLU A 85 5.659 1.837 8.940 1.00 0.00 O ATOM 1343 CB GLU A 85 5.869 1.421 12.448 1.00 0.00 C ATOM 1344 CG GLU A 85 5.088 0.317 13.196 1.00 0.00 C ATOM 1345 CD GLU A 85 3.745 0.686 13.742 1.00 0.00 C ATOM 1346 OE1 GLU A 85 3.122 1.653 13.377 1.00 0.00 O ATOM 1347 OE2 GLU A 85 3.312 -0.145 14.656 1.00 0.00 O ATOM 0 H GLU A 85 7.498 2.382 10.054 1.00 0.00 H new ATOM 0 HA GLU A 85 6.443 -0.108 11.117 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.739 1.710 13.038 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.240 2.306 12.352 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.958 -0.525 12.517 1.00 0.00 H new ATOM 0 HG3 GLU A 85 5.705 -0.033 14.023 1.00 0.00 H new ATOM 1354 N GLY A 86 4.041 1.075 10.287 1.00 0.00 N ATOM 1355 CA GLY A 86 2.944 1.340 9.418 1.00 0.00 C ATOM 1356 C GLY A 86 2.941 2.847 9.265 1.00 0.00 C ATOM 1357 O GLY A 86 2.351 3.306 8.310 1.00 0.00 O ATOM 0 H GLY A 86 3.751 0.656 11.170 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.070 0.843 8.456 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.006 0.982 9.842 1.00 0.00 H new ATOM 1361 N ASN A 87 3.578 3.565 10.172 1.00 0.00 N ATOM 1362 CA ASN A 87 3.609 5.004 10.068 1.00 0.00 C ATOM 1363 C ASN A 87 4.830 5.647 10.700 1.00 0.00 C ATOM 1364 O ASN A 87 4.737 6.761 11.199 1.00 0.00 O ATOM 1365 CB ASN A 87 2.292 5.730 10.255 1.00 0.00 C ATOM 1366 CG ASN A 87 1.938 5.568 11.718 1.00 0.00 C ATOM 1367 OD1 ASN A 87 2.223 4.509 12.300 1.00 0.00 O ATOM 1368 ND2 ASN A 87 1.331 6.610 12.278 1.00 0.00 N ATOM 0 H ASN A 87 4.073 3.179 10.976 1.00 0.00 H new ATOM 0 HA ASN A 87 3.759 5.169 9.001 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.384 6.783 9.989 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.517 5.306 9.616 1.00 0.00 H new ATOM 0 HD21 ASN A 87 1.062 6.576 13.261 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.134 7.444 11.724 1.00 0.00 H new ATOM 1375 N LYS A 88 5.973 4.999 10.707 1.00 0.00 N ATOM 1376 CA LYS A 88 7.067 5.655 11.324 1.00 0.00 C ATOM 1377 C LYS A 88 8.347 4.810 11.403 1.00 0.00 C ATOM 1378 O LYS A 88 8.276 3.744 11.950 1.00 0.00 O ATOM 1379 CB LYS A 88 6.852 5.872 12.810 1.00 0.00 C ATOM 1380 CG LYS A 88 5.837 5.027 13.534 1.00 0.00 C ATOM 1381 CD LYS A 88 5.694 5.484 14.976 1.00 0.00 C ATOM 1382 CE LYS A 88 4.276 5.849 15.377 1.00 0.00 C ATOM 1383 NZ LYS A 88 3.361 4.713 15.485 1.00 0.00 N ATOM 0 H LYS A 88 6.151 4.075 10.314 1.00 0.00 H new ATOM 0 HA LYS A 88 7.150 6.552 10.710 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.812 5.729 13.305 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.572 6.916 12.953 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.874 5.093 13.028 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.141 3.980 13.507 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.053 4.692 15.633 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.339 6.348 15.137 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.306 6.367 16.336 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.876 6.553 14.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 2.625 4.925 16.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 2.916 4.537 14.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 3.890 3.868 15.781 1.00 0.00 H new ATOM 1397 N LEU A 89 9.416 5.402 10.861 1.00 0.00 N ATOM 1398 CA LEU A 89 10.766 4.921 10.828 1.00 0.00 C ATOM 1399 C LEU A 89 11.127 4.651 12.304 1.00 0.00 C ATOM 1400 O LEU A 89 10.358 5.028 13.165 1.00 0.00 O ATOM 1401 CB LEU A 89 11.726 6.034 10.310 1.00 0.00 C ATOM 1402 CG LEU A 89 12.535 5.766 9.054 1.00 0.00 C ATOM 1403 CD1 LEU A 89 11.899 4.730 8.172 1.00 0.00 C ATOM 1404 CD2 LEU A 89 12.581 7.055 8.208 1.00 0.00 C ATOM 0 H LEU A 89 9.332 6.307 10.399 1.00 0.00 H new ATOM 0 HA LEU A 89 10.858 4.048 10.182 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.131 6.930 10.136 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.426 6.267 11.112 1.00 0.00 H new ATOM 0 HG LEU A 89 13.517 5.424 9.381 1.00 0.00 H new ATOM 0 HD11 LEU A 89 12.517 4.576 7.288 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.808 3.792 8.720 1.00 0.00 H new ATOM 0 HD13 LEU A 89 10.909 5.069 7.868 1.00 0.00 H new ATOM 0 HD21 LEU A 89 13.160 6.875 7.302 1.00 0.00 H new ATOM 0 HD22 LEU A 89 11.567 7.349 7.938 1.00 0.00 H new ATOM 0 HD23 LEU A 89 13.049 7.853 8.785 1.00 0.00 H new ATOM 1416 N VAL A 90 12.292 4.069 12.453 1.00 0.00 N ATOM 1417 CA VAL A 90 12.954 3.749 13.678 1.00 0.00 C ATOM 1418 C VAL A 90 14.445 3.585 13.299 1.00 0.00 C ATOM 1419 O VAL A 90 14.766 2.530 12.776 1.00 0.00 O ATOM 1420 CB VAL A 90 12.438 2.484 14.359 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.426 2.606 15.880 1.00 0.00 C ATOM 1422 CG2 VAL A 90 11.058 2.067 13.903 1.00 0.00 C ATOM 0 H VAL A 90 12.843 3.785 11.643 1.00 0.00 H new ATOM 0 HA VAL A 90 12.774 4.539 14.407 1.00 0.00 H new ATOM 0 HB VAL A 90 13.147 1.714 14.056 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.051 1.680 16.316 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.439 2.792 16.238 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.780 3.433 16.174 1.00 0.00 H new ATOM 0 HG21 VAL A 90 10.759 1.161 14.430 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.347 2.864 14.119 1.00 0.00 H new ATOM 0 HG23 VAL A 90 11.072 1.875 12.830 1.00 0.00 H new ATOM 1432 N GLY A 91 15.216 4.623 13.562 1.00 0.00 N ATOM 1433 CA GLY A 91 16.620 4.744 13.333 1.00 0.00 C ATOM 1434 C GLY A 91 17.397 3.632 14.057 1.00 0.00 C ATOM 1435 O GLY A 91 18.529 3.283 13.761 1.00 0.00 O ATOM 0 H GLY A 91 14.829 5.470 13.978 1.00 0.00 H new ATOM 0 HA2 GLY A 91 16.823 4.696 12.263 1.00 0.00 H new ATOM 0 HA3 GLY A 91 16.965 5.718 13.679 1.00 0.00 H new ATOM 1439 N LYS A 92 16.701 3.097 15.015 1.00 0.00 N ATOM 1440 CA LYS A 92 17.131 1.998 15.833 1.00 0.00 C ATOM 1441 C LYS A 92 18.510 2.169 16.359 1.00 0.00 C ATOM 1442 O LYS A 92 18.885 3.321 16.535 1.00 0.00 O ATOM 1443 CB LYS A 92 16.914 0.675 15.119 1.00 0.00 C ATOM 1444 CG LYS A 92 15.398 0.449 15.166 1.00 0.00 C ATOM 1445 CD LYS A 92 15.054 -0.072 16.554 1.00 0.00 C ATOM 1446 CE LYS A 92 14.141 -1.249 16.524 1.00 0.00 C ATOM 1447 NZ LYS A 92 14.349 -2.087 17.717 1.00 0.00 N ATOM 0 H LYS A 92 15.769 3.431 15.261 1.00 0.00 H new ATOM 0 HA LYS A 92 16.501 1.986 16.722 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.276 0.716 14.092 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.450 -0.134 15.614 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.866 1.378 14.963 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.093 -0.266 14.402 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.973 -0.345 17.072 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.589 0.727 17.131 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.105 -0.913 16.483 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.322 -1.835 15.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.706 -2.904 17.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.333 -2.421 17.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.154 -1.528 18.572 1.00 0.00 H new ATOM 1461 N PHE A 93 19.229 1.082 16.640 1.00 0.00 N ATOM 1462 CA PHE A 93 20.535 1.219 17.261 1.00 0.00 C ATOM 1463 C PHE A 93 21.054 -0.082 17.895 1.00 0.00 C ATOM 1464 O PHE A 93 20.561 -1.150 17.554 1.00 0.00 O ATOM 1465 CB PHE A 93 20.186 1.979 18.585 1.00 0.00 C ATOM 1466 CG PHE A 93 18.860 1.542 19.120 1.00 0.00 C ATOM 1467 CD1 PHE A 93 18.777 0.199 19.520 1.00 0.00 C ATOM 1468 CD2 PHE A 93 17.729 2.298 19.267 1.00 0.00 C ATOM 1469 CE1 PHE A 93 17.647 -0.404 20.040 1.00 0.00 C ATOM 1470 CE2 PHE A 93 16.586 1.712 19.797 1.00 0.00 C ATOM 1471 CZ PHE A 93 16.527 0.362 20.183 1.00 0.00 C ATOM 0 H PHE A 93 18.935 0.124 16.452 1.00 0.00 H new ATOM 0 HA PHE A 93 21.230 1.623 16.525 1.00 0.00 H new ATOM 0 HB2 PHE A 93 20.961 1.795 19.329 1.00 0.00 H new ATOM 0 HB3 PHE A 93 20.171 3.053 18.399 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.663 -0.409 19.413 1.00 0.00 H new ATOM 0 HD2 PHE A 93 17.725 3.338 18.975 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.651 -1.446 20.323 1.00 0.00 H new ATOM 0 HE2 PHE A 93 15.703 2.322 19.918 1.00 0.00 H new ATOM 0 HZ PHE A 93 15.617 -0.059 20.583 1.00 0.00 H new ATOM 1481 N LYS A 94 21.938 0.292 18.776 1.00 0.00 N ATOM 1482 CA LYS A 94 22.718 -0.423 19.776 1.00 0.00 C ATOM 1483 C LYS A 94 24.121 -0.232 19.322 1.00 0.00 C ATOM 1484 O LYS A 94 24.635 -1.084 18.636 1.00 0.00 O ATOM 1485 CB LYS A 94 22.396 -1.867 19.936 1.00 0.00 C ATOM 1486 CG LYS A 94 21.536 -1.722 21.188 1.00 0.00 C ATOM 1487 CD LYS A 94 20.834 -2.885 21.795 1.00 0.00 C ATOM 1488 CE LYS A 94 20.773 -2.799 23.305 1.00 0.00 C ATOM 1489 NZ LYS A 94 21.101 -4.113 23.873 1.00 0.00 N ATOM 0 H LYS A 94 22.175 1.283 18.822 1.00 0.00 H new ATOM 0 HA LYS A 94 22.503 -0.029 20.769 1.00 0.00 H new ATOM 0 HB2 LYS A 94 21.854 -2.284 19.087 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.277 -2.490 20.089 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.176 -1.300 21.963 1.00 0.00 H new ATOM 0 HG3 LYS A 94 20.774 -0.976 20.963 1.00 0.00 H new ATOM 0 HD2 LYS A 94 19.821 -2.943 21.396 1.00 0.00 H new ATOM 0 HD3 LYS A 94 21.344 -3.804 21.507 1.00 0.00 H new ATOM 0 HE2 LYS A 94 21.473 -2.047 23.668 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.778 -2.489 23.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 21.061 -4.062 24.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 20.416 -4.818 23.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 22.058 -4.390 23.576 1.00 0.00 H new ATOM 1503 N ARG A 95 24.609 0.920 19.726 1.00 0.00 N ATOM 1504 CA ARG A 95 25.939 1.258 19.349 1.00 0.00 C ATOM 1505 C ARG A 95 26.847 0.127 19.889 1.00 0.00 C ATOM 1506 O ARG A 95 26.420 -0.851 20.422 1.00 0.00 O ATOM 1507 CB ARG A 95 26.533 2.450 20.070 1.00 0.00 C ATOM 1508 CG ARG A 95 25.708 3.682 20.262 1.00 0.00 C ATOM 1509 CD ARG A 95 24.682 3.839 19.157 1.00 0.00 C ATOM 1510 NE ARG A 95 25.330 4.083 17.878 1.00 0.00 N ATOM 1511 CZ ARG A 95 26.055 5.183 17.634 1.00 0.00 C ATOM 1512 NH1 ARG A 95 26.238 6.144 18.559 1.00 0.00 N ATOM 1513 NH2 ARG A 95 26.683 5.444 16.468 1.00 0.00 N ATOM 0 H ARG A 95 24.116 1.608 20.295 1.00 0.00 H new ATOM 0 HA ARG A 95 25.895 1.437 18.275 1.00 0.00 H new ATOM 0 HB2 ARG A 95 26.848 2.111 21.057 1.00 0.00 H new ATOM 0 HB3 ARG A 95 27.434 2.742 19.531 1.00 0.00 H new ATOM 0 HG2 ARG A 95 25.202 3.636 21.226 1.00 0.00 H new ATOM 0 HG3 ARG A 95 26.358 4.557 20.284 1.00 0.00 H new ATOM 0 HD2 ARG A 95 24.070 2.939 19.093 1.00 0.00 H new ATOM 0 HD3 ARG A 95 24.011 4.665 19.393 1.00 0.00 H new ATOM 0 HE ARG A 95 25.228 3.389 17.137 1.00 0.00 H new ATOM 0 HH11 ARG A 95 25.818 6.049 19.483 1.00 0.00 H new ATOM 0 HH12 ARG A 95 26.797 6.967 18.335 1.00 0.00 H new ATOM 0 HH21 ARG A 95 26.623 4.779 15.697 1.00 0.00 H new ATOM 0 HH22 ARG A 95 27.217 6.306 16.358 1.00 0.00 H new ATOM 1527 N VAL A 96 28.096 0.351 19.761 1.00 0.00 N ATOM 1528 CA VAL A 96 29.151 -0.545 20.213 1.00 0.00 C ATOM 1529 C VAL A 96 29.822 0.152 21.420 1.00 0.00 C ATOM 1530 O VAL A 96 30.157 -0.587 22.325 1.00 0.00 O ATOM 1531 CB VAL A 96 30.085 -0.747 19.059 1.00 0.00 C ATOM 1532 CG1 VAL A 96 31.522 -0.658 19.615 1.00 0.00 C ATOM 1533 CG2 VAL A 96 29.803 -2.006 18.266 1.00 0.00 C ATOM 0 H VAL A 96 28.456 1.198 19.320 1.00 0.00 H new ATOM 0 HA VAL A 96 28.800 -1.527 20.530 1.00 0.00 H new ATOM 0 HB VAL A 96 29.936 0.036 18.315 1.00 0.00 H new ATOM 0 HG11 VAL A 96 32.236 -0.800 18.803 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.677 0.322 20.067 1.00 0.00 H new ATOM 0 HG13 VAL A 96 31.669 -1.432 20.368 1.00 0.00 H new ATOM 0 HG21 VAL A 96 30.517 -2.088 17.447 1.00 0.00 H new ATOM 0 HG22 VAL A 96 29.897 -2.875 18.917 1.00 0.00 H new ATOM 0 HG23 VAL A 96 28.791 -1.963 17.863 1.00 0.00 H new ATOM 1543 N ASP A 97 29.941 1.458 21.322 1.00 0.00 N ATOM 1544 CA ASP A 97 30.543 2.174 22.497 1.00 0.00 C ATOM 1545 C ASP A 97 29.885 1.678 23.784 1.00 0.00 C ATOM 1546 O ASP A 97 30.549 1.441 24.809 1.00 0.00 O ATOM 1547 CB ASP A 97 30.479 3.691 22.364 1.00 0.00 C ATOM 1548 CG ASP A 97 30.668 4.415 23.693 1.00 0.00 C ATOM 1549 OD1 ASP A 97 31.638 4.285 24.413 1.00 0.00 O ATOM 1550 OD2 ASP A 97 29.667 5.187 23.961 1.00 0.00 O ATOM 0 H ASP A 97 29.665 2.034 20.527 1.00 0.00 H new ATOM 0 HA ASP A 97 31.607 1.938 22.530 1.00 0.00 H new ATOM 0 HB2 ASP A 97 31.247 4.021 21.664 1.00 0.00 H new ATOM 0 HB3 ASP A 97 29.516 3.972 21.937 1.00 0.00 H new ATOM 1555 N ASN A 98 28.590 1.529 23.645 1.00 0.00 N ATOM 1556 CA ASN A 98 27.659 1.081 24.672 1.00 0.00 C ATOM 1557 C ASN A 98 26.214 0.857 24.351 1.00 0.00 C ATOM 1558 O ASN A 98 25.341 1.255 25.123 1.00 0.00 O ATOM 1559 CB ASN A 98 27.872 2.075 25.873 1.00 0.00 C ATOM 1560 CG ASN A 98 27.169 1.805 27.169 1.00 0.00 C ATOM 1561 OD1 ASN A 98 26.445 0.796 27.458 1.00 0.00 O ATOM 1562 ND2 ASN A 98 27.357 2.727 28.103 1.00 0.00 N ATOM 0 H ASN A 98 28.122 1.727 22.761 1.00 0.00 H new ATOM 0 HA ASN A 98 27.910 0.041 24.878 1.00 0.00 H new ATOM 0 HB2 ASN A 98 28.941 2.117 26.080 1.00 0.00 H new ATOM 0 HB3 ASN A 98 27.573 3.068 25.536 1.00 0.00 H new ATOM 0 HD21 ASN A 98 26.928 2.617 29.022 1.00 0.00 H new ATOM 0 HD22 ASN A 98 27.931 3.546 27.903 1.00 0.00 H new ATOM 1569 N GLY A 99 25.854 0.224 23.227 1.00 0.00 N ATOM 1570 CA GLY A 99 24.527 -0.065 22.788 1.00 0.00 C ATOM 1571 C GLY A 99 23.422 0.954 23.182 1.00 0.00 C ATOM 1572 O GLY A 99 22.493 0.637 23.954 1.00 0.00 O ATOM 0 H GLY A 99 26.553 -0.116 22.567 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.539 -0.150 21.701 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.244 -1.042 23.181 1.00 0.00 H new ATOM 1576 N LYS A 100 23.562 2.153 22.627 1.00 0.00 N ATOM 1577 CA LYS A 100 22.646 3.247 22.832 1.00 0.00 C ATOM 1578 C LYS A 100 21.317 2.979 22.076 1.00 0.00 C ATOM 1579 O LYS A 100 21.270 1.900 21.543 1.00 0.00 O ATOM 1580 CB LYS A 100 23.223 4.465 22.127 1.00 0.00 C ATOM 1581 CG LYS A 100 24.301 5.203 22.851 1.00 0.00 C ATOM 1582 CD LYS A 100 25.106 4.288 23.757 1.00 0.00 C ATOM 1583 CE LYS A 100 25.961 5.001 24.790 1.00 0.00 C ATOM 1584 NZ LYS A 100 25.867 4.402 26.125 1.00 0.00 N ATOM 0 H LYS A 100 24.338 2.387 22.008 1.00 0.00 H new ATOM 0 HA LYS A 100 22.490 3.375 23.903 1.00 0.00 H new ATOM 0 HB2 LYS A 100 23.616 4.146 21.162 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.409 5.161 21.926 1.00 0.00 H new ATOM 0 HG2 LYS A 100 24.967 5.674 22.128 1.00 0.00 H new ATOM 0 HG3 LYS A 100 23.858 6.003 23.445 1.00 0.00 H new ATOM 0 HD2 LYS A 100 24.420 3.618 24.275 1.00 0.00 H new ATOM 0 HD3 LYS A 100 25.753 3.666 23.138 1.00 0.00 H new ATOM 0 HE2 LYS A 100 27.001 4.987 24.464 1.00 0.00 H new ATOM 0 HE3 LYS A 100 25.658 6.047 24.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 26.797 4.439 26.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 25.175 4.930 26.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 25.562 3.411 26.040 1.00 0.00 H new ATOM 1598 N GLU A 101 20.464 3.965 22.074 1.00 0.00 N ATOM 1599 CA GLU A 101 19.240 3.798 21.276 1.00 0.00 C ATOM 1600 C GLU A 101 18.725 5.042 20.556 1.00 0.00 C ATOM 1601 O GLU A 101 17.648 5.503 20.806 1.00 0.00 O ATOM 1602 CB GLU A 101 18.201 2.974 22.022 1.00 0.00 C ATOM 1603 CG GLU A 101 18.638 1.507 22.283 1.00 0.00 C ATOM 1604 CD GLU A 101 19.398 1.312 23.585 1.00 0.00 C ATOM 1605 OE1 GLU A 101 19.579 2.409 24.254 1.00 0.00 O ATOM 1606 OE2 GLU A 101 19.795 0.220 23.957 1.00 0.00 O ATOM 0 H GLU A 101 20.563 4.848 22.575 1.00 0.00 H new ATOM 0 HA GLU A 101 19.530 3.202 20.411 1.00 0.00 H new ATOM 0 HB2 GLU A 101 17.986 3.455 22.976 1.00 0.00 H new ATOM 0 HB3 GLU A 101 17.273 2.971 21.450 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.753 0.871 22.292 1.00 0.00 H new ATOM 0 HG3 GLU A 101 19.263 1.172 21.455 1.00 0.00 H new ATOM 1613 N LEU A 102 19.637 5.472 19.674 1.00 0.00 N ATOM 1614 CA LEU A 102 19.530 6.638 18.826 1.00 0.00 C ATOM 1615 C LEU A 102 18.064 6.610 18.356 1.00 0.00 C ATOM 1616 O LEU A 102 17.390 7.554 18.666 1.00 0.00 O ATOM 1617 CB LEU A 102 20.389 6.489 17.535 1.00 0.00 C ATOM 1618 CG LEU A 102 21.857 6.716 17.850 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.626 5.448 17.433 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.274 7.879 16.967 1.00 0.00 C ATOM 0 H LEU A 102 20.517 4.976 19.535 1.00 0.00 H new ATOM 0 HA LEU A 102 19.848 7.534 19.359 1.00 0.00 H new ATOM 0 HB2 LEU A 102 20.251 5.495 17.111 1.00 0.00 H new ATOM 0 HB3 LEU A 102 20.056 7.205 16.784 1.00 0.00 H new ATOM 0 HG LEU A 102 22.049 6.922 18.903 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.687 5.579 17.647 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.246 4.592 17.991 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.490 5.274 16.366 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.327 8.105 17.137 1.00 0.00 H new ATOM 0 HD22 LEU A 102 22.124 7.613 15.921 1.00 0.00 H new ATOM 0 HD23 LEU A 102 21.671 8.754 17.209 1.00 0.00 H new ATOM 1632 N ILE A 103 17.749 5.538 17.677 1.00 0.00 N ATOM 1633 CA ILE A 103 16.415 5.305 17.194 1.00 0.00 C ATOM 1634 C ILE A 103 16.086 6.181 16.000 1.00 0.00 C ATOM 1635 O ILE A 103 14.964 5.957 15.519 1.00 0.00 O ATOM 1636 CB ILE A 103 15.406 5.583 18.336 1.00 0.00 C ATOM 1637 CG1 ILE A 103 15.040 4.223 18.892 1.00 0.00 C ATOM 1638 CG2 ILE A 103 14.223 6.414 17.974 1.00 0.00 C ATOM 1639 CD1 ILE A 103 14.651 3.135 17.897 1.00 0.00 C ATOM 0 H ILE A 103 18.413 4.800 17.443 1.00 0.00 H new ATOM 0 HA ILE A 103 16.348 4.266 16.871 1.00 0.00 H new ATOM 0 HB ILE A 103 15.876 6.219 19.086 1.00 0.00 H new ATOM 0 HG12 ILE A 103 15.887 3.859 19.474 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.210 4.356 19.586 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.587 6.543 18.850 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.558 7.390 17.622 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.658 5.918 17.185 1.00 0.00 H new ATOM 0 HD11 ILE A 103 14.415 2.217 18.435 1.00 0.00 H new ATOM 0 HD12 ILE A 103 13.778 3.457 17.329 1.00 0.00 H new ATOM 0 HD13 ILE A 103 15.481 2.952 17.215 1.00 0.00 H new ATOM 1651 N ALA A 104 16.941 7.075 15.568 1.00 0.00 N ATOM 1652 CA ALA A 104 16.758 7.982 14.453 1.00 0.00 C ATOM 1653 C ALA A 104 15.490 7.657 13.716 1.00 0.00 C ATOM 1654 O ALA A 104 15.610 7.167 12.583 1.00 0.00 O ATOM 1655 CB ALA A 104 17.988 7.898 13.527 1.00 0.00 C ATOM 0 H ALA A 104 17.849 7.200 16.016 1.00 0.00 H new ATOM 0 HA ALA A 104 16.667 9.004 14.820 1.00 0.00 H new ATOM 0 HB1 ALA A 104 17.857 8.578 12.685 1.00 0.00 H new ATOM 0 HB2 ALA A 104 18.882 8.178 14.084 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.095 6.879 13.156 1.00 0.00 H new ATOM 1661 N VAL A 105 14.315 7.885 14.290 1.00 0.00 N ATOM 1662 CA VAL A 105 13.141 7.534 13.517 1.00 0.00 C ATOM 1663 C VAL A 105 12.983 8.572 12.404 1.00 0.00 C ATOM 1664 O VAL A 105 13.916 8.721 11.643 1.00 0.00 O ATOM 1665 CB VAL A 105 11.827 7.412 14.324 1.00 0.00 C ATOM 1666 CG1 VAL A 105 11.821 6.325 15.389 1.00 0.00 C ATOM 1667 CG2 VAL A 105 11.674 8.734 15.034 1.00 0.00 C ATOM 0 H VAL A 105 14.156 8.281 15.217 1.00 0.00 H new ATOM 0 HA VAL A 105 13.311 6.531 13.126 1.00 0.00 H new ATOM 0 HB VAL A 105 11.029 7.153 13.628 1.00 0.00 H new ATOM 0 HG11 VAL A 105 10.857 6.320 15.898 1.00 0.00 H new ATOM 0 HG12 VAL A 105 11.989 5.355 14.920 1.00 0.00 H new ATOM 0 HG13 VAL A 105 12.613 6.520 16.112 1.00 0.00 H new ATOM 0 HG21 VAL A 105 10.761 8.724 15.629 1.00 0.00 H new ATOM 0 HG22 VAL A 105 12.531 8.898 15.687 1.00 0.00 H new ATOM 0 HG23 VAL A 105 11.619 9.537 14.299 1.00 0.00 H new ATOM 1677 N ARG A 106 11.895 9.276 12.249 1.00 0.00 N ATOM 1678 CA ARG A 106 11.610 10.213 11.176 1.00 0.00 C ATOM 1679 C ARG A 106 10.071 10.171 11.104 1.00 0.00 C ATOM 1680 O ARG A 106 9.581 11.177 10.691 1.00 0.00 O ATOM 1681 CB ARG A 106 12.069 9.831 9.827 1.00 0.00 C ATOM 1682 CG ARG A 106 12.661 11.075 9.181 1.00 0.00 C ATOM 1683 CD ARG A 106 14.002 10.783 8.590 1.00 0.00 C ATOM 1684 NE ARG A 106 14.954 10.661 9.672 1.00 0.00 N ATOM 1685 CZ ARG A 106 16.105 10.023 9.700 1.00 0.00 C ATOM 1686 NH1 ARG A 106 16.528 9.352 8.664 1.00 0.00 N ATOM 1687 NH2 ARG A 106 16.847 10.078 10.811 1.00 0.00 N ATOM 0 H ARG A 106 11.123 9.211 12.913 1.00 0.00 H new ATOM 0 HA ARG A 106 12.108 11.156 11.401 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.813 9.037 9.885 1.00 0.00 H new ATOM 0 HB3 ARG A 106 11.239 9.447 9.233 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.989 11.441 8.405 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.751 11.867 9.924 1.00 0.00 H new ATOM 0 HD2 ARG A 106 13.969 9.863 8.007 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.300 11.581 7.909 1.00 0.00 H new ATOM 0 HE ARG A 106 14.697 11.137 10.537 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.964 9.316 7.815 1.00 0.00 H new ATOM 0 HH12 ARG A 106 17.423 8.864 8.703 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.518 10.608 11.618 1.00 0.00 H new ATOM 0 HH22 ARG A 106 17.742 9.590 10.851 1.00 0.00 H new ATOM 1701 N GLU A 107 9.597 9.033 11.529 1.00 0.00 N ATOM 1702 CA GLU A 107 8.224 8.683 11.597 1.00 0.00 C ATOM 1703 C GLU A 107 7.348 9.247 10.486 1.00 0.00 C ATOM 1704 O GLU A 107 6.659 8.492 9.826 1.00 0.00 O ATOM 1705 CB GLU A 107 7.568 9.376 12.841 1.00 0.00 C ATOM 1706 CG GLU A 107 8.337 9.152 14.130 1.00 0.00 C ATOM 1707 CD GLU A 107 7.655 9.404 15.490 1.00 0.00 C ATOM 1708 OE1 GLU A 107 6.484 9.623 15.655 1.00 0.00 O ATOM 1709 OE2 GLU A 107 8.518 9.346 16.496 1.00 0.00 O ATOM 0 H GLU A 107 10.207 8.284 11.856 1.00 0.00 H new ATOM 0 HA GLU A 107 8.250 7.593 11.580 1.00 0.00 H new ATOM 0 HB2 GLU A 107 7.492 10.447 12.653 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.552 9.001 12.963 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.680 8.118 14.127 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.225 9.783 14.091 1.00 0.00 H new ATOM 1716 N ILE A 108 7.406 10.563 10.459 1.00 0.00 N ATOM 1717 CA ILE A 108 6.647 11.449 9.601 1.00 0.00 C ATOM 1718 C ILE A 108 5.172 11.424 9.836 1.00 0.00 C ATOM 1719 O ILE A 108 4.517 10.404 9.798 1.00 0.00 O ATOM 1720 CB ILE A 108 7.023 10.976 8.180 1.00 0.00 C ATOM 1721 CG1 ILE A 108 6.945 12.314 7.452 1.00 0.00 C ATOM 1722 CG2 ILE A 108 6.024 10.062 7.526 1.00 0.00 C ATOM 1723 CD1 ILE A 108 7.273 12.219 6.001 1.00 0.00 C ATOM 0 H ILE A 108 8.030 11.078 11.081 1.00 0.00 H new ATOM 0 HA ILE A 108 6.893 12.494 9.792 1.00 0.00 H new ATOM 0 HB ILE A 108 7.958 10.415 8.172 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.940 12.722 7.564 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.629 13.018 7.926 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.379 9.786 6.533 1.00 0.00 H new ATOM 0 HG22 ILE A 108 5.903 9.163 8.131 1.00 0.00 H new ATOM 0 HG23 ILE A 108 5.065 10.573 7.440 1.00 0.00 H new ATOM 0 HD11 ILE A 108 7.198 13.206 5.546 1.00 0.00 H new ATOM 0 HD12 ILE A 108 8.288 11.841 5.881 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.573 11.540 5.513 1.00 0.00 H new ATOM 1735 N SER A 109 4.653 12.618 10.116 1.00 0.00 N ATOM 1736 CA SER A 109 3.221 12.706 10.363 1.00 0.00 C ATOM 1737 C SER A 109 2.854 14.131 10.454 1.00 0.00 C ATOM 1738 O SER A 109 3.063 14.871 11.385 1.00 0.00 O ATOM 1739 CB SER A 109 2.935 11.937 11.648 1.00 0.00 C ATOM 1740 OG SER A 109 1.657 12.191 12.161 1.00 0.00 O ATOM 0 H SER A 109 5.172 13.494 10.175 1.00 0.00 H new ATOM 0 HA SER A 109 2.625 12.268 9.562 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.039 10.869 11.457 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.681 12.201 12.397 1.00 0.00 H new ATOM 0 HG SER A 109 1.525 11.673 12.982 1.00 0.00 H new ATOM 1746 N GLY A 110 2.205 14.557 9.365 1.00 0.00 N ATOM 1747 CA GLY A 110 1.702 15.877 9.183 1.00 0.00 C ATOM 1748 C GLY A 110 2.802 16.902 9.238 1.00 0.00 C ATOM 1749 O GLY A 110 3.149 17.350 10.332 1.00 0.00 O ATOM 0 H GLY A 110 2.020 13.949 8.567 1.00 0.00 H new ATOM 0 HA2 GLY A 110 1.190 15.943 8.223 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.962 16.095 9.954 1.00 0.00 H new ATOM 1753 N ASN A 111 3.356 17.286 8.097 1.00 0.00 N ATOM 1754 CA ASN A 111 4.403 18.266 8.043 1.00 0.00 C ATOM 1755 C ASN A 111 5.529 18.069 9.092 1.00 0.00 C ATOM 1756 O ASN A 111 6.089 19.006 9.627 1.00 0.00 O ATOM 1757 CB ASN A 111 3.939 19.736 8.073 1.00 0.00 C ATOM 1758 CG ASN A 111 4.653 20.602 7.039 1.00 0.00 C ATOM 1759 OD1 ASN A 111 5.909 20.309 6.752 1.00 0.00 O flip ATOM 1760 ND2 ASN A 111 4.074 21.548 6.489 1.00 0.00 N flip ATOM 0 H ASN A 111 3.083 16.918 7.186 1.00 0.00 H new ATOM 0 HA ASN A 111 4.815 18.072 7.053 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.864 19.777 7.895 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.113 20.147 9.067 1.00 0.00 H new ATOM 0 HD21 ASN A 111 3.104 21.758 6.724 1.00 0.00 H new ATOM 0 HD22 ASN A 111 4.567 22.117 5.801 1.00 0.00 H new ATOM 1767 N GLU A 112 5.785 16.790 9.307 1.00 0.00 N ATOM 1768 CA GLU A 112 6.796 16.333 10.219 1.00 0.00 C ATOM 1769 C GLU A 112 7.693 15.397 9.362 1.00 0.00 C ATOM 1770 O GLU A 112 7.412 15.184 8.206 1.00 0.00 O ATOM 1771 CB GLU A 112 6.207 15.387 11.322 1.00 0.00 C ATOM 1772 CG GLU A 112 6.142 15.978 12.724 1.00 0.00 C ATOM 1773 CD GLU A 112 5.958 17.489 12.894 1.00 0.00 C ATOM 1774 OE1 GLU A 112 4.848 17.984 12.784 1.00 0.00 O ATOM 1775 OE2 GLU A 112 7.017 18.198 13.149 1.00 0.00 O ATOM 0 H GLU A 112 5.283 16.035 8.840 1.00 0.00 H new ATOM 0 HA GLU A 112 7.281 17.190 10.686 1.00 0.00 H new ATOM 0 HB2 GLU A 112 5.201 15.092 11.024 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.809 14.479 11.357 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.322 15.487 13.248 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.061 15.700 13.239 1.00 0.00 H new ATOM 1782 N LEU A 113 8.675 14.900 10.083 1.00 0.00 N ATOM 1783 CA LEU A 113 9.666 13.918 9.701 1.00 0.00 C ATOM 1784 C LEU A 113 10.537 13.755 10.975 1.00 0.00 C ATOM 1785 O LEU A 113 11.743 13.694 10.907 1.00 0.00 O ATOM 1786 CB LEU A 113 10.590 14.317 8.556 1.00 0.00 C ATOM 1787 CG LEU A 113 10.020 14.177 7.147 1.00 0.00 C ATOM 1788 CD1 LEU A 113 9.594 15.548 6.713 1.00 0.00 C ATOM 1789 CD2 LEU A 113 11.157 13.669 6.283 1.00 0.00 C ATOM 0 H LEU A 113 8.812 15.204 11.047 1.00 0.00 H new ATOM 0 HA LEU A 113 9.151 13.026 9.344 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.888 15.355 8.703 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.495 13.713 8.620 1.00 0.00 H new ATOM 0 HG LEU A 113 9.170 13.498 7.082 1.00 0.00 H new ATOM 0 HD11 LEU A 113 9.178 15.498 5.707 1.00 0.00 H new ATOM 0 HD12 LEU A 113 8.838 15.929 7.400 1.00 0.00 H new ATOM 0 HD13 LEU A 113 10.456 16.215 6.717 1.00 0.00 H new ATOM 0 HD21 LEU A 113 10.809 13.548 5.257 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.979 14.385 6.305 1.00 0.00 H new ATOM 0 HD23 LEU A 113 11.503 12.708 6.664 1.00 0.00 H new ATOM 1801 N ILE A 114 9.830 13.716 12.051 1.00 0.00 N ATOM 1802 CA ILE A 114 10.377 13.576 13.361 1.00 0.00 C ATOM 1803 C ILE A 114 11.450 12.484 13.408 1.00 0.00 C ATOM 1804 O ILE A 114 11.200 11.335 13.744 1.00 0.00 O ATOM 1805 CB ILE A 114 9.303 13.097 14.310 1.00 0.00 C ATOM 1806 CG1 ILE A 114 8.119 12.408 13.619 1.00 0.00 C ATOM 1807 CG2 ILE A 114 8.921 14.147 15.352 1.00 0.00 C ATOM 1808 CD1 ILE A 114 6.749 13.087 13.759 1.00 0.00 C ATOM 0 H ILE A 114 8.812 13.783 12.044 1.00 0.00 H new ATOM 0 HA ILE A 114 10.788 14.549 13.632 1.00 0.00 H new ATOM 0 HB ILE A 114 9.755 12.290 14.886 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.349 12.321 12.557 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.038 11.395 14.012 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.146 13.746 16.005 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.798 14.406 15.946 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.547 15.039 14.850 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.998 12.503 13.227 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.480 13.150 14.813 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.795 14.090 13.336 1.00 0.00 H new ATOM 1820 N GLN A 115 12.646 12.941 13.073 1.00 0.00 N ATOM 1821 CA GLN A 115 13.888 12.260 13.089 1.00 0.00 C ATOM 1822 C GLN A 115 13.908 11.410 14.366 1.00 0.00 C ATOM 1823 O GLN A 115 14.395 10.298 14.302 1.00 0.00 O ATOM 1824 CB GLN A 115 14.911 13.395 13.355 1.00 0.00 C ATOM 1825 CG GLN A 115 15.043 14.455 12.278 1.00 0.00 C ATOM 1826 CD GLN A 115 16.139 15.423 12.734 1.00 0.00 C ATOM 1827 OE1 GLN A 115 16.875 15.079 13.658 1.00 0.00 O ATOM 1828 NE2 GLN A 115 16.252 16.571 12.086 1.00 0.00 N ATOM 0 H GLN A 115 12.759 13.903 12.752 1.00 0.00 H new ATOM 0 HA GLN A 115 14.072 11.666 12.194 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.638 13.889 14.288 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.890 12.942 13.509 1.00 0.00 H new ATOM 0 HG2 GLN A 115 15.302 14.002 11.321 1.00 0.00 H new ATOM 0 HG3 GLN A 115 14.099 14.981 12.137 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.607 16.794 11.328 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.984 17.233 12.345 1.00 0.00 H new ATOM 1837 N THR A 116 13.375 12.039 15.384 1.00 0.00 N ATOM 1838 CA THR A 116 13.202 11.508 16.737 1.00 0.00 C ATOM 1839 C THR A 116 14.196 10.458 17.098 1.00 0.00 C ATOM 1840 O THR A 116 13.789 9.328 17.309 1.00 0.00 O ATOM 1841 CB THR A 116 11.776 10.981 16.859 1.00 0.00 C ATOM 1842 OG1 THR A 116 10.922 12.132 16.899 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.531 10.225 18.134 1.00 0.00 C ATOM 0 H THR A 116 13.026 12.993 15.298 1.00 0.00 H new ATOM 0 HA THR A 116 13.378 12.317 17.446 1.00 0.00 H new ATOM 0 HB THR A 116 11.591 10.305 16.024 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.988 11.844 16.976 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.498 9.877 18.158 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.203 9.369 18.184 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.713 10.880 18.986 1.00 0.00 H new ATOM 1851 N TYR A 117 15.476 10.825 17.204 1.00 0.00 N ATOM 1852 CA TYR A 117 16.382 9.834 17.655 1.00 0.00 C ATOM 1853 C TYR A 117 16.697 10.028 19.154 1.00 0.00 C ATOM 1854 O TYR A 117 17.410 10.982 19.550 1.00 0.00 O ATOM 1855 CB TYR A 117 17.779 9.910 17.034 1.00 0.00 C ATOM 1856 CG TYR A 117 18.206 10.534 15.735 1.00 0.00 C ATOM 1857 CD1 TYR A 117 17.584 11.527 15.023 1.00 0.00 C ATOM 1858 CD2 TYR A 117 19.400 10.062 15.148 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.126 12.021 13.821 1.00 0.00 C ATOM 1860 CE2 TYR A 117 19.954 10.525 13.963 1.00 0.00 C ATOM 1861 CZ TYR A 117 19.314 11.533 13.272 1.00 0.00 C ATOM 1862 OH TYR A 117 19.859 11.995 12.107 1.00 0.00 O ATOM 0 H TYR A 117 15.865 11.744 16.993 1.00 0.00 H new ATOM 0 HA TYR A 117 15.876 8.905 17.393 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.395 10.395 17.792 1.00 0.00 H new ATOM 0 HB3 TYR A 117 18.111 8.874 16.968 1.00 0.00 H new ATOM 0 HD1 TYR A 117 16.657 11.940 15.393 1.00 0.00 H new ATOM 0 HD2 TYR A 117 19.927 9.274 15.665 1.00 0.00 H new ATOM 0 HE1 TYR A 117 17.602 12.810 13.302 1.00 0.00 H new ATOM 0 HE2 TYR A 117 20.874 10.102 13.587 1.00 0.00 H new ATOM 0 HH TYR A 117 20.767 12.321 12.278 1.00 0.00 H new ATOM 1872 N THR A 118 16.144 9.112 19.922 1.00 0.00 N ATOM 1873 CA THR A 118 16.202 9.132 21.368 1.00 0.00 C ATOM 1874 C THR A 118 17.120 8.115 21.929 1.00 0.00 C ATOM 1875 O THR A 118 16.673 7.162 22.565 1.00 0.00 O ATOM 1876 CB THR A 118 14.837 8.943 22.074 1.00 0.00 C ATOM 1877 OG1 THR A 118 13.951 9.831 21.406 1.00 0.00 O ATOM 1878 CG2 THR A 118 14.950 9.301 23.521 1.00 0.00 C ATOM 0 H THR A 118 15.630 8.314 19.549 1.00 0.00 H new ATOM 0 HA THR A 118 16.571 10.138 21.569 1.00 0.00 H new ATOM 0 HB THR A 118 14.488 7.911 22.030 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.058 9.763 21.804 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.984 9.164 24.006 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.690 8.658 23.998 1.00 0.00 H new ATOM 0 HG23 THR A 118 15.259 10.342 23.615 1.00 0.00 H new ATOM 1886 N TYR A 119 18.453 8.276 21.786 1.00 0.00 N ATOM 1887 CA TYR A 119 19.407 7.386 22.378 1.00 0.00 C ATOM 1888 C TYR A 119 19.271 7.639 23.887 1.00 0.00 C ATOM 1889 O TYR A 119 19.373 8.733 24.379 1.00 0.00 O ATOM 1890 CB TYR A 119 20.865 7.677 21.920 1.00 0.00 C ATOM 1891 CG TYR A 119 21.451 8.702 22.813 1.00 0.00 C ATOM 1892 CD1 TYR A 119 21.273 10.071 22.688 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.220 8.261 23.898 1.00 0.00 C ATOM 1894 CE1 TYR A 119 21.810 10.947 23.590 1.00 0.00 C ATOM 1895 CE2 TYR A 119 22.771 9.125 24.820 1.00 0.00 C ATOM 1896 CZ TYR A 119 22.550 10.474 24.659 1.00 0.00 C ATOM 1897 OH TYR A 119 23.043 11.380 25.548 1.00 0.00 O ATOM 0 H TYR A 119 18.873 9.036 21.251 1.00 0.00 H new ATOM 0 HA TYR A 119 19.213 6.354 22.086 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.460 6.764 21.952 1.00 0.00 H new ATOM 0 HB3 TYR A 119 20.873 8.027 20.888 1.00 0.00 H new ATOM 0 HD1 TYR A 119 20.697 10.455 21.859 1.00 0.00 H new ATOM 0 HD2 TYR A 119 22.388 7.201 24.017 1.00 0.00 H new ATOM 0 HE1 TYR A 119 21.656 12.009 23.468 1.00 0.00 H new ATOM 0 HE2 TYR A 119 23.360 8.754 25.646 1.00 0.00 H new ATOM 0 HH TYR A 119 23.329 10.917 26.363 1.00 0.00 H new ATOM 1907 N GLU A 120 19.001 6.548 24.630 1.00 0.00 N ATOM 1908 CA GLU A 120 18.864 6.683 26.085 1.00 0.00 C ATOM 1909 C GLU A 120 17.862 7.663 26.607 1.00 0.00 C ATOM 1910 O GLU A 120 17.699 7.860 27.817 1.00 0.00 O ATOM 1911 CB GLU A 120 20.317 6.949 26.584 1.00 0.00 C ATOM 1912 CG GLU A 120 20.423 8.076 27.615 1.00 0.00 C ATOM 1913 CD GLU A 120 20.268 7.598 29.053 1.00 0.00 C ATOM 1914 OE1 GLU A 120 19.679 6.443 29.115 1.00 0.00 O ATOM 1915 OE2 GLU A 120 20.643 8.198 30.062 1.00 0.00 O ATOM 0 H GLU A 120 18.879 5.604 24.263 1.00 0.00 H new ATOM 0 HA GLU A 120 18.422 5.771 26.486 1.00 0.00 H new ATOM 0 HB2 GLU A 120 20.714 6.032 27.020 1.00 0.00 H new ATOM 0 HB3 GLU A 120 20.946 7.193 25.728 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.389 8.568 27.506 1.00 0.00 H new ATOM 0 HG3 GLU A 120 19.659 8.824 27.404 1.00 0.00 H new ATOM 1922 N GLY A 121 17.125 8.348 25.767 1.00 0.00 N ATOM 1923 CA GLY A 121 16.155 9.322 26.182 1.00 0.00 C ATOM 1924 C GLY A 121 16.444 10.744 25.704 1.00 0.00 C ATOM 1925 O GLY A 121 15.924 11.684 26.268 1.00 0.00 O ATOM 0 H GLY A 121 17.187 8.239 24.755 1.00 0.00 H new ATOM 0 HA2 GLY A 121 15.175 9.020 25.814 1.00 0.00 H new ATOM 0 HA3 GLY A 121 16.101 9.322 27.271 1.00 0.00 H new ATOM 1929 N VAL A 122 17.293 10.866 24.650 1.00 0.00 N ATOM 1930 CA VAL A 122 17.666 12.132 24.100 1.00 0.00 C ATOM 1931 C VAL A 122 17.214 12.265 22.653 1.00 0.00 C ATOM 1932 O VAL A 122 18.038 12.447 21.755 1.00 0.00 O ATOM 1933 CB VAL A 122 19.219 12.228 24.129 1.00 0.00 C ATOM 1934 CG1 VAL A 122 19.724 13.617 23.732 1.00 0.00 C ATOM 1935 CG2 VAL A 122 19.644 11.886 25.533 1.00 0.00 C ATOM 0 H VAL A 122 17.722 10.069 24.179 1.00 0.00 H new ATOM 0 HA VAL A 122 17.195 12.921 24.686 1.00 0.00 H new ATOM 0 HB VAL A 122 19.648 11.539 23.401 1.00 0.00 H new ATOM 0 HG11 VAL A 122 20.813 13.632 23.768 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.391 13.850 22.721 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.328 14.360 24.424 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.730 11.939 25.607 1.00 0.00 H new ATOM 0 HG22 VAL A 122 19.198 12.594 26.231 1.00 0.00 H new ATOM 0 HG23 VAL A 122 19.312 10.877 25.778 1.00 0.00 H new ATOM 1945 N GLU A 123 15.949 12.198 22.355 1.00 0.00 N ATOM 1946 CA GLU A 123 15.352 12.338 21.067 1.00 0.00 C ATOM 1947 C GLU A 123 15.871 13.619 20.454 1.00 0.00 C ATOM 1948 O GLU A 123 15.805 14.655 21.107 1.00 0.00 O ATOM 1949 CB GLU A 123 13.836 12.726 21.218 1.00 0.00 C ATOM 1950 CG GLU A 123 13.115 12.577 19.842 1.00 0.00 C ATOM 1951 CD GLU A 123 11.648 12.836 19.739 1.00 0.00 C ATOM 1952 OE1 GLU A 123 11.038 12.172 20.700 1.00 0.00 O ATOM 1953 OE2 GLU A 123 10.953 13.508 18.995 1.00 0.00 O ATOM 0 H GLU A 123 15.249 12.028 23.077 1.00 0.00 H new ATOM 0 HA GLU A 123 15.540 11.416 20.517 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.359 12.086 21.960 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.747 13.751 21.577 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.613 13.246 19.140 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.291 11.560 19.492 1.00 0.00 H new ATOM 1960 N ALA A 124 16.352 13.474 19.213 1.00 0.00 N ATOM 1961 CA ALA A 124 16.856 14.664 18.517 1.00 0.00 C ATOM 1962 C ALA A 124 16.121 14.744 17.178 1.00 0.00 C ATOM 1963 O ALA A 124 16.204 13.833 16.411 1.00 0.00 O ATOM 1964 CB ALA A 124 18.338 14.734 18.312 1.00 0.00 C ATOM 0 H ALA A 124 16.403 12.598 18.694 1.00 0.00 H new ATOM 0 HA ALA A 124 16.657 15.519 19.163 1.00 0.00 H new ATOM 0 HB1 ALA A 124 18.590 15.656 17.788 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.840 14.717 19.279 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.664 13.879 17.719 1.00 0.00 H new ATOM 1970 N LYS A 125 15.418 15.860 17.015 1.00 0.00 N ATOM 1971 CA LYS A 125 14.668 15.969 15.769 1.00 0.00 C ATOM 1972 C LYS A 125 14.629 17.405 15.348 1.00 0.00 C ATOM 1973 O LYS A 125 15.519 18.147 15.835 1.00 0.00 O ATOM 1974 CB LYS A 125 13.222 15.420 15.960 1.00 0.00 C ATOM 1975 CG LYS A 125 13.084 14.681 17.281 1.00 0.00 C ATOM 1976 CD LYS A 125 12.910 15.661 18.478 1.00 0.00 C ATOM 1977 CE LYS A 125 11.987 16.851 18.254 1.00 0.00 C ATOM 1978 NZ LYS A 125 11.460 17.355 19.536 1.00 0.00 N ATOM 0 H LYS A 125 15.351 16.641 17.667 1.00 0.00 H new ATOM 0 HA LYS A 125 15.157 15.377 14.995 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.510 16.244 15.926 1.00 0.00 H new ATOM 0 HB3 LYS A 125 12.973 14.749 15.138 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.227 14.010 17.234 1.00 0.00 H new ATOM 0 HG3 LYS A 125 13.966 14.061 17.444 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.535 15.095 19.331 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.894 16.040 18.754 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.529 17.646 17.741 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.161 16.559 17.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 10.833 18.166 19.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 10.924 16.601 20.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 12.250 17.654 20.143 1.00 0.00 H new ATOM 1992 N ARG A 126 13.687 17.774 14.516 1.00 0.00 N ATOM 1993 CA ARG A 126 13.563 19.183 14.053 1.00 0.00 C ATOM 1994 C ARG A 126 12.817 18.996 12.750 1.00 0.00 C ATOM 1995 O ARG A 126 11.795 19.628 12.659 1.00 0.00 O ATOM 1996 CB ARG A 126 14.806 19.976 13.904 1.00 0.00 C ATOM 1997 CG ARG A 126 14.966 20.784 15.140 1.00 0.00 C ATOM 1998 CD ARG A 126 13.986 21.938 15.080 1.00 0.00 C ATOM 1999 NE ARG A 126 12.810 21.622 15.877 1.00 0.00 N ATOM 2000 CZ ARG A 126 11.548 21.591 15.451 1.00 0.00 C ATOM 2001 NH1 ARG A 126 11.191 21.864 14.206 1.00 0.00 N ATOM 2002 NH2 ARG A 126 10.571 21.274 16.294 1.00 0.00 N ATOM 0 H ARG A 126 12.985 17.141 14.132 1.00 0.00 H new ATOM 0 HA ARG A 126 13.068 19.800 14.803 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.665 19.321 13.760 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.747 20.622 13.028 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.779 20.171 16.022 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.987 21.156 15.222 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.457 22.848 15.453 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.697 22.129 14.047 1.00 0.00 H new ATOM 0 HE ARG A 126 12.968 21.402 16.860 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.899 22.114 13.516 1.00 0.00 H new ATOM 0 HH12 ARG A 126 10.208 21.824 13.937 1.00 0.00 H new ATOM 0 HH21 ARG A 126 10.788 21.055 17.266 1.00 0.00 H new ATOM 0 HH22 ARG A 126 9.605 21.250 15.969 1.00 0.00 H new ATOM 2016 N ILE A 127 13.347 18.162 11.847 1.00 0.00 N ATOM 2017 CA ILE A 127 12.765 17.763 10.603 1.00 0.00 C ATOM 2018 C ILE A 127 13.533 18.120 9.389 1.00 0.00 C ATOM 2019 O ILE A 127 14.441 18.925 9.464 1.00 0.00 O ATOM 2020 CB ILE A 127 11.264 18.153 10.457 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.453 17.145 11.270 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.677 18.265 9.066 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.887 16.838 12.694 1.00 0.00 C ATOM 0 H ILE A 127 14.258 17.729 11.997 1.00 0.00 H new ATOM 0 HA ILE A 127 12.818 16.676 10.665 1.00 0.00 H new ATOM 0 HB ILE A 127 11.209 19.180 10.817 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.424 17.502 11.308 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.444 16.206 10.717 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.625 18.543 9.136 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.217 19.026 8.503 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.765 17.306 8.556 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.209 16.105 13.131 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.900 16.436 12.687 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.864 17.753 13.287 1.00 0.00 H new ATOM 2035 N PHE A 128 13.052 17.427 8.331 1.00 0.00 N ATOM 2036 CA PHE A 128 13.448 17.378 6.996 1.00 0.00 C ATOM 2037 C PHE A 128 12.881 18.401 6.044 1.00 0.00 C ATOM 2038 O PHE A 128 11.694 18.729 6.030 1.00 0.00 O ATOM 2039 CB PHE A 128 13.062 15.917 6.583 1.00 0.00 C ATOM 2040 CG PHE A 128 13.871 14.970 7.487 1.00 0.00 C ATOM 2041 CD1 PHE A 128 13.514 14.584 8.750 1.00 0.00 C ATOM 2042 CD2 PHE A 128 15.103 14.446 7.060 1.00 0.00 C ATOM 2043 CE1 PHE A 128 14.251 13.727 9.535 1.00 0.00 C ATOM 2044 CE2 PHE A 128 15.884 13.608 7.853 1.00 0.00 C ATOM 2045 CZ PHE A 128 15.461 13.231 9.105 1.00 0.00 C ATOM 0 H PHE A 128 12.253 16.809 8.473 1.00 0.00 H new ATOM 0 HA PHE A 128 14.505 17.633 6.922 1.00 0.00 H new ATOM 0 HB2 PHE A 128 11.992 15.750 6.708 1.00 0.00 H new ATOM 0 HB3 PHE A 128 13.292 15.739 5.533 1.00 0.00 H new ATOM 0 HD1 PHE A 128 12.594 14.977 9.157 1.00 0.00 H new ATOM 0 HD2 PHE A 128 15.460 14.704 6.074 1.00 0.00 H new ATOM 0 HE1 PHE A 128 13.874 13.439 10.505 1.00 0.00 H new ATOM 0 HE2 PHE A 128 16.832 13.251 7.480 1.00 0.00 H new ATOM 0 HZ PHE A 128 16.053 12.574 9.725 1.00 0.00 H new ATOM 2055 N LYS A 129 13.813 18.866 5.205 1.00 0.00 N ATOM 2056 CA LYS A 129 13.639 19.800 4.166 1.00 0.00 C ATOM 2057 C LYS A 129 13.045 19.149 2.936 1.00 0.00 C ATOM 2058 O LYS A 129 13.445 19.607 1.877 1.00 0.00 O ATOM 2059 CB LYS A 129 14.695 20.849 3.852 1.00 0.00 C ATOM 2060 CG LYS A 129 15.356 21.410 5.090 1.00 0.00 C ATOM 2061 CD LYS A 129 16.755 21.942 4.793 1.00 0.00 C ATOM 2062 CE LYS A 129 16.671 22.922 3.604 1.00 0.00 C ATOM 2063 NZ LYS A 129 17.816 23.789 3.341 1.00 0.00 N ATOM 0 H LYS A 129 14.781 18.550 5.269 1.00 0.00 H new ATOM 0 HA LYS A 129 12.927 20.477 4.637 1.00 0.00 H new ATOM 0 HB2 LYS A 129 15.456 20.409 3.208 1.00 0.00 H new ATOM 0 HB3 LYS A 129 14.235 21.663 3.292 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.741 22.212 5.499 1.00 0.00 H new ATOM 0 HG3 LYS A 129 15.416 20.634 5.853 1.00 0.00 H new ATOM 0 HD2 LYS A 129 17.161 22.446 5.670 1.00 0.00 H new ATOM 0 HD3 LYS A 129 17.430 21.119 4.557 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.483 22.337 2.704 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.800 23.559 3.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 17.615 24.389 2.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 17.994 24.390 4.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 18.656 23.206 3.149 1.00 0.00 H new ATOM 2077 N LYS A 130 12.123 18.243 3.133 1.00 0.00 N ATOM 2078 CA LYS A 130 11.440 17.663 2.042 1.00 0.00 C ATOM 2079 C LYS A 130 11.603 18.438 0.751 1.00 0.00 C ATOM 2080 O LYS A 130 11.606 19.689 0.635 1.00 0.00 O ATOM 2081 CB LYS A 130 9.915 17.512 2.231 1.00 0.00 C ATOM 2082 CG LYS A 130 9.115 17.408 0.899 1.00 0.00 C ATOM 2083 CD LYS A 130 8.599 18.685 0.312 1.00 0.00 C ATOM 2084 CE LYS A 130 7.091 18.697 -0.026 1.00 0.00 C ATOM 2085 NZ LYS A 130 6.575 20.064 -0.134 1.00 0.00 N ATOM 0 H LYS A 130 11.838 17.899 4.050 1.00 0.00 H new ATOM 0 HA LYS A 130 11.912 16.682 1.991 1.00 0.00 H new ATOM 0 HB2 LYS A 130 9.721 16.622 2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 130 9.544 18.365 2.799 1.00 0.00 H new ATOM 0 HG2 LYS A 130 9.754 16.929 0.157 1.00 0.00 H new ATOM 0 HG3 LYS A 130 8.266 16.745 1.065 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.804 19.496 1.011 1.00 0.00 H new ATOM 0 HD3 LYS A 130 9.160 18.900 -0.598 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.923 18.169 -0.965 1.00 0.00 H new ATOM 0 HE3 LYS A 130 6.540 18.159 0.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.561 20.035 -0.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.713 20.560 0.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.084 20.569 -0.887 1.00 0.00 H new ATOM 2099 N GLU A 131 11.661 17.555 -0.269 1.00 0.00 N ATOM 2100 CA GLU A 131 11.923 18.047 -1.661 1.00 0.00 C ATOM 2101 C GLU A 131 11.201 17.355 -2.775 1.00 0.00 C ATOM 2102 O GLU A 131 11.752 16.727 -3.686 1.00 0.00 O ATOM 2103 CB GLU A 131 13.458 18.213 -1.602 1.00 0.00 C ATOM 2104 CG GLU A 131 14.395 18.890 -2.607 1.00 0.00 C ATOM 2105 CD GLU A 131 14.056 20.344 -2.922 1.00 0.00 C ATOM 2106 OE1 GLU A 131 12.836 20.754 -2.811 1.00 0.00 O ATOM 2107 OE2 GLU A 131 15.025 21.119 -3.294 1.00 0.00 O ATOM 2108 OXT GLU A 131 10.420 18.667 -2.511 1.00 0.00 O ATOM 0 H GLU A 131 11.539 16.547 -0.177 1.00 0.00 H new ATOM 0 HA GLU A 131 11.461 18.986 -1.967 1.00 0.00 H new ATOM 0 HB2 GLU A 131 13.647 18.723 -0.657 1.00 0.00 H new ATOM 0 HB3 GLU A 131 13.844 17.199 -1.500 1.00 0.00 H new ATOM 0 HG2 GLU A 131 15.413 18.845 -2.220 1.00 0.00 H new ATOM 0 HG3 GLU A 131 14.382 18.319 -3.536 1.00 0.00 H new