USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=30 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 20 LYS NZ :NH3+ -178:sc= -1.59! (180deg=-2.39!) USER MOD Set 1.2: A 119 TYR OH : rot -17:sc= -2.27 USER MOD Set 2.1: A 14 TYR OH : rot 30:sc= 0.752 USER MOD Set 2.2: A 117 TYR OH : rot 59:sc= 2.49 USER MOD Set 3.1: A 42 GLN : amide:sc= -0.159 K(o=-1,f=-5.7!) USER MOD Set 3.2: A 84 MET CE :methyl -112:sc= -0.879 (180deg=-4.97!) USER MOD Set 4.1: A 37 LYS NZ :NH3+ -153:sc= 1.08 (180deg=0.314) USER MOD Set 4.2: A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 ALA N :NH3+ -121:sc= 0.545 (180deg=0.035) USER MOD Single : A 5 THR OG1 : rot -92:sc= -7.3! USER MOD Single : A 7 LYS NZ :NH3+ -149:sc= -0.728 (180deg=-2.85!) USER MOD Single : A 11 ASN : amide:sc= -0.0414 X(o=-0.041,f=-0.043) USER MOD Single : A 13 ASN :FLIP amide:sc= -3.83! C(o=-4.8!,f=-3.8!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -165:sc= -0.763 (180deg=-0.978) USER MOD Single : A 21 MET CE :methyl -161:sc= -12.6! (180deg=-15.3!) USER MOD Single : A 24 ASN : amide:sc= -0.213 X(o=-0.21,f=-0.038) USER MOD Single : A 27 LYS NZ :NH3+ 160:sc= 0.583 (180deg=0.39) USER MOD Single : A 39 THR OG1 : rot 59:sc= -5.06! USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.0393 X(o=-0.039,f=-0.23) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 52 SER OG : rot -64:sc= 1.1 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.896 X(o=-0.9,f=-0.54) USER MOD Single : A 57 ASN : amide:sc= -0.0169 X(o=-0.017,f=-0.29) USER MOD Single : A 70 TYR OH : rot 180:sc= -0.202 USER MOD Single : A 71 SER OG : rot -110:sc= -0.833 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot -4:sc= 0.999 USER MOD Single : A 81 THR OG1 : rot 52:sc= 0.482 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.0465 K(o=-0.046,f=-3!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 152:sc= 0.433 (180deg=0.119) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -0.282 K(o=-0.28,f=-3.4!) USER MOD Single : A 100 LYS NZ :NH3+ 149:sc= 1.86 (180deg=-0.0441) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 GLN : amide:sc= -9.86! C(o=-9.9!,f=-17!) USER MOD Single : A 116 THR OG1 : rot -25:sc= -1.74 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 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+ -145:sc= -0.555 (180deg=-2.03!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 2.867 8.818 3.266 1.00 0.00 N ATOM 2 CA ALA A 1 3.726 9.836 3.803 1.00 0.00 C ATOM 3 C ALA A 1 5.148 9.327 3.526 1.00 0.00 C ATOM 4 O ALA A 1 5.175 8.382 2.762 1.00 0.00 O ATOM 5 CB ALA A 1 3.417 9.900 5.286 1.00 0.00 C ATOM 0 H1 ALA A 1 2.251 9.232 2.537 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.445 8.064 2.843 1.00 0.00 H new ATOM 0 H3 ALA A 1 2.282 8.420 4.028 1.00 0.00 H new ATOM 0 HA ALA A 1 3.602 10.833 3.380 1.00 0.00 H new ATOM 0 HB1 ALA A 1 4.041 10.660 5.755 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.367 10.155 5.428 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.620 8.931 5.742 1.00 0.00 H new ATOM 13 N PHE A 2 6.209 9.910 4.107 1.00 0.00 N ATOM 14 CA PHE A 2 7.597 9.451 3.870 1.00 0.00 C ATOM 15 C PHE A 2 8.076 9.503 2.394 1.00 0.00 C ATOM 16 O PHE A 2 9.165 9.995 2.162 1.00 0.00 O ATOM 17 CB PHE A 2 7.808 7.942 4.213 1.00 0.00 C ATOM 18 CG PHE A 2 8.155 7.646 5.639 1.00 0.00 C ATOM 19 CD1 PHE A 2 9.389 8.005 6.130 1.00 0.00 C ATOM 20 CD2 PHE A 2 7.219 6.992 6.435 1.00 0.00 C ATOM 21 CE1 PHE A 2 9.731 7.719 7.438 1.00 0.00 C ATOM 22 CE2 PHE A 2 7.534 6.698 7.739 1.00 0.00 C ATOM 23 CZ PHE A 2 8.793 7.065 8.223 1.00 0.00 C ATOM 0 H PHE A 2 6.137 10.702 4.746 1.00 0.00 H new ATOM 0 HA PHE A 2 8.147 10.145 4.506 1.00 0.00 H new ATOM 0 HB2 PHE A 2 6.898 7.399 3.959 1.00 0.00 H new ATOM 0 HB3 PHE A 2 8.601 7.550 3.576 1.00 0.00 H new ATOM 0 HD1 PHE A 2 10.095 8.513 5.489 1.00 0.00 H new ATOM 0 HD2 PHE A 2 6.255 6.719 6.031 1.00 0.00 H new ATOM 0 HE1 PHE A 2 10.696 7.995 7.836 1.00 0.00 H new ATOM 0 HE2 PHE A 2 6.824 6.194 8.377 1.00 0.00 H new ATOM 0 HZ PHE A 2 9.045 6.830 9.247 1.00 0.00 H new ATOM 33 N ASP A 3 7.320 9.020 1.421 1.00 0.00 N ATOM 34 CA ASP A 3 7.797 9.071 0.018 1.00 0.00 C ATOM 35 C ASP A 3 8.266 10.428 -0.426 1.00 0.00 C ATOM 36 O ASP A 3 7.508 11.380 -0.210 1.00 0.00 O ATOM 37 CB ASP A 3 6.774 8.486 -0.972 1.00 0.00 C ATOM 38 CG ASP A 3 5.483 9.255 -0.886 1.00 0.00 C ATOM 39 OD1 ASP A 3 4.751 8.812 0.106 1.00 0.00 O ATOM 40 OD2 ASP A 3 5.145 10.172 -1.628 1.00 0.00 O ATOM 0 H ASP A 3 6.401 8.598 1.552 1.00 0.00 H new ATOM 0 HA ASP A 3 8.680 8.432 0.008 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.169 8.533 -1.987 1.00 0.00 H new ATOM 0 HB3 ASP A 3 6.597 7.434 -0.747 1.00 0.00 H new ATOM 45 N GLY A 4 9.465 10.513 -1.012 1.00 0.00 N ATOM 46 CA GLY A 4 9.981 11.775 -1.431 1.00 0.00 C ATOM 47 C GLY A 4 11.335 12.156 -0.797 1.00 0.00 C ATOM 48 O GLY A 4 11.999 11.243 -0.369 1.00 0.00 O ATOM 0 H GLY A 4 10.075 9.717 -1.196 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.092 11.766 -2.515 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.252 12.549 -1.192 1.00 0.00 H new ATOM 52 N THR A 5 11.516 13.439 -0.811 1.00 0.00 N ATOM 53 CA THR A 5 12.574 14.203 -0.245 1.00 0.00 C ATOM 54 C THR A 5 12.165 14.534 1.158 1.00 0.00 C ATOM 55 O THR A 5 10.993 14.412 1.453 1.00 0.00 O ATOM 56 CB THR A 5 12.867 15.455 -1.109 1.00 0.00 C ATOM 57 OG1 THR A 5 11.615 16.134 -0.952 1.00 0.00 O ATOM 58 CG2 THR A 5 13.122 14.998 -2.524 1.00 0.00 C ATOM 0 H THR A 5 10.841 14.045 -1.277 1.00 0.00 H new ATOM 0 HA THR A 5 13.511 13.646 -0.223 1.00 0.00 H new ATOM 0 HB THR A 5 13.729 16.069 -0.848 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.011 15.878 -1.680 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.331 15.863 -3.154 1.00 0.00 H new ATOM 0 HG22 THR A 5 13.977 14.322 -2.540 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.242 14.478 -2.903 1.00 0.00 H new ATOM 66 N TRP A 6 13.193 14.910 1.852 1.00 0.00 N ATOM 67 CA TRP A 6 13.136 15.187 3.260 1.00 0.00 C ATOM 68 C TRP A 6 14.552 15.547 3.665 1.00 0.00 C ATOM 69 O TRP A 6 15.413 15.141 2.916 1.00 0.00 O ATOM 70 CB TRP A 6 12.995 13.725 3.794 1.00 0.00 C ATOM 71 CG TRP A 6 11.576 13.315 3.839 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.168 12.036 3.596 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.371 14.070 4.057 1.00 0.00 C ATOM 74 NE1 TRP A 6 9.815 11.965 3.643 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.285 13.171 3.911 1.00 0.00 C ATOM 76 CE3 TRP A 6 10.023 15.384 4.343 1.00 0.00 C ATOM 77 CZ2 TRP A 6 7.955 13.515 4.024 1.00 0.00 C ATOM 78 CZ3 TRP A 6 8.687 15.732 4.463 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.673 14.806 4.298 1.00 0.00 C ATOM 0 H TRP A 6 14.121 15.037 1.448 1.00 0.00 H new ATOM 0 HA TRP A 6 12.400 15.929 3.570 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.554 13.044 3.153 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.430 13.654 4.791 1.00 0.00 H new ATOM 0 HD1 TRP A 6 11.826 11.203 3.396 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.273 11.113 3.495 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.791 16.132 4.471 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.172 12.782 3.899 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.430 16.756 4.692 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.644 15.120 4.389 1.00 0.00 H new ATOM 90 N LYS A 7 14.708 16.210 4.778 1.00 0.00 N ATOM 91 CA LYS A 7 16.085 16.642 5.102 1.00 0.00 C ATOM 92 C LYS A 7 16.151 16.660 6.590 1.00 0.00 C ATOM 93 O LYS A 7 15.606 15.762 7.239 1.00 0.00 O ATOM 94 CB LYS A 7 16.282 18.001 4.404 1.00 0.00 C ATOM 95 CG LYS A 7 15.630 18.030 3.045 1.00 0.00 C ATOM 96 CD LYS A 7 15.899 19.127 2.034 1.00 0.00 C ATOM 97 CE LYS A 7 17.218 18.935 1.240 1.00 0.00 C ATOM 98 NZ LYS A 7 17.408 19.936 0.167 1.00 0.00 N ATOM 0 H LYS A 7 13.978 16.459 5.445 1.00 0.00 H new ATOM 0 HA LYS A 7 16.894 16.000 4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.864 18.793 5.025 1.00 0.00 H new ATOM 0 HB3 LYS A 7 17.348 18.206 4.301 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.883 17.088 2.558 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.553 18.021 3.216 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.066 19.174 1.332 1.00 0.00 H new ATOM 0 HD3 LYS A 7 15.933 20.085 2.552 1.00 0.00 H new ATOM 0 HE2 LYS A 7 18.060 18.988 1.930 1.00 0.00 H new ATOM 0 HE3 LYS A 7 17.228 17.937 0.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 17.944 19.509 -0.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 16.480 20.252 -0.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.933 20.752 0.542 1.00 0.00 H new ATOM 112 N VAL A 8 16.802 17.684 7.086 1.00 0.00 N ATOM 113 CA VAL A 8 16.874 17.872 8.523 1.00 0.00 C ATOM 114 C VAL A 8 17.077 19.384 8.718 1.00 0.00 C ATOM 115 O VAL A 8 18.036 19.828 9.294 1.00 0.00 O ATOM 116 CB VAL A 8 17.853 16.968 9.239 1.00 0.00 C ATOM 117 CG1 VAL A 8 18.131 17.474 10.654 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.423 15.471 9.271 1.00 0.00 C ATOM 0 H VAL A 8 17.284 18.392 6.531 1.00 0.00 H new ATOM 0 HA VAL A 8 15.956 17.550 9.014 1.00 0.00 H new ATOM 0 HB VAL A 8 18.771 17.008 8.653 1.00 0.00 H new ATOM 0 HG11 VAL A 8 18.838 16.806 11.147 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.554 18.478 10.605 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.200 17.499 11.221 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.176 14.887 9.801 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.465 15.378 9.783 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.327 15.098 8.251 1.00 0.00 H new ATOM 128 N ASP A 9 16.110 20.095 8.153 1.00 0.00 N ATOM 129 CA ASP A 9 16.009 21.528 8.092 1.00 0.00 C ATOM 130 C ASP A 9 16.550 22.175 9.377 1.00 0.00 C ATOM 131 O ASP A 9 17.273 23.137 9.301 1.00 0.00 O ATOM 132 CB ASP A 9 14.498 21.838 8.122 1.00 0.00 C ATOM 133 CG ASP A 9 14.022 23.103 7.492 1.00 0.00 C ATOM 134 OD1 ASP A 9 14.780 23.991 7.176 1.00 0.00 O ATOM 135 OD2 ASP A 9 12.727 23.189 7.297 1.00 0.00 O ATOM 0 H ASP A 9 15.321 19.640 7.694 1.00 0.00 H new ATOM 0 HA ASP A 9 16.551 21.892 7.219 1.00 0.00 H new ATOM 0 HB2 ASP A 9 13.979 21.010 7.638 1.00 0.00 H new ATOM 0 HB3 ASP A 9 14.181 21.847 9.165 1.00 0.00 H new ATOM 140 N ARG A 10 16.102 21.570 10.452 1.00 0.00 N ATOM 141 CA ARG A 10 16.482 22.123 11.695 1.00 0.00 C ATOM 142 C ARG A 10 17.148 21.129 12.591 1.00 0.00 C ATOM 143 O ARG A 10 17.219 19.942 12.210 1.00 0.00 O ATOM 144 CB ARG A 10 15.249 22.788 12.311 1.00 0.00 C ATOM 145 CG ARG A 10 13.908 22.471 11.644 1.00 0.00 C ATOM 146 CD ARG A 10 13.388 23.531 10.675 1.00 0.00 C ATOM 147 NE ARG A 10 12.990 24.697 11.456 1.00 0.00 N ATOM 148 CZ ARG A 10 11.832 24.900 12.099 1.00 0.00 C ATOM 149 NH1 ARG A 10 10.878 23.983 12.069 1.00 0.00 N ATOM 150 NH2 ARG A 10 11.599 26.016 12.782 1.00 0.00 N ATOM 0 H ARG A 10 15.508 20.742 10.480 1.00 0.00 H new ATOM 0 HA ARG A 10 17.250 22.882 11.546 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.189 22.494 13.359 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.395 23.868 12.290 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.004 21.528 11.106 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.161 22.319 12.423 1.00 0.00 H new ATOM 0 HD2 ARG A 10 14.160 23.800 9.954 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.542 23.146 10.107 1.00 0.00 H new ATOM 0 HE ARG A 10 13.676 25.449 11.520 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.022 23.114 11.554 1.00 0.00 H new ATOM 0 HH12 ARG A 10 9.999 24.145 12.561 1.00 0.00 H new ATOM 0 HH21 ARG A 10 12.311 26.745 12.826 1.00 0.00 H new ATOM 0 HH22 ARG A 10 10.708 26.144 13.262 1.00 0.00 H new ATOM 164 N ASN A 11 17.646 21.537 13.726 1.00 0.00 N ATOM 165 CA ASN A 11 18.286 20.546 14.559 1.00 0.00 C ATOM 166 C ASN A 11 18.159 20.799 16.031 1.00 0.00 C ATOM 167 O ASN A 11 18.889 21.701 16.524 1.00 0.00 O ATOM 168 CB ASN A 11 19.780 20.526 14.159 1.00 0.00 C ATOM 169 CG ASN A 11 20.336 21.868 13.739 1.00 0.00 C ATOM 170 OD1 ASN A 11 20.247 22.321 12.607 1.00 0.00 O ATOM 171 ND2 ASN A 11 20.946 22.546 14.695 1.00 0.00 N ATOM 0 H ASN A 11 17.628 22.492 14.085 1.00 0.00 H new ATOM 0 HA ASN A 11 17.789 19.590 14.393 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.363 20.153 15.001 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.914 19.819 13.340 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.351 23.460 14.493 1.00 0.00 H new ATOM 0 HD22 ASN A 11 21.012 22.155 15.635 1.00 0.00 H new ATOM 178 N GLU A 12 17.301 20.060 16.726 1.00 0.00 N ATOM 179 CA GLU A 12 17.201 20.289 18.154 1.00 0.00 C ATOM 180 C GLU A 12 17.678 18.978 18.815 1.00 0.00 C ATOM 181 O GLU A 12 17.331 17.940 18.300 1.00 0.00 O ATOM 182 CB GLU A 12 15.841 20.744 18.732 1.00 0.00 C ATOM 183 CG GLU A 12 15.222 19.867 19.852 1.00 0.00 C ATOM 184 CD GLU A 12 15.695 20.227 21.241 1.00 0.00 C ATOM 185 OE1 GLU A 12 16.908 20.712 21.306 1.00 0.00 O ATOM 186 OE2 GLU A 12 15.013 20.079 22.221 1.00 0.00 O ATOM 0 H GLU A 12 16.695 19.334 16.345 1.00 0.00 H new ATOM 0 HA GLU A 12 17.815 21.161 18.378 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.960 21.755 19.121 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.126 20.800 17.911 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.136 19.958 19.813 1.00 0.00 H new ATOM 0 HG3 GLU A 12 15.462 18.822 19.656 1.00 0.00 H new ATOM 193 N ASN A 13 18.441 19.051 19.902 1.00 0.00 N ATOM 194 CA ASN A 13 18.946 17.862 20.595 1.00 0.00 C ATOM 195 C ASN A 13 19.840 17.039 19.670 1.00 0.00 C ATOM 196 O ASN A 13 20.063 15.891 19.978 1.00 0.00 O ATOM 197 CB ASN A 13 17.789 16.968 21.055 1.00 0.00 C ATOM 198 CG ASN A 13 16.774 17.626 21.977 1.00 0.00 C ATOM 199 OD1 ASN A 13 15.500 17.447 21.679 1.00 0.00 O flip ATOM 200 ND2 ASN A 13 17.160 18.289 22.946 1.00 0.00 N flip ATOM 0 H ASN A 13 18.728 19.932 20.329 1.00 0.00 H new ATOM 0 HA ASN A 13 19.516 18.207 21.458 1.00 0.00 H new ATOM 0 HB2 ASN A 13 17.266 16.600 20.173 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.206 16.099 21.564 1.00 0.00 H new ATOM 0 HD21 ASN A 13 18.158 18.393 23.128 1.00 0.00 H new ATOM 0 HD22 ASN A 13 16.480 18.732 23.564 1.00 0.00 H new ATOM 207 N TYR A 14 20.296 17.678 18.581 1.00 0.00 N ATOM 208 CA TYR A 14 21.147 17.020 17.600 1.00 0.00 C ATOM 209 C TYR A 14 22.646 17.127 17.738 1.00 0.00 C ATOM 210 O TYR A 14 23.321 16.140 17.427 1.00 0.00 O ATOM 211 CB TYR A 14 20.560 17.421 16.229 1.00 0.00 C ATOM 212 CG TYR A 14 20.875 16.525 15.096 1.00 0.00 C ATOM 213 CD1 TYR A 14 22.196 16.321 14.701 1.00 0.00 C ATOM 214 CD2 TYR A 14 19.796 15.904 14.453 1.00 0.00 C ATOM 215 CE1 TYR A 14 22.444 15.465 13.624 1.00 0.00 C ATOM 216 CE2 TYR A 14 20.071 15.049 13.373 1.00 0.00 C ATOM 217 CZ TYR A 14 21.390 14.840 12.972 1.00 0.00 C ATOM 218 OH TYR A 14 21.592 13.988 11.903 1.00 0.00 O ATOM 0 H TYR A 14 20.084 18.652 18.365 1.00 0.00 H new ATOM 0 HA TYR A 14 21.108 15.944 17.768 1.00 0.00 H new ATOM 0 HB2 TYR A 14 19.476 17.483 16.325 1.00 0.00 H new ATOM 0 HB3 TYR A 14 20.916 18.422 15.984 1.00 0.00 H new ATOM 0 HD1 TYR A 14 23.009 16.813 15.215 1.00 0.00 H new ATOM 0 HD2 TYR A 14 18.781 16.078 14.779 1.00 0.00 H new ATOM 0 HE1 TYR A 14 23.459 15.289 13.298 1.00 0.00 H new ATOM 0 HE2 TYR A 14 19.263 14.555 12.854 1.00 0.00 H new ATOM 0 HH TYR A 14 22.462 13.546 11.997 1.00 0.00 H new ATOM 228 N GLU A 15 23.236 18.225 18.171 1.00 0.00 N ATOM 229 CA GLU A 15 24.690 18.262 18.279 1.00 0.00 C ATOM 230 C GLU A 15 25.258 17.506 19.484 1.00 0.00 C ATOM 231 O GLU A 15 26.166 16.690 19.387 1.00 0.00 O ATOM 232 CB GLU A 15 25.256 19.707 18.287 1.00 0.00 C ATOM 233 CG GLU A 15 24.237 20.755 17.794 1.00 0.00 C ATOM 234 CD GLU A 15 23.408 21.331 18.898 1.00 0.00 C ATOM 235 OE1 GLU A 15 23.283 20.530 19.927 1.00 0.00 O ATOM 236 OE2 GLU A 15 22.904 22.429 18.833 1.00 0.00 O ATOM 0 H GLU A 15 22.754 19.080 18.447 1.00 0.00 H new ATOM 0 HA GLU A 15 25.018 17.744 17.378 1.00 0.00 H new ATOM 0 HB2 GLU A 15 25.571 19.962 19.299 1.00 0.00 H new ATOM 0 HB3 GLU A 15 26.144 19.747 17.657 1.00 0.00 H new ATOM 0 HG2 GLU A 15 24.769 21.561 17.289 1.00 0.00 H new ATOM 0 HG3 GLU A 15 23.580 20.295 17.056 1.00 0.00 H new ATOM 243 N LYS A 16 24.706 17.775 20.686 1.00 0.00 N ATOM 244 CA LYS A 16 25.151 17.125 21.903 1.00 0.00 C ATOM 245 C LYS A 16 24.706 15.671 21.921 1.00 0.00 C ATOM 246 O LYS A 16 25.282 14.871 22.620 1.00 0.00 O ATOM 247 CB LYS A 16 24.692 17.914 23.134 1.00 0.00 C ATOM 248 CG LYS A 16 25.884 18.234 24.029 1.00 0.00 C ATOM 249 CD LYS A 16 25.459 19.097 25.198 1.00 0.00 C ATOM 250 CE LYS A 16 26.377 20.193 25.698 1.00 0.00 C ATOM 251 NZ LYS A 16 26.358 21.416 24.877 1.00 0.00 N ATOM 0 H LYS A 16 23.948 18.444 20.823 1.00 0.00 H new ATOM 0 HA LYS A 16 26.241 17.116 21.933 1.00 0.00 H new ATOM 0 HB2 LYS A 16 24.204 18.837 22.822 1.00 0.00 H new ATOM 0 HB3 LYS A 16 23.954 17.336 23.691 1.00 0.00 H new ATOM 0 HG2 LYS A 16 26.328 17.309 24.396 1.00 0.00 H new ATOM 0 HG3 LYS A 16 26.651 18.749 23.451 1.00 0.00 H new ATOM 0 HD2 LYS A 16 24.511 19.564 24.930 1.00 0.00 H new ATOM 0 HD3 LYS A 16 25.260 18.431 26.038 1.00 0.00 H new ATOM 0 HE2 LYS A 16 26.096 20.450 26.719 1.00 0.00 H new ATOM 0 HE3 LYS A 16 27.397 19.809 25.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 27.010 22.117 25.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 26.655 21.188 23.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 25.395 21.808 24.861 1.00 0.00 H new ATOM 265 N PHE A 17 23.667 15.248 21.162 1.00 0.00 N ATOM 266 CA PHE A 17 23.198 13.846 21.144 1.00 0.00 C ATOM 267 C PHE A 17 24.202 12.879 20.487 1.00 0.00 C ATOM 268 O PHE A 17 24.326 11.668 20.692 1.00 0.00 O ATOM 269 CB PHE A 17 21.884 13.817 20.357 1.00 0.00 C ATOM 270 CG PHE A 17 21.530 12.449 19.809 1.00 0.00 C ATOM 271 CD1 PHE A 17 21.004 11.506 20.654 1.00 0.00 C ATOM 272 CD2 PHE A 17 21.743 12.171 18.471 1.00 0.00 C ATOM 273 CE1 PHE A 17 20.683 10.262 20.164 1.00 0.00 C ATOM 274 CE2 PHE A 17 21.429 10.920 17.943 1.00 0.00 C ATOM 275 CZ PHE A 17 20.896 9.982 18.825 1.00 0.00 C ATOM 0 H PHE A 17 23.135 15.866 20.550 1.00 0.00 H new ATOM 0 HA PHE A 17 23.075 13.511 22.174 1.00 0.00 H new ATOM 0 HB2 PHE A 17 21.076 14.159 21.004 1.00 0.00 H new ATOM 0 HB3 PHE A 17 21.951 14.523 19.530 1.00 0.00 H new ATOM 0 HD1 PHE A 17 20.843 11.738 21.696 1.00 0.00 H new ATOM 0 HD2 PHE A 17 22.158 12.933 17.827 1.00 0.00 H new ATOM 0 HE1 PHE A 17 20.268 9.510 20.818 1.00 0.00 H new ATOM 0 HE2 PHE A 17 21.591 10.689 16.901 1.00 0.00 H new ATOM 0 HZ PHE A 17 20.640 9.002 18.451 1.00 0.00 H new ATOM 285 N MET A 18 24.991 13.509 19.608 1.00 0.00 N ATOM 286 CA MET A 18 26.027 12.877 18.843 1.00 0.00 C ATOM 287 C MET A 18 27.244 12.718 19.758 1.00 0.00 C ATOM 288 O MET A 18 27.801 11.634 19.895 1.00 0.00 O ATOM 289 CB MET A 18 26.478 13.758 17.648 1.00 0.00 C ATOM 290 CG MET A 18 25.669 13.387 16.451 1.00 0.00 C ATOM 291 SD MET A 18 26.062 14.370 14.988 1.00 0.00 S ATOM 292 CE MET A 18 25.609 13.130 13.772 1.00 0.00 C ATOM 0 H MET A 18 24.908 14.507 19.417 1.00 0.00 H new ATOM 0 HA MET A 18 25.646 11.928 18.465 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.342 14.814 17.884 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.539 13.610 17.448 1.00 0.00 H new ATOM 0 HG2 MET A 18 25.830 12.333 16.225 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.611 13.505 16.686 1.00 0.00 H new ATOM 0 HE1 MET A 18 26.013 13.410 12.799 1.00 0.00 H new ATOM 0 HE2 MET A 18 26.015 12.163 14.069 1.00 0.00 H new ATOM 0 HE3 MET A 18 24.523 13.063 13.708 1.00 0.00 H new ATOM 302 N GLU A 19 27.577 13.846 20.349 1.00 0.00 N ATOM 303 CA GLU A 19 28.690 13.993 21.259 1.00 0.00 C ATOM 304 C GLU A 19 28.764 12.930 22.364 1.00 0.00 C ATOM 305 O GLU A 19 29.799 12.370 22.695 1.00 0.00 O ATOM 306 CB GLU A 19 28.466 15.285 22.083 1.00 0.00 C ATOM 307 CG GLU A 19 28.942 15.197 23.568 1.00 0.00 C ATOM 308 CD GLU A 19 28.984 16.521 24.284 1.00 0.00 C ATOM 309 OE1 GLU A 19 28.934 17.581 23.723 1.00 0.00 O ATOM 310 OE2 GLU A 19 29.075 16.456 25.591 1.00 0.00 O ATOM 0 H GLU A 19 27.062 14.714 20.203 1.00 0.00 H new ATOM 0 HA GLU A 19 29.575 13.952 20.624 1.00 0.00 H new ATOM 0 HB2 GLU A 19 28.989 16.107 21.595 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.404 15.530 22.069 1.00 0.00 H new ATOM 0 HG2 GLU A 19 28.278 14.524 24.111 1.00 0.00 H new ATOM 0 HG3 GLU A 19 29.937 14.752 23.593 1.00 0.00 H new ATOM 317 N LYS A 20 27.588 12.724 22.946 1.00 0.00 N ATOM 318 CA LYS A 20 27.544 11.806 24.103 1.00 0.00 C ATOM 319 C LYS A 20 27.834 10.360 23.801 1.00 0.00 C ATOM 320 O LYS A 20 28.203 9.593 24.706 1.00 0.00 O ATOM 321 CB LYS A 20 26.206 12.098 24.781 1.00 0.00 C ATOM 322 CG LYS A 20 26.147 13.561 25.181 1.00 0.00 C ATOM 323 CD LYS A 20 24.727 13.962 25.407 1.00 0.00 C ATOM 324 CE LYS A 20 24.138 13.599 26.751 1.00 0.00 C ATOM 325 NZ LYS A 20 24.645 12.319 27.209 1.00 0.00 N ATOM 0 H LYS A 20 26.701 13.143 22.668 1.00 0.00 H new ATOM 0 HA LYS A 20 28.372 11.994 24.787 1.00 0.00 H new ATOM 0 HB2 LYS A 20 25.385 11.862 24.104 1.00 0.00 H new ATOM 0 HB3 LYS A 20 26.086 11.465 25.660 1.00 0.00 H new ATOM 0 HG2 LYS A 20 26.730 13.724 26.087 1.00 0.00 H new ATOM 0 HG3 LYS A 20 26.590 14.180 24.401 1.00 0.00 H new ATOM 0 HD2 LYS A 20 24.651 15.042 25.280 1.00 0.00 H new ATOM 0 HD3 LYS A 20 24.114 13.506 24.630 1.00 0.00 H new ATOM 0 HE2 LYS A 20 24.380 14.373 27.480 1.00 0.00 H new ATOM 0 HE3 LYS A 20 23.051 13.559 26.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 24.201 12.075 28.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 24.422 11.586 26.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 25.676 12.378 27.332 1.00 0.00 H new ATOM 339 N MET A 21 27.708 9.917 22.530 1.00 0.00 N ATOM 340 CA MET A 21 28.015 8.541 22.180 1.00 0.00 C ATOM 341 C MET A 21 29.547 8.397 21.972 1.00 0.00 C ATOM 342 O MET A 21 30.040 7.318 21.702 1.00 0.00 O ATOM 343 CB MET A 21 27.342 8.005 20.918 1.00 0.00 C ATOM 344 CG MET A 21 26.010 8.680 20.566 1.00 0.00 C ATOM 345 SD MET A 21 24.709 7.535 20.083 1.00 0.00 S ATOM 346 CE MET A 21 23.394 8.769 20.306 1.00 0.00 C ATOM 0 H MET A 21 27.399 10.496 21.749 1.00 0.00 H new ATOM 0 HA MET A 21 27.627 7.957 23.014 1.00 0.00 H new ATOM 0 HB2 MET A 21 28.027 8.124 20.079 1.00 0.00 H new ATOM 0 HB3 MET A 21 27.171 6.936 21.040 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.670 9.258 21.426 1.00 0.00 H new ATOM 0 HG3 MET A 21 26.177 9.387 19.753 1.00 0.00 H new ATOM 0 HE1 MET A 21 22.433 8.263 20.401 1.00 0.00 H new ATOM 0 HE2 MET A 21 23.589 9.350 21.207 1.00 0.00 H new ATOM 0 HE3 MET A 21 23.370 9.435 19.443 1.00 0.00 H new ATOM 356 N GLY A 22 30.248 9.537 22.102 1.00 0.00 N ATOM 357 CA GLY A 22 31.706 9.606 21.937 1.00 0.00 C ATOM 358 C GLY A 22 32.148 10.406 20.711 1.00 0.00 C ATOM 359 O GLY A 22 33.278 10.345 20.242 1.00 0.00 O ATOM 0 H GLY A 22 29.818 10.435 22.324 1.00 0.00 H new ATOM 0 HA2 GLY A 22 32.143 10.054 22.829 1.00 0.00 H new ATOM 0 HA3 GLY A 22 32.103 8.594 21.862 1.00 0.00 H new ATOM 363 N ILE A 23 31.231 11.186 20.154 1.00 0.00 N ATOM 364 CA ILE A 23 31.494 12.008 18.969 1.00 0.00 C ATOM 365 C ILE A 23 32.522 13.041 19.345 1.00 0.00 C ATOM 366 O ILE A 23 32.135 14.030 19.972 1.00 0.00 O ATOM 367 CB ILE A 23 30.219 12.544 18.369 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.435 11.476 17.641 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.454 13.713 17.388 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.650 10.088 18.196 1.00 0.00 C ATOM 0 H ILE A 23 30.279 11.270 20.509 1.00 0.00 H new ATOM 0 HA ILE A 23 31.915 11.416 18.156 1.00 0.00 H new ATOM 0 HB ILE A 23 29.649 12.907 19.224 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.373 11.718 17.691 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.715 11.485 16.588 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.497 14.053 16.991 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.942 14.535 17.912 1.00 0.00 H new ATOM 0 HG23 ILE A 23 31.088 13.378 16.568 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.057 9.372 17.626 1.00 0.00 H new ATOM 0 HD12 ILE A 23 30.705 9.826 18.122 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.343 10.063 19.241 1.00 0.00 H new ATOM 382 N ASN A 24 33.770 12.788 18.961 1.00 0.00 N ATOM 383 CA ASN A 24 34.884 13.686 19.249 1.00 0.00 C ATOM 384 C ASN A 24 34.565 15.127 19.031 1.00 0.00 C ATOM 385 O ASN A 24 33.664 15.509 18.316 1.00 0.00 O ATOM 386 CB ASN A 24 36.246 13.296 18.629 1.00 0.00 C ATOM 387 CG ASN A 24 37.089 12.460 19.571 1.00 0.00 C ATOM 388 OD1 ASN A 24 38.316 12.617 19.581 1.00 0.00 O ATOM 389 ND2 ASN A 24 36.498 11.590 20.355 1.00 0.00 N ATOM 0 H ASN A 24 34.038 11.953 18.440 1.00 0.00 H new ATOM 0 HA ASN A 24 35.023 13.544 20.321 1.00 0.00 H new ATOM 0 HB2 ASN A 24 36.077 12.741 17.707 1.00 0.00 H new ATOM 0 HB3 ASN A 24 36.793 14.200 18.361 1.00 0.00 H new ATOM 0 HD21 ASN A 24 37.052 11.021 20.995 1.00 0.00 H new ATOM 0 HD22 ASN A 24 35.484 11.482 20.325 1.00 0.00 H new ATOM 396 N VAL A 25 35.362 15.967 19.687 1.00 0.00 N ATOM 397 CA VAL A 25 35.161 17.410 19.557 1.00 0.00 C ATOM 398 C VAL A 25 35.447 18.084 18.234 1.00 0.00 C ATOM 399 O VAL A 25 34.930 19.190 17.998 1.00 0.00 O ATOM 400 CB VAL A 25 35.579 18.244 20.764 1.00 0.00 C ATOM 401 CG1 VAL A 25 35.078 17.576 22.027 1.00 0.00 C ATOM 402 CG2 VAL A 25 37.091 18.393 20.816 1.00 0.00 C ATOM 0 H VAL A 25 36.131 15.687 20.296 1.00 0.00 H new ATOM 0 HA VAL A 25 34.071 17.399 19.548 1.00 0.00 H new ATOM 0 HB VAL A 25 35.143 19.239 20.678 1.00 0.00 H new ATOM 0 HG11 VAL A 25 35.374 18.168 22.893 1.00 0.00 H new ATOM 0 HG12 VAL A 25 33.991 17.501 21.993 1.00 0.00 H new ATOM 0 HG13 VAL A 25 35.508 16.577 22.106 1.00 0.00 H new ATOM 0 HG21 VAL A 25 37.368 18.991 21.684 1.00 0.00 H new ATOM 0 HG22 VAL A 25 37.551 17.408 20.892 1.00 0.00 H new ATOM 0 HG23 VAL A 25 37.439 18.887 19.909 1.00 0.00 H new ATOM 412 N VAL A 26 36.223 17.524 17.323 1.00 0.00 N ATOM 413 CA VAL A 26 36.533 18.094 16.012 1.00 0.00 C ATOM 414 C VAL A 26 35.283 18.371 15.201 1.00 0.00 C ATOM 415 O VAL A 26 35.211 19.259 14.350 1.00 0.00 O ATOM 416 CB VAL A 26 37.487 17.228 15.228 1.00 0.00 C ATOM 417 CG1 VAL A 26 37.017 16.977 13.792 1.00 0.00 C ATOM 418 CG2 VAL A 26 38.805 17.945 15.089 1.00 0.00 C ATOM 0 H VAL A 26 36.676 16.623 17.477 1.00 0.00 H new ATOM 0 HA VAL A 26 37.026 19.047 16.206 1.00 0.00 H new ATOM 0 HB VAL A 26 37.556 16.285 15.771 1.00 0.00 H new ATOM 0 HG11 VAL A 26 37.743 16.348 13.276 1.00 0.00 H new ATOM 0 HG12 VAL A 26 36.049 16.476 13.808 1.00 0.00 H new ATOM 0 HG13 VAL A 26 36.924 17.928 13.268 1.00 0.00 H new ATOM 0 HG21 VAL A 26 39.499 17.324 14.523 1.00 0.00 H new ATOM 0 HG22 VAL A 26 38.652 18.889 14.565 1.00 0.00 H new ATOM 0 HG23 VAL A 26 39.218 18.142 16.078 1.00 0.00 H new ATOM 428 N LYS A 27 34.282 17.536 15.529 1.00 0.00 N ATOM 429 CA LYS A 27 32.979 17.564 14.971 1.00 0.00 C ATOM 430 C LYS A 27 32.169 18.690 15.669 1.00 0.00 C ATOM 431 O LYS A 27 31.237 19.273 15.099 1.00 0.00 O ATOM 432 CB LYS A 27 32.278 16.198 14.995 1.00 0.00 C ATOM 433 CG LYS A 27 33.224 14.992 14.892 1.00 0.00 C ATOM 434 CD LYS A 27 33.282 14.338 13.514 1.00 0.00 C ATOM 435 CE LYS A 27 34.670 13.855 13.087 1.00 0.00 C ATOM 436 NZ LYS A 27 34.886 13.577 11.646 1.00 0.00 N ATOM 0 H LYS A 27 34.396 16.800 16.226 1.00 0.00 H new ATOM 0 HA LYS A 27 33.052 17.792 13.908 1.00 0.00 H new ATOM 0 HB2 LYS A 27 31.704 16.115 15.918 1.00 0.00 H new ATOM 0 HB3 LYS A 27 31.565 16.155 14.171 1.00 0.00 H new ATOM 0 HG2 LYS A 27 34.229 15.312 15.169 1.00 0.00 H new ATOM 0 HG3 LYS A 27 32.915 14.243 15.621 1.00 0.00 H new ATOM 0 HD2 LYS A 27 32.598 13.489 13.502 1.00 0.00 H new ATOM 0 HD3 LYS A 27 32.918 15.051 12.774 1.00 0.00 H new ATOM 0 HE2 LYS A 27 35.397 14.605 13.397 1.00 0.00 H new ATOM 0 HE3 LYS A 27 34.895 12.944 13.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 35.905 13.592 11.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 34.498 12.641 11.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 34.406 14.303 11.077 1.00 0.00 H new ATOM 595 N LYS A 37 19.279 16.227 2.861 1.00 0.00 N ATOM 596 CA LYS A 37 18.262 15.397 2.300 1.00 0.00 C ATOM 597 C LYS A 37 18.419 13.928 2.624 1.00 0.00 C ATOM 598 O LYS A 37 18.930 13.194 1.780 1.00 0.00 O ATOM 599 CB LYS A 37 18.046 15.613 0.804 1.00 0.00 C ATOM 600 CG LYS A 37 16.580 15.650 0.374 1.00 0.00 C ATOM 601 CD LYS A 37 16.521 15.378 -1.113 1.00 0.00 C ATOM 602 CE LYS A 37 17.573 16.120 -1.917 1.00 0.00 C ATOM 603 NZ LYS A 37 17.545 15.805 -3.356 1.00 0.00 N ATOM 0 HA LYS A 37 17.354 15.731 2.801 1.00 0.00 H new ATOM 0 HB2 LYS A 37 18.521 16.550 0.513 1.00 0.00 H new ATOM 0 HB3 LYS A 37 18.552 14.817 0.258 1.00 0.00 H new ATOM 0 HG2 LYS A 37 16.004 14.904 0.921 1.00 0.00 H new ATOM 0 HG3 LYS A 37 16.141 16.621 0.601 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.638 14.307 -1.281 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.534 15.653 -1.484 1.00 0.00 H new ATOM 0 HE2 LYS A 37 17.430 17.192 -1.785 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.559 15.879 -1.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.493 15.944 -3.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.254 14.816 -3.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.868 16.432 -3.836 1.00 0.00 H new ATOM 617 N LEU A 38 17.944 13.585 3.808 1.00 0.00 N ATOM 618 CA LEU A 38 17.886 12.211 4.289 1.00 0.00 C ATOM 619 C LEU A 38 17.184 11.539 3.113 1.00 0.00 C ATOM 620 O LEU A 38 17.655 10.458 2.782 1.00 0.00 O ATOM 621 CB LEU A 38 16.813 12.108 5.366 1.00 0.00 C ATOM 622 CG LEU A 38 16.491 10.816 6.082 1.00 0.00 C ATOM 623 CD1 LEU A 38 16.751 9.599 5.240 1.00 0.00 C ATOM 624 CD2 LEU A 38 17.431 10.719 7.285 1.00 0.00 C ATOM 0 H LEU A 38 17.580 14.264 4.477 1.00 0.00 H new ATOM 0 HA LEU A 38 18.852 11.837 4.628 1.00 0.00 H new ATOM 0 HB2 LEU A 38 17.077 12.832 6.137 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.883 12.451 4.911 1.00 0.00 H new ATOM 0 HG LEU A 38 15.433 10.836 6.344 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.501 8.703 5.808 1.00 0.00 H new ATOM 0 HD12 LEU A 38 16.137 9.641 4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 38 17.804 9.569 4.960 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.230 9.797 7.830 1.00 0.00 H new ATOM 0 HD22 LEU A 38 18.465 10.718 6.940 1.00 0.00 H new ATOM 0 HD23 LEU A 38 17.269 11.573 7.943 1.00 0.00 H new ATOM 636 N THR A 39 16.209 12.262 2.649 1.00 0.00 N ATOM 637 CA THR A 39 15.298 11.954 1.527 1.00 0.00 C ATOM 638 C THR A 39 14.688 10.609 1.751 1.00 0.00 C ATOM 639 O THR A 39 15.383 9.714 2.201 1.00 0.00 O ATOM 640 CB THR A 39 15.987 11.930 0.121 1.00 0.00 C ATOM 641 OG1 THR A 39 17.066 12.810 0.211 1.00 0.00 O ATOM 642 CG2 THR A 39 15.068 12.310 -1.031 1.00 0.00 C ATOM 0 H THR A 39 15.991 13.167 3.065 1.00 0.00 H new ATOM 0 HA THR A 39 14.562 12.758 1.514 1.00 0.00 H new ATOM 0 HB THR A 39 16.295 10.911 -0.113 1.00 0.00 H new ATOM 0 HG1 THR A 39 17.668 12.518 0.927 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.623 12.268 -1.968 1.00 0.00 H new ATOM 0 HG22 THR A 39 14.231 11.613 -1.074 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.691 13.321 -0.877 1.00 0.00 H new ATOM 650 N ILE A 40 13.429 10.322 1.450 1.00 0.00 N ATOM 651 CA ILE A 40 12.904 8.973 1.636 1.00 0.00 C ATOM 652 C ILE A 40 12.007 8.440 0.551 1.00 0.00 C ATOM 653 O ILE A 40 10.933 8.915 0.240 1.00 0.00 O ATOM 654 CB ILE A 40 12.173 8.828 2.981 1.00 0.00 C ATOM 655 CG1 ILE A 40 13.013 9.291 4.175 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.762 7.353 3.184 1.00 0.00 C ATOM 657 CD1 ILE A 40 12.151 9.598 5.420 1.00 0.00 C ATOM 0 H ILE A 40 12.758 10.995 1.080 1.00 0.00 H new ATOM 0 HA ILE A 40 13.810 8.367 1.602 1.00 0.00 H new ATOM 0 HB ILE A 40 11.296 9.474 2.939 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.742 8.520 4.423 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.574 10.183 3.896 1.00 0.00 H new ATOM 0 HG21 ILE A 40 11.244 7.248 4.137 1.00 0.00 H new ATOM 0 HG22 ILE A 40 11.100 7.045 2.375 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.652 6.724 3.184 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.795 9.922 6.238 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.439 10.389 5.184 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.610 8.700 5.718 1.00 0.00 H new ATOM 669 N THR A 41 12.440 7.343 -0.083 1.00 0.00 N ATOM 670 CA THR A 41 11.712 6.676 -1.139 1.00 0.00 C ATOM 671 C THR A 41 11.400 5.280 -0.609 1.00 0.00 C ATOM 672 O THR A 41 12.293 4.455 -0.382 1.00 0.00 O ATOM 673 CB THR A 41 12.369 6.547 -2.500 1.00 0.00 C ATOM 674 OG1 THR A 41 12.890 7.783 -2.871 1.00 0.00 O ATOM 675 CG2 THR A 41 11.361 6.150 -3.574 1.00 0.00 C ATOM 0 H THR A 41 13.329 6.894 0.139 1.00 0.00 H new ATOM 0 HA THR A 41 10.851 7.310 -1.351 1.00 0.00 H new ATOM 0 HB THR A 41 13.141 5.782 -2.421 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.318 7.707 -3.749 1.00 0.00 H new ATOM 0 HG21 THR A 41 11.868 6.067 -4.536 1.00 0.00 H new ATOM 0 HG22 THR A 41 10.913 5.190 -3.316 1.00 0.00 H new ATOM 0 HG23 THR A 41 10.581 6.909 -3.639 1.00 0.00 H new ATOM 683 N GLN A 42 10.158 4.955 -0.393 1.00 0.00 N ATOM 684 CA GLN A 42 9.738 3.669 0.109 1.00 0.00 C ATOM 685 C GLN A 42 9.571 2.648 -0.954 1.00 0.00 C ATOM 686 O GLN A 42 9.017 2.866 -2.036 1.00 0.00 O ATOM 687 CB GLN A 42 8.330 3.949 0.701 1.00 0.00 C ATOM 688 CG GLN A 42 7.731 2.730 1.395 1.00 0.00 C ATOM 689 CD GLN A 42 6.344 3.045 1.965 1.00 0.00 C ATOM 690 OE1 GLN A 42 6.045 3.085 3.197 1.00 0.00 O ATOM 691 NE2 GLN A 42 5.448 3.275 0.990 1.00 0.00 N ATOM 0 H GLN A 42 9.382 5.594 -0.565 1.00 0.00 H new ATOM 0 HA GLN A 42 10.480 3.278 0.805 1.00 0.00 H new ATOM 0 HB2 GLN A 42 8.397 4.771 1.413 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.662 4.272 -0.098 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.658 1.904 0.687 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.392 2.404 2.198 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.736 3.232 0.012 1.00 0.00 H new ATOM 0 HE22 GLN A 42 4.480 3.493 1.228 1.00 0.00 H new ATOM 700 N GLU A 43 10.060 1.465 -0.671 1.00 0.00 N ATOM 701 CA GLU A 43 10.014 0.308 -1.563 1.00 0.00 C ATOM 702 C GLU A 43 9.125 -0.631 -0.793 1.00 0.00 C ATOM 703 O GLU A 43 8.834 -0.319 0.358 1.00 0.00 O ATOM 704 CB GLU A 43 11.424 -0.207 -1.848 1.00 0.00 C ATOM 705 CG GLU A 43 11.797 -0.411 -3.308 1.00 0.00 C ATOM 706 CD GLU A 43 11.613 -1.853 -3.559 1.00 0.00 C ATOM 707 OE1 GLU A 43 10.615 -2.491 -3.268 1.00 0.00 O ATOM 708 OE2 GLU A 43 12.651 -2.383 -4.136 1.00 0.00 O ATOM 0 H GLU A 43 10.520 1.263 0.217 1.00 0.00 H new ATOM 0 HA GLU A 43 9.625 0.489 -2.565 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.136 0.492 -1.410 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.550 -1.157 -1.329 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.163 0.186 -3.963 1.00 0.00 H new ATOM 0 HG3 GLU A 43 12.827 -0.107 -3.497 1.00 0.00 H new ATOM 715 N GLY A 44 8.722 -1.735 -1.436 1.00 0.00 N ATOM 716 CA GLY A 44 7.873 -2.779 -0.924 1.00 0.00 C ATOM 717 C GLY A 44 8.129 -3.010 0.554 1.00 0.00 C ATOM 718 O GLY A 44 7.199 -3.245 1.338 1.00 0.00 O ATOM 0 H GLY A 44 9.011 -1.920 -2.397 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.828 -2.512 -1.079 1.00 0.00 H new ATOM 0 HA3 GLY A 44 8.051 -3.702 -1.476 1.00 0.00 H new ATOM 722 N ASN A 45 9.423 -2.923 0.870 1.00 0.00 N ATOM 723 CA ASN A 45 10.010 -3.083 2.174 1.00 0.00 C ATOM 724 C ASN A 45 11.119 -2.012 2.273 1.00 0.00 C ATOM 725 O ASN A 45 10.880 -0.999 2.895 1.00 0.00 O ATOM 726 CB ASN A 45 10.544 -4.500 2.469 1.00 0.00 C ATOM 727 CG ASN A 45 9.669 -5.614 1.894 1.00 0.00 C ATOM 728 OD1 ASN A 45 8.444 -5.726 2.079 1.00 0.00 O ATOM 729 ND2 ASN A 45 10.318 -6.501 1.153 1.00 0.00 N ATOM 0 H ASN A 45 10.127 -2.724 0.159 1.00 0.00 H new ATOM 0 HA ASN A 45 9.242 -2.949 2.936 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.551 -4.592 2.061 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.624 -4.632 3.548 1.00 0.00 H new ATOM 0 HD21 ASN A 45 9.813 -7.280 0.731 1.00 0.00 H new ATOM 0 HD22 ASN A 45 11.322 -6.404 1.005 1.00 0.00 H new ATOM 736 N LYS A 46 12.251 -2.270 1.670 1.00 0.00 N ATOM 737 CA LYS A 46 13.367 -1.312 1.704 1.00 0.00 C ATOM 738 C LYS A 46 12.925 0.074 1.322 1.00 0.00 C ATOM 739 O LYS A 46 11.827 0.359 0.839 1.00 0.00 O ATOM 740 CB LYS A 46 14.441 -1.667 0.660 1.00 0.00 C ATOM 741 CG LYS A 46 14.839 -0.635 -0.361 1.00 0.00 C ATOM 742 CD LYS A 46 15.167 -1.343 -1.698 1.00 0.00 C ATOM 743 CE LYS A 46 16.354 -2.305 -1.572 1.00 0.00 C ATOM 744 NZ LYS A 46 16.908 -2.851 -2.827 1.00 0.00 N ATOM 0 H LYS A 46 12.441 -3.126 1.148 1.00 0.00 H new ATOM 0 HA LYS A 46 13.746 -1.354 2.725 1.00 0.00 H new ATOM 0 HB2 LYS A 46 15.341 -1.958 1.201 1.00 0.00 H new ATOM 0 HB3 LYS A 46 14.095 -2.548 0.119 1.00 0.00 H new ATOM 0 HG2 LYS A 46 14.031 0.083 -0.504 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.705 -0.074 -0.010 1.00 0.00 H new ATOM 0 HD2 LYS A 46 14.291 -1.894 -2.039 1.00 0.00 H new ATOM 0 HD3 LYS A 46 15.389 -0.594 -2.458 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.155 -1.788 -1.044 1.00 0.00 H new ATOM 0 HE3 LYS A 46 16.047 -3.142 -0.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.703 -3.485 -2.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 16.169 -3.382 -3.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.243 -2.070 -3.427 1.00 0.00 H new ATOM 758 N PHE A 47 13.895 0.976 1.529 1.00 0.00 N ATOM 759 CA PHE A 47 13.628 2.330 1.126 1.00 0.00 C ATOM 760 C PHE A 47 14.900 3.051 0.616 1.00 0.00 C ATOM 761 O PHE A 47 15.860 3.164 1.338 1.00 0.00 O ATOM 762 CB PHE A 47 13.044 3.186 2.272 1.00 0.00 C ATOM 763 CG PHE A 47 12.863 2.506 3.611 1.00 0.00 C ATOM 764 CD1 PHE A 47 11.795 1.721 3.972 1.00 0.00 C ATOM 765 CD2 PHE A 47 13.877 2.698 4.582 1.00 0.00 C ATOM 766 CE1 PHE A 47 11.717 1.140 5.245 1.00 0.00 C ATOM 767 CE2 PHE A 47 13.846 2.147 5.851 1.00 0.00 C ATOM 768 CZ PHE A 47 12.743 1.358 6.174 1.00 0.00 C ATOM 0 H PHE A 47 14.808 0.796 1.946 1.00 0.00 H new ATOM 0 HA PHE A 47 12.898 2.240 0.322 1.00 0.00 H new ATOM 0 HB2 PHE A 47 13.694 4.050 2.415 1.00 0.00 H new ATOM 0 HB3 PHE A 47 12.074 3.566 1.951 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.000 1.548 3.261 1.00 0.00 H new ATOM 0 HD2 PHE A 47 14.725 3.311 4.316 1.00 0.00 H new ATOM 0 HE1 PHE A 47 10.869 0.526 5.509 1.00 0.00 H new ATOM 0 HE2 PHE A 47 14.642 2.321 6.560 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.678 0.909 7.154 1.00 0.00 H new ATOM 778 N THR A 48 14.789 3.484 -0.609 1.00 0.00 N ATOM 779 CA THR A 48 15.791 4.195 -1.347 1.00 0.00 C ATOM 780 C THR A 48 15.780 5.502 -0.613 1.00 0.00 C ATOM 781 O THR A 48 15.019 6.424 -0.935 1.00 0.00 O ATOM 782 CB THR A 48 15.503 4.402 -2.855 1.00 0.00 C ATOM 783 OG1 THR A 48 14.658 3.407 -3.356 1.00 0.00 O ATOM 784 CG2 THR A 48 16.835 4.488 -3.640 1.00 0.00 C ATOM 0 H THR A 48 13.938 3.339 -1.153 1.00 0.00 H new ATOM 0 HA THR A 48 16.737 3.655 -1.380 1.00 0.00 H new ATOM 0 HB THR A 48 14.975 5.347 -2.984 1.00 0.00 H new ATOM 0 HG1 THR A 48 14.494 3.566 -4.309 1.00 0.00 H new ATOM 0 HG21 THR A 48 16.624 4.634 -4.699 1.00 0.00 H new ATOM 0 HG22 THR A 48 17.423 5.327 -3.268 1.00 0.00 H new ATOM 0 HG23 THR A 48 17.397 3.564 -3.506 1.00 0.00 H new ATOM 792 N VAL A 49 16.637 5.551 0.371 1.00 0.00 N ATOM 793 CA VAL A 49 16.794 6.747 1.227 1.00 0.00 C ATOM 794 C VAL A 49 18.081 7.332 0.745 1.00 0.00 C ATOM 795 O VAL A 49 19.039 6.589 0.545 1.00 0.00 O ATOM 796 CB VAL A 49 16.861 6.349 2.692 1.00 0.00 C ATOM 797 CG1 VAL A 49 17.836 7.207 3.500 1.00 0.00 C ATOM 798 CG2 VAL A 49 15.485 6.421 3.345 1.00 0.00 C ATOM 0 H VAL A 49 17.254 4.778 0.620 1.00 0.00 H new ATOM 0 HA VAL A 49 15.965 7.451 1.162 1.00 0.00 H new ATOM 0 HB VAL A 49 17.226 5.322 2.701 1.00 0.00 H new ATOM 0 HG11 VAL A 49 17.839 6.874 4.538 1.00 0.00 H new ATOM 0 HG12 VAL A 49 18.839 7.108 3.084 1.00 0.00 H new ATOM 0 HG13 VAL A 49 17.526 8.251 3.455 1.00 0.00 H new ATOM 0 HG21 VAL A 49 15.564 6.131 4.393 1.00 0.00 H new ATOM 0 HG22 VAL A 49 15.103 7.440 3.278 1.00 0.00 H new ATOM 0 HG23 VAL A 49 14.803 5.744 2.831 1.00 0.00 H new ATOM 808 N LYS A 50 18.136 8.615 0.550 1.00 0.00 N ATOM 809 CA LYS A 50 19.324 9.339 0.085 1.00 0.00 C ATOM 810 C LYS A 50 20.128 9.518 1.323 1.00 0.00 C ATOM 811 O LYS A 50 20.346 8.486 1.967 1.00 0.00 O ATOM 812 CB LYS A 50 18.885 10.685 -0.436 1.00 0.00 C ATOM 813 CG LYS A 50 19.876 11.334 -1.362 1.00 0.00 C ATOM 814 CD LYS A 50 19.166 12.194 -2.376 1.00 0.00 C ATOM 815 CE LYS A 50 19.948 12.034 -3.625 1.00 0.00 C ATOM 816 NZ LYS A 50 19.425 12.862 -4.705 1.00 0.00 N ATOM 0 H LYS A 50 17.335 9.226 0.711 1.00 0.00 H new ATOM 0 HA LYS A 50 19.875 8.829 -0.705 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.936 10.569 -0.959 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.704 11.349 0.409 1.00 0.00 H new ATOM 0 HG2 LYS A 50 20.576 11.941 -0.788 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.462 10.569 -1.872 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.133 11.873 -2.512 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.137 13.236 -2.059 1.00 0.00 H new ATOM 0 HE2 LYS A 50 20.989 12.297 -3.438 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.934 10.988 -3.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 20.000 12.721 -5.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 18.440 12.594 -4.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 19.462 13.863 -4.424 1.00 0.00 H new ATOM 830 N GLU A 51 20.479 10.746 1.579 1.00 0.00 N ATOM 831 CA GLU A 51 21.192 11.217 2.751 1.00 0.00 C ATOM 832 C GLU A 51 22.419 11.915 2.195 1.00 0.00 C ATOM 833 O GLU A 51 23.556 11.530 2.497 1.00 0.00 O ATOM 834 CB GLU A 51 21.695 10.117 3.632 1.00 0.00 C ATOM 835 CG GLU A 51 22.397 10.604 4.897 1.00 0.00 C ATOM 836 CD GLU A 51 22.223 9.605 5.977 1.00 0.00 C ATOM 837 OE1 GLU A 51 22.992 8.669 5.966 1.00 0.00 O ATOM 838 OE2 GLU A 51 21.231 9.822 6.876 1.00 0.00 O ATOM 0 H GLU A 51 20.263 11.505 0.933 1.00 0.00 H new ATOM 0 HA GLU A 51 20.522 11.832 3.352 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.856 9.481 3.916 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.386 9.496 3.062 1.00 0.00 H new ATOM 0 HG2 GLU A 51 23.458 10.760 4.699 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.986 11.565 5.207 1.00 0.00 H new ATOM 845 N SER A 52 22.221 12.923 1.383 1.00 0.00 N ATOM 846 CA SER A 52 23.342 13.641 0.791 1.00 0.00 C ATOM 847 C SER A 52 23.607 14.788 1.778 1.00 0.00 C ATOM 848 O SER A 52 23.477 15.928 1.369 1.00 0.00 O ATOM 849 CB SER A 52 23.074 14.168 -0.565 1.00 0.00 C ATOM 850 OG SER A 52 24.056 15.129 -0.943 1.00 0.00 O ATOM 0 H SER A 52 21.301 13.271 1.112 1.00 0.00 H new ATOM 0 HA SER A 52 24.192 12.974 0.647 1.00 0.00 H new ATOM 0 HB2 SER A 52 23.067 13.348 -1.283 1.00 0.00 H new ATOM 0 HB3 SER A 52 22.084 14.624 -0.593 1.00 0.00 H new ATOM 0 HG SER A 52 23.996 15.908 -0.351 1.00 0.00 H new ATOM 856 N SER A 53 23.955 14.393 2.980 1.00 0.00 N ATOM 857 CA SER A 53 24.255 15.258 4.091 1.00 0.00 C ATOM 858 C SER A 53 25.309 16.277 3.768 1.00 0.00 C ATOM 859 O SER A 53 25.769 16.343 2.628 1.00 0.00 O ATOM 860 CB SER A 53 24.710 14.471 5.334 1.00 0.00 C ATOM 861 OG SER A 53 25.651 13.507 4.952 1.00 0.00 O ATOM 0 H SER A 53 24.040 13.405 3.219 1.00 0.00 H new ATOM 0 HA SER A 53 23.318 15.772 4.304 1.00 0.00 H new ATOM 0 HB2 SER A 53 25.144 15.149 6.069 1.00 0.00 H new ATOM 0 HB3 SER A 53 23.854 13.992 5.809 1.00 0.00 H new ATOM 0 HG SER A 53 25.944 13.005 5.741 1.00 0.00 H new ATOM 867 N ASN A 54 25.718 17.086 4.715 1.00 0.00 N ATOM 868 CA ASN A 54 26.735 18.116 4.378 1.00 0.00 C ATOM 869 C ASN A 54 28.012 17.575 3.832 1.00 0.00 C ATOM 870 O ASN A 54 28.979 18.358 3.692 1.00 0.00 O ATOM 871 CB ASN A 54 27.065 19.051 5.579 1.00 0.00 C ATOM 872 CG ASN A 54 27.855 20.277 5.213 1.00 0.00 C ATOM 873 OD1 ASN A 54 29.043 20.372 5.528 1.00 0.00 O ATOM 874 ND2 ASN A 54 27.185 21.219 4.545 1.00 0.00 N ATOM 0 H ASN A 54 25.398 17.076 5.683 1.00 0.00 H new ATOM 0 HA ASN A 54 26.253 18.688 3.585 1.00 0.00 H new ATOM 0 HB2 ASN A 54 26.132 19.362 6.049 1.00 0.00 H new ATOM 0 HB3 ASN A 54 27.623 18.483 6.323 1.00 0.00 H new ATOM 0 HD21 ASN A 54 27.657 22.079 4.265 1.00 0.00 H new ATOM 0 HD22 ASN A 54 26.201 21.079 4.315 1.00 0.00 H new ATOM 881 N PHE A 55 28.165 16.326 3.502 1.00 0.00 N ATOM 882 CA PHE A 55 29.456 15.875 2.983 1.00 0.00 C ATOM 883 C PHE A 55 29.525 14.610 2.255 1.00 0.00 C ATOM 884 O PHE A 55 30.022 14.556 1.138 1.00 0.00 O ATOM 885 CB PHE A 55 30.448 15.601 4.133 1.00 0.00 C ATOM 886 CG PHE A 55 29.879 16.023 5.443 1.00 0.00 C ATOM 887 CD1 PHE A 55 28.902 15.292 6.102 1.00 0.00 C ATOM 888 CD2 PHE A 55 30.328 17.187 6.042 1.00 0.00 C ATOM 889 CE1 PHE A 55 28.363 15.677 7.324 1.00 0.00 C ATOM 890 CE2 PHE A 55 29.813 17.600 7.257 1.00 0.00 C ATOM 891 CZ PHE A 55 28.832 16.847 7.898 1.00 0.00 C ATOM 0 H PHE A 55 27.445 15.607 3.574 1.00 0.00 H new ATOM 0 HA PHE A 55 29.673 16.702 2.306 1.00 0.00 H new ATOM 0 HB2 PHE A 55 30.690 14.539 4.163 1.00 0.00 H new ATOM 0 HB3 PHE A 55 31.380 16.135 3.949 1.00 0.00 H new ATOM 0 HD1 PHE A 55 28.543 14.382 5.645 1.00 0.00 H new ATOM 0 HD2 PHE A 55 31.089 17.779 5.555 1.00 0.00 H new ATOM 0 HE1 PHE A 55 27.603 15.083 7.810 1.00 0.00 H new ATOM 0 HE2 PHE A 55 30.173 18.511 7.711 1.00 0.00 H new ATOM 0 HZ PHE A 55 28.435 17.177 8.847 1.00 0.00 H new ATOM 901 N ARG A 56 29.006 13.575 2.925 1.00 0.00 N ATOM 902 CA ARG A 56 29.003 12.248 2.334 1.00 0.00 C ATOM 903 C ARG A 56 27.755 12.081 1.522 1.00 0.00 C ATOM 904 O ARG A 56 26.717 11.623 1.957 1.00 0.00 O ATOM 905 CB ARG A 56 29.027 11.175 3.420 1.00 0.00 C ATOM 906 CG ARG A 56 29.593 9.845 2.946 1.00 0.00 C ATOM 907 CD ARG A 56 30.741 9.364 3.830 1.00 0.00 C ATOM 908 NE ARG A 56 31.589 8.379 3.192 1.00 0.00 N ATOM 909 CZ ARG A 56 31.281 7.099 3.033 1.00 0.00 C ATOM 910 NH1 ARG A 56 30.113 6.619 3.478 1.00 0.00 N ATOM 911 NH2 ARG A 56 32.098 6.256 2.438 1.00 0.00 N ATOM 0 H ARG A 56 28.593 13.635 3.856 1.00 0.00 H new ATOM 0 HA ARG A 56 29.889 12.140 1.708 1.00 0.00 H new ATOM 0 HB2 ARG A 56 29.620 11.534 4.261 1.00 0.00 H new ATOM 0 HB3 ARG A 56 28.013 11.019 3.788 1.00 0.00 H new ATOM 0 HG2 ARG A 56 28.801 9.096 2.940 1.00 0.00 H new ATOM 0 HG3 ARG A 56 29.944 9.946 1.919 1.00 0.00 H new ATOM 0 HD2 ARG A 56 31.349 10.221 4.121 1.00 0.00 H new ATOM 0 HD3 ARG A 56 30.330 8.939 4.746 1.00 0.00 H new ATOM 0 HE ARG A 56 32.492 8.694 2.838 1.00 0.00 H new ATOM 0 HH11 ARG A 56 29.451 7.239 3.944 1.00 0.00 H new ATOM 0 HH12 ARG A 56 29.885 5.633 3.351 1.00 0.00 H new ATOM 0 HH21 ARG A 56 32.997 6.582 2.084 1.00 0.00 H new ATOM 0 HH22 ARG A 56 31.832 5.277 2.331 1.00 0.00 H new ATOM 925 N ASN A 57 27.945 12.497 0.299 1.00 0.00 N ATOM 926 CA ASN A 57 26.907 12.445 -0.678 1.00 0.00 C ATOM 927 C ASN A 57 26.732 10.955 -0.917 1.00 0.00 C ATOM 928 O ASN A 57 27.592 10.286 -1.501 1.00 0.00 O ATOM 929 CB ASN A 57 27.363 13.239 -1.913 1.00 0.00 C ATOM 930 CG ASN A 57 26.836 12.603 -3.190 1.00 0.00 C ATOM 931 OD1 ASN A 57 25.612 12.359 -3.303 1.00 0.00 O ATOM 932 ND2 ASN A 57 27.696 12.337 -4.128 1.00 0.00 N ATOM 0 H ASN A 57 28.826 12.881 -0.042 1.00 0.00 H new ATOM 0 HA ASN A 57 25.956 12.893 -0.390 1.00 0.00 H new ATOM 0 HB2 ASN A 57 27.009 14.267 -1.841 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.452 13.278 -1.944 1.00 0.00 H new ATOM 0 HD21 ASN A 57 27.383 11.912 -5.001 1.00 0.00 H new ATOM 0 HD22 ASN A 57 28.683 12.554 -3.991 1.00 0.00 H new ATOM 939 N ILE A 58 25.589 10.459 -0.449 1.00 0.00 N ATOM 940 CA ILE A 58 25.287 9.091 -0.599 1.00 0.00 C ATOM 941 C ILE A 58 23.772 8.853 -0.529 1.00 0.00 C ATOM 942 O ILE A 58 22.968 9.767 -0.347 1.00 0.00 O ATOM 943 CB ILE A 58 25.854 8.310 0.583 1.00 0.00 C ATOM 944 CG1 ILE A 58 26.400 6.961 0.185 1.00 0.00 C ATOM 945 CG2 ILE A 58 24.859 8.228 1.727 1.00 0.00 C ATOM 946 CD1 ILE A 58 27.587 6.551 1.019 1.00 0.00 C ATOM 0 H ILE A 58 24.876 11.006 0.033 1.00 0.00 H new ATOM 0 HA ILE A 58 25.701 8.777 -1.557 1.00 0.00 H new ATOM 0 HB ILE A 58 26.712 8.873 0.951 1.00 0.00 H new ATOM 0 HG12 ILE A 58 25.615 6.211 0.283 1.00 0.00 H new ATOM 0 HG13 ILE A 58 26.689 6.985 -0.866 1.00 0.00 H new ATOM 0 HG21 ILE A 58 25.297 7.665 2.551 1.00 0.00 H new ATOM 0 HG22 ILE A 58 24.611 9.234 2.066 1.00 0.00 H new ATOM 0 HG23 ILE A 58 23.953 7.727 1.386 1.00 0.00 H new ATOM 0 HD11 ILE A 58 27.941 5.573 0.692 1.00 0.00 H new ATOM 0 HD12 ILE A 58 28.385 7.284 0.901 1.00 0.00 H new ATOM 0 HD13 ILE A 58 27.294 6.499 2.068 1.00 0.00 H new ATOM 958 N ASP A 59 23.473 7.592 -0.679 1.00 0.00 N ATOM 959 CA ASP A 59 22.087 7.141 -0.640 1.00 0.00 C ATOM 960 C ASP A 59 22.200 5.728 -0.130 1.00 0.00 C ATOM 961 O ASP A 59 22.977 4.918 -0.648 1.00 0.00 O ATOM 962 CB ASP A 59 21.463 7.126 -2.029 1.00 0.00 C ATOM 963 CG ASP A 59 21.496 5.864 -2.839 1.00 0.00 C ATOM 964 OD1 ASP A 59 22.586 5.658 -3.538 1.00 0.00 O ATOM 965 OD2 ASP A 59 20.544 5.094 -2.825 1.00 0.00 O ATOM 0 H ASP A 59 24.159 6.852 -0.829 1.00 0.00 H new ATOM 0 HA ASP A 59 21.460 7.791 -0.029 1.00 0.00 H new ATOM 0 HB2 ASP A 59 20.418 7.418 -1.921 1.00 0.00 H new ATOM 0 HB3 ASP A 59 21.952 7.904 -2.615 1.00 0.00 H new ATOM 970 N VAL A 60 21.409 5.457 0.900 1.00 0.00 N ATOM 971 CA VAL A 60 21.360 4.187 1.545 1.00 0.00 C ATOM 972 C VAL A 60 20.007 3.570 1.401 1.00 0.00 C ATOM 973 O VAL A 60 18.980 4.046 1.914 1.00 0.00 O ATOM 974 CB VAL A 60 21.658 4.394 3.041 1.00 0.00 C ATOM 975 CG1 VAL A 60 21.488 3.094 3.817 1.00 0.00 C ATOM 976 CG2 VAL A 60 23.021 4.991 3.250 1.00 0.00 C ATOM 0 H VAL A 60 20.774 6.144 1.307 1.00 0.00 H new ATOM 0 HA VAL A 60 22.094 3.524 1.087 1.00 0.00 H new ATOM 0 HB VAL A 60 20.931 5.107 3.431 1.00 0.00 H new ATOM 0 HG11 VAL A 60 21.705 3.268 4.871 1.00 0.00 H new ATOM 0 HG12 VAL A 60 20.463 2.738 3.711 1.00 0.00 H new ATOM 0 HG13 VAL A 60 22.175 2.344 3.425 1.00 0.00 H new ATOM 0 HG21 VAL A 60 23.200 5.124 4.317 1.00 0.00 H new ATOM 0 HG22 VAL A 60 23.778 4.325 2.835 1.00 0.00 H new ATOM 0 HG23 VAL A 60 23.075 5.958 2.749 1.00 0.00 H new ATOM 986 N VAL A 61 19.958 2.464 0.685 1.00 0.00 N ATOM 987 CA VAL A 61 18.750 1.692 0.421 1.00 0.00 C ATOM 988 C VAL A 61 18.887 0.369 1.119 1.00 0.00 C ATOM 989 O VAL A 61 19.914 -0.304 0.920 1.00 0.00 O ATOM 990 CB VAL A 61 18.551 1.483 -1.077 1.00 0.00 C ATOM 991 CG1 VAL A 61 17.055 1.352 -1.445 1.00 0.00 C ATOM 992 CG2 VAL A 61 19.137 2.591 -1.930 1.00 0.00 C ATOM 0 H VAL A 61 20.788 2.059 0.253 1.00 0.00 H new ATOM 0 HA VAL A 61 17.878 2.231 0.792 1.00 0.00 H new ATOM 0 HB VAL A 61 19.084 0.557 -1.291 1.00 0.00 H new ATOM 0 HG11 VAL A 61 16.956 1.204 -2.520 1.00 0.00 H new ATOM 0 HG12 VAL A 61 16.625 0.499 -0.921 1.00 0.00 H new ATOM 0 HG13 VAL A 61 16.528 2.260 -1.154 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.957 2.374 -2.983 1.00 0.00 H new ATOM 0 HG22 VAL A 61 18.666 3.539 -1.669 1.00 0.00 H new ATOM 0 HG23 VAL A 61 20.210 2.658 -1.752 1.00 0.00 H new ATOM 1002 N PHE A 62 17.910 -0.025 1.920 1.00 0.00 N ATOM 1003 CA PHE A 62 18.075 -1.292 2.573 1.00 0.00 C ATOM 1004 C PHE A 62 16.768 -1.875 3.060 1.00 0.00 C ATOM 1005 O PHE A 62 16.009 -1.154 3.719 1.00 0.00 O ATOM 1006 CB PHE A 62 18.995 -1.099 3.811 1.00 0.00 C ATOM 1007 CG PHE A 62 18.501 0.013 4.730 1.00 0.00 C ATOM 1008 CD1 PHE A 62 18.911 1.309 4.528 1.00 0.00 C ATOM 1009 CD2 PHE A 62 17.639 -0.252 5.775 1.00 0.00 C ATOM 1010 CE1 PHE A 62 18.472 2.343 5.356 1.00 0.00 C ATOM 1011 CE2 PHE A 62 17.196 0.755 6.602 1.00 0.00 C ATOM 1012 CZ PHE A 62 17.593 2.074 6.422 1.00 0.00 C ATOM 0 H PHE A 62 17.049 0.484 2.120 1.00 0.00 H new ATOM 0 HA PHE A 62 18.503 -1.977 1.841 1.00 0.00 H new ATOM 0 HB2 PHE A 62 19.049 -2.033 4.370 1.00 0.00 H new ATOM 0 HB3 PHE A 62 20.007 -0.869 3.477 1.00 0.00 H new ATOM 0 HD1 PHE A 62 19.585 1.531 3.714 1.00 0.00 H new ATOM 0 HD2 PHE A 62 17.307 -1.265 5.946 1.00 0.00 H new ATOM 0 HE1 PHE A 62 18.808 3.354 5.178 1.00 0.00 H new ATOM 0 HE2 PHE A 62 16.523 0.514 7.411 1.00 0.00 H new ATOM 0 HZ PHE A 62 17.242 2.861 7.073 1.00 0.00 H new ATOM 1022 N GLU A 63 16.561 -3.139 2.717 1.00 0.00 N ATOM 1023 CA GLU A 63 15.354 -3.892 3.106 1.00 0.00 C ATOM 1024 C GLU A 63 15.289 -3.640 4.612 1.00 0.00 C ATOM 1025 O GLU A 63 16.020 -4.330 5.329 1.00 0.00 O ATOM 1026 CB GLU A 63 15.353 -5.392 2.782 1.00 0.00 C ATOM 1027 CG GLU A 63 15.002 -5.549 1.264 1.00 0.00 C ATOM 1028 CD GLU A 63 14.979 -6.963 0.790 1.00 0.00 C ATOM 1029 OE1 GLU A 63 15.505 -7.896 1.391 1.00 0.00 O ATOM 1030 OE2 GLU A 63 14.349 -7.160 -0.334 1.00 0.00 O ATOM 0 H GLU A 63 17.221 -3.682 2.160 1.00 0.00 H new ATOM 0 HA GLU A 63 14.488 -3.555 2.536 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.327 -5.831 2.997 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.624 -5.917 3.400 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.027 -5.098 1.079 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.729 -4.990 0.674 1.00 0.00 H new ATOM 1037 N LEU A 64 14.463 -2.678 5.018 1.00 0.00 N ATOM 1038 CA LEU A 64 14.282 -2.245 6.387 1.00 0.00 C ATOM 1039 C LEU A 64 14.633 -3.290 7.434 1.00 0.00 C ATOM 1040 O LEU A 64 14.075 -4.391 7.474 1.00 0.00 O ATOM 1041 CB LEU A 64 12.849 -1.683 6.625 1.00 0.00 C ATOM 1042 CG LEU A 64 11.691 -2.678 6.621 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.594 -2.099 7.524 1.00 0.00 C ATOM 1044 CD2 LEU A 64 11.078 -2.688 5.207 1.00 0.00 C ATOM 0 H LEU A 64 13.877 -2.159 4.364 1.00 0.00 H new ATOM 0 HA LEU A 64 15.006 -1.442 6.521 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.845 -1.167 7.585 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.651 -0.933 5.859 1.00 0.00 H new ATOM 0 HG LEU A 64 12.033 -3.664 6.936 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.745 -2.782 7.549 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.985 -1.969 8.533 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.272 -1.134 7.132 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.247 -3.392 5.176 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.717 -1.690 4.960 1.00 0.00 H new ATOM 0 HD23 LEU A 64 11.836 -2.989 4.484 1.00 0.00 H new ATOM 1056 N GLY A 65 15.587 -2.994 8.329 1.00 0.00 N ATOM 1057 CA GLY A 65 16.011 -3.928 9.386 1.00 0.00 C ATOM 1058 C GLY A 65 17.224 -4.805 9.134 1.00 0.00 C ATOM 1059 O GLY A 65 17.117 -6.014 9.384 1.00 0.00 O ATOM 0 H GLY A 65 16.086 -2.104 8.342 1.00 0.00 H new ATOM 0 HA2 GLY A 65 16.205 -3.344 10.286 1.00 0.00 H new ATOM 0 HA3 GLY A 65 15.168 -4.583 9.607 1.00 0.00 H new ATOM 1063 N VAL A 66 18.332 -4.256 8.662 1.00 0.00 N ATOM 1064 CA VAL A 66 19.521 -5.075 8.407 1.00 0.00 C ATOM 1065 C VAL A 66 20.651 -4.505 9.282 1.00 0.00 C ATOM 1066 O VAL A 66 20.800 -3.285 9.279 1.00 0.00 O ATOM 1067 CB VAL A 66 19.967 -5.041 6.969 1.00 0.00 C ATOM 1068 CG1 VAL A 66 19.149 -6.028 6.142 1.00 0.00 C ATOM 1069 CG2 VAL A 66 19.844 -3.651 6.354 1.00 0.00 C ATOM 0 H VAL A 66 18.440 -3.264 8.449 1.00 0.00 H new ATOM 0 HA VAL A 66 19.282 -6.113 8.638 1.00 0.00 H new ATOM 0 HB VAL A 66 21.021 -5.320 6.958 1.00 0.00 H new ATOM 0 HG11 VAL A 66 19.480 -5.995 5.104 1.00 0.00 H new ATOM 0 HG12 VAL A 66 19.288 -7.035 6.535 1.00 0.00 H new ATOM 0 HG13 VAL A 66 18.094 -5.760 6.195 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.178 -3.681 5.317 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.804 -3.328 6.391 1.00 0.00 H new ATOM 0 HG23 VAL A 66 20.462 -2.949 6.914 1.00 0.00 H new ATOM 1079 N ASP A 67 21.378 -5.356 9.965 1.00 0.00 N ATOM 1080 CA ASP A 67 22.458 -4.880 10.805 1.00 0.00 C ATOM 1081 C ASP A 67 23.389 -3.994 10.046 1.00 0.00 C ATOM 1082 O ASP A 67 23.856 -4.418 8.967 1.00 0.00 O ATOM 1083 CB ASP A 67 23.092 -5.994 11.661 1.00 0.00 C ATOM 1084 CG ASP A 67 24.592 -5.955 11.755 1.00 0.00 C ATOM 1085 OD1 ASP A 67 25.216 -4.976 12.064 1.00 0.00 O ATOM 1086 OD2 ASP A 67 25.170 -7.091 11.471 1.00 0.00 O ATOM 0 H ASP A 67 21.247 -6.368 9.959 1.00 0.00 H new ATOM 0 HA ASP A 67 22.043 -4.223 11.570 1.00 0.00 H new ATOM 0 HB2 ASP A 67 22.679 -5.935 12.668 1.00 0.00 H new ATOM 0 HB3 ASP A 67 22.795 -6.959 11.250 1.00 0.00 H new ATOM 1091 N PHE A 68 23.655 -2.818 10.571 1.00 0.00 N ATOM 1092 CA PHE A 68 24.548 -1.879 9.917 1.00 0.00 C ATOM 1093 C PHE A 68 25.954 -1.909 10.466 1.00 0.00 C ATOM 1094 O PHE A 68 26.889 -2.265 9.760 1.00 0.00 O ATOM 1095 CB PHE A 68 24.031 -0.398 9.962 1.00 0.00 C ATOM 1096 CG PHE A 68 23.333 0.058 8.736 1.00 0.00 C ATOM 1097 CD1 PHE A 68 23.814 -0.199 7.443 1.00 0.00 C ATOM 1098 CD2 PHE A 68 22.122 0.786 8.815 1.00 0.00 C ATOM 1099 CE1 PHE A 68 23.172 0.221 6.288 1.00 0.00 C ATOM 1100 CE2 PHE A 68 21.445 1.227 7.672 1.00 0.00 C ATOM 1101 CZ PHE A 68 21.998 0.928 6.441 1.00 0.00 C ATOM 0 H PHE A 68 23.265 -2.486 11.453 1.00 0.00 H new ATOM 0 HA PHE A 68 24.564 -2.219 8.882 1.00 0.00 H new ATOM 0 HB2 PHE A 68 23.354 -0.291 10.809 1.00 0.00 H new ATOM 0 HB3 PHE A 68 24.879 0.262 10.146 1.00 0.00 H new ATOM 0 HD1 PHE A 68 24.735 -0.754 7.342 1.00 0.00 H new ATOM 0 HD2 PHE A 68 21.707 1.008 9.787 1.00 0.00 H new ATOM 0 HE1 PHE A 68 23.574 0.004 5.310 1.00 0.00 H new ATOM 0 HE2 PHE A 68 20.522 1.782 7.749 1.00 0.00 H new ATOM 0 HZ PHE A 68 21.484 1.266 5.553 1.00 0.00 H new ATOM 1111 N ALA A 69 26.031 -1.519 11.733 1.00 0.00 N ATOM 1112 CA ALA A 69 27.305 -1.463 12.453 1.00 0.00 C ATOM 1113 C ALA A 69 28.136 -0.368 11.763 1.00 0.00 C ATOM 1114 O ALA A 69 29.301 -0.507 11.415 1.00 0.00 O ATOM 1115 CB ALA A 69 28.008 -2.786 12.432 1.00 0.00 C ATOM 0 H ALA A 69 25.224 -1.235 12.288 1.00 0.00 H new ATOM 0 HA ALA A 69 27.151 -1.232 13.507 1.00 0.00 H new ATOM 0 HB1 ALA A 69 28.949 -2.706 12.976 1.00 0.00 H new ATOM 0 HB2 ALA A 69 27.379 -3.540 12.905 1.00 0.00 H new ATOM 0 HB3 ALA A 69 28.208 -3.075 11.400 1.00 0.00 H new ATOM 1121 N TYR A 70 27.424 0.740 11.588 1.00 0.00 N ATOM 1122 CA TYR A 70 27.928 1.939 10.958 1.00 0.00 C ATOM 1123 C TYR A 70 27.740 3.037 11.978 1.00 0.00 C ATOM 1124 O TYR A 70 26.609 3.347 12.213 1.00 0.00 O ATOM 1125 CB TYR A 70 27.076 2.295 9.717 1.00 0.00 C ATOM 1126 CG TYR A 70 27.107 3.791 9.388 1.00 0.00 C ATOM 1127 CD1 TYR A 70 28.303 4.519 9.299 1.00 0.00 C ATOM 1128 CD2 TYR A 70 25.942 4.507 9.159 1.00 0.00 C ATOM 1129 CE1 TYR A 70 28.369 5.882 9.004 1.00 0.00 C ATOM 1130 CE2 TYR A 70 25.961 5.882 8.857 1.00 0.00 C ATOM 1131 CZ TYR A 70 27.182 6.579 8.780 1.00 0.00 C ATOM 1132 OH TYR A 70 27.127 7.909 8.486 1.00 0.00 O ATOM 0 H TYR A 70 26.454 0.824 11.892 1.00 0.00 H new ATOM 0 HA TYR A 70 28.964 1.810 10.645 1.00 0.00 H new ATOM 0 HB2 TYR A 70 27.439 1.731 8.858 1.00 0.00 H new ATOM 0 HB3 TYR A 70 26.045 1.986 9.889 1.00 0.00 H new ATOM 0 HD1 TYR A 70 29.230 3.992 9.469 1.00 0.00 H new ATOM 0 HD2 TYR A 70 24.993 3.995 9.214 1.00 0.00 H new ATOM 0 HE1 TYR A 70 29.322 6.387 8.950 1.00 0.00 H new ATOM 0 HE2 TYR A 70 25.033 6.406 8.683 1.00 0.00 H new ATOM 0 HH TYR A 70 26.192 8.180 8.369 1.00 0.00 H new ATOM 1142 N SER A 71 28.876 3.515 12.494 1.00 0.00 N ATOM 1143 CA SER A 71 28.781 4.548 13.488 1.00 0.00 C ATOM 1144 C SER A 71 27.850 5.687 13.081 1.00 0.00 C ATOM 1145 O SER A 71 27.881 6.095 11.931 1.00 0.00 O ATOM 1146 CB SER A 71 30.066 5.182 13.924 1.00 0.00 C ATOM 1147 OG SER A 71 30.453 6.326 13.208 1.00 0.00 O ATOM 0 H SER A 71 29.818 3.213 12.247 1.00 0.00 H new ATOM 0 HA SER A 71 28.385 3.980 14.330 1.00 0.00 H new ATOM 0 HB2 SER A 71 29.980 5.447 14.978 1.00 0.00 H new ATOM 0 HB3 SER A 71 30.861 4.440 13.846 1.00 0.00 H new ATOM 0 HG SER A 71 31.239 6.119 12.661 1.00 0.00 H new ATOM 1153 N LEU A 72 27.092 6.093 14.053 1.00 0.00 N ATOM 1154 CA LEU A 72 26.088 7.107 13.999 1.00 0.00 C ATOM 1155 C LEU A 72 26.650 8.395 13.439 1.00 0.00 C ATOM 1156 O LEU A 72 26.828 9.463 14.093 1.00 0.00 O ATOM 1157 CB LEU A 72 25.425 7.340 15.372 1.00 0.00 C ATOM 1158 CG LEU A 72 26.362 7.477 16.549 1.00 0.00 C ATOM 1159 CD1 LEU A 72 26.588 6.160 17.310 1.00 0.00 C ATOM 1160 CD2 LEU A 72 27.719 8.033 16.198 1.00 0.00 C ATOM 0 H LEU A 72 27.169 5.686 14.985 1.00 0.00 H new ATOM 0 HA LEU A 72 25.308 6.753 13.324 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.817 8.243 15.311 1.00 0.00 H new ATOM 0 HB3 LEU A 72 24.745 6.511 15.570 1.00 0.00 H new ATOM 0 HG LEU A 72 25.837 8.189 17.186 1.00 0.00 H new ATOM 0 HD11 LEU A 72 27.271 6.333 18.142 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.636 5.793 17.693 1.00 0.00 H new ATOM 0 HD13 LEU A 72 27.018 5.419 16.636 1.00 0.00 H new ATOM 0 HD21 LEU A 72 28.329 8.099 17.099 1.00 0.00 H new ATOM 0 HD22 LEU A 72 28.206 7.376 15.477 1.00 0.00 H new ATOM 0 HD23 LEU A 72 27.604 9.026 15.764 1.00 0.00 H new ATOM 1172 N ALA A 73 26.972 8.399 12.127 1.00 0.00 N ATOM 1173 CA ALA A 73 27.518 9.553 11.434 1.00 0.00 C ATOM 1174 C ALA A 73 28.789 9.998 12.152 1.00 0.00 C ATOM 1175 O ALA A 73 28.747 11.061 12.785 1.00 0.00 O ATOM 1176 CB ALA A 73 26.544 10.715 11.275 1.00 0.00 C ATOM 0 H ALA A 73 26.853 7.584 11.525 1.00 0.00 H new ATOM 0 HA ALA A 73 27.738 9.239 10.414 1.00 0.00 H new ATOM 0 HB1 ALA A 73 27.036 11.532 10.747 1.00 0.00 H new ATOM 0 HB2 ALA A 73 25.675 10.386 10.705 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.224 11.059 12.259 1.00 0.00 H new ATOM 1182 N ASP A 74 29.841 9.194 12.032 1.00 0.00 N ATOM 1183 CA ASP A 74 31.152 9.439 12.640 1.00 0.00 C ATOM 1184 C ASP A 74 31.114 9.289 14.145 1.00 0.00 C ATOM 1185 O ASP A 74 30.710 10.170 14.894 1.00 0.00 O ATOM 1186 CB ASP A 74 31.879 10.693 12.255 1.00 0.00 C ATOM 1187 CG ASP A 74 32.550 10.583 10.879 1.00 0.00 C ATOM 1188 OD1 ASP A 74 31.846 10.196 9.877 1.00 0.00 O ATOM 1189 OD2 ASP A 74 33.799 10.894 10.788 1.00 0.00 O ATOM 0 H ASP A 74 29.808 8.328 11.494 1.00 0.00 H new ATOM 0 HA ASP A 74 31.755 8.649 12.192 1.00 0.00 H new ATOM 0 HB2 ASP A 74 31.179 11.528 12.249 1.00 0.00 H new ATOM 0 HB3 ASP A 74 32.635 10.917 13.008 1.00 0.00 H new ATOM 1194 N GLY A 75 31.549 8.133 14.633 1.00 0.00 N ATOM 1195 CA GLY A 75 31.592 7.799 16.054 1.00 0.00 C ATOM 1196 C GLY A 75 32.166 6.362 16.265 1.00 0.00 C ATOM 1197 O GLY A 75 33.335 6.101 16.020 1.00 0.00 O ATOM 0 H GLY A 75 31.891 7.381 14.035 1.00 0.00 H new ATOM 0 HA2 GLY A 75 32.209 8.524 16.585 1.00 0.00 H new ATOM 0 HA3 GLY A 75 30.590 7.862 16.478 1.00 0.00 H new ATOM 1201 N THR A 76 31.379 5.419 16.709 1.00 0.00 N ATOM 1202 CA THR A 76 31.782 4.063 16.936 1.00 0.00 C ATOM 1203 C THR A 76 30.909 3.011 16.259 1.00 0.00 C ATOM 1204 O THR A 76 31.514 2.043 15.774 1.00 0.00 O ATOM 1205 CB THR A 76 31.787 3.708 18.449 1.00 0.00 C ATOM 1206 OG1 THR A 76 33.121 3.557 18.822 1.00 0.00 O ATOM 1207 CG2 THR A 76 31.061 2.412 18.803 1.00 0.00 C ATOM 0 H THR A 76 30.397 5.585 16.931 1.00 0.00 H new ATOM 0 HA THR A 76 32.780 4.030 16.500 1.00 0.00 H new ATOM 0 HB THR A 76 31.261 4.508 18.970 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.171 3.333 19.775 1.00 0.00 H new ATOM 0 HG21 THR A 76 31.116 2.246 19.879 1.00 0.00 H new ATOM 0 HG22 THR A 76 30.016 2.486 18.501 1.00 0.00 H new ATOM 0 HG23 THR A 76 31.531 1.578 18.283 1.00 0.00 H new ATOM 1215 N GLU A 77 29.595 3.164 16.229 1.00 0.00 N ATOM 1216 CA GLU A 77 28.776 2.095 15.594 1.00 0.00 C ATOM 1217 C GLU A 77 27.309 2.438 15.673 1.00 0.00 C ATOM 1218 O GLU A 77 26.849 3.544 15.995 1.00 0.00 O ATOM 1219 CB GLU A 77 29.035 0.764 16.312 1.00 0.00 C ATOM 1220 CG GLU A 77 29.981 -0.248 15.630 1.00 0.00 C ATOM 1221 CD GLU A 77 29.528 -1.669 15.684 1.00 0.00 C ATOM 1222 OE1 GLU A 77 28.472 -2.018 15.216 1.00 0.00 O ATOM 1223 OE2 GLU A 77 30.365 -2.502 16.278 1.00 0.00 O ATOM 0 H GLU A 77 29.079 3.959 16.606 1.00 0.00 H new ATOM 0 HA GLU A 77 29.057 2.009 14.544 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.440 0.989 17.299 1.00 0.00 H new ATOM 0 HB3 GLU A 77 28.074 0.273 16.466 1.00 0.00 H new ATOM 0 HG2 GLU A 77 30.104 0.039 14.586 1.00 0.00 H new ATOM 0 HG3 GLU A 77 30.963 -0.177 16.098 1.00 0.00 H new ATOM 1230 N LEU A 78 26.461 1.477 15.367 1.00 0.00 N ATOM 1231 CA LEU A 78 25.001 1.550 15.409 1.00 0.00 C ATOM 1232 C LEU A 78 24.521 0.302 14.643 1.00 0.00 C ATOM 1233 O LEU A 78 23.750 0.285 13.685 1.00 0.00 O ATOM 1234 CB LEU A 78 24.447 2.802 14.696 1.00 0.00 C ATOM 1235 CG LEU A 78 23.899 3.913 15.619 1.00 0.00 C ATOM 1236 CD1 LEU A 78 23.289 4.969 14.696 1.00 0.00 C ATOM 1237 CD2 LEU A 78 22.702 3.322 16.332 1.00 0.00 C ATOM 0 H LEU A 78 26.788 0.560 15.061 1.00 0.00 H new ATOM 0 HA LEU A 78 24.658 1.601 16.442 1.00 0.00 H new ATOM 0 HB2 LEU A 78 25.239 3.226 14.079 1.00 0.00 H new ATOM 0 HB3 LEU A 78 23.650 2.490 14.021 1.00 0.00 H new ATOM 0 HG LEU A 78 24.667 4.298 16.290 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.883 5.784 15.294 1.00 0.00 H new ATOM 0 HD12 LEU A 78 24.058 5.357 14.029 1.00 0.00 H new ATOM 0 HD13 LEU A 78 22.490 4.519 14.106 1.00 0.00 H new ATOM 0 HD21 LEU A 78 22.273 4.067 17.001 1.00 0.00 H new ATOM 0 HD22 LEU A 78 21.955 3.019 15.599 1.00 0.00 H new ATOM 0 HD23 LEU A 78 23.016 2.453 16.910 1.00 0.00 H new ATOM 1249 N THR A 79 25.048 -0.792 15.136 1.00 0.00 N ATOM 1250 CA THR A 79 24.826 -2.153 14.657 1.00 0.00 C ATOM 1251 C THR A 79 23.342 -2.443 14.446 1.00 0.00 C ATOM 1252 O THR A 79 23.007 -3.387 13.717 1.00 0.00 O ATOM 1253 CB THR A 79 25.329 -3.346 15.528 1.00 0.00 C ATOM 1254 OG1 THR A 79 25.025 -4.533 14.820 1.00 0.00 O ATOM 1255 CG2 THR A 79 24.786 -3.411 16.944 1.00 0.00 C ATOM 0 H THR A 79 25.685 -0.764 15.932 1.00 0.00 H new ATOM 0 HA THR A 79 25.429 -2.126 13.750 1.00 0.00 H new ATOM 0 HB THR A 79 26.399 -3.206 15.678 1.00 0.00 H new ATOM 0 HG1 THR A 79 24.525 -4.310 14.007 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.203 -4.279 17.454 1.00 0.00 H new ATOM 0 HG22 THR A 79 25.064 -2.505 17.482 1.00 0.00 H new ATOM 0 HG23 THR A 79 23.700 -3.496 16.914 1.00 0.00 H new ATOM 1263 N GLY A 80 22.539 -1.632 15.087 1.00 0.00 N ATOM 1264 CA GLY A 80 21.114 -1.722 15.015 1.00 0.00 C ATOM 1265 C GLY A 80 20.573 -1.933 13.615 1.00 0.00 C ATOM 1266 O GLY A 80 21.192 -1.859 12.575 1.00 0.00 O ATOM 0 H GLY A 80 22.872 -0.876 15.685 1.00 0.00 H new ATOM 0 HA2 GLY A 80 20.781 -2.544 15.648 1.00 0.00 H new ATOM 0 HA3 GLY A 80 20.683 -0.809 15.425 1.00 0.00 H new ATOM 1270 N THR A 81 19.271 -2.219 13.658 1.00 0.00 N ATOM 1271 CA THR A 81 18.493 -2.477 12.445 1.00 0.00 C ATOM 1272 C THR A 81 17.258 -1.573 12.373 1.00 0.00 C ATOM 1273 O THR A 81 16.196 -1.859 12.869 1.00 0.00 O ATOM 1274 CB THR A 81 17.945 -3.920 12.498 1.00 0.00 C ATOM 1275 OG1 THR A 81 17.321 -4.188 13.758 1.00 0.00 O ATOM 1276 CG2 THR A 81 19.055 -4.956 12.264 1.00 0.00 C ATOM 0 H THR A 81 18.732 -2.278 14.522 1.00 0.00 H new ATOM 0 HA THR A 81 19.150 -2.302 11.593 1.00 0.00 H new ATOM 0 HB THR A 81 17.207 -4.004 11.700 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.663 -3.489 13.952 1.00 0.00 H new ATOM 0 HG21 THR A 81 18.631 -5.959 12.309 1.00 0.00 H new ATOM 0 HG22 THR A 81 19.503 -4.794 11.283 1.00 0.00 H new ATOM 0 HG23 THR A 81 19.819 -4.850 13.034 1.00 0.00 H new ATOM 1284 N TRP A 82 17.561 -0.482 11.715 1.00 0.00 N ATOM 1285 CA TRP A 82 16.569 0.531 11.530 1.00 0.00 C ATOM 1286 C TRP A 82 15.437 -0.240 10.791 1.00 0.00 C ATOM 1287 O TRP A 82 15.728 -1.074 9.926 1.00 0.00 O ATOM 1288 CB TRP A 82 16.840 1.686 10.564 1.00 0.00 C ATOM 1289 CG TRP A 82 18.140 2.364 10.532 1.00 0.00 C ATOM 1290 CD1 TRP A 82 19.387 1.947 10.781 1.00 0.00 C ATOM 1291 CD2 TRP A 82 18.307 3.746 10.196 1.00 0.00 C ATOM 1292 NE1 TRP A 82 20.281 2.978 10.621 1.00 0.00 N ATOM 1293 CE2 TRP A 82 19.667 4.126 10.256 1.00 0.00 C ATOM 1294 CE3 TRP A 82 17.424 4.783 9.832 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 20.113 5.415 9.980 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 17.873 6.049 9.564 1.00 0.00 C ATOM 1297 CH2 TRP A 82 19.221 6.379 9.634 1.00 0.00 C ATOM 0 H TRP A 82 18.474 -0.280 11.307 1.00 0.00 H new ATOM 0 HA TRP A 82 16.425 0.982 12.512 1.00 0.00 H new ATOM 0 HB2 TRP A 82 16.653 1.309 9.558 1.00 0.00 H new ATOM 0 HB3 TRP A 82 16.088 2.450 10.763 1.00 0.00 H new ATOM 0 HD1 TRP A 82 19.653 0.940 11.068 1.00 0.00 H new ATOM 0 HE1 TRP A 82 21.287 2.888 10.761 1.00 0.00 H new ATOM 0 HE3 TRP A 82 16.367 4.574 9.763 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 21.166 5.648 10.041 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 17.159 6.812 9.291 1.00 0.00 H new ATOM 0 HH2 TRP A 82 19.553 7.384 9.417 1.00 0.00 H new ATOM 1308 N THR A 83 14.238 0.120 11.184 1.00 0.00 N ATOM 1309 CA THR A 83 13.008 -0.420 10.640 1.00 0.00 C ATOM 1310 C THR A 83 11.971 0.670 10.910 1.00 0.00 C ATOM 1311 O THR A 83 12.187 1.506 11.749 1.00 0.00 O ATOM 1312 CB THR A 83 12.484 -1.741 11.229 1.00 0.00 C ATOM 1313 OG1 THR A 83 13.143 -2.010 12.420 1.00 0.00 O ATOM 1314 CG2 THR A 83 12.688 -2.920 10.275 1.00 0.00 C ATOM 0 H THR A 83 14.084 0.817 11.912 1.00 0.00 H new ATOM 0 HA THR A 83 13.198 -0.673 9.597 1.00 0.00 H new ATOM 0 HB THR A 83 11.413 -1.622 11.396 1.00 0.00 H new ATOM 0 HG1 THR A 83 12.808 -2.851 12.796 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.303 -3.830 10.734 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.156 -2.730 9.343 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.751 -3.040 10.067 1.00 0.00 H new ATOM 1322 N MET A 84 10.877 0.655 10.205 1.00 0.00 N ATOM 1323 CA MET A 84 9.824 1.632 10.391 1.00 0.00 C ATOM 1324 C MET A 84 8.568 0.841 10.658 1.00 0.00 C ATOM 1325 O MET A 84 8.678 -0.283 11.157 1.00 0.00 O ATOM 1326 CB MET A 84 9.781 2.454 9.079 1.00 0.00 C ATOM 1327 CG MET A 84 9.133 1.751 7.884 1.00 0.00 C ATOM 1328 SD MET A 84 8.227 2.823 6.724 1.00 0.00 S ATOM 1329 CE MET A 84 8.492 1.973 5.156 1.00 0.00 C ATOM 0 H MET A 84 10.682 -0.035 9.480 1.00 0.00 H new ATOM 0 HA MET A 84 9.963 2.326 11.220 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.241 3.382 9.269 1.00 0.00 H new ATOM 0 HB3 MET A 84 10.801 2.728 8.808 1.00 0.00 H new ATOM 0 HG2 MET A 84 9.912 1.226 7.330 1.00 0.00 H new ATOM 0 HG3 MET A 84 8.445 0.994 8.262 1.00 0.00 H new ATOM 0 HE1 MET A 84 9.129 2.583 4.515 1.00 0.00 H new ATOM 0 HE2 MET A 84 8.975 1.013 5.340 1.00 0.00 H new ATOM 0 HE3 MET A 84 7.533 1.809 4.665 1.00 0.00 H new ATOM 1339 N GLU A 85 7.433 1.410 10.332 1.00 0.00 N ATOM 1340 CA GLU A 85 6.174 0.707 10.560 1.00 0.00 C ATOM 1341 C GLU A 85 5.152 1.238 9.630 1.00 0.00 C ATOM 1342 O GLU A 85 5.503 1.514 8.475 1.00 0.00 O ATOM 1343 CB GLU A 85 5.791 0.902 12.045 1.00 0.00 C ATOM 1344 CG GLU A 85 5.100 -0.330 12.631 1.00 0.00 C ATOM 1345 CD GLU A 85 3.606 -0.334 12.831 1.00 0.00 C ATOM 1346 OE1 GLU A 85 3.154 0.711 13.493 1.00 0.00 O ATOM 1347 OE2 GLU A 85 2.870 -1.207 12.426 1.00 0.00 O ATOM 0 H GLU A 85 7.344 2.337 9.916 1.00 0.00 H new ATOM 0 HA GLU A 85 6.258 -0.362 10.365 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.688 1.123 12.624 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.131 1.765 12.138 1.00 0.00 H new ATOM 0 HG2 GLU A 85 5.343 -1.175 11.986 1.00 0.00 H new ATOM 0 HG3 GLU A 85 5.557 -0.527 13.601 1.00 0.00 H new ATOM 1354 N GLY A 86 3.915 1.404 10.045 1.00 0.00 N ATOM 1355 CA GLY A 86 2.864 1.915 9.206 1.00 0.00 C ATOM 1356 C GLY A 86 2.890 3.396 9.404 1.00 0.00 C ATOM 1357 O GLY A 86 2.409 4.135 8.572 1.00 0.00 O ATOM 0 H GLY A 86 3.611 1.182 10.993 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.032 1.654 8.161 1.00 0.00 H new ATOM 0 HA3 GLY A 86 1.897 1.497 9.487 1.00 0.00 H new ATOM 1361 N ASN A 87 3.470 3.805 10.530 1.00 0.00 N ATOM 1362 CA ASN A 87 3.547 5.215 10.823 1.00 0.00 C ATOM 1363 C ASN A 87 4.908 5.686 11.274 1.00 0.00 C ATOM 1364 O ASN A 87 5.025 6.818 11.718 1.00 0.00 O ATOM 1365 CB ASN A 87 2.298 5.819 11.455 1.00 0.00 C ATOM 1366 CG ASN A 87 2.076 5.207 12.816 1.00 0.00 C ATOM 1367 OD1 ASN A 87 3.077 4.796 13.446 1.00 0.00 O ATOM 1368 ND2 ASN A 87 0.826 5.157 13.231 1.00 0.00 N ATOM 0 H ASN A 87 3.881 3.190 11.232 1.00 0.00 H new ATOM 0 HA ASN A 87 3.492 5.723 9.860 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.409 6.900 11.544 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.432 5.639 10.818 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.607 4.755 14.143 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.078 5.520 12.641 1.00 0.00 H new ATOM 1375 N LYS A 88 5.965 4.920 11.200 1.00 0.00 N ATOM 1376 CA LYS A 88 7.186 5.488 11.659 1.00 0.00 C ATOM 1377 C LYS A 88 8.391 4.541 11.562 1.00 0.00 C ATOM 1378 O LYS A 88 8.194 3.395 11.865 1.00 0.00 O ATOM 1379 CB LYS A 88 7.257 5.800 13.141 1.00 0.00 C ATOM 1380 CG LYS A 88 6.659 4.829 14.098 1.00 0.00 C ATOM 1381 CD LYS A 88 7.426 4.712 15.388 1.00 0.00 C ATOM 1382 CE LYS A 88 8.256 5.918 15.775 1.00 0.00 C ATOM 1383 NZ LYS A 88 8.708 5.807 17.174 1.00 0.00 N ATOM 0 H LYS A 88 6.002 3.963 10.849 1.00 0.00 H new ATOM 0 HA LYS A 88 7.215 6.368 11.016 1.00 0.00 H new ATOM 0 HB2 LYS A 88 8.308 5.922 13.405 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.774 6.764 13.301 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.635 5.131 14.319 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.607 3.849 13.625 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.718 4.509 16.192 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.086 3.848 15.319 1.00 0.00 H new ATOM 0 HE2 LYS A 88 9.118 6.001 15.114 1.00 0.00 H new ATOM 0 HE3 LYS A 88 7.668 6.827 15.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 9.276 6.642 17.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.881 5.751 17.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.286 4.950 17.285 1.00 0.00 H new ATOM 1397 N LEU A 89 9.506 5.131 11.160 1.00 0.00 N ATOM 1398 CA LEU A 89 10.821 4.543 11.006 1.00 0.00 C ATOM 1399 C LEU A 89 11.209 4.252 12.468 1.00 0.00 C ATOM 1400 O LEU A 89 10.405 4.409 13.373 1.00 0.00 O ATOM 1401 CB LEU A 89 11.826 5.580 10.422 1.00 0.00 C ATOM 1402 CG LEU A 89 12.648 5.190 9.203 1.00 0.00 C ATOM 1403 CD1 LEU A 89 13.930 6.034 9.276 1.00 0.00 C ATOM 1404 CD2 LEU A 89 13.131 3.759 9.220 1.00 0.00 C ATOM 0 H LEU A 89 9.510 6.120 10.912 1.00 0.00 H new ATOM 0 HA LEU A 89 10.831 3.680 10.341 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.264 6.479 10.169 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.521 5.852 11.217 1.00 0.00 H new ATOM 0 HG LEU A 89 12.021 5.335 8.324 1.00 0.00 H new ATOM 0 HD11 LEU A 89 14.568 5.801 8.424 1.00 0.00 H new ATOM 0 HD12 LEU A 89 13.670 7.092 9.256 1.00 0.00 H new ATOM 0 HD13 LEU A 89 14.462 5.808 10.200 1.00 0.00 H new ATOM 0 HD21 LEU A 89 13.709 3.559 8.318 1.00 0.00 H new ATOM 0 HD22 LEU A 89 13.759 3.597 10.096 1.00 0.00 H new ATOM 0 HD23 LEU A 89 12.274 3.086 9.258 1.00 0.00 H new ATOM 1416 N VAL A 90 12.472 3.840 12.643 1.00 0.00 N ATOM 1417 CA VAL A 90 12.937 3.604 13.965 1.00 0.00 C ATOM 1418 C VAL A 90 14.466 3.592 14.063 1.00 0.00 C ATOM 1419 O VAL A 90 14.905 2.977 15.025 1.00 0.00 O ATOM 1420 CB VAL A 90 12.459 2.239 14.539 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.538 2.177 16.064 1.00 0.00 C ATOM 1422 CG2 VAL A 90 11.041 1.912 14.223 1.00 0.00 C ATOM 0 H VAL A 90 13.149 3.675 11.898 1.00 0.00 H new ATOM 0 HA VAL A 90 12.519 4.432 14.538 1.00 0.00 H new ATOM 0 HB VAL A 90 13.138 1.533 14.062 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.192 1.202 16.407 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.570 2.328 16.381 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.909 2.957 16.493 1.00 0.00 H new ATOM 0 HG21 VAL A 90 10.785 0.946 14.658 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.389 2.681 14.638 1.00 0.00 H new ATOM 0 HG23 VAL A 90 10.910 1.870 13.142 1.00 0.00 H new ATOM 1432 N GLY A 91 15.231 4.214 13.190 1.00 0.00 N ATOM 1433 CA GLY A 91 16.667 4.224 13.150 1.00 0.00 C ATOM 1434 C GLY A 91 17.266 2.953 13.762 1.00 0.00 C ATOM 1435 O GLY A 91 17.976 2.164 13.157 1.00 0.00 O ATOM 0 H GLY A 91 14.827 4.767 12.434 1.00 0.00 H new ATOM 0 HA2 GLY A 91 17.000 4.321 12.117 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.039 5.096 13.688 1.00 0.00 H new ATOM 1439 N LYS A 92 16.958 2.771 14.997 1.00 0.00 N ATOM 1440 CA LYS A 92 17.309 1.590 15.786 1.00 0.00 C ATOM 1441 C LYS A 92 18.698 1.719 16.317 1.00 0.00 C ATOM 1442 O LYS A 92 19.145 2.858 16.341 1.00 0.00 O ATOM 1443 CB LYS A 92 16.996 0.280 15.133 1.00 0.00 C ATOM 1444 CG LYS A 92 15.515 -0.028 15.396 1.00 0.00 C ATOM 1445 CD LYS A 92 15.378 -0.367 16.878 1.00 0.00 C ATOM 1446 CE LYS A 92 14.338 -1.423 17.129 1.00 0.00 C ATOM 1447 NZ LYS A 92 14.707 -2.360 18.189 1.00 0.00 N ATOM 0 H LYS A 92 16.429 3.460 15.532 1.00 0.00 H new ATOM 0 HA LYS A 92 16.640 1.564 16.646 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.192 0.330 14.062 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.629 -0.510 15.537 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.893 0.829 15.139 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.180 -0.862 14.779 1.00 0.00 H new ATOM 0 HD2 LYS A 92 16.340 -0.709 17.260 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.118 0.535 17.432 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.397 -0.940 17.392 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.165 -1.978 16.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.846 -2.733 18.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.254 -3.146 17.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.284 -1.869 18.901 1.00 0.00 H new ATOM 1461 N PHE A 93 19.322 0.627 16.758 1.00 0.00 N ATOM 1462 CA PHE A 93 20.632 0.778 17.381 1.00 0.00 C ATOM 1463 C PHE A 93 21.276 -0.479 17.907 1.00 0.00 C ATOM 1464 O PHE A 93 20.941 -1.641 17.671 1.00 0.00 O ATOM 1465 CB PHE A 93 20.221 1.486 18.720 1.00 0.00 C ATOM 1466 CG PHE A 93 18.902 0.988 19.230 1.00 0.00 C ATOM 1467 CD1 PHE A 93 18.872 -0.394 19.520 1.00 0.00 C ATOM 1468 CD2 PHE A 93 17.740 1.668 19.445 1.00 0.00 C ATOM 1469 CE1 PHE A 93 17.759 -1.033 19.992 1.00 0.00 C ATOM 1470 CE2 PHE A 93 16.588 1.026 19.949 1.00 0.00 C ATOM 1471 CZ PHE A 93 16.582 -0.328 20.220 1.00 0.00 C ATOM 0 H PHE A 93 18.963 -0.326 16.700 1.00 0.00 H new ATOM 0 HA PHE A 93 21.313 1.230 16.660 1.00 0.00 H new ATOM 0 HB2 PHE A 93 20.990 1.315 19.473 1.00 0.00 H new ATOM 0 HB3 PHE A 93 20.166 2.563 18.560 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.770 -0.973 19.362 1.00 0.00 H new ATOM 0 HD2 PHE A 93 17.700 2.724 19.224 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.794 -2.094 20.189 1.00 0.00 H new ATOM 0 HE2 PHE A 93 15.694 1.605 20.126 1.00 0.00 H new ATOM 0 HZ PHE A 93 15.697 -0.821 20.595 1.00 0.00 H new ATOM 1481 N LYS A 94 22.242 -0.070 18.715 1.00 0.00 N ATOM 1482 CA LYS A 94 23.156 -0.760 19.593 1.00 0.00 C ATOM 1483 C LYS A 94 24.575 -0.587 19.122 1.00 0.00 C ATOM 1484 O LYS A 94 25.252 -1.577 18.961 1.00 0.00 O ATOM 1485 CB LYS A 94 22.878 -2.220 19.796 1.00 0.00 C ATOM 1486 CG LYS A 94 21.747 -2.067 20.808 1.00 0.00 C ATOM 1487 CD LYS A 94 20.820 -3.224 20.962 1.00 0.00 C ATOM 1488 CE LYS A 94 19.854 -3.086 22.127 1.00 0.00 C ATOM 1489 NZ LYS A 94 19.267 -4.397 22.402 1.00 0.00 N ATOM 0 H LYS A 94 22.425 0.932 18.771 1.00 0.00 H new ATOM 0 HA LYS A 94 23.003 -0.290 20.564 1.00 0.00 H new ATOM 0 HB2 LYS A 94 22.569 -2.728 18.882 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.734 -2.768 20.191 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.189 -1.854 21.781 1.00 0.00 H new ATOM 0 HG3 LYS A 94 21.157 -1.194 20.528 1.00 0.00 H new ATOM 0 HD2 LYS A 94 20.249 -3.345 20.041 1.00 0.00 H new ATOM 0 HD3 LYS A 94 21.407 -4.133 21.095 1.00 0.00 H new ATOM 0 HE2 LYS A 94 20.375 -2.712 23.008 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.073 -2.364 21.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 18.602 -4.320 23.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 18.760 -4.734 21.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 20.021 -5.071 22.645 1.00 0.00 H new ATOM 1503 N ARG A 95 24.895 0.674 18.936 1.00 0.00 N ATOM 1504 CA ARG A 95 26.141 1.136 18.481 1.00 0.00 C ATOM 1505 C ARG A 95 27.342 0.383 19.075 1.00 0.00 C ATOM 1506 O ARG A 95 28.388 0.871 18.755 1.00 0.00 O ATOM 1507 CB ARG A 95 26.534 2.553 18.894 1.00 0.00 C ATOM 1508 CG ARG A 95 25.510 3.587 19.093 1.00 0.00 C ATOM 1509 CD ARG A 95 24.355 3.302 20.075 1.00 0.00 C ATOM 1510 NE ARG A 95 24.588 2.108 20.820 1.00 0.00 N ATOM 1511 CZ ARG A 95 25.654 1.806 21.607 1.00 0.00 C ATOM 1512 NH1 ARG A 95 26.523 2.751 21.841 1.00 0.00 N ATOM 1513 NH2 ARG A 95 25.658 0.565 22.022 1.00 0.00 N ATOM 0 H ARG A 95 24.236 1.432 19.116 1.00 0.00 H new ATOM 0 HA ARG A 95 25.975 1.017 17.410 1.00 0.00 H new ATOM 0 HB2 ARG A 95 27.093 2.472 19.826 1.00 0.00 H new ATOM 0 HB3 ARG A 95 27.225 2.927 18.139 1.00 0.00 H new ATOM 0 HG2 ARG A 95 26.015 4.493 19.429 1.00 0.00 H new ATOM 0 HG3 ARG A 95 25.071 3.809 18.121 1.00 0.00 H new ATOM 0 HD2 ARG A 95 24.241 4.143 20.759 1.00 0.00 H new ATOM 0 HD3 ARG A 95 23.420 3.211 19.523 1.00 0.00 H new ATOM 0 HE ARG A 95 23.865 1.392 20.754 1.00 0.00 H new ATOM 0 HH11 ARG A 95 26.389 3.678 21.438 1.00 0.00 H new ATOM 0 HH12 ARG A 95 27.336 2.562 22.427 1.00 0.00 H new ATOM 0 HH21 ARG A 95 24.906 -0.067 21.748 1.00 0.00 H new ATOM 0 HH22 ARG A 95 26.413 0.230 22.620 1.00 0.00 H new ATOM 1527 N VAL A 96 27.255 -0.556 19.912 1.00 0.00 N ATOM 1528 CA VAL A 96 28.525 -1.075 20.429 1.00 0.00 C ATOM 1529 C VAL A 96 29.207 0.037 21.263 1.00 0.00 C ATOM 1530 O VAL A 96 29.764 -0.344 22.303 1.00 0.00 O ATOM 1531 CB VAL A 96 29.391 -1.623 19.347 1.00 0.00 C ATOM 1532 CG1 VAL A 96 30.715 -2.117 19.977 1.00 0.00 C ATOM 1533 CG2 VAL A 96 28.674 -2.704 18.538 1.00 0.00 C ATOM 0 H VAL A 96 26.399 -0.987 20.262 1.00 0.00 H new ATOM 0 HA VAL A 96 28.337 -1.927 21.082 1.00 0.00 H new ATOM 0 HB VAL A 96 29.623 -0.838 18.627 1.00 0.00 H new ATOM 0 HG11 VAL A 96 31.360 -2.521 19.197 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.218 -1.284 20.468 1.00 0.00 H new ATOM 0 HG13 VAL A 96 30.501 -2.895 20.710 1.00 0.00 H new ATOM 0 HG21 VAL A 96 29.339 -3.077 17.760 1.00 0.00 H new ATOM 0 HG22 VAL A 96 28.391 -3.524 19.198 1.00 0.00 H new ATOM 0 HG23 VAL A 96 27.780 -2.282 18.079 1.00 0.00 H new ATOM 1543 N ASP A 97 29.177 1.295 20.910 1.00 0.00 N ATOM 1544 CA ASP A 97 29.758 2.347 21.818 1.00 0.00 C ATOM 1545 C ASP A 97 29.287 2.093 23.221 1.00 0.00 C ATOM 1546 O ASP A 97 29.863 2.506 24.242 1.00 0.00 O ATOM 1547 CB ASP A 97 29.303 3.781 21.422 1.00 0.00 C ATOM 1548 CG ASP A 97 29.415 4.760 22.557 1.00 0.00 C ATOM 1549 OD1 ASP A 97 30.652 4.939 22.902 1.00 0.00 O ATOM 1550 OD2 ASP A 97 28.519 5.358 23.138 1.00 0.00 O ATOM 0 H ASP A 97 28.779 1.645 20.039 1.00 0.00 H new ATOM 0 HA ASP A 97 30.843 2.288 21.734 1.00 0.00 H new ATOM 0 HB2 ASP A 97 29.907 4.131 20.585 1.00 0.00 H new ATOM 0 HB3 ASP A 97 28.269 3.747 21.077 1.00 0.00 H new ATOM 1555 N ASN A 98 28.156 1.376 23.237 1.00 0.00 N ATOM 1556 CA ASN A 98 27.516 1.145 24.519 1.00 0.00 C ATOM 1557 C ASN A 98 26.394 0.172 24.701 1.00 0.00 C ATOM 1558 O ASN A 98 26.643 -0.931 25.202 1.00 0.00 O ATOM 1559 CB ASN A 98 27.080 2.623 24.866 1.00 0.00 C ATOM 1560 CG ASN A 98 26.524 2.902 26.230 1.00 0.00 C ATOM 1561 OD1 ASN A 98 25.637 2.137 26.735 1.00 0.00 O ATOM 1562 ND2 ASN A 98 26.963 3.941 26.900 1.00 0.00 N ATOM 0 H ASN A 98 27.694 0.970 22.423 1.00 0.00 H new ATOM 0 HA ASN A 98 28.214 0.614 25.166 1.00 0.00 H new ATOM 0 HB2 ASN A 98 27.948 3.267 24.723 1.00 0.00 H new ATOM 0 HB3 ASN A 98 26.332 2.929 24.134 1.00 0.00 H new ATOM 0 HD21 ASN A 98 26.595 4.141 27.830 1.00 0.00 H new ATOM 0 HD22 ASN A 98 27.672 4.549 26.491 1.00 0.00 H new ATOM 1569 N GLY A 99 25.206 0.589 24.272 1.00 0.00 N ATOM 1570 CA GLY A 99 23.967 -0.116 24.247 1.00 0.00 C ATOM 1571 C GLY A 99 22.752 0.858 24.280 1.00 0.00 C ATOM 1572 O GLY A 99 21.807 0.697 25.065 1.00 0.00 O ATOM 0 H GLY A 99 25.097 1.532 23.898 1.00 0.00 H new ATOM 0 HA2 GLY A 99 23.916 -0.732 23.349 1.00 0.00 H new ATOM 0 HA3 GLY A 99 23.915 -0.792 25.100 1.00 0.00 H new ATOM 1576 N LYS A 100 22.869 1.862 23.420 1.00 0.00 N ATOM 1577 CA LYS A 100 21.938 2.957 23.273 1.00 0.00 C ATOM 1578 C LYS A 100 20.773 2.658 22.330 1.00 0.00 C ATOM 1579 O LYS A 100 20.747 1.604 21.756 1.00 0.00 O ATOM 1580 CB LYS A 100 22.664 4.146 22.643 1.00 0.00 C ATOM 1581 CG LYS A 100 23.135 5.162 23.642 1.00 0.00 C ATOM 1582 CD LYS A 100 24.661 5.213 23.504 1.00 0.00 C ATOM 1583 CE LYS A 100 25.356 6.550 23.739 1.00 0.00 C ATOM 1584 NZ LYS A 100 24.886 7.187 24.948 1.00 0.00 N ATOM 0 H LYS A 100 23.658 1.931 22.777 1.00 0.00 H new ATOM 0 HA LYS A 100 21.552 3.147 24.275 1.00 0.00 H new ATOM 0 HB2 LYS A 100 23.521 3.780 22.079 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.997 4.632 21.930 1.00 0.00 H new ATOM 0 HG2 LYS A 100 22.692 6.138 23.444 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.844 4.879 24.654 1.00 0.00 H new ATOM 0 HD2 LYS A 100 25.084 4.490 24.201 1.00 0.00 H new ATOM 0 HD3 LYS A 100 24.917 4.875 22.500 1.00 0.00 H new ATOM 0 HE2 LYS A 100 26.433 6.395 23.804 1.00 0.00 H new ATOM 0 HE3 LYS A 100 25.179 7.208 22.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 25.654 7.752 25.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 24.082 7.808 24.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 24.583 6.461 25.628 1.00 0.00 H new ATOM 1598 N GLU A 101 19.953 3.685 22.246 1.00 0.00 N ATOM 1599 CA GLU A 101 18.831 3.531 21.341 1.00 0.00 C ATOM 1600 C GLU A 101 18.476 4.835 20.604 1.00 0.00 C ATOM 1601 O GLU A 101 17.380 5.280 20.761 1.00 0.00 O ATOM 1602 CB GLU A 101 17.670 2.785 21.961 1.00 0.00 C ATOM 1603 CG GLU A 101 17.957 1.309 22.354 1.00 0.00 C ATOM 1604 CD GLU A 101 16.874 0.614 23.148 1.00 0.00 C ATOM 1605 OE1 GLU A 101 15.757 1.091 23.309 1.00 0.00 O ATOM 1606 OE2 GLU A 101 17.330 -0.525 23.593 1.00 0.00 O ATOM 0 H GLU A 101 20.027 4.570 22.749 1.00 0.00 H new ATOM 0 HA GLU A 101 19.154 2.867 20.540 1.00 0.00 H new ATOM 0 HB2 GLU A 101 17.349 3.324 22.852 1.00 0.00 H new ATOM 0 HB3 GLU A 101 16.835 2.801 21.261 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.135 0.739 21.442 1.00 0.00 H new ATOM 0 HG3 GLU A 101 18.880 1.280 22.933 1.00 0.00 H new ATOM 1613 N LEU A 102 19.505 5.259 19.900 1.00 0.00 N ATOM 1614 CA LEU A 102 19.539 6.421 19.021 1.00 0.00 C ATOM 1615 C LEU A 102 18.108 6.344 18.431 1.00 0.00 C ATOM 1616 O LEU A 102 17.423 7.307 18.629 1.00 0.00 O ATOM 1617 CB LEU A 102 20.532 6.178 17.867 1.00 0.00 C ATOM 1618 CG LEU A 102 21.949 6.450 18.343 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.833 5.212 18.441 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.520 7.438 17.336 1.00 0.00 C ATOM 0 H LEU A 102 20.401 4.772 19.925 1.00 0.00 H new ATOM 0 HA LEU A 102 19.820 7.354 19.510 1.00 0.00 H new ATOM 0 HB2 LEU A 102 20.448 5.151 17.513 1.00 0.00 H new ATOM 0 HB3 LEU A 102 20.291 6.826 17.025 1.00 0.00 H new ATOM 0 HG LEU A 102 21.924 6.833 19.363 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.825 5.500 18.788 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.393 4.506 19.145 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.914 4.744 17.460 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.545 7.686 17.611 1.00 0.00 H new ATOM 0 HD22 LEU A 102 22.509 6.992 16.342 1.00 0.00 H new ATOM 0 HD23 LEU A 102 21.916 8.345 17.333 1.00 0.00 H new ATOM 1632 N ILE A 103 17.838 5.215 17.836 1.00 0.00 N ATOM 1633 CA ILE A 103 16.528 4.894 17.311 1.00 0.00 C ATOM 1634 C ILE A 103 16.203 5.711 16.084 1.00 0.00 C ATOM 1635 O ILE A 103 15.053 5.595 15.650 1.00 0.00 O ATOM 1636 CB ILE A 103 15.522 5.174 18.456 1.00 0.00 C ATOM 1637 CG1 ILE A 103 15.171 3.870 19.142 1.00 0.00 C ATOM 1638 CG2 ILE A 103 14.320 5.980 18.073 1.00 0.00 C ATOM 1639 CD1 ILE A 103 14.925 2.655 18.248 1.00 0.00 C ATOM 0 H ILE A 103 18.528 4.477 17.697 1.00 0.00 H new ATOM 0 HA ILE A 103 16.483 3.853 16.992 1.00 0.00 H new ATOM 0 HB ILE A 103 16.026 5.832 19.164 1.00 0.00 H new ATOM 0 HG12 ILE A 103 15.978 3.624 19.832 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.276 4.034 19.743 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.682 6.118 18.946 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.639 6.953 17.698 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.763 5.456 17.296 1.00 0.00 H new ATOM 0 HD11 ILE A 103 14.684 1.791 18.867 1.00 0.00 H new ATOM 0 HD12 ILE A 103 14.094 2.862 17.574 1.00 0.00 H new ATOM 0 HD13 ILE A 103 15.822 2.445 17.665 1.00 0.00 H new ATOM 1651 N ALA A 104 17.122 6.471 15.517 1.00 0.00 N ATOM 1652 CA ALA A 104 16.956 7.341 14.384 1.00 0.00 C ATOM 1653 C ALA A 104 15.631 7.164 13.727 1.00 0.00 C ATOM 1654 O ALA A 104 15.599 6.725 12.569 1.00 0.00 O ATOM 1655 CB ALA A 104 18.070 7.187 13.327 1.00 0.00 C ATOM 0 H ALA A 104 18.078 6.492 15.871 1.00 0.00 H new ATOM 0 HA ALA A 104 17.020 8.348 14.797 1.00 0.00 H new ATOM 0 HB1 ALA A 104 17.884 7.872 12.500 1.00 0.00 H new ATOM 0 HB2 ALA A 104 19.035 7.418 13.779 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.079 6.163 12.955 1.00 0.00 H new ATOM 1661 N VAL A 105 14.522 7.487 14.381 1.00 0.00 N ATOM 1662 CA VAL A 105 13.274 7.283 13.680 1.00 0.00 C ATOM 1663 C VAL A 105 13.052 8.593 12.908 1.00 0.00 C ATOM 1664 O VAL A 105 13.428 9.616 13.426 1.00 0.00 O ATOM 1665 CB VAL A 105 12.050 6.989 14.525 1.00 0.00 C ATOM 1666 CG1 VAL A 105 12.307 6.504 15.958 1.00 0.00 C ATOM 1667 CG2 VAL A 105 11.045 8.120 14.606 1.00 0.00 C ATOM 0 H VAL A 105 14.462 7.864 15.327 1.00 0.00 H new ATOM 0 HA VAL A 105 13.374 6.383 13.073 1.00 0.00 H new ATOM 0 HB VAL A 105 11.636 6.159 13.953 1.00 0.00 H new ATOM 0 HG11 VAL A 105 11.355 6.328 16.459 1.00 0.00 H new ATOM 0 HG12 VAL A 105 12.879 5.577 15.931 1.00 0.00 H new ATOM 0 HG13 VAL A 105 12.869 7.262 16.503 1.00 0.00 H new ATOM 0 HG21 VAL A 105 10.205 7.816 15.231 1.00 0.00 H new ATOM 0 HG22 VAL A 105 11.521 8.999 15.040 1.00 0.00 H new ATOM 0 HG23 VAL A 105 10.685 8.359 13.605 1.00 0.00 H new ATOM 1677 N ARG A 106 12.444 8.582 11.762 1.00 0.00 N ATOM 1678 CA ARG A 106 12.063 9.738 10.947 1.00 0.00 C ATOM 1679 C ARG A 106 10.541 9.542 10.817 1.00 0.00 C ATOM 1680 O ARG A 106 10.024 10.157 9.915 1.00 0.00 O ATOM 1681 CB ARG A 106 12.523 9.531 9.551 1.00 0.00 C ATOM 1682 CG ARG A 106 13.240 10.781 9.085 1.00 0.00 C ATOM 1683 CD ARG A 106 14.738 10.736 9.025 1.00 0.00 C ATOM 1684 NE ARG A 106 15.357 10.940 10.336 1.00 0.00 N ATOM 1685 CZ ARG A 106 15.949 10.012 11.069 1.00 0.00 C ATOM 1686 NH1 ARG A 106 16.081 8.746 10.744 1.00 0.00 N ATOM 1687 NH2 ARG A 106 16.455 10.398 12.246 1.00 0.00 N ATOM 0 H ARG A 106 12.171 7.704 11.321 1.00 0.00 H new ATOM 0 HA ARG A 106 12.434 10.675 11.363 1.00 0.00 H new ATOM 0 HB2 ARG A 106 13.190 8.671 9.497 1.00 0.00 H new ATOM 0 HB3 ARG A 106 11.674 9.318 8.901 1.00 0.00 H new ATOM 0 HG2 ARG A 106 12.870 11.030 8.090 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.954 11.599 9.746 1.00 0.00 H new ATOM 0 HD2 ARG A 106 15.054 9.773 8.623 1.00 0.00 H new ATOM 0 HD3 ARG A 106 15.094 11.501 8.335 1.00 0.00 H new ATOM 0 HE ARG A 106 15.329 11.885 10.719 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.709 8.406 9.857 1.00 0.00 H new ATOM 0 HH12 ARG A 106 16.556 8.103 11.378 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.374 11.371 12.541 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.921 9.719 12.848 1.00 0.00 H new ATOM 1701 N GLU A 107 10.038 8.716 11.693 1.00 0.00 N ATOM 1702 CA GLU A 107 8.640 8.429 11.865 1.00 0.00 C ATOM 1703 C GLU A 107 7.774 8.940 10.701 1.00 0.00 C ATOM 1704 O GLU A 107 7.082 8.264 9.966 1.00 0.00 O ATOM 1705 CB GLU A 107 8.270 9.401 13.036 1.00 0.00 C ATOM 1706 CG GLU A 107 8.093 8.675 14.372 1.00 0.00 C ATOM 1707 CD GLU A 107 6.832 8.925 15.191 1.00 0.00 C ATOM 1708 OE1 GLU A 107 5.703 8.821 14.542 1.00 0.00 O ATOM 1709 OE2 GLU A 107 6.912 9.204 16.377 1.00 0.00 O ATOM 0 H GLU A 107 10.627 8.195 12.343 1.00 0.00 H new ATOM 0 HA GLU A 107 8.479 7.358 11.985 1.00 0.00 H new ATOM 0 HB2 GLU A 107 9.051 10.155 13.137 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.348 9.928 12.788 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.149 7.605 14.174 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.948 8.928 14.999 1.00 0.00 H new ATOM 1716 N ILE A 108 7.828 10.259 10.608 1.00 0.00 N ATOM 1717 CA ILE A 108 7.087 11.036 9.637 1.00 0.00 C ATOM 1718 C ILE A 108 5.590 10.914 9.943 1.00 0.00 C ATOM 1719 O ILE A 108 4.944 9.882 9.731 1.00 0.00 O ATOM 1720 CB ILE A 108 7.380 10.615 8.204 1.00 0.00 C ATOM 1721 CG1 ILE A 108 7.416 11.891 7.385 1.00 0.00 C ATOM 1722 CG2 ILE A 108 6.254 9.780 7.562 1.00 0.00 C ATOM 1723 CD1 ILE A 108 8.359 11.694 6.198 1.00 0.00 C ATOM 0 H ILE A 108 8.405 10.831 11.224 1.00 0.00 H new ATOM 0 HA ILE A 108 7.404 12.076 9.720 1.00 0.00 H new ATOM 0 HB ILE A 108 8.298 10.027 8.219 1.00 0.00 H new ATOM 0 HG12 ILE A 108 6.415 12.141 7.033 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.755 12.724 8.001 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.533 9.516 6.542 1.00 0.00 H new ATOM 0 HG22 ILE A 108 6.099 8.870 8.142 1.00 0.00 H new ATOM 0 HG23 ILE A 108 5.333 10.362 7.547 1.00 0.00 H new ATOM 0 HD11 ILE A 108 8.391 12.607 5.603 1.00 0.00 H new ATOM 0 HD12 ILE A 108 9.360 11.463 6.563 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.999 10.871 5.580 1.00 0.00 H new ATOM 1735 N SER A 109 5.029 12.004 10.467 1.00 0.00 N ATOM 1736 CA SER A 109 3.610 12.006 10.677 1.00 0.00 C ATOM 1737 C SER A 109 3.117 13.402 10.738 1.00 0.00 C ATOM 1738 O SER A 109 3.350 14.130 11.677 1.00 0.00 O ATOM 1739 CB SER A 109 3.249 11.206 11.922 1.00 0.00 C ATOM 1740 OG SER A 109 2.028 11.596 12.486 1.00 0.00 O ATOM 0 H SER A 109 5.522 12.855 10.739 1.00 0.00 H new ATOM 0 HA SER A 109 3.116 11.516 9.838 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.204 10.147 11.667 1.00 0.00 H new ATOM 0 HB3 SER A 109 4.039 11.322 12.664 1.00 0.00 H new ATOM 0 HG SER A 109 1.845 11.050 13.279 1.00 0.00 H new ATOM 1746 N GLY A 110 2.389 13.759 9.676 1.00 0.00 N ATOM 1747 CA GLY A 110 1.754 15.012 9.478 1.00 0.00 C ATOM 1748 C GLY A 110 2.749 16.142 9.361 1.00 0.00 C ATOM 1749 O GLY A 110 3.107 16.648 10.436 1.00 0.00 O ATOM 0 H GLY A 110 2.233 13.120 8.896 1.00 0.00 H new ATOM 0 HA2 GLY A 110 1.146 14.971 8.575 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.077 15.210 10.309 1.00 0.00 H new ATOM 1753 N ASN A 111 3.175 16.541 8.173 1.00 0.00 N ATOM 1754 CA ASN A 111 4.200 17.570 8.046 1.00 0.00 C ATOM 1755 C ASN A 111 5.370 17.050 8.867 1.00 0.00 C ATOM 1756 O ASN A 111 5.352 17.245 10.086 1.00 0.00 O ATOM 1757 CB ASN A 111 3.833 18.998 8.457 1.00 0.00 C ATOM 1758 CG ASN A 111 2.615 19.584 7.754 1.00 0.00 C ATOM 1759 OD1 ASN A 111 2.728 20.277 6.733 1.00 0.00 O ATOM 1760 ND2 ASN A 111 1.436 19.334 8.273 1.00 0.00 N ATOM 0 H ASN A 111 2.831 16.172 7.287 1.00 0.00 H new ATOM 0 HA ASN A 111 4.406 17.706 6.984 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.655 19.015 9.532 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.689 19.645 8.266 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.596 19.712 7.836 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.360 18.762 9.114 1.00 0.00 H new ATOM 1767 N GLU A 112 6.389 16.412 8.271 1.00 0.00 N ATOM 1768 CA GLU A 112 7.358 15.875 9.157 1.00 0.00 C ATOM 1769 C GLU A 112 8.489 15.082 8.546 1.00 0.00 C ATOM 1770 O GLU A 112 8.732 14.909 7.373 1.00 0.00 O ATOM 1771 CB GLU A 112 6.513 14.708 9.814 1.00 0.00 C ATOM 1772 CG GLU A 112 5.627 13.943 8.834 1.00 0.00 C ATOM 1773 CD GLU A 112 5.319 14.375 7.443 1.00 0.00 C ATOM 1774 OE1 GLU A 112 6.270 14.559 6.594 1.00 0.00 O ATOM 1775 OE2 GLU A 112 4.152 14.508 7.107 1.00 0.00 O ATOM 0 H GLU A 112 6.536 16.276 7.271 1.00 0.00 H new ATOM 0 HA GLU A 112 7.793 16.696 9.728 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.196 14.006 10.292 1.00 0.00 H new ATOM 0 HB3 GLU A 112 5.886 15.128 10.600 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.065 12.949 8.748 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.664 13.825 9.331 1.00 0.00 H new ATOM 1782 N LEU A 113 9.201 14.464 9.500 1.00 0.00 N ATOM 1783 CA LEU A 113 10.287 13.541 9.367 1.00 0.00 C ATOM 1784 C LEU A 113 10.544 13.139 10.844 1.00 0.00 C ATOM 1785 O LEU A 113 10.674 12.014 11.246 1.00 0.00 O ATOM 1786 CB LEU A 113 11.559 14.058 8.689 1.00 0.00 C ATOM 1787 CG LEU A 113 11.575 13.943 7.186 1.00 0.00 C ATOM 1788 CD1 LEU A 113 12.942 14.466 6.745 1.00 0.00 C ATOM 1789 CD2 LEU A 113 11.526 12.477 6.757 1.00 0.00 C ATOM 0 H LEU A 113 8.989 14.632 10.483 1.00 0.00 H new ATOM 0 HA LEU A 113 10.020 12.728 8.691 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.696 15.105 8.959 1.00 0.00 H new ATOM 0 HB3 LEU A 113 12.413 13.511 9.089 1.00 0.00 H new ATOM 0 HG LEU A 113 10.728 14.481 6.760 1.00 0.00 H new ATOM 0 HD11 LEU A 113 13.020 14.410 5.659 1.00 0.00 H new ATOM 0 HD12 LEU A 113 13.055 15.502 7.064 1.00 0.00 H new ATOM 0 HD13 LEU A 113 13.727 13.859 7.197 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.538 12.416 5.669 1.00 0.00 H new ATOM 0 HD22 LEU A 113 12.391 11.951 7.160 1.00 0.00 H new ATOM 0 HD23 LEU A 113 10.613 12.017 7.136 1.00 0.00 H new ATOM 1801 N ILE A 114 10.578 14.106 11.734 1.00 0.00 N ATOM 1802 CA ILE A 114 10.696 13.897 13.120 1.00 0.00 C ATOM 1803 C ILE A 114 11.992 13.316 13.601 1.00 0.00 C ATOM 1804 O ILE A 114 12.147 13.366 14.842 1.00 0.00 O ATOM 1805 CB ILE A 114 9.571 12.977 13.617 1.00 0.00 C ATOM 1806 CG1 ILE A 114 8.363 12.715 12.742 1.00 0.00 C ATOM 1807 CG2 ILE A 114 9.255 13.456 15.043 1.00 0.00 C ATOM 1808 CD1 ILE A 114 7.149 13.667 12.946 1.00 0.00 C ATOM 0 H ILE A 114 10.520 15.092 11.479 1.00 0.00 H new ATOM 0 HA ILE A 114 10.638 14.905 13.530 1.00 0.00 H new ATOM 0 HB ILE A 114 9.946 11.954 13.580 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.675 12.776 11.699 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.029 11.692 12.916 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.458 12.844 15.464 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.147 13.367 15.663 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.936 14.498 15.015 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.346 13.383 12.266 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.797 13.592 13.975 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.453 14.693 12.740 1.00 0.00 H new ATOM 1820 N GLN A 115 12.814 12.789 12.723 1.00 0.00 N ATOM 1821 CA GLN A 115 14.140 12.274 12.961 1.00 0.00 C ATOM 1822 C GLN A 115 14.385 11.889 14.386 1.00 0.00 C ATOM 1823 O GLN A 115 15.518 11.936 14.832 1.00 0.00 O ATOM 1824 CB GLN A 115 14.996 13.546 12.710 1.00 0.00 C ATOM 1825 CG GLN A 115 14.527 14.472 11.615 1.00 0.00 C ATOM 1826 CD GLN A 115 15.262 15.801 11.804 1.00 0.00 C ATOM 1827 OE1 GLN A 115 14.932 16.787 11.140 1.00 0.00 O ATOM 1828 NE2 GLN A 115 16.250 15.886 12.674 1.00 0.00 N ATOM 0 H GLN A 115 12.548 12.703 11.742 1.00 0.00 H new ATOM 0 HA GLN A 115 14.337 11.388 12.357 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.043 14.114 13.639 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.013 13.231 12.477 1.00 0.00 H new ATOM 0 HG2 GLN A 115 14.743 14.049 10.634 1.00 0.00 H new ATOM 0 HG3 GLN A 115 13.448 14.617 11.669 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.520 15.068 13.221 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.744 16.769 12.800 1.00 0.00 H new ATOM 1837 N THR A 116 13.364 11.490 15.105 1.00 0.00 N ATOM 1838 CA THR A 116 13.354 11.120 16.501 1.00 0.00 C ATOM 1839 C THR A 116 14.386 10.120 16.890 1.00 0.00 C ATOM 1840 O THR A 116 14.046 8.938 16.895 1.00 0.00 O ATOM 1841 CB THR A 116 11.949 10.551 16.837 1.00 0.00 C ATOM 1842 OG1 THR A 116 10.956 11.581 16.800 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.955 9.795 18.132 1.00 0.00 C ATOM 0 H THR A 116 12.435 11.409 14.691 1.00 0.00 H new ATOM 0 HA THR A 116 13.590 12.022 17.065 1.00 0.00 H new ATOM 0 HB THR A 116 11.682 9.829 16.066 1.00 0.00 H new ATOM 0 HG1 THR A 116 11.378 12.449 16.970 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.955 9.412 18.334 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.656 8.963 18.064 1.00 0.00 H new ATOM 0 HG23 THR A 116 12.259 10.460 18.940 1.00 0.00 H new ATOM 1851 N TYR A 117 15.607 10.543 17.221 1.00 0.00 N ATOM 1852 CA TYR A 117 16.523 9.571 17.691 1.00 0.00 C ATOM 1853 C TYR A 117 16.779 9.736 19.204 1.00 0.00 C ATOM 1854 O TYR A 117 17.564 10.611 19.630 1.00 0.00 O ATOM 1855 CB TYR A 117 17.921 9.659 17.067 1.00 0.00 C ATOM 1856 CG TYR A 117 18.325 10.405 15.818 1.00 0.00 C ATOM 1857 CD1 TYR A 117 18.143 11.766 15.683 1.00 0.00 C ATOM 1858 CD2 TYR A 117 18.920 9.758 14.731 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.525 12.435 14.532 1.00 0.00 C ATOM 1860 CE2 TYR A 117 19.323 10.385 13.550 1.00 0.00 C ATOM 1861 CZ TYR A 117 19.119 11.763 13.450 1.00 0.00 C ATOM 1862 OH TYR A 117 19.515 12.380 12.293 1.00 0.00 O ATOM 0 H TYR A 117 15.948 11.503 17.169 1.00 0.00 H new ATOM 0 HA TYR A 117 16.046 8.628 17.423 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.563 10.052 17.856 1.00 0.00 H new ATOM 0 HB3 TYR A 117 18.224 8.626 16.895 1.00 0.00 H new ATOM 0 HD1 TYR A 117 17.693 12.322 16.492 1.00 0.00 H new ATOM 0 HD2 TYR A 117 19.080 8.693 14.811 1.00 0.00 H new ATOM 0 HE1 TYR A 117 18.362 13.501 14.464 1.00 0.00 H new ATOM 0 HE2 TYR A 117 19.775 9.825 12.745 1.00 0.00 H new ATOM 0 HH TYR A 117 20.171 13.077 12.502 1.00 0.00 H new ATOM 1872 N THR A 118 16.133 8.871 19.967 1.00 0.00 N ATOM 1873 CA THR A 118 16.100 8.849 21.413 1.00 0.00 C ATOM 1874 C THR A 118 16.981 7.814 22.005 1.00 0.00 C ATOM 1875 O THR A 118 16.508 6.834 22.588 1.00 0.00 O ATOM 1876 CB THR A 118 14.692 8.622 22.018 1.00 0.00 C ATOM 1877 OG1 THR A 118 13.797 9.200 21.046 1.00 0.00 O ATOM 1878 CG2 THR A 118 14.533 9.377 23.294 1.00 0.00 C ATOM 0 H THR A 118 15.581 8.115 19.561 1.00 0.00 H new ATOM 0 HA THR A 118 16.452 9.849 21.666 1.00 0.00 H new ATOM 0 HB THR A 118 14.510 7.568 22.227 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.872 9.098 21.352 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.536 9.201 23.699 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.281 9.040 24.012 1.00 0.00 H new ATOM 0 HG23 THR A 118 14.665 10.442 23.105 1.00 0.00 H new ATOM 1886 N TYR A 119 18.316 7.973 21.948 1.00 0.00 N ATOM 1887 CA TYR A 119 19.272 7.073 22.512 1.00 0.00 C ATOM 1888 C TYR A 119 19.246 7.146 24.045 1.00 0.00 C ATOM 1889 O TYR A 119 19.860 6.233 24.596 1.00 0.00 O ATOM 1890 CB TYR A 119 20.736 7.430 22.124 1.00 0.00 C ATOM 1891 CG TYR A 119 21.342 8.557 22.885 1.00 0.00 C ATOM 1892 CD1 TYR A 119 20.615 9.640 23.369 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.709 8.557 23.151 1.00 0.00 C ATOM 1894 CE1 TYR A 119 21.144 10.683 24.083 1.00 0.00 C ATOM 1895 CE2 TYR A 119 23.282 9.606 23.876 1.00 0.00 C ATOM 1896 CZ TYR A 119 22.502 10.642 24.330 1.00 0.00 C ATOM 1897 OH TYR A 119 23.071 11.655 25.041 1.00 0.00 O ATOM 0 H TYR A 119 18.750 8.771 21.484 1.00 0.00 H new ATOM 0 HA TYR A 119 18.996 6.091 22.128 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.357 6.545 22.263 1.00 0.00 H new ATOM 0 HB3 TYR A 119 20.763 7.675 21.062 1.00 0.00 H new ATOM 0 HD1 TYR A 119 19.554 9.660 23.167 1.00 0.00 H new ATOM 0 HD2 TYR A 119 23.327 7.745 22.797 1.00 0.00 H new ATOM 0 HE1 TYR A 119 20.529 11.498 24.435 1.00 0.00 H new ATOM 0 HE2 TYR A 119 24.343 9.602 24.080 1.00 0.00 H new ATOM 0 HH TYR A 119 22.465 12.425 25.055 1.00 0.00 H new ATOM 1907 N GLU A 120 18.603 8.135 24.631 1.00 0.00 N ATOM 1908 CA GLU A 120 18.606 8.216 26.091 1.00 0.00 C ATOM 1909 C GLU A 120 17.824 9.305 26.746 1.00 0.00 C ATOM 1910 O GLU A 120 17.928 9.671 27.916 1.00 0.00 O ATOM 1911 CB GLU A 120 20.113 8.185 26.491 1.00 0.00 C ATOM 1912 CG GLU A 120 20.537 9.330 27.416 1.00 0.00 C ATOM 1913 CD GLU A 120 20.365 9.019 28.897 1.00 0.00 C ATOM 1914 OE1 GLU A 120 20.370 7.918 29.430 1.00 0.00 O ATOM 1915 OE2 GLU A 120 20.198 10.130 29.533 1.00 0.00 O ATOM 0 H GLU A 120 18.088 8.871 24.149 1.00 0.00 H new ATOM 0 HA GLU A 120 18.038 7.372 26.482 1.00 0.00 H new ATOM 0 HB2 GLU A 120 20.328 7.236 26.982 1.00 0.00 H new ATOM 0 HB3 GLU A 120 20.719 8.220 25.586 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.582 9.572 27.224 1.00 0.00 H new ATOM 0 HG3 GLU A 120 19.954 10.218 27.171 1.00 0.00 H new ATOM 1922 N GLY A 121 16.941 9.918 25.990 1.00 0.00 N ATOM 1923 CA GLY A 121 16.139 11.021 26.487 1.00 0.00 C ATOM 1924 C GLY A 121 16.515 12.365 25.866 1.00 0.00 C ATOM 1925 O GLY A 121 16.275 13.406 26.440 1.00 0.00 O ATOM 0 H GLY A 121 16.757 9.670 25.018 1.00 0.00 H new ATOM 0 HA2 GLY A 121 15.087 10.817 26.286 1.00 0.00 H new ATOM 0 HA3 GLY A 121 16.250 11.084 27.569 1.00 0.00 H new ATOM 1929 N VAL A 122 17.126 12.229 24.659 1.00 0.00 N ATOM 1930 CA VAL A 122 17.582 13.361 23.917 1.00 0.00 C ATOM 1931 C VAL A 122 17.254 13.213 22.428 1.00 0.00 C ATOM 1932 O VAL A 122 18.085 13.685 21.645 1.00 0.00 O ATOM 1933 CB VAL A 122 19.118 13.534 24.093 1.00 0.00 C ATOM 1934 CG1 VAL A 122 19.595 14.908 23.654 1.00 0.00 C ATOM 1935 CG2 VAL A 122 19.518 13.359 25.552 1.00 0.00 C ATOM 0 H VAL A 122 17.299 11.331 24.207 1.00 0.00 H new ATOM 0 HA VAL A 122 17.068 14.242 24.301 1.00 0.00 H new ATOM 0 HB VAL A 122 19.580 12.771 23.467 1.00 0.00 H new ATOM 0 HG11 VAL A 122 20.673 14.981 23.796 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.356 15.057 22.601 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.098 15.673 24.250 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.596 13.484 25.651 1.00 0.00 H new ATOM 0 HG22 VAL A 122 19.008 14.106 26.161 1.00 0.00 H new ATOM 0 HG23 VAL A 122 19.236 12.362 25.889 1.00 0.00 H new ATOM 1945 N GLU A 123 16.139 12.628 22.075 1.00 0.00 N ATOM 1946 CA GLU A 123 15.623 12.468 20.756 1.00 0.00 C ATOM 1947 C GLU A 123 16.076 13.656 19.929 1.00 0.00 C ATOM 1948 O GLU A 123 15.760 14.762 20.347 1.00 0.00 O ATOM 1949 CB GLU A 123 14.066 12.677 20.753 1.00 0.00 C ATOM 1950 CG GLU A 123 13.527 12.418 19.313 1.00 0.00 C ATOM 1951 CD GLU A 123 12.049 12.530 19.178 1.00 0.00 C ATOM 1952 OE1 GLU A 123 11.473 11.674 19.996 1.00 0.00 O ATOM 1953 OE2 GLU A 123 11.306 13.265 18.535 1.00 0.00 O ATOM 0 H GLU A 123 15.519 12.217 22.773 1.00 0.00 H new ATOM 0 HA GLU A 123 15.938 11.489 20.396 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.593 11.997 21.461 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.821 13.690 21.071 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.996 13.126 18.630 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.833 11.421 18.998 1.00 0.00 H new ATOM 1960 N ALA A 124 16.798 13.374 18.835 1.00 0.00 N ATOM 1961 CA ALA A 124 17.322 14.482 18.027 1.00 0.00 C ATOM 1962 C ALA A 124 16.556 14.678 16.758 1.00 0.00 C ATOM 1963 O ALA A 124 16.563 13.983 15.785 1.00 0.00 O ATOM 1964 CB ALA A 124 18.803 14.364 17.715 1.00 0.00 C ATOM 0 H ALA A 124 17.024 12.437 18.502 1.00 0.00 H new ATOM 0 HA ALA A 124 17.189 15.361 18.658 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.118 15.218 17.115 1.00 0.00 H new ATOM 0 HB2 ALA A 124 19.370 14.345 18.645 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.986 13.444 17.160 1.00 0.00 H new ATOM 1970 N LYS A 125 15.791 15.783 16.757 1.00 0.00 N ATOM 1971 CA LYS A 125 14.979 16.030 15.571 1.00 0.00 C ATOM 1972 C LYS A 125 14.781 17.490 15.427 1.00 0.00 C ATOM 1973 O LYS A 125 15.407 18.243 16.209 1.00 0.00 O ATOM 1974 CB LYS A 125 13.538 15.445 15.746 1.00 0.00 C ATOM 1975 CG LYS A 125 13.483 14.547 16.963 1.00 0.00 C ATOM 1976 CD LYS A 125 13.255 15.390 18.248 1.00 0.00 C ATOM 1977 CE LYS A 125 12.161 16.466 18.160 1.00 0.00 C ATOM 1978 NZ LYS A 125 12.087 17.101 19.489 1.00 0.00 N ATOM 0 H LYS A 125 15.722 16.470 17.508 1.00 0.00 H new ATOM 0 HA LYS A 125 15.490 15.576 14.722 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.818 16.257 15.851 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.256 14.882 14.856 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.679 13.820 16.850 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.412 13.984 17.050 1.00 0.00 H new ATOM 0 HD2 LYS A 125 13.006 14.712 19.064 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.195 15.875 18.512 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.402 17.201 17.392 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.203 16.023 17.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 11.356 17.841 19.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 11.846 16.385 20.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 13.007 17.526 19.722 1.00 0.00 H new ATOM 1992 N ARG A 126 13.923 17.846 14.487 1.00 0.00 N ATOM 1993 CA ARG A 126 13.587 19.261 14.280 1.00 0.00 C ATOM 1994 C ARG A 126 12.703 19.188 13.053 1.00 0.00 C ATOM 1995 O ARG A 126 11.695 19.841 13.096 1.00 0.00 O ATOM 1996 CB ARG A 126 14.667 20.244 14.020 1.00 0.00 C ATOM 1997 CG ARG A 126 15.056 21.010 15.243 1.00 0.00 C ATOM 1998 CD ARG A 126 13.852 21.917 15.450 1.00 0.00 C ATOM 1999 NE ARG A 126 14.255 23.299 15.306 1.00 0.00 N ATOM 2000 CZ ARG A 126 14.831 24.085 16.178 1.00 0.00 C ATOM 2001 NH1 ARG A 126 15.146 23.691 17.418 1.00 0.00 N ATOM 2002 NH2 ARG A 126 15.127 25.322 15.846 1.00 0.00 N ATOM 0 H ARG A 126 13.449 17.195 13.861 1.00 0.00 H new ATOM 0 HA ARG A 126 13.175 19.646 15.213 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.541 19.723 13.629 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.340 20.941 13.248 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.224 20.355 16.098 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.973 21.579 15.092 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.074 21.677 14.725 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.426 21.753 16.440 1.00 0.00 H new ATOM 0 HE ARG A 126 14.063 23.719 14.397 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.937 22.739 17.719 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.595 24.343 18.062 1.00 0.00 H new ATOM 0 HH21 ARG A 126 14.907 25.666 14.911 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.576 25.938 16.523 1.00 0.00 H new ATOM 2016 N ILE A 127 13.187 18.420 12.106 1.00 0.00 N ATOM 2017 CA ILE A 127 12.539 18.080 10.887 1.00 0.00 C ATOM 2018 C ILE A 127 13.236 18.474 9.647 1.00 0.00 C ATOM 2019 O ILE A 127 14.088 19.353 9.563 1.00 0.00 O ATOM 2020 CB ILE A 127 11.066 18.571 10.770 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.196 17.581 11.535 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.495 18.714 9.358 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.642 17.161 12.929 1.00 0.00 C ATOM 0 H ILE A 127 14.110 17.992 12.185 1.00 0.00 H new ATOM 0 HA ILE A 127 12.563 16.993 10.964 1.00 0.00 H new ATOM 0 HB ILE A 127 11.064 19.584 11.172 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.198 18.011 11.620 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.105 16.680 10.929 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.464 19.063 9.416 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.090 19.434 8.796 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.524 17.748 8.854 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.922 16.455 13.344 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.622 16.688 12.870 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.701 18.039 13.572 1.00 0.00 H new ATOM 2035 N PHE A 128 12.765 17.735 8.614 1.00 0.00 N ATOM 2036 CA PHE A 128 13.056 17.773 7.262 1.00 0.00 C ATOM 2037 C PHE A 128 13.188 19.170 6.636 1.00 0.00 C ATOM 2038 O PHE A 128 12.481 20.057 7.086 1.00 0.00 O ATOM 2039 CB PHE A 128 11.889 17.187 6.420 1.00 0.00 C ATOM 2040 CG PHE A 128 10.669 18.115 6.236 1.00 0.00 C ATOM 2041 CD1 PHE A 128 10.659 19.264 5.486 1.00 0.00 C ATOM 2042 CD2 PHE A 128 9.434 17.845 6.849 1.00 0.00 C ATOM 2043 CE1 PHE A 128 9.526 20.065 5.353 1.00 0.00 C ATOM 2044 CE2 PHE A 128 8.298 18.601 6.747 1.00 0.00 C ATOM 2045 CZ PHE A 128 8.334 19.749 5.975 1.00 0.00 C ATOM 0 H PHE A 128 12.074 17.008 8.800 1.00 0.00 H new ATOM 0 HA PHE A 128 14.000 17.229 7.232 1.00 0.00 H new ATOM 0 HB2 PHE A 128 12.273 16.921 5.435 1.00 0.00 H new ATOM 0 HB3 PHE A 128 11.553 16.263 6.891 1.00 0.00 H new ATOM 0 HD1 PHE A 128 11.565 19.560 4.978 1.00 0.00 H new ATOM 0 HD2 PHE A 128 9.376 16.956 7.459 1.00 0.00 H new ATOM 0 HE1 PHE A 128 9.582 20.957 4.747 1.00 0.00 H new ATOM 0 HE2 PHE A 128 7.393 18.308 7.258 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.461 20.375 5.863 1.00 0.00 H new ATOM 2055 N LYS A 129 14.013 19.088 5.638 1.00 0.00 N ATOM 2056 CA LYS A 129 14.343 20.194 4.790 1.00 0.00 C ATOM 2057 C LYS A 129 13.747 19.915 3.421 1.00 0.00 C ATOM 2058 O LYS A 129 13.936 20.753 2.585 1.00 0.00 O ATOM 2059 CB LYS A 129 15.690 20.820 4.844 1.00 0.00 C ATOM 2060 CG LYS A 129 15.543 22.350 4.719 1.00 0.00 C ATOM 2061 CD LYS A 129 15.695 22.929 3.338 1.00 0.00 C ATOM 2062 CE LYS A 129 14.457 23.712 2.912 1.00 0.00 C ATOM 2063 NZ LYS A 129 14.480 24.343 1.578 1.00 0.00 N ATOM 0 H LYS A 129 14.490 18.224 5.383 1.00 0.00 H new ATOM 0 HA LYS A 129 13.878 21.072 5.238 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.185 20.566 5.781 1.00 0.00 H new ATOM 0 HB3 LYS A 129 16.315 20.436 4.038 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.561 22.631 5.100 1.00 0.00 H new ATOM 0 HG3 LYS A 129 16.283 22.818 5.368 1.00 0.00 H new ATOM 0 HD2 LYS A 129 16.566 23.584 3.312 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.880 22.125 2.625 1.00 0.00 H new ATOM 0 HE2 LYS A 129 13.602 23.038 2.951 1.00 0.00 H new ATOM 0 HE3 LYS A 129 14.281 24.493 3.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 13.582 24.841 1.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.266 25.022 1.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.608 23.611 0.850 1.00 0.00 H new ATOM 2077 N LYS A 130 13.017 18.845 3.453 1.00 0.00 N ATOM 2078 CA LYS A 130 12.347 18.299 2.318 1.00 0.00 C ATOM 2079 C LYS A 130 12.757 18.906 0.998 1.00 0.00 C ATOM 2080 O LYS A 130 13.068 20.092 0.773 1.00 0.00 O ATOM 2081 CB LYS A 130 10.818 18.336 2.406 1.00 0.00 C ATOM 2082 CG LYS A 130 10.058 18.377 1.052 1.00 0.00 C ATOM 2083 CD LYS A 130 9.459 19.721 0.672 1.00 0.00 C ATOM 2084 CE LYS A 130 7.930 19.585 0.483 1.00 0.00 C ATOM 2085 NZ LYS A 130 7.563 18.347 -0.242 1.00 0.00 N ATOM 0 H LYS A 130 12.866 18.307 4.306 1.00 0.00 H new ATOM 0 HA LYS A 130 12.677 17.260 2.345 1.00 0.00 H new ATOM 0 HB2 LYS A 130 10.485 17.459 2.960 1.00 0.00 H new ATOM 0 HB3 LYS A 130 10.529 19.210 2.989 1.00 0.00 H new ATOM 0 HG2 LYS A 130 10.743 18.069 0.262 1.00 0.00 H new ATOM 0 HG3 LYS A 130 9.257 17.639 1.084 1.00 0.00 H new ATOM 0 HD2 LYS A 130 9.674 20.456 1.447 1.00 0.00 H new ATOM 0 HD3 LYS A 130 9.916 20.085 -0.248 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.443 19.590 1.458 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.555 20.449 -0.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.737 18.531 -0.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 8.362 18.041 -0.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.332 17.599 0.443 1.00 0.00 H new ATOM 2099 N GLU A 131 12.675 17.960 0.032 1.00 0.00 N ATOM 2100 CA GLU A 131 13.104 18.288 -1.361 1.00 0.00 C ATOM 2101 C GLU A 131 12.318 17.716 -2.496 1.00 0.00 C ATOM 2102 O GLU A 131 12.765 17.501 -3.620 1.00 0.00 O ATOM 2103 CB GLU A 131 14.643 18.267 -1.270 1.00 0.00 C ATOM 2104 CG GLU A 131 15.581 18.996 -2.216 1.00 0.00 C ATOM 2105 CD GLU A 131 15.430 18.667 -3.717 1.00 0.00 C ATOM 2106 OE1 GLU A 131 14.614 19.367 -4.429 1.00 0.00 O ATOM 2107 OE2 GLU A 131 16.109 17.715 -4.235 1.00 0.00 O ATOM 2108 OXT GLU A 131 11.333 18.686 -1.770 1.00 0.00 O ATOM 0 H GLU A 131 12.335 17.009 0.172 1.00 0.00 H new ATOM 0 HA GLU A 131 12.809 19.270 -1.731 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.889 18.625 -0.270 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.931 17.217 -1.313 1.00 0.00 H new ATOM 0 HG2 GLU A 131 15.435 20.068 -2.084 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.606 18.775 -1.919 1.00 0.00 H new