USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1045 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 120 CYS SG : rot 56:sc= -6.16! USER MOD Set 1.2: A 127 CYS SG : rot 97:sc= -9.39! USER MOD Set 2.1: A 97 HIS : no HD1:sc= 0.722 K(o=0.72,f=-3.4!) USER MOD Set 2.2: A 106 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 67 CYS SG : rot -71:sc= 0.149 USER MOD Set 3.2: A 87 CYS SG : rot 85:sc= -0.775 USER MOD Set 4.1: A 83 THR OG1 : rot -47:sc= 0.536 USER MOD Set 4.2: A 85 THR OG1 : rot 77:sc= 1.15 USER MOD Set 5.1: A 55 LYS NZ :NH3+ 131:sc= 1.27 (180deg=0) USER MOD Set 5.2: A 64 GLN : amide:sc= 1.03 K(o=2.3,f=-6.8!) USER MOD Set 6.1: A 43 CYS SG : rot 140:sc= -0.365 USER MOD Set 6.2: A 56 THR OG1 : rot 3:sc= 0.588 USER MOD Set 7.1: A 22 TYR OH : rot 16:sc= 1.28 USER MOD Set 7.2: A 105 SER OG : rot 14:sc= 2.31 USER MOD Single : A 5 GLN : amide:sc= 0.216 X(o=0.22,f=0) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 41:sc= 0.74 USER MOD Single : A 17 LYS NZ :NH3+ -173:sc= 1.1 (180deg=0.861) USER MOD Single : A 23 MET CE :methyl -167:sc= 0 (180deg=-0.306) USER MOD Single : A 24 LYS NZ :NH3+ -178:sc= 1.17 (180deg=1.02) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 178:sc= 0 (180deg=-0.00264) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -3:sc= 0.719 USER MOD Single : A 47 CYS SG : rot -55:sc= -2.36 USER MOD Single : A 50 LYS NZ :NH3+ 172:sc= 2.16 (180deg=1.89) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -139:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 70:sc= 1.54 USER MOD Single : A 63 THR OG1 : rot 180:sc=-0.00506 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 158:sc= 0.605 (180deg=0.205) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot -82:sc= 1.16 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 1.1 K(o=1.1,f=-0.1) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 1.83 K(o=1.8,f=-8.5!) USER MOD Single : A 98 GLN : amide:sc= 0.993 K(o=0.99,f=-1.4!) USER MOD Single : A 103 LYS NZ :NH3+ -163:sc= 2.32 (180deg=1.11) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 166:sc= 1.08 (180deg=0.544) USER MOD Single : A 112 LYS NZ :NH3+ 147:sc= 1.27 (180deg=0.336!) USER MOD Single : A 115 LYS NZ :NH3+ -170:sc= 0.883 (180deg=0.81) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0.676 K(o=0.68,f=-0.0016) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 THR OG1 : rot 40:sc= 0.639 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 175:sc= 1.75 (180deg=1.47) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 -0.328 -1.593 -3.099 1.00 0.00 N ATOM 15 CA VAL A 4 0.723 -1.329 -4.138 1.00 0.00 C ATOM 16 C VAL A 4 2.152 -1.899 -3.830 1.00 0.00 C ATOM 17 O VAL A 4 2.793 -2.443 -4.733 1.00 0.00 O ATOM 18 CB VAL A 4 0.698 0.173 -4.583 1.00 0.00 C ATOM 19 CG1 VAL A 4 1.338 1.182 -3.602 1.00 0.00 C ATOM 20 CG2 VAL A 4 1.317 0.365 -5.985 1.00 0.00 C ATOM 0 HA VAL A 4 0.444 -1.930 -5.004 1.00 0.00 H new ATOM 0 HB VAL A 4 -0.367 0.406 -4.597 1.00 0.00 H new ATOM 0 HG11 VAL A 4 1.263 2.188 -4.014 1.00 0.00 H new ATOM 0 HG12 VAL A 4 0.816 1.141 -2.646 1.00 0.00 H new ATOM 0 HG13 VAL A 4 2.388 0.929 -3.453 1.00 0.00 H new ATOM 0 HG21 VAL A 4 1.281 1.420 -6.257 1.00 0.00 H new ATOM 0 HG22 VAL A 4 2.354 0.028 -5.974 1.00 0.00 H new ATOM 0 HG23 VAL A 4 0.754 -0.217 -6.714 1.00 0.00 H new ATOM 30 N GLN A 5 2.624 -1.834 -2.569 1.00 0.00 N ATOM 31 CA GLN A 5 3.816 -2.596 -2.112 1.00 0.00 C ATOM 32 C GLN A 5 3.641 -4.152 -2.169 1.00 0.00 C ATOM 33 O GLN A 5 4.573 -4.816 -2.613 1.00 0.00 O ATOM 34 CB GLN A 5 4.228 -2.037 -0.723 1.00 0.00 C ATOM 35 CG GLN A 5 5.652 -2.423 -0.235 1.00 0.00 C ATOM 36 CD GLN A 5 5.754 -3.664 0.659 1.00 0.00 C ATOM 37 OE1 GLN A 5 5.729 -3.591 1.882 1.00 0.00 O ATOM 38 NE2 GLN A 5 5.878 -4.833 0.085 1.00 0.00 N ATOM 0 H GLN A 5 2.199 -1.260 -1.841 1.00 0.00 H new ATOM 0 HA GLN A 5 4.638 -2.443 -2.811 1.00 0.00 H new ATOM 0 HB2 GLN A 5 4.157 -0.950 -0.754 1.00 0.00 H new ATOM 0 HB3 GLN A 5 3.505 -2.382 0.016 1.00 0.00 H new ATOM 0 HG2 GLN A 5 6.282 -2.580 -1.110 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.068 -1.575 0.309 1.00 0.00 H new ATOM 0 HE21 GLN A 5 5.900 -4.902 -0.932 1.00 0.00 H new ATOM 0 HE22 GLN A 5 5.953 -5.676 0.655 1.00 0.00 H new ATOM 47 N GLN A 6 2.492 -4.746 -1.780 1.00 0.00 N ATOM 48 CA GLN A 6 2.209 -6.205 -1.999 1.00 0.00 C ATOM 49 C GLN A 6 2.261 -6.752 -3.473 1.00 0.00 C ATOM 50 O GLN A 6 2.522 -7.944 -3.657 1.00 0.00 O ATOM 51 CB GLN A 6 0.846 -6.554 -1.342 1.00 0.00 C ATOM 52 CG GLN A 6 0.845 -6.575 0.209 1.00 0.00 C ATOM 53 CD GLN A 6 -0.553 -6.709 0.815 1.00 0.00 C ATOM 54 OE1 GLN A 6 -1.246 -5.723 1.044 1.00 0.00 O ATOM 55 NE2 GLN A 6 -1.016 -7.906 1.084 1.00 0.00 N ATOM 0 H GLN A 6 1.736 -4.247 -1.311 1.00 0.00 H new ATOM 0 HA GLN A 6 3.049 -6.715 -1.528 1.00 0.00 H new ATOM 0 HB2 GLN A 6 0.103 -5.832 -1.680 1.00 0.00 H new ATOM 0 HB3 GLN A 6 0.527 -7.532 -1.703 1.00 0.00 H new ATOM 0 HG2 GLN A 6 1.463 -7.404 0.554 1.00 0.00 H new ATOM 0 HG3 GLN A 6 1.306 -5.659 0.577 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -0.443 -8.729 0.895 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -1.949 -8.014 1.482 1.00 0.00 H new ATOM 64 N LEU A 7 2.074 -5.910 -4.508 1.00 0.00 N ATOM 65 CA LEU A 7 2.434 -6.255 -5.916 1.00 0.00 C ATOM 66 C LEU A 7 3.954 -6.490 -6.248 1.00 0.00 C ATOM 67 O LEU A 7 4.225 -6.914 -7.372 1.00 0.00 O ATOM 68 CB LEU A 7 1.879 -5.138 -6.855 1.00 0.00 C ATOM 69 CG LEU A 7 0.346 -4.913 -6.955 1.00 0.00 C ATOM 70 CD1 LEU A 7 0.076 -3.649 -7.785 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.393 -6.078 -7.635 1.00 0.00 C ATOM 0 H LEU A 7 1.674 -4.978 -4.404 1.00 0.00 H new ATOM 0 HA LEU A 7 1.981 -7.233 -6.076 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.327 -4.195 -6.541 1.00 0.00 H new ATOM 0 HB3 LEU A 7 2.245 -5.346 -7.861 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.023 -4.825 -5.933 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.999 -3.485 -7.859 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.541 -2.790 -7.302 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.494 -3.774 -8.784 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.460 -5.859 -7.674 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.012 -6.208 -8.648 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.231 -6.993 -7.066 1.00 0.00 H new ATOM 83 N GLU A 8 4.939 -6.268 -5.349 1.00 0.00 N ATOM 84 CA GLU A 8 6.360 -6.667 -5.586 1.00 0.00 C ATOM 85 C GLU A 8 6.610 -8.212 -5.715 1.00 0.00 C ATOM 86 O GLU A 8 5.787 -9.030 -5.296 1.00 0.00 O ATOM 87 CB GLU A 8 7.276 -5.969 -4.532 1.00 0.00 C ATOM 88 CG GLU A 8 7.234 -6.444 -3.049 1.00 0.00 C ATOM 89 CD GLU A 8 7.853 -7.786 -2.698 1.00 0.00 C ATOM 90 OE1 GLU A 8 8.974 -8.093 -3.147 1.00 0.00 O ATOM 91 OE2 GLU A 8 7.194 -8.560 -1.970 1.00 0.00 O ATOM 0 H GLU A 8 4.783 -5.814 -4.449 1.00 0.00 H new ATOM 0 HA GLU A 8 6.631 -6.310 -6.580 1.00 0.00 H new ATOM 0 HB2 GLU A 8 8.305 -6.066 -4.878 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.035 -4.906 -4.542 1.00 0.00 H new ATOM 0 HG2 GLU A 8 7.727 -5.683 -2.444 1.00 0.00 H new ATOM 0 HG3 GLU A 8 6.189 -6.470 -2.739 1.00 0.00 H new ATOM 98 N GLY A 9 7.750 -8.609 -6.302 1.00 0.00 N ATOM 99 CA GLY A 9 8.183 -10.034 -6.349 1.00 0.00 C ATOM 100 C GLY A 9 8.486 -10.583 -7.755 1.00 0.00 C ATOM 101 O GLY A 9 8.161 -9.976 -8.778 1.00 0.00 O ATOM 0 H GLY A 9 8.399 -7.966 -6.756 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.075 -10.146 -5.733 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.404 -10.648 -5.897 1.00 0.00 H new ATOM 105 N ARG A 10 9.086 -11.783 -7.791 1.00 0.00 N ATOM 106 CA ARG A 10 9.366 -12.512 -9.062 1.00 0.00 C ATOM 107 C ARG A 10 8.111 -13.314 -9.531 1.00 0.00 C ATOM 108 O ARG A 10 7.876 -14.430 -9.064 1.00 0.00 O ATOM 109 CB ARG A 10 10.635 -13.378 -8.820 1.00 0.00 C ATOM 110 CG ARG A 10 11.102 -14.235 -10.025 1.00 0.00 C ATOM 111 CD ARG A 10 12.454 -14.953 -9.815 1.00 0.00 C ATOM 112 NE ARG A 10 13.608 -14.069 -10.149 1.00 0.00 N ATOM 113 CZ ARG A 10 14.136 -13.908 -11.368 1.00 0.00 C ATOM 114 NH1 ARG A 10 13.766 -14.561 -12.441 1.00 0.00 N ATOM 115 NH2 ARG A 10 15.083 -13.029 -11.520 1.00 0.00 N ATOM 0 H ARG A 10 9.392 -12.281 -6.955 1.00 0.00 H new ATOM 0 HA ARG A 10 9.571 -11.832 -9.889 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.452 -12.719 -8.528 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.444 -14.042 -7.977 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.338 -14.982 -10.241 1.00 0.00 H new ATOM 0 HG3 ARG A 10 11.178 -13.594 -10.903 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.535 -15.280 -8.778 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.490 -15.848 -10.436 1.00 0.00 H new ATOM 0 HE ARG A 10 14.030 -13.543 -9.384 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.020 -15.255 -12.384 1.00 0.00 H new ATOM 0 HH12 ARG A 10 14.223 -14.376 -13.334 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.405 -12.483 -10.721 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.503 -12.886 -12.438 1.00 0.00 H new ATOM 129 N TRP A 11 7.300 -12.751 -10.440 1.00 0.00 N ATOM 130 CA TRP A 11 5.978 -13.337 -10.796 1.00 0.00 C ATOM 131 C TRP A 11 6.081 -14.205 -12.095 1.00 0.00 C ATOM 132 O TRP A 11 6.077 -13.677 -13.207 1.00 0.00 O ATOM 133 CB TRP A 11 4.925 -12.200 -10.902 1.00 0.00 C ATOM 134 CG TRP A 11 4.614 -11.401 -9.629 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.055 -10.091 -9.376 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.780 -11.723 -8.570 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.501 -9.577 -8.194 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.720 -10.601 -7.706 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.010 -12.879 -8.293 1.00 0.00 C ATOM 140 CZ2 TRP A 11 2.885 -10.620 -6.565 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.206 -12.886 -7.150 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.143 -11.771 -6.304 1.00 0.00 C ATOM 0 H TRP A 11 7.526 -11.894 -10.945 1.00 0.00 H new ATOM 0 HA TRP A 11 5.649 -14.018 -10.011 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.263 -11.499 -11.665 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.993 -12.637 -11.261 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.737 -9.547 -10.013 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.644 -8.653 -7.787 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.043 -13.735 -8.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 2.824 -9.763 -5.911 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.624 -13.765 -6.915 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.507 -11.804 -5.432 1.00 0.00 H new ATOM 153 N ARG A 12 6.161 -15.538 -11.966 1.00 0.00 N ATOM 154 CA ARG A 12 6.272 -16.483 -13.120 1.00 0.00 C ATOM 155 C ARG A 12 4.914 -16.710 -13.854 1.00 0.00 C ATOM 156 O ARG A 12 3.953 -17.154 -13.221 1.00 0.00 O ATOM 157 CB ARG A 12 6.812 -17.821 -12.541 1.00 0.00 C ATOM 158 CG ARG A 12 6.981 -19.008 -13.537 1.00 0.00 C ATOM 159 CD ARG A 12 6.908 -20.396 -12.869 1.00 0.00 C ATOM 160 NE ARG A 12 8.161 -20.674 -12.124 1.00 0.00 N ATOM 161 CZ ARG A 12 8.261 -21.335 -10.970 1.00 0.00 C ATOM 162 NH1 ARG A 12 7.253 -21.844 -10.298 1.00 0.00 N ATOM 163 NH2 ARG A 12 9.452 -21.480 -10.465 1.00 0.00 N ATOM 0 H ARG A 12 6.152 -16.006 -11.060 1.00 0.00 H new ATOM 0 HA ARG A 12 6.940 -16.065 -13.873 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.781 -17.624 -12.081 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.140 -18.141 -11.744 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.207 -18.942 -14.301 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.940 -18.910 -14.045 1.00 0.00 H new ATOM 0 HD2 ARG A 12 6.056 -20.436 -12.190 1.00 0.00 H new ATOM 0 HD3 ARG A 12 6.749 -21.164 -13.626 1.00 0.00 H new ATOM 0 HE ARG A 12 9.028 -20.326 -12.533 1.00 0.00 H new ATOM 0 HH11 ARG A 12 6.302 -21.747 -10.654 1.00 0.00 H new ATOM 0 HH12 ARG A 12 7.422 -22.336 -9.420 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.262 -21.095 -10.950 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.575 -21.979 -9.584 1.00 0.00 H new ATOM 177 N LEU A 13 4.855 -16.531 -15.190 1.00 0.00 N ATOM 178 CA LEU A 13 3.637 -16.877 -15.983 1.00 0.00 C ATOM 179 C LEU A 13 3.349 -18.417 -16.024 1.00 0.00 C ATOM 180 O LEU A 13 4.174 -19.217 -16.479 1.00 0.00 O ATOM 181 CB LEU A 13 3.734 -16.260 -17.410 1.00 0.00 C ATOM 182 CG LEU A 13 2.483 -16.407 -18.330 1.00 0.00 C ATOM 183 CD1 LEU A 13 1.208 -15.792 -17.728 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.722 -15.768 -19.710 1.00 0.00 C ATOM 0 H LEU A 13 5.623 -16.154 -15.746 1.00 0.00 H new ATOM 0 HA LEU A 13 2.779 -16.438 -15.474 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.955 -15.198 -17.306 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.584 -16.714 -17.919 1.00 0.00 H new ATOM 0 HG LEU A 13 2.331 -17.482 -18.430 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.376 -15.929 -18.419 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.979 -16.283 -16.782 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.364 -14.727 -17.555 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.831 -15.888 -20.326 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.938 -14.707 -19.587 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.567 -16.256 -20.196 1.00 0.00 H new ATOM 196 N VAL A 14 2.155 -18.800 -15.555 1.00 0.00 N ATOM 197 CA VAL A 14 1.664 -20.217 -15.583 1.00 0.00 C ATOM 198 C VAL A 14 0.467 -20.442 -16.571 1.00 0.00 C ATOM 199 O VAL A 14 0.483 -21.415 -17.329 1.00 0.00 O ATOM 200 CB VAL A 14 1.404 -20.780 -14.139 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.713 -20.979 -13.344 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.425 -19.977 -13.246 1.00 0.00 C ATOM 0 H VAL A 14 1.488 -18.148 -15.141 1.00 0.00 H new ATOM 0 HA VAL A 14 2.475 -20.815 -15.998 1.00 0.00 H new ATOM 0 HB VAL A 14 0.919 -21.731 -14.358 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.481 -21.369 -12.353 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.355 -21.685 -13.871 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.228 -20.023 -13.246 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.331 -20.467 -12.277 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.807 -18.966 -13.105 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.552 -19.932 -13.727 1.00 0.00 H new ATOM 212 N ASP A 15 -0.558 -19.572 -16.554 1.00 0.00 N ATOM 213 CA ASP A 15 -1.790 -19.704 -17.381 1.00 0.00 C ATOM 214 C ASP A 15 -1.941 -18.442 -18.294 1.00 0.00 C ATOM 215 O ASP A 15 -1.852 -17.308 -17.811 1.00 0.00 O ATOM 216 CB ASP A 15 -2.939 -19.877 -16.352 1.00 0.00 C ATOM 217 CG ASP A 15 -4.378 -20.004 -16.833 1.00 0.00 C ATOM 218 OD1 ASP A 15 -4.653 -19.932 -18.050 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.268 -20.142 -15.965 1.00 0.00 O ATOM 0 H ASP A 15 -0.563 -18.743 -15.960 1.00 0.00 H new ATOM 0 HA ASP A 15 -1.779 -20.551 -18.067 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -2.715 -20.766 -15.762 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -2.898 -19.025 -15.674 1.00 0.00 H new ATOM 224 N SER A 16 -2.193 -18.636 -19.603 1.00 0.00 N ATOM 225 CA SER A 16 -2.521 -17.518 -20.540 1.00 0.00 C ATOM 226 C SER A 16 -3.778 -17.813 -21.427 1.00 0.00 C ATOM 227 O SER A 16 -3.673 -18.007 -22.645 1.00 0.00 O ATOM 228 CB SER A 16 -1.258 -17.148 -21.361 1.00 0.00 C ATOM 229 OG SER A 16 -0.989 -18.114 -22.378 1.00 0.00 O ATOM 0 H SER A 16 -2.178 -19.554 -20.046 1.00 0.00 H new ATOM 0 HA SER A 16 -2.810 -16.646 -19.954 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.394 -16.167 -21.817 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.399 -17.073 -20.694 1.00 0.00 H new ATOM 0 HG SER A 16 -1.830 -18.390 -22.798 1.00 0.00 H new ATOM 235 N LYS A 17 -4.970 -17.814 -20.811 1.00 0.00 N ATOM 236 CA LYS A 17 -6.263 -18.080 -21.510 1.00 0.00 C ATOM 237 C LYS A 17 -6.845 -16.819 -22.234 1.00 0.00 C ATOM 238 O LYS A 17 -6.971 -15.747 -21.634 1.00 0.00 O ATOM 239 CB LYS A 17 -7.234 -18.744 -20.492 1.00 0.00 C ATOM 240 CG LYS A 17 -7.658 -17.899 -19.257 1.00 0.00 C ATOM 241 CD LYS A 17 -7.873 -18.755 -17.989 1.00 0.00 C ATOM 242 CE LYS A 17 -7.711 -17.964 -16.674 1.00 0.00 C ATOM 243 NZ LYS A 17 -7.511 -18.933 -15.567 1.00 0.00 N ATOM 0 H LYS A 17 -5.078 -17.632 -19.813 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.101 -18.775 -22.334 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.137 -19.035 -21.028 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.768 -19.661 -20.130 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -6.894 -17.148 -19.057 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.579 -17.363 -19.488 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -8.872 -19.191 -18.020 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.164 -19.583 -17.995 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.861 -17.285 -16.742 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.594 -17.352 -16.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.518 -18.428 -14.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -8.277 -19.636 -15.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -6.597 -19.415 -15.688 1.00 0.00 H new ATOM 257 N GLY A 18 -7.162 -16.957 -23.536 1.00 0.00 N ATOM 258 CA GLY A 18 -7.522 -15.800 -24.417 1.00 0.00 C ATOM 259 C GLY A 18 -6.377 -15.016 -25.121 1.00 0.00 C ATOM 260 O GLY A 18 -6.609 -13.892 -25.574 1.00 0.00 O ATOM 0 H GLY A 18 -7.179 -17.858 -24.014 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.195 -16.170 -25.191 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.089 -15.089 -23.815 1.00 0.00 H new ATOM 264 N PHE A 19 -5.153 -15.567 -25.226 1.00 0.00 N ATOM 265 CA PHE A 19 -3.944 -14.780 -25.611 1.00 0.00 C ATOM 266 C PHE A 19 -3.685 -14.590 -27.145 1.00 0.00 C ATOM 267 O PHE A 19 -3.377 -13.463 -27.543 1.00 0.00 O ATOM 268 CB PHE A 19 -2.748 -15.322 -24.774 1.00 0.00 C ATOM 269 CG PHE A 19 -1.479 -14.446 -24.685 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.548 -13.075 -24.396 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.223 -15.044 -24.841 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.387 -12.310 -24.324 1.00 0.00 C ATOM 273 CE2 PHE A 19 0.938 -14.280 -24.752 1.00 0.00 C ATOM 274 CZ PHE A 19 0.854 -12.913 -24.505 1.00 0.00 C ATOM 0 H PHE A 19 -4.965 -16.554 -25.051 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.115 -13.734 -25.357 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.103 -15.502 -23.759 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.460 -16.289 -25.187 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.508 -12.610 -24.228 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.154 -16.105 -25.032 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.449 -11.250 -24.128 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.903 -14.748 -24.875 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.754 -12.319 -24.454 1.00 0.00 H new ATOM 284 N ASP A 20 -3.848 -15.613 -28.015 1.00 0.00 N ATOM 285 CA ASP A 20 -3.836 -15.415 -29.502 1.00 0.00 C ATOM 286 C ASP A 20 -4.954 -14.457 -30.056 1.00 0.00 C ATOM 287 O ASP A 20 -4.685 -13.686 -30.981 1.00 0.00 O ATOM 288 CB ASP A 20 -3.825 -16.803 -30.206 1.00 0.00 C ATOM 289 CG ASP A 20 -3.465 -16.776 -31.699 1.00 0.00 C ATOM 290 OD1 ASP A 20 -2.265 -16.779 -32.036 1.00 0.00 O ATOM 291 OD2 ASP A 20 -4.370 -16.710 -32.560 1.00 0.00 O ATOM 0 H ASP A 20 -3.989 -16.581 -27.726 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.918 -14.880 -29.743 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.115 -17.449 -29.689 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -4.810 -17.257 -30.094 1.00 0.00 H new ATOM 296 N GLU A 21 -6.202 -14.488 -29.541 1.00 0.00 N ATOM 297 CA GLU A 21 -7.226 -13.431 -29.821 1.00 0.00 C ATOM 298 C GLU A 21 -6.834 -11.978 -29.387 1.00 0.00 C ATOM 299 O GLU A 21 -6.897 -11.072 -30.223 1.00 0.00 O ATOM 300 CB GLU A 21 -8.633 -13.901 -29.361 1.00 0.00 C ATOM 301 CG GLU A 21 -8.857 -14.094 -27.841 1.00 0.00 C ATOM 302 CD GLU A 21 -10.245 -14.572 -27.460 1.00 0.00 C ATOM 303 OE1 GLU A 21 -11.199 -13.771 -27.526 1.00 0.00 O ATOM 304 OE2 GLU A 21 -10.372 -15.747 -27.056 1.00 0.00 O ATOM 0 H GLU A 21 -6.535 -15.231 -28.927 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.266 -13.316 -30.904 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.364 -13.177 -29.720 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.851 -14.847 -29.857 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.126 -14.811 -27.468 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.662 -13.148 -27.336 1.00 0.00 H new ATOM 311 N TYR A 22 -6.358 -11.760 -28.143 1.00 0.00 N ATOM 312 CA TYR A 22 -5.742 -10.466 -27.721 1.00 0.00 C ATOM 313 C TYR A 22 -4.540 -9.971 -28.600 1.00 0.00 C ATOM 314 O TYR A 22 -4.539 -8.814 -29.029 1.00 0.00 O ATOM 315 CB TYR A 22 -5.401 -10.581 -26.206 1.00 0.00 C ATOM 316 CG TYR A 22 -4.726 -9.340 -25.589 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.449 -8.156 -25.426 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.364 -9.365 -25.264 1.00 0.00 C ATOM 319 CE1 TYR A 22 -4.814 -7.010 -24.957 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.745 -8.225 -24.754 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.469 -7.046 -24.606 1.00 0.00 C ATOM 322 OH TYR A 22 -2.843 -5.914 -24.151 1.00 0.00 O ATOM 0 H TYR A 22 -6.385 -12.462 -27.404 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.470 -9.672 -27.887 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.321 -10.785 -25.657 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.746 -11.440 -26.062 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.502 -8.130 -25.664 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.792 -10.270 -25.409 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.369 -6.088 -24.865 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.703 -8.257 -24.473 1.00 0.00 H new ATOM 0 HH TYR A 22 -3.516 -5.250 -23.892 1.00 0.00 H new ATOM 332 N MET A 23 -3.539 -10.826 -28.873 1.00 0.00 N ATOM 333 CA MET A 23 -2.427 -10.490 -29.803 1.00 0.00 C ATOM 334 C MET A 23 -2.850 -10.259 -31.303 1.00 0.00 C ATOM 335 O MET A 23 -2.319 -9.343 -31.933 1.00 0.00 O ATOM 336 CB MET A 23 -1.302 -11.540 -29.628 1.00 0.00 C ATOM 337 CG MET A 23 -0.555 -11.550 -28.276 1.00 0.00 C ATOM 338 SD MET A 23 0.897 -12.627 -28.350 1.00 0.00 S ATOM 339 CE MET A 23 0.150 -14.267 -28.419 1.00 0.00 C ATOM 0 H MET A 23 -3.470 -11.759 -28.466 1.00 0.00 H new ATOM 0 HA MET A 23 -2.051 -9.506 -29.525 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.734 -12.528 -29.783 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.568 -11.385 -30.419 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.248 -10.536 -28.018 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.226 -11.891 -27.488 1.00 0.00 H new ATOM 0 HE1 MET A 23 0.914 -15.023 -28.236 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.627 -14.345 -27.659 1.00 0.00 H new ATOM 0 HE3 MET A 23 -0.288 -14.426 -29.404 1.00 0.00 H new ATOM 349 N LYS A 24 -3.828 -10.989 -31.881 1.00 0.00 N ATOM 350 CA LYS A 24 -4.510 -10.553 -33.145 1.00 0.00 C ATOM 351 C LYS A 24 -5.223 -9.157 -33.082 1.00 0.00 C ATOM 352 O LYS A 24 -5.016 -8.352 -33.993 1.00 0.00 O ATOM 353 CB LYS A 24 -5.480 -11.650 -33.663 1.00 0.00 C ATOM 354 CG LYS A 24 -4.789 -12.921 -34.213 1.00 0.00 C ATOM 355 CD LYS A 24 -5.723 -13.944 -34.904 1.00 0.00 C ATOM 356 CE LYS A 24 -6.906 -14.509 -34.090 1.00 0.00 C ATOM 357 NZ LYS A 24 -6.460 -15.180 -32.842 1.00 0.00 N ATOM 0 H LYS A 24 -4.169 -11.875 -31.507 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.698 -10.414 -33.859 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.147 -11.939 -32.850 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.102 -11.223 -34.449 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.022 -12.617 -34.926 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.278 -13.420 -33.390 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.128 -13.474 -35.800 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.112 -14.785 -35.233 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.592 -13.700 -33.840 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.461 -15.219 -34.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.285 -15.573 -32.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.799 -15.948 -33.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.983 -14.489 -32.228 1.00 0.00 H new ATOM 371 N GLU A 25 -6.003 -8.851 -32.025 1.00 0.00 N ATOM 372 CA GLU A 25 -6.573 -7.489 -31.791 1.00 0.00 C ATOM 373 C GLU A 25 -5.518 -6.330 -31.627 1.00 0.00 C ATOM 374 O GLU A 25 -5.663 -5.281 -32.261 1.00 0.00 O ATOM 375 CB GLU A 25 -7.574 -7.617 -30.607 1.00 0.00 C ATOM 376 CG GLU A 25 -8.549 -6.427 -30.400 1.00 0.00 C ATOM 377 CD GLU A 25 -9.548 -6.165 -31.520 1.00 0.00 C ATOM 378 OE1 GLU A 25 -10.286 -7.092 -31.910 1.00 0.00 O ATOM 379 OE2 GLU A 25 -9.609 -5.010 -31.993 1.00 0.00 O ATOM 0 H GLU A 25 -6.260 -9.530 -31.308 1.00 0.00 H new ATOM 0 HA GLU A 25 -7.091 -7.161 -32.692 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -8.164 -8.521 -30.754 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.003 -7.755 -29.689 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.106 -6.598 -29.479 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -7.958 -5.523 -30.252 1.00 0.00 H new ATOM 386 N LEU A 26 -4.426 -6.523 -30.856 1.00 0.00 N ATOM 387 CA LEU A 26 -3.211 -5.646 -30.920 1.00 0.00 C ATOM 388 C LEU A 26 -2.519 -5.463 -32.324 1.00 0.00 C ATOM 389 O LEU A 26 -1.991 -4.385 -32.614 1.00 0.00 O ATOM 390 CB LEU A 26 -2.148 -6.190 -29.918 1.00 0.00 C ATOM 391 CG LEU A 26 -2.385 -6.026 -28.395 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.240 -6.712 -27.628 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.463 -4.553 -27.961 1.00 0.00 C ATOM 0 H LEU A 26 -4.350 -7.279 -30.175 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.588 -4.654 -30.671 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -2.025 -7.255 -30.117 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.199 -5.710 -30.155 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.345 -6.488 -28.166 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.402 -6.600 -26.556 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.215 -7.772 -27.882 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.291 -6.251 -27.902 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.630 -4.499 -26.885 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.528 -4.051 -28.209 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.287 -4.064 -28.481 1.00 0.00 H new ATOM 405 N GLY A 27 -2.463 -6.528 -33.139 1.00 0.00 N ATOM 406 CA GLY A 27 -1.754 -6.542 -34.446 1.00 0.00 C ATOM 407 C GLY A 27 -0.384 -7.250 -34.424 1.00 0.00 C ATOM 408 O GLY A 27 0.632 -6.630 -34.745 1.00 0.00 O ATOM 0 H GLY A 27 -2.910 -7.417 -32.915 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.389 -7.031 -35.184 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.612 -5.514 -34.779 1.00 0.00 H new ATOM 412 N VAL A 28 -0.374 -8.540 -34.057 1.00 0.00 N ATOM 413 CA VAL A 28 0.879 -9.320 -33.828 1.00 0.00 C ATOM 414 C VAL A 28 0.954 -10.460 -34.904 1.00 0.00 C ATOM 415 O VAL A 28 0.048 -11.301 -35.020 1.00 0.00 O ATOM 416 CB VAL A 28 0.924 -9.887 -32.363 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.252 -10.605 -32.030 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.708 -8.873 -31.211 1.00 0.00 C ATOM 0 H VAL A 28 -1.225 -9.082 -33.908 1.00 0.00 H new ATOM 0 HA VAL A 28 1.751 -8.674 -33.935 1.00 0.00 H new ATOM 0 HB VAL A 28 0.072 -10.566 -32.396 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.219 -10.973 -31.005 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.393 -11.443 -32.712 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.081 -9.905 -32.138 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.763 -9.392 -30.254 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.481 -8.105 -31.252 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.272 -8.407 -31.315 1.00 0.00 H new ATOM 428 N GLY A 29 2.066 -10.518 -35.660 1.00 0.00 N ATOM 429 CA GLY A 29 2.282 -11.564 -36.700 1.00 0.00 C ATOM 430 C GLY A 29 2.511 -13.016 -36.204 1.00 0.00 C ATOM 431 O GLY A 29 2.813 -13.261 -35.034 1.00 0.00 O ATOM 0 H GLY A 29 2.836 -9.854 -35.576 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.417 -11.565 -37.363 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.144 -11.272 -37.300 1.00 0.00 H new ATOM 435 N ILE A 30 2.374 -13.989 -37.120 1.00 0.00 N ATOM 436 CA ILE A 30 2.416 -15.457 -36.785 1.00 0.00 C ATOM 437 C ILE A 30 3.679 -15.982 -36.019 1.00 0.00 C ATOM 438 O ILE A 30 3.530 -16.648 -34.990 1.00 0.00 O ATOM 439 CB ILE A 30 2.030 -16.357 -38.016 1.00 0.00 C ATOM 440 CG1 ILE A 30 2.935 -16.242 -39.287 1.00 0.00 C ATOM 441 CG2 ILE A 30 0.539 -16.199 -38.410 1.00 0.00 C ATOM 442 CD1 ILE A 30 3.987 -17.357 -39.425 1.00 0.00 C ATOM 0 H ILE A 30 2.231 -13.802 -38.112 1.00 0.00 H new ATOM 0 HA ILE A 30 1.637 -15.556 -36.029 1.00 0.00 H new ATOM 0 HB ILE A 30 2.215 -17.361 -37.635 1.00 0.00 H new ATOM 0 HG12 ILE A 30 2.299 -16.249 -40.172 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.445 -15.279 -39.268 1.00 0.00 H new ATOM 0 HG21 ILE A 30 0.319 -16.839 -39.264 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -0.092 -16.486 -37.569 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.341 -15.160 -38.674 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.569 -17.198 -40.333 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.651 -17.340 -38.561 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.487 -18.324 -39.479 1.00 0.00 H new ATOM 454 N ALA A 31 4.899 -15.648 -36.472 1.00 0.00 N ATOM 455 CA ALA A 31 6.153 -15.901 -35.707 1.00 0.00 C ATOM 456 C ALA A 31 6.260 -15.202 -34.307 1.00 0.00 C ATOM 457 O ALA A 31 6.613 -15.867 -33.330 1.00 0.00 O ATOM 458 CB ALA A 31 7.325 -15.543 -36.640 1.00 0.00 C ATOM 0 H ALA A 31 5.054 -15.197 -37.373 1.00 0.00 H new ATOM 0 HA ALA A 31 6.168 -16.954 -35.426 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.268 -15.713 -36.121 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.284 -16.168 -37.532 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.253 -14.494 -36.928 1.00 0.00 H new ATOM 464 N LEU A 32 5.906 -13.905 -34.197 1.00 0.00 N ATOM 465 CA LEU A 32 5.758 -13.200 -32.888 1.00 0.00 C ATOM 466 C LEU A 32 4.689 -13.805 -31.911 1.00 0.00 C ATOM 467 O LEU A 32 4.995 -13.963 -30.727 1.00 0.00 O ATOM 468 CB LEU A 32 5.491 -11.688 -33.144 1.00 0.00 C ATOM 469 CG LEU A 32 6.631 -10.836 -33.766 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.084 -9.460 -34.185 1.00 0.00 C ATOM 471 CD2 LEU A 32 7.812 -10.632 -32.798 1.00 0.00 C ATOM 0 H LEU A 32 5.713 -13.311 -35.004 1.00 0.00 H new ATOM 0 HA LEU A 32 6.703 -13.343 -32.364 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.622 -11.609 -33.798 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.216 -11.233 -32.192 1.00 0.00 H new ATOM 0 HG LEU A 32 7.001 -11.384 -34.633 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.888 -8.866 -34.621 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.291 -9.592 -34.921 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.686 -8.945 -33.311 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.580 -10.030 -33.283 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.463 -10.121 -31.901 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.229 -11.601 -32.524 1.00 0.00 H new ATOM 483 N ARG A 33 3.476 -14.175 -32.376 1.00 0.00 N ATOM 484 CA ARG A 33 2.482 -14.924 -31.545 1.00 0.00 C ATOM 485 C ARG A 33 2.909 -16.374 -31.146 1.00 0.00 C ATOM 486 O ARG A 33 2.754 -16.738 -29.979 1.00 0.00 O ATOM 487 CB ARG A 33 1.076 -14.952 -32.203 1.00 0.00 C ATOM 488 CG ARG A 33 0.440 -13.578 -32.534 1.00 0.00 C ATOM 489 CD ARG A 33 -1.088 -13.530 -32.741 1.00 0.00 C ATOM 490 NE ARG A 33 -1.644 -14.677 -33.495 1.00 0.00 N ATOM 491 CZ ARG A 33 -1.736 -14.799 -34.806 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.313 -13.895 -35.658 1.00 0.00 N ATOM 493 NH2 ARG A 33 -2.290 -15.889 -35.247 1.00 0.00 N ATOM 0 H ARG A 33 3.152 -13.971 -33.322 1.00 0.00 H new ATOM 0 HA ARG A 33 2.441 -14.354 -30.617 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.143 -15.528 -33.126 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.399 -15.490 -31.539 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.692 -12.888 -31.728 1.00 0.00 H new ATOM 0 HG3 ARG A 33 0.914 -13.198 -33.439 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.572 -13.484 -31.766 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.342 -12.609 -33.266 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.994 -15.458 -32.940 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -0.883 -13.035 -35.318 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.415 -14.052 -36.661 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.625 -16.593 -34.589 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.389 -16.041 -36.251 1.00 0.00 H new ATOM 507 N LYS A 34 3.467 -17.186 -32.070 1.00 0.00 N ATOM 508 CA LYS A 34 4.119 -18.483 -31.734 1.00 0.00 C ATOM 509 C LYS A 34 5.285 -18.389 -30.685 1.00 0.00 C ATOM 510 O LYS A 34 5.257 -19.127 -29.697 1.00 0.00 O ATOM 511 CB LYS A 34 4.503 -19.141 -33.084 1.00 0.00 C ATOM 512 CG LYS A 34 5.017 -20.591 -32.971 1.00 0.00 C ATOM 513 CD LYS A 34 5.285 -21.231 -34.346 1.00 0.00 C ATOM 514 CE LYS A 34 5.820 -22.669 -34.219 1.00 0.00 C ATOM 515 NZ LYS A 34 6.066 -23.237 -35.573 1.00 0.00 N ATOM 0 H LYS A 34 3.481 -16.968 -33.066 1.00 0.00 H new ATOM 0 HA LYS A 34 3.421 -19.122 -31.192 1.00 0.00 H new ATOM 0 HB2 LYS A 34 3.632 -19.129 -33.739 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.271 -18.534 -33.563 1.00 0.00 H new ATOM 0 HG2 LYS A 34 5.935 -20.603 -32.383 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.285 -21.191 -32.431 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.364 -21.237 -34.929 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.005 -20.624 -34.894 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.743 -22.673 -33.640 1.00 0.00 H new ATOM 0 HE3 LYS A 34 5.102 -23.288 -33.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 6.427 -24.208 -35.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 5.177 -23.248 -36.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 6.766 -22.653 -36.073 1.00 0.00 H new ATOM 529 N MET A 35 6.250 -17.460 -30.857 1.00 0.00 N ATOM 530 CA MET A 35 7.196 -17.040 -29.780 1.00 0.00 C ATOM 531 C MET A 35 6.509 -16.589 -28.440 1.00 0.00 C ATOM 532 O MET A 35 6.773 -17.203 -27.406 1.00 0.00 O ATOM 533 CB MET A 35 8.113 -15.952 -30.408 1.00 0.00 C ATOM 534 CG MET A 35 9.288 -15.475 -29.533 1.00 0.00 C ATOM 535 SD MET A 35 10.066 -14.015 -30.260 1.00 0.00 S ATOM 536 CE MET A 35 8.970 -12.710 -29.666 1.00 0.00 C ATOM 0 H MET A 35 6.402 -16.976 -31.742 1.00 0.00 H new ATOM 0 HA MET A 35 7.781 -17.898 -29.449 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.516 -16.340 -31.343 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.499 -15.088 -30.660 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.931 -15.243 -28.530 1.00 0.00 H new ATOM 0 HG3 MET A 35 10.023 -16.274 -29.433 1.00 0.00 H new ATOM 0 HE1 MET A 35 9.341 -11.742 -30.003 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.966 -12.871 -30.059 1.00 0.00 H new ATOM 0 HE3 MET A 35 8.940 -12.728 -28.577 1.00 0.00 H new ATOM 546 N GLY A 36 5.625 -15.570 -28.456 1.00 0.00 N ATOM 547 CA GLY A 36 4.871 -15.110 -27.254 1.00 0.00 C ATOM 548 C GLY A 36 4.001 -16.123 -26.472 1.00 0.00 C ATOM 549 O GLY A 36 4.049 -16.127 -25.241 1.00 0.00 O ATOM 0 H GLY A 36 5.408 -15.038 -29.299 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.594 -14.691 -26.554 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.221 -14.293 -27.568 1.00 0.00 H new ATOM 553 N ALA A 37 3.220 -16.970 -27.161 1.00 0.00 N ATOM 554 CA ALA A 37 2.458 -18.078 -26.525 1.00 0.00 C ATOM 555 C ALA A 37 3.297 -19.175 -25.786 1.00 0.00 C ATOM 556 O ALA A 37 2.943 -19.531 -24.659 1.00 0.00 O ATOM 557 CB ALA A 37 1.544 -18.668 -27.616 1.00 0.00 C ATOM 0 H ALA A 37 3.093 -16.914 -28.172 1.00 0.00 H new ATOM 0 HA ALA A 37 1.890 -17.655 -25.696 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.961 -19.489 -27.198 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.870 -17.894 -27.983 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.154 -19.039 -28.440 1.00 0.00 H new ATOM 563 N MET A 38 4.402 -19.690 -26.370 1.00 0.00 N ATOM 564 CA MET A 38 5.375 -20.547 -25.619 1.00 0.00 C ATOM 565 C MET A 38 6.325 -19.819 -24.598 1.00 0.00 C ATOM 566 O MET A 38 6.729 -20.434 -23.606 1.00 0.00 O ATOM 567 CB MET A 38 6.114 -21.496 -26.604 1.00 0.00 C ATOM 568 CG MET A 38 7.259 -20.894 -27.443 1.00 0.00 C ATOM 569 SD MET A 38 8.002 -22.167 -28.484 1.00 0.00 S ATOM 570 CE MET A 38 7.155 -21.859 -30.042 1.00 0.00 C ATOM 0 H MET A 38 4.650 -19.535 -27.347 1.00 0.00 H new ATOM 0 HA MET A 38 4.771 -21.144 -24.936 1.00 0.00 H new ATOM 0 HB2 MET A 38 6.519 -22.329 -26.029 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.376 -21.911 -27.290 1.00 0.00 H new ATOM 0 HG2 MET A 38 6.878 -20.083 -28.063 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.015 -20.464 -26.786 1.00 0.00 H new ATOM 0 HE1 MET A 38 7.505 -22.567 -30.793 1.00 0.00 H new ATOM 0 HE2 MET A 38 6.081 -21.980 -29.902 1.00 0.00 H new ATOM 0 HE3 MET A 38 7.365 -20.843 -30.376 1.00 0.00 H new ATOM 580 N ALA A 39 6.676 -18.534 -24.814 1.00 0.00 N ATOM 581 CA ALA A 39 7.462 -17.722 -23.854 1.00 0.00 C ATOM 582 C ALA A 39 6.675 -17.389 -22.548 1.00 0.00 C ATOM 583 O ALA A 39 5.817 -16.502 -22.512 1.00 0.00 O ATOM 584 CB ALA A 39 7.906 -16.440 -24.586 1.00 0.00 C ATOM 0 H ALA A 39 6.423 -18.026 -25.662 1.00 0.00 H new ATOM 0 HA ALA A 39 8.326 -18.298 -23.523 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.489 -15.817 -23.907 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.517 -16.707 -25.449 1.00 0.00 H new ATOM 0 HB3 ALA A 39 7.027 -15.889 -24.920 1.00 0.00 H new ATOM 590 N LYS A 40 7.002 -18.116 -21.471 1.00 0.00 N ATOM 591 CA LYS A 40 6.403 -17.902 -20.127 1.00 0.00 C ATOM 592 C LYS A 40 7.409 -17.136 -19.193 1.00 0.00 C ATOM 593 O LYS A 40 8.248 -17.797 -18.570 1.00 0.00 O ATOM 594 CB LYS A 40 5.840 -19.248 -19.586 1.00 0.00 C ATOM 595 CG LYS A 40 6.806 -20.450 -19.430 1.00 0.00 C ATOM 596 CD LYS A 40 6.105 -21.695 -18.842 1.00 0.00 C ATOM 597 CE LYS A 40 7.011 -22.938 -18.722 1.00 0.00 C ATOM 598 NZ LYS A 40 7.987 -22.777 -17.608 1.00 0.00 N ATOM 0 H LYS A 40 7.688 -18.871 -21.497 1.00 0.00 H new ATOM 0 HA LYS A 40 5.539 -17.240 -20.175 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.396 -19.052 -18.610 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.031 -19.558 -20.248 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.230 -20.700 -20.402 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.636 -20.164 -18.784 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.717 -21.446 -17.854 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.248 -21.944 -19.468 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.399 -23.824 -18.550 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.545 -23.096 -19.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.586 -23.625 -17.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 8.584 -21.944 -17.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.474 -22.649 -16.713 1.00 0.00 H new ATOM 612 N PRO A 41 7.406 -15.771 -19.069 1.00 0.00 N ATOM 613 CA PRO A 41 8.461 -15.041 -18.318 1.00 0.00 C ATOM 614 C PRO A 41 8.303 -15.012 -16.769 1.00 0.00 C ATOM 615 O PRO A 41 7.199 -15.112 -16.218 1.00 0.00 O ATOM 616 CB PRO A 41 8.353 -13.623 -18.921 1.00 0.00 C ATOM 617 CG PRO A 41 6.885 -13.475 -19.318 1.00 0.00 C ATOM 618 CD PRO A 41 6.535 -14.863 -19.845 1.00 0.00 C ATOM 0 HA PRO A 41 9.429 -15.530 -18.427 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.645 -12.862 -18.197 1.00 0.00 H new ATOM 0 HB3 PRO A 41 9.009 -13.510 -19.784 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.262 -13.196 -18.468 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.747 -12.707 -20.079 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.481 -15.094 -19.692 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.727 -14.944 -20.915 1.00 0.00 H new ATOM 626 N ASP A 42 9.430 -14.733 -16.098 1.00 0.00 N ATOM 627 CA ASP A 42 9.416 -14.191 -14.714 1.00 0.00 C ATOM 628 C ASP A 42 9.272 -12.633 -14.770 1.00 0.00 C ATOM 629 O ASP A 42 10.212 -11.905 -15.103 1.00 0.00 O ATOM 630 CB ASP A 42 10.689 -14.647 -13.960 1.00 0.00 C ATOM 631 CG ASP A 42 10.707 -16.048 -13.340 1.00 0.00 C ATOM 632 OD1 ASP A 42 9.763 -16.850 -13.503 1.00 0.00 O ATOM 633 OD2 ASP A 42 11.710 -16.335 -12.650 1.00 0.00 O ATOM 0 H ASP A 42 10.365 -14.870 -16.482 1.00 0.00 H new ATOM 0 HA ASP A 42 8.561 -14.579 -14.160 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.527 -14.580 -14.654 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.877 -13.929 -13.162 1.00 0.00 H new ATOM 638 N CYS A 43 8.067 -12.131 -14.462 1.00 0.00 N ATOM 639 CA CYS A 43 7.763 -10.683 -14.401 1.00 0.00 C ATOM 640 C CYS A 43 8.092 -10.105 -12.990 1.00 0.00 C ATOM 641 O CYS A 43 7.303 -10.216 -12.047 1.00 0.00 O ATOM 642 CB CYS A 43 6.285 -10.540 -14.821 1.00 0.00 C ATOM 643 SG CYS A 43 5.809 -8.786 -14.943 1.00 0.00 S ATOM 0 H CYS A 43 7.264 -12.721 -14.245 1.00 0.00 H new ATOM 0 HA CYS A 43 8.383 -10.094 -15.077 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.127 -11.031 -15.781 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.646 -11.044 -14.096 1.00 0.00 H new ATOM 0 HG CYS A 43 5.044 -8.615 -15.980 1.00 0.00 H new ATOM 649 N ILE A 44 9.287 -9.513 -12.838 1.00 0.00 N ATOM 650 CA ILE A 44 9.809 -9.070 -11.510 1.00 0.00 C ATOM 651 C ILE A 44 9.342 -7.605 -11.248 1.00 0.00 C ATOM 652 O ILE A 44 9.855 -6.659 -11.855 1.00 0.00 O ATOM 653 CB ILE A 44 11.350 -9.291 -11.304 1.00 0.00 C ATOM 654 CG1 ILE A 44 11.865 -10.698 -11.741 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.758 -9.055 -9.825 1.00 0.00 C ATOM 656 CD1 ILE A 44 12.467 -10.724 -13.153 1.00 0.00 C ATOM 0 H ILE A 44 9.921 -9.324 -13.614 1.00 0.00 H new ATOM 0 HA ILE A 44 9.379 -9.719 -10.747 1.00 0.00 H new ATOM 0 HB ILE A 44 11.819 -8.556 -11.958 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.617 -11.037 -11.029 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.039 -11.408 -11.695 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.830 -9.215 -9.713 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.512 -8.032 -9.538 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.218 -9.751 -9.183 1.00 0.00 H new ATOM 0 HD11 ILE A 44 12.803 -11.734 -13.387 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.712 -10.416 -13.876 1.00 0.00 H new ATOM 0 HD13 ILE A 44 13.314 -10.040 -13.200 1.00 0.00 H new ATOM 668 N ILE A 45 8.363 -7.436 -10.346 1.00 0.00 N ATOM 669 CA ILE A 45 7.784 -6.104 -10.002 1.00 0.00 C ATOM 670 C ILE A 45 8.488 -5.577 -8.702 1.00 0.00 C ATOM 671 O ILE A 45 8.840 -6.324 -7.780 1.00 0.00 O ATOM 672 CB ILE A 45 6.210 -6.180 -9.911 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.528 -6.715 -11.213 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.572 -4.813 -9.529 1.00 0.00 C ATOM 675 CD1 ILE A 45 4.014 -6.995 -11.139 1.00 0.00 C ATOM 0 H ILE A 45 7.943 -8.209 -9.829 1.00 0.00 H new ATOM 0 HA ILE A 45 7.977 -5.377 -10.790 1.00 0.00 H new ATOM 0 HB ILE A 45 6.023 -6.901 -9.115 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.701 -5.991 -12.009 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.030 -7.637 -11.505 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.488 -4.918 -9.479 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.950 -4.494 -8.558 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.830 -4.068 -10.282 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.664 -7.361 -12.104 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.820 -7.747 -10.374 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.486 -6.076 -10.886 1.00 0.00 H new ATOM 687 N THR A 46 8.697 -4.257 -8.613 1.00 0.00 N ATOM 688 CA THR A 46 9.092 -3.580 -7.341 1.00 0.00 C ATOM 689 C THR A 46 8.466 -2.151 -7.325 1.00 0.00 C ATOM 690 O THR A 46 8.808 -1.309 -8.163 1.00 0.00 O ATOM 691 CB THR A 46 10.639 -3.605 -7.148 1.00 0.00 C ATOM 692 OG1 THR A 46 11.105 -4.953 -7.161 1.00 0.00 O ATOM 693 CG2 THR A 46 11.121 -3.009 -5.816 1.00 0.00 C ATOM 0 H THR A 46 8.602 -3.621 -9.405 1.00 0.00 H new ATOM 0 HA THR A 46 8.699 -4.118 -6.478 1.00 0.00 H new ATOM 0 HB THR A 46 11.031 -3.001 -7.966 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.341 -5.563 -7.232 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.208 -3.066 -5.764 1.00 0.00 H new ATOM 0 HG22 THR A 46 10.809 -1.967 -5.750 1.00 0.00 H new ATOM 0 HG23 THR A 46 10.688 -3.571 -4.988 1.00 0.00 H new ATOM 701 N CYS A 47 7.546 -1.889 -6.375 1.00 0.00 N ATOM 702 CA CYS A 47 6.951 -0.542 -6.175 1.00 0.00 C ATOM 703 C CYS A 47 7.352 0.064 -4.800 1.00 0.00 C ATOM 704 O CYS A 47 6.820 -0.324 -3.752 1.00 0.00 O ATOM 705 CB CYS A 47 5.421 -0.638 -6.329 1.00 0.00 C ATOM 706 SG CYS A 47 4.720 1.051 -6.311 1.00 0.00 S ATOM 0 H CYS A 47 7.194 -2.594 -5.728 1.00 0.00 H new ATOM 0 HA CYS A 47 7.342 0.135 -6.934 1.00 0.00 H new ATOM 0 HB2 CYS A 47 5.166 -1.142 -7.261 1.00 0.00 H new ATOM 0 HB3 CYS A 47 4.997 -1.231 -5.519 1.00 0.00 H new ATOM 0 HG CYS A 47 5.100 1.667 -5.231 1.00 0.00 H new ATOM 712 N ASP A 48 8.243 1.068 -4.821 1.00 0.00 N ATOM 713 CA ASP A 48 8.646 1.816 -3.597 1.00 0.00 C ATOM 714 C ASP A 48 7.865 3.171 -3.524 1.00 0.00 C ATOM 715 O ASP A 48 8.364 4.245 -3.886 1.00 0.00 O ATOM 716 CB ASP A 48 10.190 1.959 -3.580 1.00 0.00 C ATOM 717 CG ASP A 48 10.940 0.667 -3.252 1.00 0.00 C ATOM 718 OD1 ASP A 48 10.948 0.267 -2.068 1.00 0.00 O ATOM 719 OD2 ASP A 48 11.529 0.060 -4.170 1.00 0.00 O ATOM 0 H ASP A 48 8.706 1.389 -5.671 1.00 0.00 H new ATOM 0 HA ASP A 48 8.377 1.275 -2.690 1.00 0.00 H new ATOM 0 HB2 ASP A 48 10.520 2.319 -4.554 1.00 0.00 H new ATOM 0 HB3 ASP A 48 10.464 2.720 -2.849 1.00 0.00 H new ATOM 724 N GLY A 49 6.598 3.101 -3.066 1.00 0.00 N ATOM 725 CA GLY A 49 5.719 4.292 -2.906 1.00 0.00 C ATOM 726 C GLY A 49 5.212 4.935 -4.216 1.00 0.00 C ATOM 727 O GLY A 49 4.144 4.582 -4.718 1.00 0.00 O ATOM 0 H GLY A 49 6.151 2.225 -2.796 1.00 0.00 H new ATOM 0 HA2 GLY A 49 4.855 4.004 -2.307 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.263 5.048 -2.339 1.00 0.00 H new ATOM 731 N LYS A 50 5.990 5.891 -4.738 1.00 0.00 N ATOM 732 CA LYS A 50 5.704 6.568 -6.040 1.00 0.00 C ATOM 733 C LYS A 50 6.493 6.057 -7.295 1.00 0.00 C ATOM 734 O LYS A 50 6.078 6.410 -8.400 1.00 0.00 O ATOM 735 CB LYS A 50 5.891 8.106 -5.847 1.00 0.00 C ATOM 736 CG LYS A 50 4.633 8.890 -5.386 1.00 0.00 C ATOM 737 CD LYS A 50 3.575 9.184 -6.480 1.00 0.00 C ATOM 738 CE LYS A 50 4.032 10.191 -7.556 1.00 0.00 C ATOM 739 NZ LYS A 50 2.943 10.442 -8.535 1.00 0.00 N ATOM 0 H LYS A 50 6.838 6.227 -4.282 1.00 0.00 H new ATOM 0 HA LYS A 50 4.675 6.307 -6.285 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.684 8.267 -5.116 1.00 0.00 H new ATOM 0 HB3 LYS A 50 6.235 8.532 -6.790 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.152 8.327 -4.586 1.00 0.00 H new ATOM 0 HG3 LYS A 50 4.957 9.839 -4.958 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.305 8.247 -6.968 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.673 9.566 -6.002 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.326 11.128 -7.083 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.911 9.805 -8.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.219 11.219 -9.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.774 9.582 -9.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.073 10.701 -8.028 1.00 0.00 H new ATOM 753 N ASN A 51 7.592 5.285 -7.183 1.00 0.00 N ATOM 754 CA ASN A 51 8.318 4.724 -8.364 1.00 0.00 C ATOM 755 C ASN A 51 8.055 3.189 -8.510 1.00 0.00 C ATOM 756 O ASN A 51 8.199 2.433 -7.544 1.00 0.00 O ATOM 757 CB ASN A 51 9.821 5.124 -8.312 1.00 0.00 C ATOM 758 CG ASN A 51 10.752 4.416 -7.317 1.00 0.00 C ATOM 759 OD1 ASN A 51 11.503 3.514 -7.671 1.00 0.00 O ATOM 760 ND2 ASN A 51 10.762 4.801 -6.065 1.00 0.00 N ATOM 0 H ASN A 51 8.006 5.029 -6.287 1.00 0.00 H new ATOM 0 HA ASN A 51 7.926 5.163 -9.281 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.234 4.976 -9.310 1.00 0.00 H new ATOM 0 HB3 ASN A 51 9.869 6.193 -8.102 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.389 4.351 -5.398 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.142 5.550 -5.757 1.00 0.00 H new ATOM 767 N LEU A 52 7.659 2.741 -9.714 1.00 0.00 N ATOM 768 CA LEU A 52 7.285 1.325 -9.976 1.00 0.00 C ATOM 769 C LEU A 52 8.122 0.757 -11.164 1.00 0.00 C ATOM 770 O LEU A 52 8.002 1.216 -12.305 1.00 0.00 O ATOM 771 CB LEU A 52 5.743 1.273 -10.172 1.00 0.00 C ATOM 772 CG LEU A 52 5.109 -0.147 -10.175 1.00 0.00 C ATOM 773 CD1 LEU A 52 3.671 -0.109 -9.633 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.092 -0.782 -11.574 1.00 0.00 C ATOM 0 H LEU A 52 7.587 3.341 -10.535 1.00 0.00 H new ATOM 0 HA LEU A 52 7.525 0.671 -9.137 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.275 1.858 -9.380 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.499 1.761 -11.115 1.00 0.00 H new ATOM 0 HG LEU A 52 5.737 -0.758 -9.527 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.251 -1.115 -9.646 1.00 0.00 H new ATOM 0 HD12 LEU A 52 3.677 0.269 -8.611 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.064 0.546 -10.258 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.639 -1.772 -11.519 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.512 -0.155 -12.251 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.113 -0.870 -11.946 1.00 0.00 H new ATOM 786 N THR A 53 8.947 -0.265 -10.886 1.00 0.00 N ATOM 787 CA THR A 53 9.803 -0.944 -11.902 1.00 0.00 C ATOM 788 C THR A 53 9.228 -2.363 -12.212 1.00 0.00 C ATOM 789 O THR A 53 8.900 -3.130 -11.300 1.00 0.00 O ATOM 790 CB THR A 53 11.278 -0.976 -11.395 1.00 0.00 C ATOM 791 OG1 THR A 53 11.754 0.353 -11.195 1.00 0.00 O ATOM 792 CG2 THR A 53 12.282 -1.623 -12.366 1.00 0.00 C ATOM 0 H THR A 53 9.048 -0.654 -9.948 1.00 0.00 H new ATOM 0 HA THR A 53 9.799 -0.392 -12.842 1.00 0.00 H new ATOM 0 HB THR A 53 11.233 -1.571 -10.483 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.680 0.324 -10.875 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.280 -1.599 -11.927 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.993 -2.657 -12.553 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.286 -1.072 -13.306 1.00 0.00 H new ATOM 800 N ILE A 54 9.140 -2.717 -13.507 1.00 0.00 N ATOM 801 CA ILE A 54 8.768 -4.094 -13.956 1.00 0.00 C ATOM 802 C ILE A 54 9.908 -4.605 -14.903 1.00 0.00 C ATOM 803 O ILE A 54 10.058 -4.149 -16.043 1.00 0.00 O ATOM 804 CB ILE A 54 7.333 -4.193 -14.599 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.215 -3.565 -13.707 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.991 -5.663 -14.968 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.750 -3.694 -14.169 1.00 0.00 C ATOM 0 H ILE A 54 9.321 -2.071 -14.275 1.00 0.00 H new ATOM 0 HA ILE A 54 8.688 -4.745 -13.085 1.00 0.00 H new ATOM 0 HB ILE A 54 7.364 -3.600 -15.513 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.291 -4.012 -12.716 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.436 -2.503 -13.596 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.996 -5.705 -15.410 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.722 -6.038 -15.684 1.00 0.00 H new ATOM 0 HG23 ILE A 54 7.015 -6.279 -14.069 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.096 -3.208 -13.445 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.632 -3.217 -15.142 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.485 -4.748 -14.248 1.00 0.00 H new ATOM 819 N LYS A 55 10.672 -5.609 -14.440 1.00 0.00 N ATOM 820 CA LYS A 55 11.494 -6.479 -15.326 1.00 0.00 C ATOM 821 C LYS A 55 10.662 -7.702 -15.850 1.00 0.00 C ATOM 822 O LYS A 55 9.605 -8.051 -15.317 1.00 0.00 O ATOM 823 CB LYS A 55 12.764 -6.847 -14.511 1.00 0.00 C ATOM 824 CG LYS A 55 13.900 -7.540 -15.297 1.00 0.00 C ATOM 825 CD LYS A 55 15.166 -7.726 -14.429 1.00 0.00 C ATOM 826 CE LYS A 55 16.350 -8.433 -15.117 1.00 0.00 C ATOM 827 NZ LYS A 55 16.910 -7.613 -16.227 1.00 0.00 N ATOM 0 H LYS A 55 10.743 -5.846 -13.451 1.00 0.00 H new ATOM 0 HA LYS A 55 11.802 -5.975 -16.242 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.162 -5.935 -14.066 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.467 -7.500 -13.690 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.556 -8.512 -15.652 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.147 -6.948 -16.178 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.499 -6.745 -14.091 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.894 -8.295 -13.540 1.00 0.00 H new ATOM 0 HE2 LYS A 55 17.130 -8.634 -14.383 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.022 -9.397 -15.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.944 -7.558 -16.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.671 -8.053 -17.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.507 -6.655 -16.188 1.00 0.00 H new ATOM 841 N THR A 56 11.087 -8.336 -16.951 1.00 0.00 N ATOM 842 CA THR A 56 10.366 -9.498 -17.557 1.00 0.00 C ATOM 843 C THR A 56 11.433 -10.428 -18.211 1.00 0.00 C ATOM 844 O THR A 56 11.963 -10.117 -19.282 1.00 0.00 O ATOM 845 CB THR A 56 9.242 -8.961 -18.497 1.00 0.00 C ATOM 846 OG1 THR A 56 8.272 -8.265 -17.715 1.00 0.00 O ATOM 847 CG2 THR A 56 8.453 -10.021 -19.274 1.00 0.00 C ATOM 0 H THR A 56 11.933 -8.071 -17.455 1.00 0.00 H new ATOM 0 HA THR A 56 9.840 -10.117 -16.830 1.00 0.00 H new ATOM 0 HB THR A 56 9.775 -8.345 -19.221 1.00 0.00 H new ATOM 0 HG1 THR A 56 8.560 -8.245 -16.778 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.700 -9.533 -19.893 1.00 0.00 H new ATOM 0 HG22 THR A 56 9.133 -10.588 -19.909 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.964 -10.697 -18.573 1.00 0.00 H new ATOM 855 N GLU A 57 11.762 -11.548 -17.541 1.00 0.00 N ATOM 856 CA GLU A 57 12.874 -12.454 -17.942 1.00 0.00 C ATOM 857 C GLU A 57 12.359 -13.686 -18.751 1.00 0.00 C ATOM 858 O GLU A 57 11.672 -14.565 -18.222 1.00 0.00 O ATOM 859 CB GLU A 57 13.635 -12.919 -16.669 1.00 0.00 C ATOM 860 CG GLU A 57 14.592 -11.875 -16.038 1.00 0.00 C ATOM 861 CD GLU A 57 15.259 -12.278 -14.727 1.00 0.00 C ATOM 862 OE1 GLU A 57 15.292 -13.471 -14.361 1.00 0.00 O ATOM 863 OE2 GLU A 57 15.719 -11.373 -14.003 1.00 0.00 O ATOM 0 H GLU A 57 11.268 -11.858 -16.704 1.00 0.00 H new ATOM 0 HA GLU A 57 13.548 -11.902 -18.597 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.902 -13.214 -15.918 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.212 -13.810 -16.918 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.373 -11.644 -16.763 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.032 -10.955 -15.869 1.00 0.00 H new ATOM 870 N SER A 58 12.748 -13.761 -20.032 1.00 0.00 N ATOM 871 CA SER A 58 12.572 -14.974 -20.879 1.00 0.00 C ATOM 872 C SER A 58 13.741 -15.097 -21.907 1.00 0.00 C ATOM 873 O SER A 58 14.136 -14.113 -22.548 1.00 0.00 O ATOM 874 CB SER A 58 11.204 -14.920 -21.604 1.00 0.00 C ATOM 875 OG SER A 58 10.981 -16.079 -22.411 1.00 0.00 O ATOM 0 H SER A 58 13.196 -12.986 -20.521 1.00 0.00 H new ATOM 0 HA SER A 58 12.591 -15.857 -20.240 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.406 -14.832 -20.867 1.00 0.00 H new ATOM 0 HB3 SER A 58 11.160 -14.028 -22.229 1.00 0.00 H new ATOM 0 HG SER A 58 10.569 -15.813 -23.259 1.00 0.00 H new ATOM 881 N THR A 59 14.232 -16.331 -22.138 1.00 0.00 N ATOM 882 CA THR A 59 15.154 -16.643 -23.284 1.00 0.00 C ATOM 883 C THR A 59 14.685 -16.255 -24.732 1.00 0.00 C ATOM 884 O THR A 59 15.524 -16.021 -25.604 1.00 0.00 O ATOM 885 CB THR A 59 15.590 -18.140 -23.217 1.00 0.00 C ATOM 886 OG1 THR A 59 16.725 -18.338 -24.054 1.00 0.00 O ATOM 887 CG2 THR A 59 14.549 -19.203 -23.614 1.00 0.00 C ATOM 0 H THR A 59 14.014 -17.138 -21.554 1.00 0.00 H new ATOM 0 HA THR A 59 15.997 -15.970 -23.128 1.00 0.00 H new ATOM 0 HB THR A 59 15.779 -18.295 -22.155 1.00 0.00 H new ATOM 0 HG1 THR A 59 17.002 -19.277 -24.013 1.00 0.00 H new ATOM 0 HG21 THR A 59 14.989 -20.196 -23.520 1.00 0.00 H new ATOM 0 HG22 THR A 59 13.682 -19.126 -22.958 1.00 0.00 H new ATOM 0 HG23 THR A 59 14.238 -19.040 -24.646 1.00 0.00 H new ATOM 895 N LEU A 60 13.367 -16.237 -24.978 1.00 0.00 N ATOM 896 CA LEU A 60 12.767 -15.846 -26.281 1.00 0.00 C ATOM 897 C LEU A 60 12.565 -14.302 -26.432 1.00 0.00 C ATOM 898 O LEU A 60 12.940 -13.749 -27.471 1.00 0.00 O ATOM 899 CB LEU A 60 11.451 -16.659 -26.447 1.00 0.00 C ATOM 900 CG LEU A 60 11.607 -18.199 -26.603 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.269 -18.908 -26.357 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.124 -18.594 -27.998 1.00 0.00 C ATOM 0 H LEU A 60 12.673 -16.495 -24.277 1.00 0.00 H new ATOM 0 HA LEU A 60 13.455 -16.088 -27.091 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.818 -16.465 -25.581 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.922 -16.279 -27.321 1.00 0.00 H new ATOM 0 HG LEU A 60 12.340 -18.511 -25.859 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.401 -19.984 -26.471 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.922 -18.690 -25.347 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.532 -18.554 -27.078 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.216 -19.678 -28.058 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.423 -18.247 -28.757 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.099 -18.137 -28.168 1.00 0.00 H new ATOM 914 N LYS A 61 12.001 -13.595 -25.427 1.00 0.00 N ATOM 915 CA LYS A 61 12.004 -12.107 -25.397 1.00 0.00 C ATOM 916 C LYS A 61 12.086 -11.579 -23.929 1.00 0.00 C ATOM 917 O LYS A 61 11.099 -11.585 -23.189 1.00 0.00 O ATOM 918 CB LYS A 61 10.782 -11.559 -26.183 1.00 0.00 C ATOM 919 CG LYS A 61 10.733 -10.026 -26.402 1.00 0.00 C ATOM 920 CD LYS A 61 11.884 -9.435 -27.257 1.00 0.00 C ATOM 921 CE LYS A 61 12.943 -8.662 -26.448 1.00 0.00 C ATOM 922 NZ LYS A 61 13.950 -8.064 -27.366 1.00 0.00 N ATOM 0 H LYS A 61 11.538 -14.025 -24.626 1.00 0.00 H new ATOM 0 HA LYS A 61 12.897 -11.733 -25.898 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.758 -12.044 -27.159 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.876 -11.858 -25.656 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.785 -9.775 -26.878 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.740 -9.537 -25.428 1.00 0.00 H new ATOM 0 HD2 LYS A 61 12.375 -10.246 -27.794 1.00 0.00 H new ATOM 0 HD3 LYS A 61 11.458 -8.768 -28.007 1.00 0.00 H new ATOM 0 HE2 LYS A 61 12.463 -7.879 -25.861 1.00 0.00 H new ATOM 0 HE3 LYS A 61 13.435 -9.332 -25.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 14.660 -7.545 -26.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 14.418 -8.819 -27.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 13.477 -7.410 -28.022 1.00 0.00 H new ATOM 936 N THR A 62 13.267 -11.065 -23.543 1.00 0.00 N ATOM 937 CA THR A 62 13.460 -10.340 -22.249 1.00 0.00 C ATOM 938 C THR A 62 13.197 -8.803 -22.429 1.00 0.00 C ATOM 939 O THR A 62 13.676 -8.181 -23.385 1.00 0.00 O ATOM 940 CB THR A 62 14.877 -10.681 -21.689 1.00 0.00 C ATOM 941 OG1 THR A 62 14.916 -12.041 -21.266 1.00 0.00 O ATOM 942 CG2 THR A 62 15.320 -9.886 -20.448 1.00 0.00 C ATOM 0 H THR A 62 14.115 -11.133 -24.105 1.00 0.00 H new ATOM 0 HA THR A 62 12.731 -10.669 -21.508 1.00 0.00 H new ATOM 0 HB THR A 62 15.538 -10.436 -22.520 1.00 0.00 H new ATOM 0 HG1 THR A 62 14.873 -12.629 -22.049 1.00 0.00 H new ATOM 0 HG21 THR A 62 16.318 -10.206 -20.148 1.00 0.00 H new ATOM 0 HG22 THR A 62 15.336 -8.822 -20.684 1.00 0.00 H new ATOM 0 HG23 THR A 62 14.621 -10.066 -19.632 1.00 0.00 H new ATOM 950 N THR A 63 12.441 -8.200 -21.493 1.00 0.00 N ATOM 951 CA THR A 63 12.160 -6.725 -21.476 1.00 0.00 C ATOM 952 C THR A 63 12.329 -6.123 -20.036 1.00 0.00 C ATOM 953 O THR A 63 12.283 -6.829 -19.023 1.00 0.00 O ATOM 954 CB THR A 63 10.756 -6.387 -22.085 1.00 0.00 C ATOM 955 OG1 THR A 63 9.724 -7.137 -21.461 1.00 0.00 O ATOM 956 CG2 THR A 63 10.629 -6.620 -23.597 1.00 0.00 C ATOM 0 H THR A 63 12.002 -8.706 -20.724 1.00 0.00 H new ATOM 0 HA THR A 63 12.904 -6.251 -22.116 1.00 0.00 H new ATOM 0 HB THR A 63 10.653 -5.318 -21.898 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.861 -6.902 -21.862 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.622 -6.358 -23.922 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.354 -5.999 -24.123 1.00 0.00 H new ATOM 0 HG23 THR A 63 10.821 -7.669 -23.821 1.00 0.00 H new ATOM 964 N GLN A 64 12.549 -4.795 -19.937 1.00 0.00 N ATOM 965 CA GLN A 64 12.637 -4.080 -18.629 1.00 0.00 C ATOM 966 C GLN A 64 12.152 -2.602 -18.771 1.00 0.00 C ATOM 967 O GLN A 64 12.607 -1.873 -19.659 1.00 0.00 O ATOM 968 CB GLN A 64 14.089 -4.178 -18.077 1.00 0.00 C ATOM 969 CG GLN A 64 14.271 -3.685 -16.618 1.00 0.00 C ATOM 970 CD GLN A 64 15.700 -3.839 -16.085 1.00 0.00 C ATOM 971 OE1 GLN A 64 16.245 -4.935 -15.976 1.00 0.00 O ATOM 972 NE2 GLN A 64 16.354 -2.762 -15.725 1.00 0.00 N ATOM 0 H GLN A 64 12.671 -4.187 -20.747 1.00 0.00 H new ATOM 0 HA GLN A 64 11.973 -4.557 -17.908 1.00 0.00 H new ATOM 0 HB2 GLN A 64 14.415 -5.216 -18.137 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.748 -3.599 -18.725 1.00 0.00 H new ATOM 0 HG2 GLN A 64 13.983 -2.635 -16.561 1.00 0.00 H new ATOM 0 HG3 GLN A 64 13.590 -4.238 -15.970 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.914 -1.846 -15.810 1.00 0.00 H new ATOM 0 HE22 GLN A 64 17.303 -2.840 -15.360 1.00 0.00 H new ATOM 981 N PHE A 65 11.259 -2.153 -17.870 1.00 0.00 N ATOM 982 CA PHE A 65 10.736 -0.757 -17.862 1.00 0.00 C ATOM 983 C PHE A 65 10.494 -0.205 -16.417 1.00 0.00 C ATOM 984 O PHE A 65 10.341 -0.957 -15.448 1.00 0.00 O ATOM 985 CB PHE A 65 9.483 -0.654 -18.786 1.00 0.00 C ATOM 986 CG PHE A 65 8.214 -1.462 -18.425 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.368 -1.039 -17.393 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.848 -2.571 -19.195 1.00 0.00 C ATOM 989 CE1 PHE A 65 6.166 -1.699 -17.152 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.648 -3.235 -18.948 1.00 0.00 C ATOM 991 CZ PHE A 65 5.805 -2.793 -17.932 1.00 0.00 C ATOM 0 H PHE A 65 10.876 -2.737 -17.127 1.00 0.00 H new ATOM 0 HA PHE A 65 11.504 -0.102 -18.274 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.199 0.397 -18.839 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.789 -0.953 -19.789 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.649 -0.196 -16.780 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.499 -2.915 -19.985 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.514 -1.362 -16.360 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.372 -4.092 -19.544 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.869 -3.300 -17.749 1.00 0.00 H new ATOM 1001 N SER A 66 10.410 1.131 -16.283 1.00 0.00 N ATOM 1002 CA SER A 66 9.995 1.803 -15.020 1.00 0.00 C ATOM 1003 C SER A 66 9.051 3.024 -15.266 1.00 0.00 C ATOM 1004 O SER A 66 9.177 3.754 -16.256 1.00 0.00 O ATOM 1005 CB SER A 66 11.242 2.177 -14.181 1.00 0.00 C ATOM 1006 OG SER A 66 12.061 3.156 -14.825 1.00 0.00 O ATOM 0 H SER A 66 10.625 1.781 -17.039 1.00 0.00 H new ATOM 0 HA SER A 66 9.400 1.094 -14.445 1.00 0.00 H new ATOM 0 HB2 SER A 66 10.923 2.557 -13.210 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.832 1.280 -13.994 1.00 0.00 H new ATOM 0 HG SER A 66 12.833 3.361 -14.258 1.00 0.00 H new ATOM 1012 N CYS A 67 8.103 3.243 -14.336 1.00 0.00 N ATOM 1013 CA CYS A 67 7.166 4.397 -14.372 1.00 0.00 C ATOM 1014 C CYS A 67 7.055 5.119 -12.990 1.00 0.00 C ATOM 1015 O CYS A 67 7.336 4.559 -11.925 1.00 0.00 O ATOM 1016 CB CYS A 67 5.793 3.869 -14.840 1.00 0.00 C ATOM 1017 SG CYS A 67 4.688 5.277 -15.223 1.00 0.00 S ATOM 0 H CYS A 67 7.960 2.628 -13.535 1.00 0.00 H new ATOM 0 HA CYS A 67 7.544 5.149 -15.065 1.00 0.00 H new ATOM 0 HB2 CYS A 67 5.916 3.240 -15.722 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.348 3.246 -14.064 1.00 0.00 H new ATOM 0 HG CYS A 67 4.347 5.874 -14.119 1.00 0.00 H new ATOM 1023 N THR A 68 6.584 6.377 -13.014 1.00 0.00 N ATOM 1024 CA THR A 68 6.094 7.074 -11.787 1.00 0.00 C ATOM 1025 C THR A 68 4.556 6.816 -11.615 1.00 0.00 C ATOM 1026 O THR A 68 3.776 6.927 -12.566 1.00 0.00 O ATOM 1027 CB THR A 68 6.473 8.580 -11.880 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.873 8.720 -12.097 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.173 9.379 -10.608 1.00 0.00 C ATOM 0 H THR A 68 6.527 6.941 -13.862 1.00 0.00 H new ATOM 0 HA THR A 68 6.570 6.682 -10.888 1.00 0.00 H new ATOM 0 HB THR A 68 5.868 8.967 -12.700 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.101 9.671 -12.156 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.466 10.419 -10.754 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.106 9.329 -10.390 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.733 8.958 -9.773 1.00 0.00 H new ATOM 1037 N LEU A 69 4.130 6.451 -10.395 1.00 0.00 N ATOM 1038 CA LEU A 69 2.752 5.973 -10.110 1.00 0.00 C ATOM 1039 C LEU A 69 1.678 7.112 -10.133 1.00 0.00 C ATOM 1040 O LEU A 69 1.846 8.145 -9.476 1.00 0.00 O ATOM 1041 CB LEU A 69 2.824 5.277 -8.723 1.00 0.00 C ATOM 1042 CG LEU A 69 1.587 4.428 -8.342 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.613 3.057 -9.035 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.506 4.254 -6.819 1.00 0.00 C ATOM 0 H LEU A 69 4.729 6.476 -9.570 1.00 0.00 H new ATOM 0 HA LEU A 69 2.424 5.288 -10.892 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.705 4.635 -8.703 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.969 6.041 -7.959 1.00 0.00 H new ATOM 0 HG LEU A 69 0.699 4.960 -8.685 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.730 2.486 -8.746 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.617 3.196 -10.116 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.510 2.515 -8.735 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.631 3.655 -6.567 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.405 3.751 -6.462 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.425 5.232 -6.345 1.00 0.00 H new ATOM 1056 N GLY A 70 0.583 6.922 -10.888 1.00 0.00 N ATOM 1057 CA GLY A 70 -0.305 8.053 -11.292 1.00 0.00 C ATOM 1058 C GLY A 70 -0.058 8.564 -12.728 1.00 0.00 C ATOM 1059 O GLY A 70 -0.980 8.609 -13.544 1.00 0.00 O ATOM 0 H GLY A 70 0.284 6.010 -11.234 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.344 7.735 -11.204 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.165 8.879 -10.594 1.00 0.00 H new ATOM 1063 N GLU A 71 1.191 8.950 -13.008 1.00 0.00 N ATOM 1064 CA GLU A 71 1.635 9.519 -14.298 1.00 0.00 C ATOM 1065 C GLU A 71 1.867 8.425 -15.407 1.00 0.00 C ATOM 1066 O GLU A 71 1.651 7.216 -15.219 1.00 0.00 O ATOM 1067 CB GLU A 71 2.904 10.375 -13.953 1.00 0.00 C ATOM 1068 CG GLU A 71 2.720 11.641 -13.058 1.00 0.00 C ATOM 1069 CD GLU A 71 2.656 11.422 -11.549 1.00 0.00 C ATOM 1070 OE1 GLU A 71 1.558 11.190 -11.005 1.00 0.00 O ATOM 1071 OE2 GLU A 71 3.704 11.478 -10.871 1.00 0.00 O ATOM 0 H GLU A 71 1.948 8.876 -12.328 1.00 0.00 H new ATOM 0 HA GLU A 71 0.867 10.145 -14.753 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.623 9.721 -13.460 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.356 10.694 -14.892 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.543 12.325 -13.266 1.00 0.00 H new ATOM 0 HG3 GLU A 71 1.803 12.143 -13.366 1.00 0.00 H new ATOM 1078 N LYS A 72 2.267 8.883 -16.610 1.00 0.00 N ATOM 1079 CA LYS A 72 2.568 7.986 -17.761 1.00 0.00 C ATOM 1080 C LYS A 72 4.070 7.932 -18.198 1.00 0.00 C ATOM 1081 O LYS A 72 4.815 8.914 -18.139 1.00 0.00 O ATOM 1082 CB LYS A 72 1.598 8.259 -18.948 1.00 0.00 C ATOM 1083 CG LYS A 72 1.793 9.544 -19.793 1.00 0.00 C ATOM 1084 CD LYS A 72 1.431 9.392 -21.293 1.00 0.00 C ATOM 1085 CE LYS A 72 -0.065 9.373 -21.678 1.00 0.00 C ATOM 1086 NZ LYS A 72 -0.725 8.066 -21.393 1.00 0.00 N ATOM 0 H LYS A 72 2.392 9.874 -16.818 1.00 0.00 H new ATOM 0 HA LYS A 72 2.385 6.976 -17.395 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.657 7.407 -19.625 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.584 8.278 -18.548 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.184 10.340 -19.365 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.833 9.860 -19.714 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.905 10.209 -21.836 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.881 8.467 -21.653 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.584 10.162 -21.134 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.164 9.600 -22.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.752 8.207 -21.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.528 7.401 -22.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.356 7.678 -20.502 1.00 0.00 H new ATOM 1100 N PHE A 73 4.453 6.758 -18.715 1.00 0.00 N ATOM 1101 CA PHE A 73 5.708 6.539 -19.491 1.00 0.00 C ATOM 1102 C PHE A 73 5.382 6.227 -20.996 1.00 0.00 C ATOM 1103 O PHE A 73 4.233 6.317 -21.442 1.00 0.00 O ATOM 1104 CB PHE A 73 6.553 5.469 -18.723 1.00 0.00 C ATOM 1105 CG PHE A 73 6.126 3.982 -18.798 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.903 3.558 -18.264 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.966 3.038 -19.399 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.525 2.223 -18.333 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.584 1.701 -19.467 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.365 1.296 -18.929 1.00 0.00 C ATOM 0 H PHE A 73 3.897 5.909 -18.611 1.00 0.00 H new ATOM 0 HA PHE A 73 6.327 7.434 -19.556 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.578 5.536 -19.087 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.569 5.755 -17.671 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.247 4.276 -17.794 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.915 3.348 -19.812 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.577 1.908 -17.922 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.233 0.977 -19.937 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.074 0.257 -18.976 1.00 0.00 H new ATOM 1120 N GLU A 74 6.395 5.851 -21.788 1.00 0.00 N ATOM 1121 CA GLU A 74 6.178 5.192 -23.109 1.00 0.00 C ATOM 1122 C GLU A 74 6.744 3.736 -23.077 1.00 0.00 C ATOM 1123 O GLU A 74 7.959 3.510 -23.056 1.00 0.00 O ATOM 1124 CB GLU A 74 6.742 6.091 -24.236 1.00 0.00 C ATOM 1125 CG GLU A 74 6.430 5.597 -25.669 1.00 0.00 C ATOM 1126 CD GLU A 74 6.885 6.569 -26.741 1.00 0.00 C ATOM 1127 OE1 GLU A 74 6.246 7.632 -26.888 1.00 0.00 O ATOM 1128 OE2 GLU A 74 7.858 6.262 -27.458 1.00 0.00 O ATOM 0 H GLU A 74 7.377 5.986 -21.548 1.00 0.00 H new ATOM 0 HA GLU A 74 5.115 5.082 -23.326 1.00 0.00 H new ATOM 0 HB2 GLU A 74 6.339 7.097 -24.117 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.823 6.164 -24.118 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.915 4.634 -25.829 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.357 5.434 -25.766 1.00 0.00 H new ATOM 1135 N GLU A 75 5.838 2.744 -23.090 1.00 0.00 N ATOM 1136 CA GLU A 75 6.191 1.309 -23.177 1.00 0.00 C ATOM 1137 C GLU A 75 6.397 0.906 -24.672 1.00 0.00 C ATOM 1138 O GLU A 75 5.435 0.715 -25.432 1.00 0.00 O ATOM 1139 CB GLU A 75 5.058 0.519 -22.468 1.00 0.00 C ATOM 1140 CG GLU A 75 5.337 -0.989 -22.249 1.00 0.00 C ATOM 1141 CD GLU A 75 4.221 -1.812 -21.611 1.00 0.00 C ATOM 1142 OE1 GLU A 75 3.112 -1.294 -21.339 1.00 0.00 O ATOM 1143 OE2 GLU A 75 4.448 -3.020 -21.396 1.00 0.00 O ATOM 0 H GLU A 75 4.833 2.912 -23.040 1.00 0.00 H new ATOM 0 HA GLU A 75 7.133 1.081 -22.679 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.868 0.981 -21.499 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.145 0.621 -23.055 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.577 -1.433 -23.215 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.226 -1.083 -21.626 1.00 0.00 H new ATOM 1150 N THR A 76 7.673 0.778 -25.081 1.00 0.00 N ATOM 1151 CA THR A 76 8.048 0.232 -26.418 1.00 0.00 C ATOM 1152 C THR A 76 7.917 -1.325 -26.400 1.00 0.00 C ATOM 1153 O THR A 76 8.771 -2.047 -25.878 1.00 0.00 O ATOM 1154 CB THR A 76 9.442 0.782 -26.845 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.378 2.199 -26.987 1.00 0.00 O ATOM 1156 CG2 THR A 76 9.968 0.244 -28.187 1.00 0.00 C ATOM 0 H THR A 76 8.473 1.045 -24.507 1.00 0.00 H new ATOM 0 HA THR A 76 7.363 0.572 -27.194 1.00 0.00 H new ATOM 0 HB THR A 76 10.118 0.453 -26.056 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.257 2.541 -27.254 1.00 0.00 H new ATOM 0 HG21 THR A 76 10.943 0.684 -28.398 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.063 -0.840 -28.132 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.271 0.507 -28.983 1.00 0.00 H new ATOM 1164 N THR A 77 6.798 -1.809 -26.956 1.00 0.00 N ATOM 1165 CA THR A 77 6.391 -3.243 -26.881 1.00 0.00 C ATOM 1166 C THR A 77 7.259 -4.197 -27.770 1.00 0.00 C ATOM 1167 O THR A 77 7.902 -3.768 -28.734 1.00 0.00 O ATOM 1168 CB THR A 77 4.865 -3.369 -27.214 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.568 -2.867 -28.514 1.00 0.00 O ATOM 1170 CG2 THR A 77 3.917 -2.674 -26.219 1.00 0.00 C ATOM 0 H THR A 77 6.140 -1.227 -27.474 1.00 0.00 H new ATOM 0 HA THR A 77 6.572 -3.577 -25.859 1.00 0.00 H new ATOM 0 HB THR A 77 4.683 -4.442 -27.149 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.484 -1.891 -28.477 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.885 -2.819 -26.538 1.00 0.00 H new ATOM 0 HG22 THR A 77 4.054 -3.102 -25.226 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.140 -1.608 -26.188 1.00 0.00 H new ATOM 1178 N ALA A 78 7.248 -5.510 -27.452 1.00 0.00 N ATOM 1179 CA ALA A 78 7.994 -6.560 -28.214 1.00 0.00 C ATOM 1180 C ALA A 78 7.938 -6.554 -29.782 1.00 0.00 C ATOM 1181 O ALA A 78 8.971 -6.740 -30.429 1.00 0.00 O ATOM 1182 CB ALA A 78 7.525 -7.911 -27.638 1.00 0.00 C ATOM 0 H ALA A 78 6.724 -5.882 -26.660 1.00 0.00 H new ATOM 0 HA ALA A 78 9.052 -6.344 -28.067 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.035 -8.724 -28.155 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.759 -7.954 -26.574 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.449 -8.012 -27.777 1.00 0.00 H new ATOM 1188 N ASP A 79 6.761 -6.292 -30.372 1.00 0.00 N ATOM 1189 CA ASP A 79 6.598 -6.024 -31.828 1.00 0.00 C ATOM 1190 C ASP A 79 7.307 -4.746 -32.409 1.00 0.00 C ATOM 1191 O ASP A 79 7.741 -4.761 -33.564 1.00 0.00 O ATOM 1192 CB ASP A 79 5.081 -5.865 -32.126 1.00 0.00 C ATOM 1193 CG ASP A 79 4.099 -6.960 -31.731 1.00 0.00 C ATOM 1194 OD1 ASP A 79 3.903 -7.200 -30.520 1.00 0.00 O ATOM 1195 OD2 ASP A 79 3.343 -7.405 -32.613 1.00 0.00 O ATOM 0 H ASP A 79 5.882 -6.258 -29.856 1.00 0.00 H new ATOM 0 HA ASP A 79 7.079 -6.875 -32.310 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.752 -4.946 -31.640 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.978 -5.712 -33.200 1.00 0.00 H new ATOM 1200 N GLY A 80 7.310 -3.623 -31.665 1.00 0.00 N ATOM 1201 CA GLY A 80 7.544 -2.266 -32.235 1.00 0.00 C ATOM 1202 C GLY A 80 6.519 -1.148 -31.904 1.00 0.00 C ATOM 1203 O GLY A 80 6.860 0.022 -32.096 1.00 0.00 O ATOM 0 H GLY A 80 7.152 -3.622 -30.657 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.525 -1.929 -31.901 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.593 -2.364 -33.320 1.00 0.00 H new ATOM 1207 N ARG A 81 5.289 -1.453 -31.427 1.00 0.00 N ATOM 1208 CA ARG A 81 4.281 -0.415 -31.051 1.00 0.00 C ATOM 1209 C ARG A 81 4.729 0.366 -29.770 1.00 0.00 C ATOM 1210 O ARG A 81 4.899 -0.228 -28.696 1.00 0.00 O ATOM 1211 CB ARG A 81 2.869 -1.028 -30.812 1.00 0.00 C ATOM 1212 CG ARG A 81 2.159 -1.721 -32.007 1.00 0.00 C ATOM 1213 CD ARG A 81 0.802 -2.386 -31.643 1.00 0.00 C ATOM 1214 NE ARG A 81 0.939 -3.489 -30.649 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.472 -4.685 -30.906 1.00 0.00 C ATOM 1216 NH1 ARG A 81 1.527 -5.208 -32.106 1.00 0.00 N ATOM 1217 NH2 ARG A 81 1.977 -5.357 -29.911 1.00 0.00 N ATOM 0 H ARG A 81 4.964 -2.410 -31.291 1.00 0.00 H new ATOM 0 HA ARG A 81 4.218 0.274 -31.893 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.955 -1.758 -30.007 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.217 -0.232 -30.453 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.991 -0.984 -32.792 1.00 0.00 H new ATOM 0 HG3 ARG A 81 2.824 -2.480 -32.420 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.128 -1.628 -31.245 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.341 -2.777 -32.550 1.00 0.00 H new ATOM 0 HE ARG A 81 0.600 -3.317 -29.703 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.150 -4.696 -32.903 1.00 0.00 H new ATOM 0 HH12 ARG A 81 1.947 -6.128 -32.243 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.957 -4.966 -28.969 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.392 -6.274 -30.074 1.00 0.00 H new ATOM 1231 N LYS A 82 4.917 1.690 -29.907 1.00 0.00 N ATOM 1232 CA LYS A 82 5.342 2.570 -28.784 1.00 0.00 C ATOM 1233 C LYS A 82 4.091 3.149 -28.065 1.00 0.00 C ATOM 1234 O LYS A 82 3.353 3.968 -28.623 1.00 0.00 O ATOM 1235 CB LYS A 82 6.295 3.680 -29.292 1.00 0.00 C ATOM 1236 CG LYS A 82 7.636 3.177 -29.874 1.00 0.00 C ATOM 1237 CD LYS A 82 8.670 4.314 -30.014 1.00 0.00 C ATOM 1238 CE LYS A 82 9.991 3.923 -30.699 1.00 0.00 C ATOM 1239 NZ LYS A 82 9.794 3.689 -32.156 1.00 0.00 N ATOM 0 H LYS A 82 4.782 2.185 -30.788 1.00 0.00 H new ATOM 0 HA LYS A 82 5.901 1.984 -28.054 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.778 4.258 -30.058 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.507 4.361 -28.468 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.041 2.397 -29.229 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.460 2.725 -30.850 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.215 5.129 -30.578 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.896 4.701 -29.020 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.728 4.713 -30.551 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.392 3.022 -30.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.701 3.427 -32.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.109 2.919 -32.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.434 4.557 -32.602 1.00 0.00 H new ATOM 1253 N THR A 83 3.836 2.662 -26.843 1.00 0.00 N ATOM 1254 CA THR A 83 2.510 2.806 -26.184 1.00 0.00 C ATOM 1255 C THR A 83 2.608 3.772 -24.972 1.00 0.00 C ATOM 1256 O THR A 83 3.208 3.458 -23.940 1.00 0.00 O ATOM 1257 CB THR A 83 1.902 1.419 -25.816 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.687 0.720 -24.861 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.685 0.447 -26.984 1.00 0.00 C ATOM 0 H THR A 83 4.526 2.162 -26.282 1.00 0.00 H new ATOM 0 HA THR A 83 1.814 3.256 -26.892 1.00 0.00 H new ATOM 0 HB THR A 83 0.927 1.705 -25.421 1.00 0.00 H new ATOM 0 HG1 THR A 83 3.629 0.744 -25.131 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.258 -0.483 -26.609 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.002 0.894 -27.707 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.640 0.239 -27.467 1.00 0.00 H new ATOM 1267 N GLN A 84 1.982 4.950 -25.088 1.00 0.00 N ATOM 1268 CA GLN A 84 1.996 6.015 -24.053 1.00 0.00 C ATOM 1269 C GLN A 84 1.107 5.581 -22.839 1.00 0.00 C ATOM 1270 O GLN A 84 -0.126 5.674 -22.869 1.00 0.00 O ATOM 1271 CB GLN A 84 1.523 7.340 -24.728 1.00 0.00 C ATOM 1272 CG GLN A 84 2.461 7.996 -25.786 1.00 0.00 C ATOM 1273 CD GLN A 84 2.515 7.296 -27.156 1.00 0.00 C ATOM 1274 OE1 GLN A 84 1.503 6.972 -27.768 1.00 0.00 O ATOM 1275 NE2 GLN A 84 3.678 7.004 -27.680 1.00 0.00 N ATOM 0 H GLN A 84 1.440 5.203 -25.914 1.00 0.00 H new ATOM 0 HA GLN A 84 2.996 6.180 -23.651 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.563 7.147 -25.207 1.00 0.00 H new ATOM 0 HB3 GLN A 84 1.345 8.072 -23.940 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.142 9.027 -25.938 1.00 0.00 H new ATOM 0 HG3 GLN A 84 3.471 8.032 -25.377 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.536 7.262 -27.193 1.00 0.00 H new ATOM 0 HE22 GLN A 84 3.726 6.519 -28.576 1.00 0.00 H new ATOM 1284 N THR A 85 1.743 5.046 -21.786 1.00 0.00 N ATOM 1285 CA THR A 85 1.102 4.076 -20.853 1.00 0.00 C ATOM 1286 C THR A 85 1.014 4.666 -19.414 1.00 0.00 C ATOM 1287 O THR A 85 2.039 4.971 -18.800 1.00 0.00 O ATOM 1288 CB THR A 85 1.864 2.716 -20.921 1.00 0.00 C ATOM 1289 OG1 THR A 85 1.789 2.173 -22.238 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.299 1.612 -20.011 1.00 0.00 C ATOM 0 H THR A 85 2.711 5.265 -21.549 1.00 0.00 H new ATOM 0 HA THR A 85 0.072 3.887 -21.157 1.00 0.00 H new ATOM 0 HB THR A 85 2.875 2.968 -20.600 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.420 2.643 -22.822 1.00 0.00 H new ATOM 0 HG21 THR A 85 1.893 0.706 -20.127 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.338 1.941 -18.973 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.265 1.406 -20.288 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.209 4.806 -18.868 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.423 5.240 -17.446 1.00 0.00 C ATOM 1300 C VAL A 86 -0.224 4.022 -16.480 1.00 0.00 C ATOM 1301 O VAL A 86 -0.856 2.983 -16.691 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.840 5.885 -17.203 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -1.906 6.643 -15.857 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -2.366 6.864 -18.278 1.00 0.00 C ATOM 0 H VAL A 86 -1.074 4.628 -19.379 1.00 0.00 H new ATOM 0 HA VAL A 86 0.318 6.012 -17.239 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.479 5.002 -17.229 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.900 7.072 -15.729 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -1.702 5.951 -15.040 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -1.163 7.441 -15.852 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.349 7.232 -17.985 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.678 7.704 -18.374 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.443 6.347 -19.235 1.00 0.00 H new ATOM 1314 N CYS A 87 0.586 4.157 -15.410 1.00 0.00 N ATOM 1315 CA CYS A 87 0.603 3.153 -14.303 1.00 0.00 C ATOM 1316 C CYS A 87 -0.098 3.741 -13.041 1.00 0.00 C ATOM 1317 O CYS A 87 0.520 4.465 -12.256 1.00 0.00 O ATOM 1318 CB CYS A 87 2.055 2.717 -14.013 1.00 0.00 C ATOM 1319 SG CYS A 87 2.854 1.993 -15.485 1.00 0.00 S ATOM 0 H CYS A 87 1.232 4.936 -15.281 1.00 0.00 H new ATOM 0 HA CYS A 87 0.047 2.264 -14.601 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.631 3.577 -13.673 1.00 0.00 H new ATOM 0 HB3 CYS A 87 2.060 1.989 -13.202 1.00 0.00 H new ATOM 0 HG CYS A 87 3.351 2.943 -16.220 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.395 3.448 -12.855 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.232 4.089 -11.796 1.00 0.00 C ATOM 1327 C ASN A 88 -2.945 3.025 -10.901 1.00 0.00 C ATOM 1328 O ASN A 88 -3.650 2.144 -11.398 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.187 5.145 -12.426 1.00 0.00 C ATOM 1330 CG ASN A 88 -4.181 4.695 -13.516 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -3.825 4.161 -14.561 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -5.455 4.946 -13.347 1.00 0.00 N ATOM 0 H ASN A 88 -1.901 2.768 -13.422 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.586 4.637 -11.110 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.765 5.591 -11.617 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.569 5.937 -12.850 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -6.125 4.698 -14.075 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.778 5.389 -12.487 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.748 3.092 -9.571 1.00 0.00 N ATOM 1340 CA PHE A 89 -3.290 2.078 -8.624 1.00 0.00 C ATOM 1341 C PHE A 89 -4.731 2.405 -8.097 1.00 0.00 C ATOM 1342 O PHE A 89 -5.040 3.549 -7.749 1.00 0.00 O ATOM 1343 CB PHE A 89 -2.240 1.934 -7.486 1.00 0.00 C ATOM 1344 CG PHE A 89 -2.526 0.791 -6.503 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -2.208 -0.530 -6.836 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -3.174 1.058 -5.291 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.546 -1.569 -5.974 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -3.512 0.017 -4.434 1.00 0.00 C ATOM 1349 CZ PHE A 89 -3.204 -1.294 -4.781 1.00 0.00 C ATOM 0 H PHE A 89 -2.217 3.837 -9.119 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.434 1.128 -9.139 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.258 1.777 -7.932 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.192 2.871 -6.931 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.699 -0.744 -7.764 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.412 2.076 -5.021 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.297 -2.588 -6.232 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -4.013 0.226 -3.500 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.478 -2.103 -4.120 1.00 0.00 H new ATOM 1359 N THR A 90 -5.576 1.363 -7.969 1.00 0.00 N ATOM 1360 CA THR A 90 -6.903 1.458 -7.291 1.00 0.00 C ATOM 1361 C THR A 90 -7.141 0.230 -6.350 1.00 0.00 C ATOM 1362 O THR A 90 -7.268 -0.903 -6.824 1.00 0.00 O ATOM 1363 CB THR A 90 -8.048 1.712 -8.322 1.00 0.00 C ATOM 1364 OG1 THR A 90 -9.272 1.928 -7.632 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.320 0.618 -9.371 1.00 0.00 C ATOM 0 H THR A 90 -5.368 0.431 -8.328 1.00 0.00 H new ATOM 0 HA THR A 90 -6.907 2.331 -6.638 1.00 0.00 H new ATOM 0 HB THR A 90 -7.683 2.576 -8.878 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.989 2.089 -8.280 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.140 0.930 -10.018 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.424 0.459 -9.971 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.589 -0.310 -8.867 1.00 0.00 H new ATOM 1373 N ASP A 91 -7.238 0.468 -5.021 1.00 0.00 N ATOM 1374 CA ASP A 91 -7.668 -0.542 -3.998 1.00 0.00 C ATOM 1375 C ASP A 91 -6.716 -1.782 -3.826 1.00 0.00 C ATOM 1376 O ASP A 91 -5.856 -1.791 -2.941 1.00 0.00 O ATOM 1377 CB ASP A 91 -9.198 -0.812 -4.144 1.00 0.00 C ATOM 1378 CG ASP A 91 -9.823 -1.612 -3.005 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -10.004 -1.049 -1.905 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -10.135 -2.804 -3.211 1.00 0.00 O ATOM 0 H ASP A 91 -7.019 1.377 -4.613 1.00 0.00 H new ATOM 0 HA ASP A 91 -7.536 -0.112 -3.005 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.715 0.145 -4.222 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -9.370 -1.345 -5.079 1.00 0.00 H new ATOM 1385 N GLY A 92 -6.859 -2.795 -4.693 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.881 -3.915 -4.821 1.00 0.00 C ATOM 1387 C GLY A 92 -5.379 -4.240 -6.253 1.00 0.00 C ATOM 1388 O GLY A 92 -5.060 -5.401 -6.525 1.00 0.00 O ATOM 0 H GLY A 92 -7.652 -2.872 -5.330 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.015 -3.683 -4.201 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.337 -4.814 -4.408 1.00 0.00 H new ATOM 1392 N ALA A 93 -5.301 -3.242 -7.156 1.00 0.00 N ATOM 1393 CA ALA A 93 -5.038 -3.457 -8.599 1.00 0.00 C ATOM 1394 C ALA A 93 -4.231 -2.288 -9.241 1.00 0.00 C ATOM 1395 O ALA A 93 -4.616 -1.118 -9.130 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.406 -3.615 -9.295 1.00 0.00 C ATOM 0 H ALA A 93 -5.419 -2.260 -6.907 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.423 -4.349 -8.723 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.255 -3.776 -10.362 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.934 -4.469 -8.871 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.997 -2.712 -9.144 1.00 0.00 H new ATOM 1402 N LEU A 94 -3.140 -2.604 -9.969 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.456 -1.612 -10.846 1.00 0.00 C ATOM 1404 C LEU A 94 -3.102 -1.593 -12.263 1.00 0.00 C ATOM 1405 O LEU A 94 -3.079 -2.592 -12.990 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.936 -1.915 -10.922 1.00 0.00 C ATOM 1407 CG LEU A 94 -0.068 -0.878 -11.691 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.118 0.412 -10.877 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.299 -1.479 -12.054 1.00 0.00 C ATOM 0 H LEU A 94 -2.711 -3.529 -9.972 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.580 -0.619 -10.413 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.552 -1.997 -9.905 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.804 -2.889 -11.393 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.596 -0.623 -12.610 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.729 1.115 -11.443 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.856 0.858 -10.675 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.613 0.179 -9.934 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.891 -0.738 -12.591 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.822 -1.770 -11.143 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.155 -2.356 -12.686 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.616 -0.427 -12.669 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.171 -0.209 -14.032 1.00 0.00 C ATOM 1423 C VAL A 95 -2.996 0.264 -14.954 1.00 0.00 C ATOM 1424 O VAL A 95 -2.577 1.425 -14.910 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.377 0.793 -13.951 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.009 1.100 -15.324 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.537 0.324 -13.035 1.00 0.00 C ATOM 0 H VAL A 95 -3.664 0.398 -12.072 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.579 -1.121 -14.468 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.909 1.683 -13.530 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.836 1.798 -15.196 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.259 1.543 -15.979 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.380 0.176 -15.769 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.328 1.074 -13.036 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.933 -0.622 -13.405 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.166 0.189 -12.019 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.475 -0.646 -15.796 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.495 -0.306 -16.866 1.00 0.00 C ATOM 1439 C GLN A 96 -2.280 0.063 -18.172 1.00 0.00 C ATOM 1440 O GLN A 96 -2.601 -0.799 -18.995 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.506 -1.503 -16.958 1.00 0.00 C ATOM 1442 CG GLN A 96 0.581 -1.445 -18.066 1.00 0.00 C ATOM 1443 CD GLN A 96 1.498 -2.679 -18.137 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.679 -3.447 -17.194 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.122 -2.929 -19.261 1.00 0.00 N ATOM 0 H GLN A 96 -2.715 -1.637 -15.762 1.00 0.00 H new ATOM 0 HA GLN A 96 -0.889 0.578 -16.664 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.002 -1.599 -15.996 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.089 -2.412 -17.105 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.090 -1.319 -19.031 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.197 -0.561 -17.904 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.994 -2.312 -20.063 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.736 -3.741 -19.334 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.634 1.352 -18.329 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.486 1.831 -19.454 1.00 0.00 C ATOM 1456 C HIS A 97 -2.601 2.280 -20.659 1.00 0.00 C ATOM 1457 O HIS A 97 -2.129 3.421 -20.705 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.356 2.996 -18.907 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.399 3.532 -19.888 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.155 4.493 -20.860 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.655 2.958 -20.084 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.314 4.397 -21.596 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.290 3.545 -21.162 1.00 0.00 N ATOM 0 H HIS A 97 -2.345 2.092 -17.690 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.130 1.034 -19.827 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.866 2.658 -18.005 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.699 3.815 -18.614 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.072 2.167 -19.479 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.449 4.981 -22.495 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -8.227 3.386 -21.531 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.440 1.394 -21.642 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.652 1.654 -22.881 1.00 0.00 C ATOM 1474 C GLN A 98 -2.463 2.493 -23.915 1.00 0.00 C ATOM 1475 O GLN A 98 -3.610 2.143 -24.201 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.260 0.288 -23.519 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.403 -0.675 -22.657 1.00 0.00 C ATOM 1478 CD GLN A 98 0.065 -1.935 -23.399 1.00 0.00 C ATOM 1479 OE1 GLN A 98 -0.678 -2.585 -24.130 1.00 0.00 O ATOM 1480 NE2 GLN A 98 1.291 -2.359 -23.219 1.00 0.00 N ATOM 0 H GLN A 98 -2.851 0.461 -21.615 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.764 2.226 -22.611 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.177 -0.232 -23.796 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.717 0.489 -24.442 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.471 -0.137 -22.291 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.982 -0.975 -21.783 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.928 -1.837 -22.617 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.609 -3.211 -23.681 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.879 3.561 -24.490 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.525 4.361 -25.570 1.00 0.00 C ATOM 1491 C GLU A 99 -1.515 4.577 -26.744 1.00 0.00 C ATOM 1492 O GLU A 99 -0.393 5.043 -26.530 1.00 0.00 O ATOM 1493 CB GLU A 99 -3.025 5.702 -24.952 1.00 0.00 C ATOM 1494 CG GLU A 99 -4.239 6.339 -25.673 1.00 0.00 C ATOM 1495 CD GLU A 99 -4.003 6.955 -27.050 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -3.534 8.110 -27.110 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -4.304 6.299 -28.070 1.00 0.00 O ATOM 0 H GLU A 99 -0.953 3.899 -24.228 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.384 3.838 -25.989 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -3.290 5.528 -23.909 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.202 6.417 -24.957 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.008 5.573 -25.775 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -4.646 7.114 -25.024 1.00 0.00 H new ATOM 1504 N TRP A 100 -1.888 4.224 -27.983 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.034 4.443 -29.185 1.00 0.00 C ATOM 1506 C TRP A 100 -1.913 4.835 -30.412 1.00 0.00 C ATOM 1507 O TRP A 100 -2.788 4.066 -30.823 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.114 3.212 -29.456 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.775 1.908 -29.943 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -0.939 1.549 -31.298 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.464 0.950 -29.218 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.720 0.383 -31.441 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -2.046 0.042 -30.138 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.716 0.821 -27.827 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.899 -0.986 -29.676 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.553 -0.205 -27.394 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -3.150 -1.084 -28.305 1.00 0.00 C ATOM 0 H TRP A 100 -2.783 3.781 -28.191 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.364 5.282 -28.996 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.629 3.507 -30.197 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.426 2.989 -28.535 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.517 2.100 -32.125 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.983 -0.097 -32.302 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.269 1.504 -27.120 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.348 -1.682 -30.369 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.744 -0.324 -26.338 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.817 -1.852 -27.942 1.00 0.00 H new ATOM 1528 N ASP A 101 -1.665 6.005 -31.035 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.345 6.431 -32.307 1.00 0.00 C ATOM 1530 C ASP A 101 -3.930 6.336 -32.324 1.00 0.00 C ATOM 1531 O ASP A 101 -4.543 5.826 -33.269 1.00 0.00 O ATOM 1532 CB ASP A 101 -1.533 5.729 -33.443 1.00 0.00 C ATOM 1533 CG ASP A 101 -1.855 6.091 -34.887 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -1.737 7.273 -35.266 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -2.229 5.171 -35.652 1.00 0.00 O ATOM 0 H ASP A 101 -0.994 6.688 -30.685 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.309 7.510 -32.454 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -0.476 5.938 -33.275 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -1.667 4.653 -33.332 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.601 6.788 -31.243 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.061 6.538 -31.028 1.00 0.00 C ATOM 1542 C GLY A 102 -6.569 5.088 -30.774 1.00 0.00 C ATOM 1543 O GLY A 102 -7.728 4.789 -31.068 1.00 0.00 O ATOM 0 H GLY A 102 -4.162 7.330 -30.499 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.373 7.145 -30.178 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.588 6.919 -31.903 1.00 0.00 H new ATOM 1547 N LYS A 103 -5.718 4.202 -30.242 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.023 2.766 -29.988 1.00 0.00 C ATOM 1549 C LYS A 103 -5.484 2.409 -28.570 1.00 0.00 C ATOM 1550 O LYS A 103 -4.314 2.675 -28.272 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.319 1.878 -31.055 1.00 0.00 C ATOM 1552 CG LYS A 103 -5.814 2.074 -32.508 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.904 1.508 -33.602 1.00 0.00 C ATOM 1554 CE LYS A 103 -3.712 2.411 -33.921 1.00 0.00 C ATOM 1555 NZ LYS A 103 -4.092 3.594 -34.742 1.00 0.00 N ATOM 0 H LYS A 103 -4.771 4.459 -29.965 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.097 2.590 -30.046 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.248 2.080 -31.023 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.455 0.832 -30.780 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.796 1.611 -32.603 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.945 3.141 -32.687 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -4.537 0.530 -33.291 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -5.489 1.355 -34.509 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -3.259 2.750 -32.990 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -2.955 1.833 -34.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.239 4.009 -35.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -4.747 3.299 -35.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.556 4.302 -34.137 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.313 1.805 -27.698 1.00 0.00 N ATOM 1570 CA GLU A 104 -5.934 1.571 -26.276 1.00 0.00 C ATOM 1571 C GLU A 104 -6.082 0.098 -25.788 1.00 0.00 C ATOM 1572 O GLU A 104 -7.003 -0.628 -26.174 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.647 2.581 -25.336 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.186 2.458 -25.159 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.690 3.196 -23.934 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -8.644 4.442 -23.911 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -9.029 2.533 -22.930 1.00 0.00 O ATOM 0 H GLU A 104 -7.245 1.469 -27.943 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.860 1.754 -26.228 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.191 2.497 -24.350 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.433 3.585 -25.702 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.683 2.851 -26.046 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.457 1.405 -25.082 1.00 0.00 H new ATOM 1584 N SER A 105 -5.183 -0.307 -24.873 1.00 0.00 N ATOM 1585 CA SER A 105 -5.290 -1.595 -24.141 1.00 0.00 C ATOM 1586 C SER A 105 -5.020 -1.398 -22.623 1.00 0.00 C ATOM 1587 O SER A 105 -3.988 -0.863 -22.214 1.00 0.00 O ATOM 1588 CB SER A 105 -4.354 -2.656 -24.765 1.00 0.00 C ATOM 1589 OG SER A 105 -4.479 -3.911 -24.093 1.00 0.00 O ATOM 0 H SER A 105 -4.363 0.242 -24.616 1.00 0.00 H new ATOM 0 HA SER A 105 -6.311 -1.964 -24.237 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.593 -2.780 -25.821 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.321 -2.312 -24.710 1.00 0.00 H new ATOM 0 HG SER A 105 -5.282 -3.902 -23.531 1.00 0.00 H new ATOM 1595 N THR A 106 -5.953 -1.847 -21.772 1.00 0.00 N ATOM 1596 CA THR A 106 -5.821 -1.725 -20.297 1.00 0.00 C ATOM 1597 C THR A 106 -5.407 -3.098 -19.681 1.00 0.00 C ATOM 1598 O THR A 106 -6.004 -4.142 -19.965 1.00 0.00 O ATOM 1599 CB THR A 106 -7.148 -1.161 -19.729 1.00 0.00 C ATOM 1600 OG1 THR A 106 -7.579 -0.011 -20.450 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.063 -0.741 -18.263 1.00 0.00 C ATOM 0 H THR A 106 -6.815 -2.302 -22.073 1.00 0.00 H new ATOM 0 HA THR A 106 -5.028 -1.028 -20.027 1.00 0.00 H new ATOM 0 HB THR A 106 -7.850 -1.989 -19.829 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.419 0.319 -20.068 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.030 -0.357 -17.938 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.791 -1.602 -17.653 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.307 0.036 -18.150 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.360 -3.083 -18.845 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.741 -4.321 -18.291 1.00 0.00 C ATOM 1611 C ILE A 107 -3.856 -4.213 -16.735 1.00 0.00 C ATOM 1612 O ILE A 107 -3.065 -3.528 -16.079 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.311 -4.525 -18.917 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -2.375 -4.742 -20.464 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.530 -5.672 -18.226 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.041 -4.806 -21.214 1.00 0.00 C ATOM 0 H ILE A 107 -3.912 -2.224 -18.528 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.246 -5.248 -18.563 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.762 -3.601 -18.737 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -2.915 -5.670 -20.654 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -2.967 -3.935 -20.895 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.550 -5.776 -18.691 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.407 -5.442 -17.168 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.083 -6.605 -18.333 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.228 -4.959 -22.277 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -0.499 -3.871 -21.072 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -0.446 -5.633 -20.827 1.00 0.00 H new ATOM 1628 N THR A 108 -4.879 -4.863 -16.149 1.00 0.00 N ATOM 1629 CA THR A 108 -5.223 -4.697 -14.705 1.00 0.00 C ATOM 1630 C THR A 108 -4.537 -5.818 -13.861 1.00 0.00 C ATOM 1631 O THR A 108 -4.976 -6.972 -13.852 1.00 0.00 O ATOM 1632 CB THR A 108 -6.771 -4.625 -14.551 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.287 -3.558 -15.344 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.259 -4.352 -13.121 1.00 0.00 C ATOM 0 H THR A 108 -5.489 -5.512 -16.646 1.00 0.00 H new ATOM 0 HA THR A 108 -4.834 -3.758 -14.312 1.00 0.00 H new ATOM 0 HB THR A 108 -7.123 -5.609 -14.860 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.261 -3.518 -15.245 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.348 -4.319 -13.108 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.913 -5.147 -12.460 1.00 0.00 H new ATOM 0 HG23 THR A 108 -6.863 -3.396 -12.778 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.447 -5.460 -13.162 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.625 -6.419 -12.372 1.00 0.00 C ATOM 1644 C ARG A 109 -3.107 -6.435 -10.888 1.00 0.00 C ATOM 1645 O ARG A 109 -2.763 -5.527 -10.121 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.126 -6.006 -12.468 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.481 -5.966 -13.875 1.00 0.00 C ATOM 1648 CD ARG A 109 1.000 -5.555 -13.817 1.00 0.00 C ATOM 1649 NE ARG A 109 1.574 -5.462 -15.188 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.291 -6.398 -15.805 1.00 0.00 C ATOM 1651 NH1 ARG A 109 2.522 -7.589 -15.312 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.783 -6.100 -16.970 1.00 0.00 N ATOM 0 H ARG A 109 -3.103 -4.501 -13.123 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.739 -7.426 -12.774 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.021 -5.017 -12.022 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.548 -6.696 -11.853 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.567 -6.947 -14.342 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -1.028 -5.264 -14.505 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.097 -4.594 -13.311 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.562 -6.282 -13.231 1.00 0.00 H new ATOM 0 HE ARG A 109 1.401 -4.599 -15.703 1.00 0.00 H new ATOM 0 HH11 ARG A 109 2.143 -7.846 -14.401 1.00 0.00 H new ATOM 0 HH12 ARG A 109 3.081 -8.260 -15.839 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.613 -5.179 -17.375 1.00 0.00 H new ATOM 0 HH22 ARG A 109 3.339 -6.787 -17.480 1.00 0.00 H new ATOM 1666 N LYS A 110 -3.910 -7.439 -10.489 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.546 -7.480 -9.138 1.00 0.00 C ATOM 1668 C LYS A 110 -4.056 -8.673 -8.260 1.00 0.00 C ATOM 1669 O LYS A 110 -3.900 -9.805 -8.738 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.089 -7.352 -9.290 1.00 0.00 C ATOM 1671 CG LYS A 110 -6.890 -8.577 -9.796 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.312 -8.182 -10.252 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.203 -9.391 -10.596 1.00 0.00 C ATOM 1674 NZ LYS A 110 -10.401 -8.925 -11.341 1.00 0.00 N ATOM 0 H LYS A 110 -4.141 -8.240 -11.077 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.214 -6.618 -8.560 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.495 -7.070 -8.318 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.287 -6.524 -9.970 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.358 -9.042 -10.626 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.956 -9.321 -9.003 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.790 -7.601 -9.463 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.238 -7.534 -11.126 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.644 -10.109 -11.196 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -9.506 -9.905 -9.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.877 -9.740 -11.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -11.055 -8.452 -10.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.110 -8.257 -12.083 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.810 -8.410 -6.961 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.260 -9.427 -6.021 1.00 0.00 C ATOM 1690 C LEU A 111 -4.378 -10.405 -5.535 1.00 0.00 C ATOM 1691 O LEU A 111 -5.309 -10.011 -4.825 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.526 -8.710 -4.843 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.287 -9.412 -4.218 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.527 -10.853 -3.731 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.076 -9.364 -5.148 1.00 0.00 C ATOM 0 H LEU A 111 -3.982 -7.501 -6.531 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.526 -10.043 -6.540 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.211 -7.728 -5.195 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.253 -8.546 -4.048 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.081 -8.827 -3.322 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.604 -11.254 -3.312 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.303 -10.854 -2.966 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.844 -11.472 -4.570 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.767 -9.865 -4.673 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.316 -9.867 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.186 -8.326 -5.350 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.286 -11.677 -5.948 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.291 -12.720 -5.626 1.00 0.00 C ATOM 1709 C LYS A 112 -4.752 -13.709 -4.539 1.00 0.00 C ATOM 1710 O LYS A 112 -4.161 -13.288 -3.538 1.00 0.00 O ATOM 1711 CB LYS A 112 -5.771 -13.263 -7.005 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.117 -14.010 -6.979 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.363 -13.108 -6.871 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.675 -13.896 -6.647 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.712 -14.575 -5.313 1.00 0.00 N ATOM 0 H LYS A 112 -3.512 -12.020 -6.517 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.188 -12.371 -5.114 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -5.850 -12.427 -7.700 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -5.008 -13.934 -7.400 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -7.199 -14.610 -7.885 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.115 -14.702 -6.137 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.224 -12.407 -6.048 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -8.454 -12.517 -7.782 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.523 -13.216 -6.729 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.787 -14.641 -7.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.691 -14.597 -4.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -9.356 -15.547 -5.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.115 -14.052 -4.641 1.00 0.00 H new ATOM 1729 N ASP A 113 -4.996 -15.020 -4.685 1.00 0.00 N ATOM 1730 CA ASP A 113 -4.949 -15.985 -3.547 1.00 0.00 C ATOM 1731 C ASP A 113 -3.509 -16.588 -3.407 1.00 0.00 C ATOM 1732 O ASP A 113 -3.243 -17.750 -3.730 1.00 0.00 O ATOM 1733 CB ASP A 113 -6.093 -17.026 -3.753 1.00 0.00 C ATOM 1734 CG ASP A 113 -7.517 -16.468 -3.929 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -8.013 -15.730 -3.055 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -8.123 -16.679 -5.004 1.00 0.00 O ATOM 0 H ASP A 113 -5.230 -15.450 -5.580 1.00 0.00 H new ATOM 0 HA ASP A 113 -5.133 -15.502 -2.587 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -5.852 -17.626 -4.631 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -6.096 -17.701 -2.897 1.00 0.00 H new ATOM 1741 N GLY A 114 -2.552 -15.724 -3.009 1.00 0.00 N ATOM 1742 CA GLY A 114 -1.097 -15.976 -3.252 1.00 0.00 C ATOM 1743 C GLY A 114 -0.611 -16.026 -4.731 1.00 0.00 C ATOM 1744 O GLY A 114 0.232 -16.855 -5.083 1.00 0.00 O ATOM 0 H GLY A 114 -2.748 -14.850 -2.521 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.531 -15.199 -2.739 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.837 -16.924 -2.781 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.180 -15.177 -5.604 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.126 -15.360 -7.081 1.00 0.00 C ATOM 1750 C LYS A 115 -1.568 -14.020 -7.762 1.00 0.00 C ATOM 1751 O LYS A 115 -2.570 -13.425 -7.363 1.00 0.00 O ATOM 1752 CB LYS A 115 -2.052 -16.561 -7.484 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.644 -17.344 -8.749 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.399 -18.254 -8.633 1.00 0.00 C ATOM 1755 CE LYS A 115 -0.564 -19.573 -7.849 1.00 0.00 C ATOM 1756 NZ LYS A 115 0.722 -20.335 -7.758 1.00 0.00 N ATOM 0 H LYS A 115 -1.692 -14.343 -5.315 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.116 -15.597 -7.415 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.091 -17.259 -6.647 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -3.063 -16.180 -7.629 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.489 -17.961 -9.054 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -1.467 -16.627 -9.551 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.064 -18.499 -9.641 1.00 0.00 H new ATOM 0 HD3 LYS A 115 0.398 -17.678 -8.163 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.928 -19.355 -6.845 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -1.319 -20.192 -8.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.537 -21.285 -7.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 1.144 -20.419 -8.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 1.380 -19.832 -7.129 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.860 -13.525 -8.789 1.00 0.00 N ATOM 1771 CA LEU A 116 -1.235 -12.263 -9.491 1.00 0.00 C ATOM 1772 C LEU A 116 -2.192 -12.557 -10.691 1.00 0.00 C ATOM 1773 O LEU A 116 -1.824 -13.262 -11.638 1.00 0.00 O ATOM 1774 CB LEU A 116 0.083 -11.557 -9.906 1.00 0.00 C ATOM 1775 CG LEU A 116 -0.027 -10.156 -10.557 1.00 0.00 C ATOM 1776 CD1 LEU A 116 -0.364 -9.080 -9.514 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.293 -9.787 -11.257 1.00 0.00 C ATOM 0 H LEU A 116 -0.022 -13.972 -9.161 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.798 -11.595 -8.839 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.709 -11.467 -9.018 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.609 -12.210 -10.602 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.833 -10.197 -11.290 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.434 -8.108 -10.003 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.317 -9.318 -9.041 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.419 -9.049 -8.757 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.201 -8.800 -11.710 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.102 -9.777 -10.526 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.512 -10.522 -12.031 1.00 0.00 H new ATOM 1789 N VAL A 117 -3.413 -11.991 -10.651 1.00 0.00 N ATOM 1790 CA VAL A 117 -4.397 -12.094 -11.772 1.00 0.00 C ATOM 1791 C VAL A 117 -4.226 -10.828 -12.675 1.00 0.00 C ATOM 1792 O VAL A 117 -4.499 -9.700 -12.250 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.853 -12.321 -11.222 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.951 -12.233 -12.311 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -6.020 -13.702 -10.553 1.00 0.00 C ATOM 0 H VAL A 117 -3.753 -11.452 -9.854 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.208 -12.969 -12.394 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.979 -11.513 -10.501 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.928 -12.400 -11.857 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.929 -11.245 -12.771 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.770 -12.992 -13.072 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.042 -13.809 -10.190 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.809 -14.486 -11.280 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -5.327 -13.787 -9.716 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.768 -11.030 -13.921 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.488 -9.923 -14.879 1.00 0.00 C ATOM 1807 C VAL A 118 -4.574 -9.973 -15.999 1.00 0.00 C ATOM 1808 O VAL A 118 -4.497 -10.784 -16.929 1.00 0.00 O ATOM 1809 CB VAL A 118 -2.012 -10.000 -15.402 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.677 -8.914 -16.450 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.958 -9.901 -14.273 1.00 0.00 C ATOM 0 H VAL A 118 -3.579 -11.957 -14.301 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.556 -8.948 -14.396 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.959 -10.984 -15.867 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.641 -9.024 -16.770 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.336 -9.024 -17.311 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.818 -7.927 -16.009 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.042 -9.961 -14.703 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.072 -8.951 -13.751 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.100 -10.721 -13.569 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.569 -9.077 -15.910 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.653 -8.961 -16.924 1.00 0.00 C ATOM 1823 C GLU A 119 -6.209 -7.965 -18.040 1.00 0.00 C ATOM 1824 O GLU A 119 -6.273 -6.740 -17.888 1.00 0.00 O ATOM 1825 CB GLU A 119 -7.968 -8.549 -16.212 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.564 -9.643 -15.287 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.666 -9.204 -14.341 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -9.568 -8.125 -13.715 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -10.587 -10.006 -14.088 1.00 0.00 O ATOM 0 H GLU A 119 -5.654 -8.412 -15.142 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.843 -9.915 -17.415 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.782 -7.652 -15.621 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.709 -8.285 -16.967 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.953 -10.445 -15.914 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.754 -10.066 -14.694 1.00 0.00 H new ATOM 1836 N CYS A 120 -5.699 -8.527 -19.144 1.00 0.00 N ATOM 1837 CA CYS A 120 -5.149 -7.765 -20.287 1.00 0.00 C ATOM 1838 C CYS A 120 -6.185 -7.703 -21.453 1.00 0.00 C ATOM 1839 O CYS A 120 -6.515 -8.711 -22.084 1.00 0.00 O ATOM 1840 CB CYS A 120 -3.758 -8.361 -20.631 1.00 0.00 C ATOM 1841 SG CYS A 120 -3.627 -10.146 -20.360 1.00 0.00 S ATOM 0 H CYS A 120 -5.654 -9.537 -19.276 1.00 0.00 H new ATOM 0 HA CYS A 120 -4.979 -6.715 -20.047 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -3.531 -8.146 -21.675 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -3.001 -7.857 -20.030 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.555 -10.757 -21.036 1.00 0.00 H new ATOM 1846 N VAL A 121 -6.733 -6.500 -21.693 1.00 0.00 N ATOM 1847 CA VAL A 121 -7.890 -6.283 -22.616 1.00 0.00 C ATOM 1848 C VAL A 121 -7.570 -5.147 -23.637 1.00 0.00 C ATOM 1849 O VAL A 121 -6.889 -4.170 -23.307 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.212 -6.051 -21.796 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -9.262 -4.768 -20.933 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -10.485 -6.083 -22.675 1.00 0.00 C ATOM 0 H VAL A 121 -6.395 -5.641 -21.258 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.060 -7.180 -23.211 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.193 -6.900 -21.113 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.219 -4.715 -20.415 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -8.454 -4.790 -20.202 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.148 -3.894 -21.574 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -11.363 -5.917 -22.050 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.425 -5.301 -23.432 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.566 -7.054 -23.163 1.00 0.00 H new ATOM 1862 N MET A 122 -8.062 -5.270 -24.883 1.00 0.00 N ATOM 1863 CA MET A 122 -8.076 -4.135 -25.853 1.00 0.00 C ATOM 1864 C MET A 122 -9.526 -3.555 -25.934 1.00 0.00 C ATOM 1865 O MET A 122 -9.951 -2.875 -24.995 1.00 0.00 O ATOM 1866 CB MET A 122 -7.325 -4.562 -27.149 1.00 0.00 C ATOM 1867 CG MET A 122 -7.096 -3.394 -28.128 1.00 0.00 C ATOM 1868 SD MET A 122 -6.049 -3.874 -29.506 1.00 0.00 S ATOM 1869 CE MET A 122 -6.223 -2.394 -30.521 1.00 0.00 C ATOM 0 H MET A 122 -8.456 -6.136 -25.251 1.00 0.00 H new ATOM 0 HA MET A 122 -7.502 -3.261 -25.544 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.362 -4.995 -26.878 1.00 0.00 H new ATOM 0 HB3 MET A 122 -7.895 -5.343 -27.652 1.00 0.00 H new ATOM 0 HG2 MET A 122 -8.056 -3.043 -28.506 1.00 0.00 H new ATOM 0 HG3 MET A 122 -6.638 -2.559 -27.597 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.636 -2.507 -31.432 1.00 0.00 H new ATOM 0 HE2 MET A 122 -7.272 -2.252 -30.780 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.866 -1.527 -29.965 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.294 -3.833 -27.000 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.735 -3.461 -27.096 1.00 0.00 C ATOM 1881 C ASN A 123 -12.592 -4.758 -26.966 1.00 0.00 C ATOM 1882 O ASN A 123 -12.707 -5.536 -27.916 1.00 0.00 O ATOM 1883 CB ASN A 123 -12.001 -2.592 -28.362 1.00 0.00 C ATOM 1884 CG ASN A 123 -11.673 -3.173 -29.747 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -12.522 -3.734 -30.428 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -10.446 -3.041 -30.196 1.00 0.00 N ATOM 0 H ASN A 123 -9.944 -4.321 -27.824 1.00 0.00 H new ATOM 0 HA ASN A 123 -12.040 -2.814 -26.274 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -13.057 -2.322 -28.360 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.435 -1.667 -28.251 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -10.197 -3.406 -31.115 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -9.742 -2.573 -29.626 1.00 0.00 H new ATOM 1893 N ASN A 124 -13.107 -5.050 -25.752 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.821 -6.334 -25.429 1.00 0.00 C ATOM 1895 C ASN A 124 -12.982 -7.664 -25.406 1.00 0.00 C ATOM 1896 O ASN A 124 -13.350 -8.585 -24.673 1.00 0.00 O ATOM 1897 CB ASN A 124 -15.160 -6.516 -26.211 1.00 0.00 C ATOM 1898 CG ASN A 124 -16.238 -5.460 -25.940 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -16.349 -4.447 -26.621 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -17.069 -5.654 -24.944 1.00 0.00 N ATOM 0 H ASN A 124 -13.047 -4.411 -24.959 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.047 -6.171 -24.375 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -14.939 -6.517 -27.278 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -15.570 -7.497 -25.970 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -17.796 -4.966 -24.745 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -16.989 -6.492 -24.369 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.892 -7.790 -26.184 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.126 -9.060 -26.345 1.00 0.00 C ATOM 1909 C VAL A 125 -10.124 -9.232 -25.147 1.00 0.00 C ATOM 1910 O VAL A 125 -9.123 -8.513 -25.043 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.440 -9.056 -27.755 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.641 -10.348 -28.026 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.405 -8.894 -28.959 1.00 0.00 C ATOM 0 H VAL A 125 -11.508 -7.016 -26.725 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.782 -9.930 -26.311 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.795 -8.180 -27.693 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.186 -10.294 -29.015 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.860 -10.458 -27.273 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.311 -11.206 -27.981 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.834 -8.904 -29.887 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -12.121 -9.716 -28.965 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.940 -7.948 -28.872 1.00 0.00 H new ATOM 1923 N THR A 126 -10.428 -10.174 -24.238 1.00 0.00 N ATOM 1924 CA THR A 126 -9.726 -10.314 -22.925 1.00 0.00 C ATOM 1925 C THR A 126 -8.786 -11.559 -22.891 1.00 0.00 C ATOM 1926 O THR A 126 -9.267 -12.696 -22.982 1.00 0.00 O ATOM 1927 CB THR A 126 -10.754 -10.465 -21.753 1.00 0.00 C ATOM 1928 OG1 THR A 126 -11.580 -11.612 -21.954 1.00 0.00 O ATOM 1929 CG2 THR A 126 -11.673 -9.264 -21.497 1.00 0.00 C ATOM 0 H THR A 126 -11.165 -10.865 -24.381 1.00 0.00 H new ATOM 0 HA THR A 126 -9.133 -9.407 -22.803 1.00 0.00 H new ATOM 0 HB THR A 126 -10.118 -10.558 -20.872 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.037 -12.349 -22.305 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.339 -9.487 -20.664 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.070 -8.389 -21.255 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.264 -9.061 -22.390 1.00 0.00 H new ATOM 1937 N CYS A 127 -7.489 -11.356 -22.610 1.00 0.00 N ATOM 1938 CA CYS A 127 -6.619 -12.425 -22.054 1.00 0.00 C ATOM 1939 C CYS A 127 -6.519 -12.325 -20.499 1.00 0.00 C ATOM 1940 O CYS A 127 -6.233 -11.260 -19.942 1.00 0.00 O ATOM 1941 CB CYS A 127 -5.242 -12.368 -22.740 1.00 0.00 C ATOM 1942 SG CYS A 127 -4.533 -10.727 -22.746 1.00 0.00 S ATOM 0 H CYS A 127 -7.013 -10.466 -22.756 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.062 -13.399 -22.263 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -4.561 -13.051 -22.232 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -5.339 -12.720 -23.767 1.00 0.00 H new ATOM 0 HG CYS A 127 -3.697 -10.612 -21.757 1.00 0.00 H new ATOM 1947 N THR A 128 -6.756 -13.441 -19.789 1.00 0.00 N ATOM 1948 CA THR A 128 -6.598 -13.498 -18.301 1.00 0.00 C ATOM 1949 C THR A 128 -5.296 -14.289 -17.970 1.00 0.00 C ATOM 1950 O THR A 128 -5.280 -15.525 -18.000 1.00 0.00 O ATOM 1951 CB THR A 128 -7.887 -14.085 -17.655 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.021 -13.321 -18.050 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.887 -14.062 -16.118 1.00 0.00 C ATOM 0 H THR A 128 -7.058 -14.321 -20.208 1.00 0.00 H new ATOM 0 HA THR A 128 -6.482 -12.503 -17.870 1.00 0.00 H new ATOM 0 HB THR A 128 -7.922 -15.119 -17.997 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.828 -13.698 -17.641 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.819 -14.488 -15.748 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.047 -14.648 -15.745 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.795 -13.033 -15.770 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.200 -13.569 -17.675 1.00 0.00 N ATOM 1962 CA ARG A 129 -2.876 -14.192 -17.411 1.00 0.00 C ATOM 1963 C ARG A 129 -2.634 -14.378 -15.880 1.00 0.00 C ATOM 1964 O ARG A 129 -2.675 -13.413 -15.110 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.754 -13.361 -18.092 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.686 -13.482 -19.636 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.385 -12.957 -20.277 1.00 0.00 C ATOM 1968 NE ARG A 129 -0.400 -11.472 -20.366 1.00 0.00 N ATOM 1969 CZ ARG A 129 0.539 -10.722 -20.938 1.00 0.00 C ATOM 1970 NH1 ARG A 129 1.653 -11.206 -21.430 1.00 0.00 N ATOM 1971 NH2 ARG A 129 0.339 -9.438 -21.016 1.00 0.00 N ATOM 0 H ARG A 129 -4.198 -12.551 -17.611 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.860 -15.191 -17.847 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -1.893 -12.312 -17.832 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.794 -13.668 -17.677 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.810 -14.530 -19.909 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.529 -12.940 -20.065 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.473 -13.282 -19.688 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.267 -13.384 -21.273 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.197 -10.988 -19.954 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.837 -12.208 -21.386 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.336 -10.580 -21.857 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -0.520 -9.032 -20.644 1.00 0.00 H new ATOM 0 HH22 ARG A 129 1.041 -8.838 -21.449 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.371 -15.621 -15.442 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.143 -15.944 -13.998 1.00 0.00 C ATOM 1987 C ILE A 130 -0.602 -16.091 -13.771 1.00 0.00 C ATOM 1988 O ILE A 130 0.061 -16.918 -14.412 1.00 0.00 O ATOM 1989 CB ILE A 130 -2.942 -17.208 -13.511 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.424 -17.330 -13.987 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.863 -17.409 -11.978 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.403 -16.258 -13.481 1.00 0.00 C ATOM 0 H ILE A 130 -2.308 -16.430 -16.060 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.531 -15.128 -13.388 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.414 -18.015 -14.020 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.434 -17.312 -15.077 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.800 -18.306 -13.681 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.432 -18.295 -11.697 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.822 -17.537 -11.681 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.279 -16.536 -11.475 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.397 -16.455 -13.882 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.440 -16.284 -12.392 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.067 -15.274 -13.810 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.049 -15.294 -12.844 1.00 0.00 N ATOM 2005 CA TYR A 131 1.407 -15.293 -12.532 1.00 0.00 C ATOM 2006 C TYR A 131 1.682 -15.650 -11.022 1.00 0.00 C ATOM 2007 O TYR A 131 0.888 -15.299 -10.144 1.00 0.00 O ATOM 2008 CB TYR A 131 2.001 -13.901 -12.879 1.00 0.00 C ATOM 2009 CG TYR A 131 2.066 -13.391 -14.336 1.00 0.00 C ATOM 2010 CD1 TYR A 131 0.950 -12.793 -14.936 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.293 -13.345 -15.001 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.075 -12.148 -16.167 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.418 -12.699 -16.228 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.306 -12.096 -16.808 1.00 0.00 C ATOM 2015 OH TYR A 131 2.430 -11.457 -18.012 1.00 0.00 O ATOM 0 H TYR A 131 -0.587 -14.631 -12.286 1.00 0.00 H new ATOM 0 HA TYR A 131 1.890 -16.062 -13.135 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.434 -13.164 -12.311 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.020 -13.886 -12.493 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -0.011 -12.831 -14.444 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.157 -13.817 -14.557 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.211 -11.687 -16.623 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.375 -12.666 -16.728 1.00 0.00 H new ATOM 0 HH TYR A 131 3.359 -11.515 -18.319 1.00 0.00 H new ATOM 2025 N GLU A 132 2.815 -16.310 -10.695 1.00 0.00 N ATOM 2026 CA GLU A 132 3.108 -16.796 -9.305 1.00 0.00 C ATOM 2027 C GLU A 132 4.430 -16.289 -8.647 1.00 0.00 C ATOM 2028 O GLU A 132 5.478 -16.251 -9.290 1.00 0.00 O ATOM 2029 CB GLU A 132 3.010 -18.338 -9.276 1.00 0.00 C ATOM 2030 CG GLU A 132 4.051 -19.211 -10.014 1.00 0.00 C ATOM 2031 CD GLU A 132 3.744 -20.704 -10.003 1.00 0.00 C ATOM 2032 OE1 GLU A 132 2.661 -21.127 -9.525 1.00 0.00 O ATOM 2033 OE2 GLU A 132 4.601 -21.464 -10.501 1.00 0.00 O ATOM 0 H GLU A 132 3.551 -16.525 -11.368 1.00 0.00 H new ATOM 0 HA GLU A 132 2.344 -16.342 -8.674 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.023 -18.640 -8.229 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.030 -18.604 -9.672 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.121 -18.875 -11.048 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.029 -19.050 -9.560 1.00 0.00 H new ATOM 2040 N LYS A 133 4.385 -15.936 -7.345 1.00 0.00 N ATOM 2041 CA LYS A 133 5.524 -15.291 -6.623 1.00 0.00 C ATOM 2042 C LYS A 133 6.657 -16.318 -6.268 1.00 0.00 C ATOM 2043 O LYS A 133 6.464 -17.217 -5.443 1.00 0.00 O ATOM 2044 CB LYS A 133 4.948 -14.586 -5.355 1.00 0.00 C ATOM 2045 CG LYS A 133 5.627 -13.255 -4.940 1.00 0.00 C ATOM 2046 CD LYS A 133 5.131 -12.786 -3.544 1.00 0.00 C ATOM 2047 CE LYS A 133 5.292 -11.295 -3.161 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.715 -10.908 -3.000 1.00 0.00 N ATOM 0 H LYS A 133 3.564 -16.086 -6.758 1.00 0.00 H new ATOM 0 HA LYS A 133 6.000 -14.553 -7.269 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.889 -14.392 -5.523 1.00 0.00 H new ATOM 0 HB3 LYS A 133 5.016 -15.280 -4.517 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.709 -13.386 -4.920 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.413 -12.487 -5.683 1.00 0.00 H new ATOM 0 HD2 LYS A 133 4.072 -13.034 -3.469 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.652 -13.379 -2.792 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.833 -10.673 -3.929 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.757 -11.101 -2.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.779 -9.884 -2.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 7.125 -11.421 -2.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 7.240 -11.146 -3.866 1.00 0.00 H new ATOM 2062 N VAL A 134 7.822 -16.193 -6.919 1.00 0.00 N ATOM 2063 CA VAL A 134 8.928 -17.201 -6.835 1.00 0.00 C ATOM 2064 C VAL A 134 10.024 -16.667 -5.859 1.00 0.00 C ATOM 2065 O VAL A 134 10.924 -15.916 -6.254 1.00 0.00 O ATOM 2066 CB VAL A 134 9.499 -17.561 -8.252 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.634 -18.615 -8.212 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.445 -18.087 -9.248 1.00 0.00 C ATOM 0 H VAL A 134 8.040 -15.399 -7.521 1.00 0.00 H new ATOM 0 HA VAL A 134 8.537 -18.137 -6.437 1.00 0.00 H new ATOM 0 HB VAL A 134 9.881 -16.600 -8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 134 10.980 -18.815 -9.226 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.462 -18.235 -7.614 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.259 -19.537 -7.768 1.00 0.00 H new ATOM 0 HG21 VAL A 134 8.925 -18.311 -10.201 1.00 0.00 H new ATOM 0 HG22 VAL A 134 7.988 -18.993 -8.850 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.676 -17.329 -9.398 1.00 0.00 H new ATOM 2078 N GLU A 135 9.936 -17.079 -4.588 1.00 0.00 N ATOM 2079 CA GLU A 135 10.796 -16.561 -3.494 1.00 0.00 C ATOM 2080 C GLU A 135 10.714 -17.512 -2.272 1.00 0.00 C ATOM 2081 O GLU A 135 9.600 -17.874 -1.819 1.00 0.00 O ATOM 2082 CB GLU A 135 10.484 -15.076 -3.149 1.00 0.00 C ATOM 2083 CG GLU A 135 9.016 -14.719 -2.798 1.00 0.00 C ATOM 2084 CD GLU A 135 8.712 -13.230 -2.827 1.00 0.00 C ATOM 2085 OE1 GLU A 135 8.854 -12.590 -3.895 1.00 0.00 O ATOM 2086 OE2 GLU A 135 8.230 -12.693 -1.807 1.00 0.00 O ATOM 2087 OXT GLU A 135 11.787 -17.908 -1.762 1.00 0.00 O ATOM 0 H GLU A 135 9.266 -17.784 -4.279 1.00 0.00 H new ATOM 0 HA GLU A 135 11.832 -16.551 -3.834 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.112 -14.787 -2.306 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.787 -14.462 -3.997 1.00 0.00 H new ATOM 0 HG2 GLU A 135 8.353 -15.227 -3.498 1.00 0.00 H new ATOM 0 HG3 GLU A 135 8.788 -15.106 -1.805 1.00 0.00 H new