USER MOD reduce.3.24.130724 H: found=0, std=0, add=1300, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1298 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 3 MET CE :methyl 180:sc= -0.389 (180deg=-0.389) USER MOD Set 1.2: A 168 MET CE :methyl -173:sc= -3.23! (180deg=-3.48) USER MOD Set 2.1: A 105 HIS : no HD1:sc= -2.23 K(o=-2.2,f=-4.1!) USER MOD Set 2.2: A 118 TYR OH : rot 180:sc= 0.00413 USER MOD Set 3.1: A 90 GLN :FLIP amide:sc= -0.393 F(o=-5.7!,f=-0.47) USER MOD Set 3.2: A 148 ASN : amide:sc= -0.0796 K(o=-0.47,f=-5.1!) USER MOD Set 4.1: A 10 SER OG : rot 142:sc= 0.853 USER MOD Set 4.2: A 62 GLN : amide:sc= -0.518 K(o=0.34,f=-4!) USER MOD Set 5.1: A 33 HIS : no HE2:sc= 0.874 K(o=1.9,f=-2.7) USER MOD Set 5.2: A 46 TYR OH : rot -130:sc= 1.03 USER MOD Set 6.1: A 12 CYS SG : rot 180:sc= -0.0104 USER MOD Set 6.2: A 16 MET CE :methyl -168:sc= -0.445 (180deg=-0.638) USER MOD Set 7.1: A 9 SER OG : rot -120:sc= 1.12 USER MOD Set 7.2: A 14 THR OG1 : rot 84:sc= 0.654 USER MOD Set 8.1: A 7 TYR OH : rot 30:sc= 0.0784 USER MOD Set 8.2: A 34 ASN : amide:sc= -1.72 K(o=-1.6,f=-8.5!) USER MOD Single : A 1 MET CE :methyl -171:sc= -0.186 (180deg=-0.294) USER MOD Single : A 1 MET N :NH3+ -142:sc= 0.242 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0.47 K(o=0.47,f=-0.064) USER MOD Single : A 11 THR OG1 : rot 171:sc= 2.64 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 1.33 (180deg=1.33) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -156:sc= 1.26 (180deg=0.898) USER MOD Single : A 43 MET CE :methyl 152:sc= -0.702 (180deg=-1.35) USER MOD Single : A 45 GLN : amide:sc= 0.452 X(o=0.45,f=0) USER MOD Single : A 55 THR OG1 : rot 80:sc= 0.249 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.0129 X(o=-0.013,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -166:sc= 2.09 (180deg=1.68) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 165:sc= -0.172 (180deg=-0.541) USER MOD Single : A 107 LYS NZ :NH3+ -174:sc= 0.486 (180deg=0.467) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ -177:sc= 1.63 (180deg=1.62) USER MOD Single : A 114 LYS NZ :NH3+ -174:sc= 0.874 (180deg=0.848) USER MOD Single : A 121 THR OG1 : rot -159:sc= 0.101 USER MOD Single : A 127 THR OG1 : rot -35:sc= 0.0344 USER MOD Single : A 128 SER OG : rot 115:sc= 0.875 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 GLN : amide:sc= 1.6 K(o=1.6,f=-4.3!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot -163:sc= 1.26 USER MOD Single : A 158 GLN : amide:sc= 0.999 K(o=1,f=-0.055) USER MOD Single : A 159 SER OG : rot 76:sc= 1.22 USER MOD Single : A 161 CYS SG : rot 74:sc= -0.925 USER MOD Single : A 163 GLN : amide:sc= 1.28 K(o=1.3,f=-0.47) USER MOD Single : A 166 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 171 HIS : no HD1:sc= -0.0185 X(o=-0.018,f=-0.33) USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.796 0.309 -0.365 1.00 0.00 N ATOM 2 CA MET A 1 1.867 0.321 -1.412 1.00 0.00 C ATOM 3 C MET A 1 2.075 1.718 -1.995 1.00 0.00 C ATOM 4 O MET A 1 1.111 2.444 -2.207 1.00 0.00 O ATOM 5 CB MET A 1 1.637 -0.707 -2.553 1.00 0.00 C ATOM 6 CG MET A 1 0.511 -0.402 -3.560 1.00 0.00 C ATOM 7 SD MET A 1 -1.167 -0.762 -2.969 1.00 0.00 S ATOM 8 CE MET A 1 -2.023 -0.936 -4.556 1.00 0.00 C ATOM 0 H1 MET A 1 1.069 -0.336 0.403 1.00 0.00 H new ATOM 0 H2 MET A 1 0.673 1.269 0.016 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.098 -0.014 -0.787 1.00 0.00 H new ATOM 0 HA MET A 1 2.775 0.016 -0.891 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.569 -0.808 -3.109 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.430 -1.676 -2.098 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.565 0.652 -3.834 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.691 -0.977 -4.468 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.097 -1.001 -4.385 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.807 -0.071 -5.183 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.680 -1.841 -5.057 1.00 0.00 H new ATOM 20 N ASN A 2 3.318 2.070 -2.331 1.00 0.00 N ATOM 21 CA ASN A 2 3.614 3.277 -3.106 1.00 0.00 C ATOM 22 C ASN A 2 3.523 2.956 -4.600 1.00 0.00 C ATOM 23 O ASN A 2 3.957 1.891 -5.040 1.00 0.00 O ATOM 24 CB ASN A 2 4.956 3.911 -2.703 1.00 0.00 C ATOM 25 CG ASN A 2 6.191 3.005 -2.627 1.00 0.00 C ATOM 26 OD1 ASN A 2 7.060 3.223 -1.789 1.00 0.00 O ATOM 27 ND2 ASN A 2 6.321 1.980 -3.459 1.00 0.00 N ATOM 0 H ASN A 2 4.144 1.529 -2.075 1.00 0.00 H new ATOM 0 HA ASN A 2 2.866 4.037 -2.880 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.173 4.711 -3.411 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.824 4.377 -1.727 1.00 0.00 H new ATOM 0 HD21 ASN A 2 7.141 1.377 -3.401 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.601 1.795 -4.157 1.00 0.00 H new ATOM 34 N MET A 3 2.966 3.884 -5.367 1.00 0.00 N ATOM 35 CA MET A 3 2.619 3.781 -6.781 1.00 0.00 C ATOM 36 C MET A 3 3.308 4.910 -7.540 1.00 0.00 C ATOM 37 O MET A 3 3.473 6.004 -7.006 1.00 0.00 O ATOM 38 CB MET A 3 1.089 3.872 -6.945 1.00 0.00 C ATOM 39 CG MET A 3 0.352 2.933 -5.975 1.00 0.00 C ATOM 40 SD MET A 3 -1.346 2.483 -6.417 1.00 0.00 S ATOM 41 CE MET A 3 -2.134 4.101 -6.600 1.00 0.00 C ATOM 0 H MET A 3 2.726 4.800 -4.988 1.00 0.00 H new ATOM 0 HA MET A 3 2.952 2.824 -7.182 1.00 0.00 H new ATOM 0 HB2 MET A 3 0.766 4.899 -6.773 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.818 3.620 -7.970 1.00 0.00 H new ATOM 0 HG2 MET A 3 0.934 2.016 -5.880 1.00 0.00 H new ATOM 0 HG3 MET A 3 0.335 3.403 -4.992 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.181 3.967 -6.871 1.00 0.00 H new ATOM 0 HE2 MET A 3 -2.070 4.646 -5.658 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.627 4.667 -7.382 1.00 0.00 H new ATOM 51 N GLY A 4 3.673 4.675 -8.795 1.00 0.00 N ATOM 52 CA GLY A 4 4.412 5.657 -9.580 1.00 0.00 C ATOM 53 C GLY A 4 3.554 6.186 -10.717 1.00 0.00 C ATOM 54 O GLY A 4 3.157 5.401 -11.575 1.00 0.00 O ATOM 0 H GLY A 4 3.468 3.809 -9.293 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.726 6.481 -8.940 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.318 5.203 -9.981 1.00 0.00 H new ATOM 58 N LEU A 5 3.264 7.491 -10.756 1.00 0.00 N ATOM 59 CA LEU A 5 2.625 8.123 -11.905 1.00 0.00 C ATOM 60 C LEU A 5 3.708 8.588 -12.882 1.00 0.00 C ATOM 61 O LEU A 5 4.416 9.544 -12.594 1.00 0.00 O ATOM 62 CB LEU A 5 1.742 9.285 -11.412 1.00 0.00 C ATOM 63 CG LEU A 5 0.794 9.935 -12.439 1.00 0.00 C ATOM 64 CD1 LEU A 5 1.442 10.378 -13.740 1.00 0.00 C ATOM 65 CD2 LEU A 5 -0.326 8.979 -12.821 1.00 0.00 C ATOM 0 H LEU A 5 3.467 8.134 -9.991 1.00 0.00 H new ATOM 0 HA LEU A 5 1.981 7.420 -12.433 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.140 8.922 -10.579 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.396 10.062 -11.017 1.00 0.00 H new ATOM 0 HG LEU A 5 0.436 10.825 -11.922 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.687 10.821 -14.390 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.217 11.115 -13.528 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.888 9.516 -14.237 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -0.983 9.459 -13.547 1.00 0.00 H new ATOM 0 HD22 LEU A 5 0.100 8.076 -13.259 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.899 8.716 -11.932 1.00 0.00 H new ATOM 77 N PHE A 6 3.785 7.974 -14.057 1.00 0.00 N ATOM 78 CA PHE A 6 4.662 8.372 -15.161 1.00 0.00 C ATOM 79 C PHE A 6 3.866 8.992 -16.301 1.00 0.00 C ATOM 80 O PHE A 6 2.760 8.554 -16.608 1.00 0.00 O ATOM 81 CB PHE A 6 5.434 7.158 -15.667 1.00 0.00 C ATOM 82 CG PHE A 6 6.374 6.585 -14.638 1.00 0.00 C ATOM 83 CD1 PHE A 6 5.892 5.749 -13.616 1.00 0.00 C ATOM 84 CD2 PHE A 6 7.728 6.939 -14.668 1.00 0.00 C ATOM 85 CE1 PHE A 6 6.760 5.312 -12.604 1.00 0.00 C ATOM 86 CE2 PHE A 6 8.598 6.472 -13.677 1.00 0.00 C ATOM 87 CZ PHE A 6 8.119 5.674 -12.622 1.00 0.00 C ATOM 0 H PHE A 6 3.219 7.155 -14.279 1.00 0.00 H new ATOM 0 HA PHE A 6 5.361 9.122 -14.790 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.727 6.387 -15.974 1.00 0.00 H new ATOM 0 HB3 PHE A 6 6.003 7.440 -16.553 1.00 0.00 H new ATOM 0 HD1 PHE A 6 4.856 5.444 -13.610 1.00 0.00 H new ATOM 0 HD2 PHE A 6 8.102 7.574 -15.458 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.381 4.692 -11.804 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.647 6.726 -13.722 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.785 5.344 -11.838 1.00 0.00 H new ATOM 97 N TYR A 7 4.445 9.983 -16.972 1.00 0.00 N ATOM 98 CA TYR A 7 3.828 10.672 -18.106 1.00 0.00 C ATOM 99 C TYR A 7 4.879 11.435 -18.913 1.00 0.00 C ATOM 100 O TYR A 7 6.035 11.542 -18.495 1.00 0.00 O ATOM 101 CB TYR A 7 2.775 11.668 -17.584 1.00 0.00 C ATOM 102 CG TYR A 7 3.364 12.853 -16.844 1.00 0.00 C ATOM 103 CD1 TYR A 7 3.740 12.705 -15.499 1.00 0.00 C ATOM 104 CD2 TYR A 7 3.588 14.078 -17.503 1.00 0.00 C ATOM 105 CE1 TYR A 7 4.293 13.781 -14.789 1.00 0.00 C ATOM 106 CE2 TYR A 7 4.189 15.141 -16.808 1.00 0.00 C ATOM 107 CZ TYR A 7 4.537 15.005 -15.448 1.00 0.00 C ATOM 108 OH TYR A 7 5.145 16.042 -14.804 1.00 0.00 O ATOM 0 H TYR A 7 5.373 10.338 -16.741 1.00 0.00 H new ATOM 0 HA TYR A 7 3.359 9.929 -18.751 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.186 12.034 -18.425 1.00 0.00 H new ATOM 0 HB3 TYR A 7 2.089 11.142 -16.920 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.602 11.754 -15.007 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.299 14.199 -18.537 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.531 13.673 -13.741 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.386 16.071 -17.320 1.00 0.00 H new ATOM 0 HH TYR A 7 5.756 15.691 -14.123 1.00 0.00 H new ATOM 118 N GLY A 8 4.431 12.024 -20.024 1.00 0.00 N ATOM 119 CA GLY A 8 5.157 13.004 -20.821 1.00 0.00 C ATOM 120 C GLY A 8 4.107 13.892 -21.482 1.00 0.00 C ATOM 121 O GLY A 8 3.058 13.380 -21.865 1.00 0.00 O ATOM 0 H GLY A 8 3.508 11.818 -20.407 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.825 13.595 -20.194 1.00 0.00 H new ATOM 0 HA3 GLY A 8 5.776 12.512 -21.571 1.00 0.00 H new ATOM 125 N SER A 9 4.341 15.201 -21.574 1.00 0.00 N ATOM 126 CA SER A 9 3.458 16.162 -22.228 1.00 0.00 C ATOM 127 C SER A 9 4.294 17.128 -23.077 1.00 0.00 C ATOM 128 O SER A 9 5.367 17.566 -22.653 1.00 0.00 O ATOM 129 CB SER A 9 2.622 16.917 -21.190 1.00 0.00 C ATOM 130 OG SER A 9 1.300 17.083 -21.674 1.00 0.00 O ATOM 0 H SER A 9 5.177 15.634 -21.182 1.00 0.00 H new ATOM 0 HA SER A 9 2.767 15.631 -22.883 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.609 16.367 -20.249 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.070 17.889 -20.985 1.00 0.00 H new ATOM 0 HG SER A 9 1.090 18.039 -21.732 1.00 0.00 H new ATOM 136 N SER A 10 3.772 17.484 -24.253 1.00 0.00 N ATOM 137 CA SER A 10 4.344 18.492 -25.138 1.00 0.00 C ATOM 138 C SER A 10 3.896 19.888 -24.690 1.00 0.00 C ATOM 139 O SER A 10 4.688 20.836 -24.697 1.00 0.00 O ATOM 140 CB SER A 10 3.860 18.225 -26.566 1.00 0.00 C ATOM 141 OG SER A 10 3.797 16.834 -26.834 1.00 0.00 O ATOM 0 H SER A 10 2.918 17.066 -24.622 1.00 0.00 H new ATOM 0 HA SER A 10 5.432 18.443 -25.102 1.00 0.00 H new ATOM 0 HB2 SER A 10 2.875 18.670 -26.708 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.533 18.705 -27.277 1.00 0.00 H new ATOM 0 HG SER A 10 3.011 16.643 -27.388 1.00 0.00 H new ATOM 147 N THR A 11 2.625 20.004 -24.293 1.00 0.00 N ATOM 148 CA THR A 11 1.957 21.243 -23.955 1.00 0.00 C ATOM 149 C THR A 11 2.022 21.394 -22.431 1.00 0.00 C ATOM 150 O THR A 11 2.906 22.066 -21.891 1.00 0.00 O ATOM 151 CB THR A 11 0.533 21.203 -24.553 1.00 0.00 C ATOM 152 OG1 THR A 11 -0.133 20.050 -24.072 1.00 0.00 O ATOM 153 CG2 THR A 11 0.536 21.061 -26.070 1.00 0.00 C ATOM 0 H THR A 11 2.014 19.193 -24.197 1.00 0.00 H new ATOM 0 HA THR A 11 2.430 22.129 -24.378 1.00 0.00 H new ATOM 0 HB THR A 11 0.052 22.139 -24.268 1.00 0.00 H new ATOM 0 HG1 THR A 11 -1.079 20.090 -24.323 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.491 21.038 -26.435 1.00 0.00 H new ATOM 0 HG22 THR A 11 1.060 21.907 -26.514 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.040 20.136 -26.348 1.00 0.00 H new ATOM 161 N CYS A 12 1.088 20.721 -21.752 1.00 0.00 N ATOM 162 CA CYS A 12 0.924 20.591 -20.310 1.00 0.00 C ATOM 163 C CYS A 12 -0.260 19.672 -19.954 1.00 0.00 C ATOM 164 O CYS A 12 -0.464 19.394 -18.779 1.00 0.00 O ATOM 165 CB CYS A 12 0.688 21.977 -19.671 1.00 0.00 C ATOM 166 SG CYS A 12 -0.606 22.931 -20.530 1.00 0.00 S ATOM 0 H CYS A 12 0.361 20.207 -22.250 1.00 0.00 H new ATOM 0 HA CYS A 12 1.841 20.149 -19.919 1.00 0.00 H new ATOM 0 HB2 CYS A 12 0.407 21.848 -18.626 1.00 0.00 H new ATOM 0 HB3 CYS A 12 1.620 22.542 -19.683 1.00 0.00 H new ATOM 0 HG CYS A 12 -0.757 24.082 -19.945 1.00 0.00 H new ATOM 172 N TYR A 13 -1.081 19.199 -20.902 1.00 0.00 N ATOM 173 CA TYR A 13 -2.348 18.536 -20.550 1.00 0.00 C ATOM 174 C TYR A 13 -2.113 17.203 -19.838 1.00 0.00 C ATOM 175 O TYR A 13 -2.769 16.902 -18.843 1.00 0.00 O ATOM 176 CB TYR A 13 -3.235 18.334 -21.786 1.00 0.00 C ATOM 177 CG TYR A 13 -3.295 19.481 -22.774 1.00 0.00 C ATOM 178 CD1 TYR A 13 -3.523 20.799 -22.338 1.00 0.00 C ATOM 179 CD2 TYR A 13 -3.088 19.217 -24.141 1.00 0.00 C ATOM 180 CE1 TYR A 13 -3.519 21.863 -23.257 1.00 0.00 C ATOM 181 CE2 TYR A 13 -3.075 20.280 -25.065 1.00 0.00 C ATOM 182 CZ TYR A 13 -3.287 21.607 -24.628 1.00 0.00 C ATOM 183 OH TYR A 13 -3.265 22.627 -25.535 1.00 0.00 O ATOM 0 H TYR A 13 -0.897 19.260 -21.903 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.869 19.197 -19.858 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.885 17.447 -22.315 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -4.249 18.124 -21.447 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.702 20.995 -21.291 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.940 18.202 -24.480 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -3.693 22.873 -22.917 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.902 20.080 -26.112 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.091 22.266 -26.429 1.00 0.00 H new ATOM 193 N THR A 14 -1.135 16.429 -20.313 1.00 0.00 N ATOM 194 CA THR A 14 -0.782 15.140 -19.718 1.00 0.00 C ATOM 195 C THR A 14 -0.137 15.397 -18.353 1.00 0.00 C ATOM 196 O THR A 14 -0.379 14.668 -17.393 1.00 0.00 O ATOM 197 CB THR A 14 0.124 14.314 -20.654 1.00 0.00 C ATOM 198 OG1 THR A 14 -0.111 14.646 -22.007 1.00 0.00 O ATOM 199 CG2 THR A 14 -0.120 12.816 -20.523 1.00 0.00 C ATOM 0 H THR A 14 -0.566 16.679 -21.121 1.00 0.00 H new ATOM 0 HA THR A 14 -1.680 14.539 -19.575 1.00 0.00 H new ATOM 0 HB THR A 14 1.146 14.552 -20.358 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.411 15.441 -22.244 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.542 12.279 -21.202 1.00 0.00 H new ATOM 0 HG22 THR A 14 0.080 12.503 -19.498 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.157 12.593 -20.775 1.00 0.00 H new ATOM 207 N GLU A 15 0.620 16.494 -18.252 1.00 0.00 N ATOM 208 CA GLU A 15 1.256 16.931 -17.022 1.00 0.00 C ATOM 209 C GLU A 15 0.201 17.274 -15.972 1.00 0.00 C ATOM 210 O GLU A 15 0.281 16.790 -14.849 1.00 0.00 O ATOM 211 CB GLU A 15 2.219 18.089 -17.340 1.00 0.00 C ATOM 212 CG GLU A 15 2.936 18.623 -16.097 1.00 0.00 C ATOM 213 CD GLU A 15 4.073 19.591 -16.478 1.00 0.00 C ATOM 214 OE1 GLU A 15 5.189 19.125 -16.815 1.00 0.00 O1- ATOM 215 OE2 GLU A 15 3.855 20.826 -16.434 1.00 0.00 O ATOM 0 H GLU A 15 0.807 17.110 -19.043 1.00 0.00 H new ATOM 0 HA GLU A 15 1.853 16.129 -16.587 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.960 17.751 -18.064 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.662 18.900 -17.809 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.220 19.135 -15.454 1.00 0.00 H new ATOM 0 HG3 GLU A 15 3.342 17.790 -15.523 1.00 0.00 H new ATOM 222 N MET A 16 -0.832 18.027 -16.344 1.00 0.00 N ATOM 223 CA MET A 16 -1.900 18.398 -15.423 1.00 0.00 C ATOM 224 C MET A 16 -2.711 17.177 -15.005 1.00 0.00 C ATOM 225 O MET A 16 -3.071 17.040 -13.835 1.00 0.00 O ATOM 226 CB MET A 16 -2.796 19.489 -16.031 1.00 0.00 C ATOM 227 CG MET A 16 -2.049 20.822 -16.189 1.00 0.00 C ATOM 228 SD MET A 16 -3.029 22.179 -16.886 1.00 0.00 S ATOM 229 CE MET A 16 -3.315 21.534 -18.555 1.00 0.00 C ATOM 0 H MET A 16 -0.951 18.395 -17.288 1.00 0.00 H new ATOM 0 HA MET A 16 -1.443 18.811 -14.524 1.00 0.00 H new ATOM 0 HB2 MET A 16 -3.160 19.159 -17.004 1.00 0.00 H new ATOM 0 HB3 MET A 16 -3.670 19.636 -15.397 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.676 21.129 -15.212 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.179 20.659 -16.825 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.717 22.326 -19.187 1.00 0.00 H new ATOM 0 HE2 MET A 16 -2.374 21.178 -18.974 1.00 0.00 H new ATOM 0 HE3 MET A 16 -4.027 20.710 -18.510 1.00 0.00 H new ATOM 239 N ALA A 17 -2.965 16.252 -15.934 1.00 0.00 N ATOM 240 CA ALA A 17 -3.659 15.012 -15.623 1.00 0.00 C ATOM 241 C ALA A 17 -2.876 14.199 -14.594 1.00 0.00 C ATOM 242 O ALA A 17 -3.482 13.698 -13.651 1.00 0.00 O ATOM 243 CB ALA A 17 -3.957 14.212 -16.895 1.00 0.00 C ATOM 0 H ALA A 17 -2.696 16.345 -16.913 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.622 15.257 -15.174 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.476 13.290 -16.632 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.585 14.805 -17.559 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.022 13.970 -17.400 1.00 0.00 H new ATOM 249 N ALA A 18 -1.547 14.138 -14.705 1.00 0.00 N ATOM 250 CA ALA A 18 -0.679 13.466 -13.748 1.00 0.00 C ATOM 251 C ALA A 18 -0.904 14.010 -12.348 1.00 0.00 C ATOM 252 O ALA A 18 -1.098 13.230 -11.416 1.00 0.00 O ATOM 253 CB ALA A 18 0.790 13.648 -14.166 1.00 0.00 C ATOM 0 H ALA A 18 -1.039 14.564 -15.480 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.918 12.403 -13.740 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.438 13.144 -13.448 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.942 13.219 -15.156 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.032 14.710 -14.190 1.00 0.00 H new ATOM 259 N GLU A 19 -0.937 15.336 -12.212 1.00 0.00 N ATOM 260 CA GLU A 19 -1.129 15.978 -10.912 1.00 0.00 C ATOM 261 C GLU A 19 -2.449 15.544 -10.318 1.00 0.00 C ATOM 262 O GLU A 19 -2.497 15.194 -9.138 1.00 0.00 O ATOM 263 CB GLU A 19 -1.093 17.513 -10.947 1.00 0.00 C ATOM 264 CG GLU A 19 0.030 18.080 -11.799 1.00 0.00 C ATOM 265 CD GLU A 19 0.238 19.584 -11.543 1.00 0.00 C ATOM 266 OE1 GLU A 19 -0.440 20.417 -12.193 1.00 0.00 O ATOM 267 OE2 GLU A 19 1.085 19.940 -10.689 1.00 0.00 O1- ATOM 0 H GLU A 19 -0.833 15.988 -12.989 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.284 15.657 -10.303 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.046 17.881 -11.327 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -0.989 17.888 -9.929 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.955 17.544 -11.586 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.196 17.918 -12.853 1.00 0.00 H new ATOM 274 N LYS A 20 -3.490 15.537 -11.152 1.00 0.00 N ATOM 275 CA LYS A 20 -4.842 15.198 -10.770 1.00 0.00 C ATOM 276 C LYS A 20 -4.878 13.770 -10.303 1.00 0.00 C ATOM 277 O LYS A 20 -5.285 13.540 -9.179 1.00 0.00 O ATOM 278 CB LYS A 20 -5.802 15.461 -11.937 1.00 0.00 C ATOM 279 CG LYS A 20 -5.991 16.962 -12.183 1.00 0.00 C ATOM 280 CD LYS A 20 -6.729 17.123 -13.514 1.00 0.00 C ATOM 281 CE LYS A 20 -6.800 18.552 -14.041 1.00 0.00 C ATOM 282 NZ LYS A 20 -7.584 19.467 -13.160 1.00 0.00 N1+ ATOM 0 H LYS A 20 -3.402 15.776 -12.140 1.00 0.00 H new ATOM 0 HA LYS A 20 -5.172 15.827 -9.944 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.416 14.989 -12.840 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.768 15.002 -11.726 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.561 17.414 -11.372 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.027 17.469 -12.216 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.239 16.500 -14.262 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.744 16.743 -13.398 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.788 18.942 -14.150 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.248 18.544 -15.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.595 20.422 -13.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.559 19.116 -13.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.145 19.502 -12.218 1.00 0.00 H new ATOM 296 N ILE A 21 -4.426 12.816 -11.112 1.00 0.00 N ATOM 297 CA ILE A 21 -4.487 11.398 -10.762 1.00 0.00 C ATOM 298 C ILE A 21 -3.864 11.180 -9.386 1.00 0.00 C ATOM 299 O ILE A 21 -4.514 10.665 -8.481 1.00 0.00 O ATOM 300 CB ILE A 21 -3.769 10.572 -11.853 1.00 0.00 C ATOM 301 CG1 ILE A 21 -4.643 10.467 -13.111 1.00 0.00 C ATOM 302 CG2 ILE A 21 -3.451 9.159 -11.354 1.00 0.00 C ATOM 303 CD1 ILE A 21 -3.797 10.521 -14.384 1.00 0.00 C ATOM 0 H ILE A 21 -4.009 13.001 -12.024 1.00 0.00 H new ATOM 0 HA ILE A 21 -5.524 11.066 -10.712 1.00 0.00 H new ATOM 0 HB ILE A 21 -2.838 11.086 -12.092 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.208 9.535 -13.087 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.369 11.280 -13.120 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -2.946 8.600 -12.142 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -2.803 9.219 -10.479 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.377 8.651 -11.085 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.446 10.444 -15.256 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.252 11.465 -14.419 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.088 9.693 -14.385 1.00 0.00 H new ATOM 315 N ARG A 22 -2.608 11.597 -9.218 1.00 0.00 N ATOM 316 CA ARG A 22 -1.881 11.437 -7.964 1.00 0.00 C ATOM 317 C ARG A 22 -2.626 12.120 -6.819 1.00 0.00 C ATOM 318 O ARG A 22 -2.674 11.565 -5.731 1.00 0.00 O ATOM 319 CB ARG A 22 -0.452 11.967 -8.216 1.00 0.00 C ATOM 320 CG ARG A 22 0.425 12.199 -6.963 1.00 0.00 C ATOM 321 CD ARG A 22 1.046 13.598 -6.824 1.00 0.00 C ATOM 322 NE ARG A 22 0.073 14.654 -7.154 1.00 0.00 N ATOM 323 CZ ARG A 22 0.075 15.935 -6.752 1.00 0.00 C ATOM 324 NH1 ARG A 22 1.036 16.404 -5.965 1.00 0.00 N1+ ATOM 325 NH2 ARG A 22 -0.895 16.743 -7.162 1.00 0.00 N ATOM 0 H ARG A 22 -2.068 12.056 -9.951 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.810 10.396 -7.648 1.00 0.00 H new ATOM 0 HB2 ARG A 22 0.064 11.263 -8.869 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.528 12.909 -8.760 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.181 12.003 -6.079 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.230 11.465 -6.967 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.406 13.738 -5.805 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.911 13.680 -7.481 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.697 14.378 -7.763 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.788 15.788 -5.656 1.00 0.00 H new ATOM 0 HH12 ARG A 22 1.022 17.380 -5.669 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.629 16.388 -7.775 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -0.906 17.719 -6.864 1.00 0.00 H new ATOM 339 N ASP A 23 -3.209 13.283 -7.068 1.00 0.00 N ATOM 340 CA ASP A 23 -3.931 14.048 -6.049 1.00 0.00 C ATOM 341 C ASP A 23 -5.203 13.325 -5.608 1.00 0.00 C ATOM 342 O ASP A 23 -5.465 13.183 -4.412 1.00 0.00 O ATOM 343 CB ASP A 23 -4.300 15.447 -6.542 1.00 0.00 C ATOM 344 CG ASP A 23 -5.089 16.204 -5.458 1.00 0.00 C ATOM 345 OD1 ASP A 23 -4.467 16.654 -4.467 1.00 0.00 O1- ATOM 346 OD2 ASP A 23 -6.323 16.368 -5.604 1.00 0.00 O ATOM 0 H ASP A 23 -3.197 13.729 -7.985 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.255 14.141 -5.199 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.396 16.000 -6.797 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -4.896 15.374 -7.451 1.00 0.00 H new ATOM 351 N ILE A 24 -5.971 12.842 -6.585 1.00 0.00 N ATOM 352 CA ILE A 24 -7.270 12.219 -6.389 1.00 0.00 C ATOM 353 C ILE A 24 -7.064 10.891 -5.645 1.00 0.00 C ATOM 354 O ILE A 24 -7.775 10.592 -4.686 1.00 0.00 O ATOM 355 CB ILE A 24 -8.006 12.078 -7.751 1.00 0.00 C ATOM 356 CG1 ILE A 24 -8.356 13.454 -8.392 1.00 0.00 C ATOM 357 CG2 ILE A 24 -9.308 11.282 -7.538 1.00 0.00 C ATOM 358 CD1 ILE A 24 -8.334 13.490 -9.929 1.00 0.00 C ATOM 0 H ILE A 24 -5.692 12.877 -7.565 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.921 12.837 -5.771 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.331 11.561 -8.433 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.348 13.752 -8.053 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.654 14.199 -8.018 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.831 11.178 -8.489 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.070 10.294 -7.145 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.946 11.810 -6.829 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.591 14.492 -10.273 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.337 13.229 -10.285 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -9.058 12.775 -10.320 1.00 0.00 H new ATOM 370 N ILE A 25 -6.080 10.103 -6.087 1.00 0.00 N ATOM 371 CA ILE A 25 -5.783 8.788 -5.531 1.00 0.00 C ATOM 372 C ILE A 25 -5.149 8.930 -4.144 1.00 0.00 C ATOM 373 O ILE A 25 -5.612 8.314 -3.183 1.00 0.00 O ATOM 374 CB ILE A 25 -4.925 8.008 -6.542 1.00 0.00 C ATOM 375 CG1 ILE A 25 -5.766 7.770 -7.812 1.00 0.00 C ATOM 376 CG2 ILE A 25 -4.407 6.669 -6.001 1.00 0.00 C ATOM 377 CD1 ILE A 25 -4.996 7.066 -8.916 1.00 0.00 C ATOM 0 H ILE A 25 -5.460 10.368 -6.853 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.694 8.210 -5.373 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.041 8.608 -6.757 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.643 7.176 -7.553 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.129 8.728 -8.185 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.810 6.174 -6.767 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.791 6.847 -5.119 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.251 6.034 -5.732 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.644 6.929 -9.781 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.134 7.670 -9.200 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.656 6.094 -8.559 1.00 0.00 H new ATOM 389 N GLY A 26 -4.114 9.760 -4.048 1.00 0.00 N ATOM 390 CA GLY A 26 -3.486 10.152 -2.796 1.00 0.00 C ATOM 391 C GLY A 26 -1.994 10.391 -2.996 1.00 0.00 C ATOM 392 O GLY A 26 -1.252 9.432 -3.209 1.00 0.00 O ATOM 0 H GLY A 26 -3.679 10.189 -4.865 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.957 11.058 -2.415 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.638 9.374 -2.047 1.00 0.00 H new ATOM 396 N PRO A 27 -1.493 11.628 -2.841 1.00 0.00 N ATOM 397 CA PRO A 27 -0.073 11.951 -2.996 1.00 0.00 C ATOM 398 C PRO A 27 0.787 11.427 -1.828 1.00 0.00 C ATOM 399 O PRO A 27 1.994 11.663 -1.782 1.00 0.00 O ATOM 400 CB PRO A 27 -0.044 13.476 -3.137 1.00 0.00 C ATOM 401 CG PRO A 27 -1.222 13.923 -2.282 1.00 0.00 C ATOM 402 CD PRO A 27 -2.253 12.831 -2.524 1.00 0.00 C ATOM 0 HA PRO A 27 0.369 11.461 -3.864 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.896 13.896 -2.780 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.158 13.787 -4.175 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.951 13.997 -1.229 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.592 14.902 -2.585 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.875 12.679 -1.642 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.921 13.099 -3.343 1.00 0.00 H new ATOM 410 N GLU A 28 0.174 10.699 -0.889 1.00 0.00 N ATOM 411 CA GLU A 28 0.840 10.015 0.209 1.00 0.00 C ATOM 412 C GLU A 28 1.605 8.808 -0.340 1.00 0.00 C ATOM 413 O GLU A 28 2.660 8.430 0.174 1.00 0.00 O ATOM 414 CB GLU A 28 -0.173 9.515 1.265 1.00 0.00 C ATOM 415 CG GLU A 28 -1.486 10.301 1.340 1.00 0.00 C ATOM 416 CD GLU A 28 -2.322 9.892 2.569 1.00 0.00 C ATOM 417 OE1 GLU A 28 -3.142 8.947 2.464 1.00 0.00 O1- ATOM 418 OE2 GLU A 28 -2.177 10.525 3.644 1.00 0.00 O ATOM 0 H GLU A 28 -0.838 10.569 -0.878 1.00 0.00 H new ATOM 0 HA GLU A 28 1.518 10.724 0.685 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.406 8.471 1.055 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.305 9.544 2.244 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.270 11.368 1.385 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.065 10.131 0.432 1.00 0.00 H new ATOM 425 N LEU A 29 1.023 8.185 -1.376 1.00 0.00 N ATOM 426 CA LEU A 29 1.432 6.914 -1.930 1.00 0.00 C ATOM 427 C LEU A 29 1.653 7.003 -3.431 1.00 0.00 C ATOM 428 O LEU A 29 2.362 6.150 -3.943 1.00 0.00 O ATOM 429 CB LEU A 29 0.420 5.827 -1.525 1.00 0.00 C ATOM 430 CG LEU A 29 -1.020 6.013 -2.061 1.00 0.00 C ATOM 431 CD1 LEU A 29 -1.473 4.738 -2.776 1.00 0.00 C ATOM 432 CD2 LEU A 29 -2.008 6.360 -0.946 1.00 0.00 C ATOM 0 H LEU A 29 0.220 8.583 -1.862 1.00 0.00 H new ATOM 0 HA LEU A 29 2.399 6.632 -1.515 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.794 4.863 -1.870 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.379 5.783 -0.437 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.007 6.849 -2.761 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.487 4.872 -3.152 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.802 4.530 -3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.453 3.902 -2.077 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.005 6.481 -1.368 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.021 5.557 -0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.702 7.289 -0.465 1.00 0.00 H new ATOM 444 N VAL A 30 1.108 7.988 -4.148 1.00 0.00 N ATOM 445 CA VAL A 30 1.445 8.190 -5.560 1.00 0.00 C ATOM 446 C VAL A 30 2.561 9.233 -5.664 1.00 0.00 C ATOM 447 O VAL A 30 2.522 10.235 -4.952 1.00 0.00 O ATOM 448 CB VAL A 30 0.197 8.551 -6.383 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.490 8.561 -7.898 1.00 0.00 C ATOM 450 CG2 VAL A 30 -0.971 7.601 -6.105 1.00 0.00 C ATOM 0 H VAL A 30 0.433 8.657 -3.776 1.00 0.00 H new ATOM 0 HA VAL A 30 1.818 7.261 -5.990 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.085 9.556 -6.069 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.418 8.821 -8.442 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.265 9.296 -8.114 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.830 7.573 -8.209 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.830 7.894 -6.708 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.680 6.582 -6.360 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.236 7.649 -5.049 1.00 0.00 H new ATOM 460 N THR A 31 3.493 9.054 -6.609 1.00 0.00 N ATOM 461 CA THR A 31 4.575 9.982 -6.885 1.00 0.00 C ATOM 462 C THR A 31 4.688 10.211 -8.394 1.00 0.00 C ATOM 463 O THR A 31 4.701 9.246 -9.151 1.00 0.00 O ATOM 464 CB THR A 31 5.873 9.444 -6.251 1.00 0.00 C ATOM 465 OG1 THR A 31 5.689 9.137 -4.874 1.00 0.00 O ATOM 466 CG2 THR A 31 7.042 10.424 -6.395 1.00 0.00 C ATOM 0 H THR A 31 3.507 8.233 -7.215 1.00 0.00 H new ATOM 0 HA THR A 31 4.377 10.956 -6.438 1.00 0.00 H new ATOM 0 HB THR A 31 6.119 8.533 -6.796 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.528 8.797 -4.500 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.933 9.999 -5.932 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.235 10.608 -7.452 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.792 11.364 -5.903 1.00 0.00 H new ATOM 474 N LEU A 32 4.721 11.477 -8.834 1.00 0.00 N ATOM 475 CA LEU A 32 4.923 11.849 -10.239 1.00 0.00 C ATOM 476 C LEU A 32 6.359 11.581 -10.694 1.00 0.00 C ATOM 477 O LEU A 32 7.296 11.773 -9.917 1.00 0.00 O ATOM 478 CB LEU A 32 4.625 13.340 -10.514 1.00 0.00 C ATOM 479 CG LEU A 32 3.238 13.889 -10.163 1.00 0.00 C ATOM 480 CD1 LEU A 32 2.974 15.194 -10.916 1.00 0.00 C ATOM 481 CD2 LEU A 32 2.129 12.890 -10.482 1.00 0.00 C ATOM 0 H LEU A 32 4.607 12.280 -8.216 1.00 0.00 H new ATOM 0 HA LEU A 32 4.220 11.229 -10.796 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.362 13.930 -9.970 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.793 13.521 -11.576 1.00 0.00 H new ATOM 0 HG LEU A 32 3.231 14.073 -9.089 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.985 15.571 -10.656 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.727 15.932 -10.640 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.021 15.011 -11.989 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.164 13.321 -10.217 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.143 12.658 -11.547 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.287 11.976 -9.910 1.00 0.00 H new ATOM 493 N HIS A 33 6.519 11.262 -11.981 1.00 0.00 N ATOM 494 CA HIS A 33 7.776 11.098 -12.675 1.00 0.00 C ATOM 495 C HIS A 33 7.574 11.625 -14.088 1.00 0.00 C ATOM 496 O HIS A 33 6.799 11.049 -14.857 1.00 0.00 O ATOM 497 CB HIS A 33 8.163 9.616 -12.688 1.00 0.00 C ATOM 498 CG HIS A 33 8.665 9.150 -11.347 1.00 0.00 C ATOM 499 ND1 HIS A 33 9.877 9.541 -10.769 1.00 0.00 N ATOM 500 CD2 HIS A 33 7.975 8.369 -10.464 1.00 0.00 C ATOM 501 CE1 HIS A 33 9.885 8.988 -9.545 1.00 0.00 C ATOM 502 NE2 HIS A 33 8.764 8.278 -9.338 1.00 0.00 N ATOM 0 H HIS A 33 5.719 11.104 -12.594 1.00 0.00 H new ATOM 0 HA HIS A 33 8.582 11.644 -12.184 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.299 9.019 -12.979 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.933 9.450 -13.441 1.00 0.00 H new ATOM 0 HD1 HIS A 33 10.602 10.123 -11.188 1.00 0.00 H new ATOM 0 HD2 HIS A 33 7.007 7.915 -10.617 1.00 0.00 H new ATOM 0 HE1 HIS A 33 10.683 9.099 -8.826 1.00 0.00 H new ATOM 510 N ASN A 34 8.227 12.732 -14.433 1.00 0.00 N ATOM 511 CA ASN A 34 8.160 13.282 -15.772 1.00 0.00 C ATOM 512 C ASN A 34 9.241 12.632 -16.615 1.00 0.00 C ATOM 513 O ASN A 34 10.425 12.912 -16.444 1.00 0.00 O ATOM 514 CB ASN A 34 8.324 14.792 -15.767 1.00 0.00 C ATOM 515 CG ASN A 34 7.909 15.300 -17.135 1.00 0.00 C ATOM 516 OD1 ASN A 34 8.341 14.816 -18.170 1.00 0.00 O ATOM 517 ND2 ASN A 34 7.048 16.281 -17.166 1.00 0.00 N ATOM 0 H ASN A 34 8.813 13.266 -13.791 1.00 0.00 H new ATOM 0 HA ASN A 34 7.177 13.071 -16.193 1.00 0.00 H new ATOM 0 HB2 ASN A 34 7.709 15.242 -14.988 1.00 0.00 H new ATOM 0 HB3 ASN A 34 9.358 15.065 -15.554 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.729 16.651 -18.061 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.694 16.677 -16.295 1.00 0.00 H new ATOM 524 N LEU A 35 8.831 11.805 -17.569 1.00 0.00 N ATOM 525 CA LEU A 35 9.750 11.008 -18.377 1.00 0.00 C ATOM 526 C LEU A 35 10.634 11.844 -19.312 1.00 0.00 C ATOM 527 O LEU A 35 11.577 11.299 -19.891 1.00 0.00 O ATOM 528 CB LEU A 35 8.976 9.938 -19.157 1.00 0.00 C ATOM 529 CG LEU A 35 8.481 8.803 -18.246 1.00 0.00 C ATOM 530 CD1 LEU A 35 7.495 7.947 -19.033 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.634 7.938 -17.719 1.00 0.00 C ATOM 0 H LEU A 35 7.849 11.667 -17.806 1.00 0.00 H new ATOM 0 HA LEU A 35 10.437 10.524 -17.682 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.124 10.399 -19.656 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.616 9.524 -19.936 1.00 0.00 H new ATOM 0 HG LEU A 35 7.996 9.243 -17.375 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.133 7.136 -18.402 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.653 8.562 -19.352 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.993 7.531 -19.909 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.235 7.150 -17.080 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.166 7.490 -18.558 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.321 8.559 -17.143 1.00 0.00 H new ATOM 543 N LYS A 36 10.390 13.157 -19.444 1.00 0.00 N ATOM 544 CA LYS A 36 11.333 14.043 -20.129 1.00 0.00 C ATOM 545 C LYS A 36 12.707 14.039 -19.444 1.00 0.00 C ATOM 546 O LYS A 36 13.718 14.285 -20.105 1.00 0.00 O ATOM 547 CB LYS A 36 10.766 15.447 -20.343 1.00 0.00 C ATOM 548 CG LYS A 36 10.968 16.281 -19.092 1.00 0.00 C ATOM 549 CD LYS A 36 10.082 17.520 -19.055 1.00 0.00 C ATOM 550 CE LYS A 36 10.130 17.847 -17.571 1.00 0.00 C ATOM 551 NZ LYS A 36 9.433 19.116 -17.218 1.00 0.00 N1+ ATOM 0 H LYS A 36 9.555 13.622 -19.088 1.00 0.00 H new ATOM 0 HA LYS A 36 11.488 13.642 -21.130 1.00 0.00 H new ATOM 0 HB2 LYS A 36 11.259 15.922 -21.191 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.705 15.387 -20.583 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.762 15.667 -18.215 1.00 0.00 H new ATOM 0 HG3 LYS A 36 12.013 16.586 -19.030 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.474 18.329 -19.671 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.069 17.317 -19.403 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.680 17.027 -17.012 1.00 0.00 H new ATOM 0 HE3 LYS A 36 11.171 17.914 -17.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.504 19.278 -16.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.876 19.908 -17.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.431 19.049 -17.489 1.00 0.00 H new ATOM 565 N ASP A 37 12.737 13.795 -18.128 1.00 0.00 N ATOM 566 CA ASP A 37 13.931 13.918 -17.291 1.00 0.00 C ATOM 567 C ASP A 37 14.134 12.700 -16.387 1.00 0.00 C ATOM 568 O ASP A 37 15.277 12.310 -16.136 1.00 0.00 O ATOM 569 CB ASP A 37 13.810 15.173 -16.426 1.00 0.00 C ATOM 570 CG ASP A 37 15.054 15.354 -15.540 1.00 0.00 C ATOM 571 OD1 ASP A 37 16.138 15.685 -16.078 1.00 0.00 O1- ATOM 572 OD2 ASP A 37 14.946 15.208 -14.298 1.00 0.00 O ATOM 0 H ASP A 37 11.912 13.500 -17.606 1.00 0.00 H new ATOM 0 HA ASP A 37 14.794 13.985 -17.953 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.683 16.048 -17.064 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.920 15.103 -15.800 1.00 0.00 H new ATOM 577 N ASP A 38 13.052 12.072 -15.920 1.00 0.00 N ATOM 578 CA ASP A 38 13.094 10.902 -15.063 1.00 0.00 C ATOM 579 C ASP A 38 13.268 9.666 -15.934 1.00 0.00 C ATOM 580 O ASP A 38 12.654 9.549 -16.998 1.00 0.00 O ATOM 581 CB ASP A 38 11.847 10.756 -14.177 1.00 0.00 C ATOM 582 CG ASP A 38 11.788 11.818 -13.063 1.00 0.00 C ATOM 583 OD1 ASP A 38 12.712 11.848 -12.212 1.00 0.00 O ATOM 584 OD2 ASP A 38 10.821 12.621 -13.037 1.00 0.00 O1- ATOM 0 H ASP A 38 12.103 12.377 -16.137 1.00 0.00 H new ATOM 0 HA ASP A 38 13.937 11.019 -14.382 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.954 10.834 -14.797 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.838 9.763 -13.728 1.00 0.00 H new ATOM 589 N SER A 39 14.078 8.722 -15.468 1.00 0.00 N ATOM 590 CA SER A 39 14.291 7.449 -16.132 1.00 0.00 C ATOM 591 C SER A 39 13.178 6.505 -15.690 1.00 0.00 C ATOM 592 O SER A 39 12.866 6.480 -14.504 1.00 0.00 O ATOM 593 CB SER A 39 15.681 6.894 -15.773 1.00 0.00 C ATOM 594 OG SER A 39 16.689 7.871 -16.005 1.00 0.00 O ATOM 0 H SER A 39 14.612 8.825 -14.605 1.00 0.00 H new ATOM 0 HA SER A 39 14.262 7.562 -17.216 1.00 0.00 H new ATOM 0 HB2 SER A 39 15.697 6.589 -14.727 1.00 0.00 H new ATOM 0 HB3 SER A 39 15.887 6.004 -16.367 1.00 0.00 H new ATOM 0 HG SER A 39 17.565 7.500 -15.769 1.00 0.00 H new ATOM 600 N PRO A 40 12.620 5.644 -16.553 1.00 0.00 N ATOM 601 CA PRO A 40 11.590 4.703 -16.136 1.00 0.00 C ATOM 602 C PRO A 40 12.167 3.575 -15.267 1.00 0.00 C ATOM 603 O PRO A 40 11.394 2.805 -14.723 1.00 0.00 O ATOM 604 CB PRO A 40 10.981 4.228 -17.457 1.00 0.00 C ATOM 605 CG PRO A 40 12.195 4.185 -18.379 1.00 0.00 C ATOM 606 CD PRO A 40 12.921 5.467 -17.967 1.00 0.00 C ATOM 0 HA PRO A 40 10.832 5.144 -15.489 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.510 3.250 -17.359 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.217 4.914 -17.822 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.804 3.296 -18.217 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.913 4.191 -19.432 1.00 0.00 H new ATOM 0 HD2 PRO A 40 13.995 5.381 -18.132 1.00 0.00 H new ATOM 0 HD3 PRO A 40 12.576 6.319 -18.552 1.00 0.00 H new ATOM 614 N LYS A 41 13.491 3.480 -15.065 1.00 0.00 N ATOM 615 CA LYS A 41 14.137 2.450 -14.235 1.00 0.00 C ATOM 616 C LYS A 41 13.544 2.416 -12.833 1.00 0.00 C ATOM 617 O LYS A 41 13.298 1.356 -12.276 1.00 0.00 O ATOM 618 CB LYS A 41 15.652 2.726 -14.148 1.00 0.00 C ATOM 619 CG LYS A 41 16.431 2.523 -15.463 1.00 0.00 C ATOM 620 CD LYS A 41 16.924 1.082 -15.666 1.00 0.00 C ATOM 621 CE LYS A 41 17.864 1.028 -16.885 1.00 0.00 C ATOM 622 NZ LYS A 41 18.488 -0.311 -17.072 1.00 0.00 N1+ ATOM 0 H LYS A 41 14.156 4.131 -15.483 1.00 0.00 H new ATOM 0 HA LYS A 41 13.963 1.481 -14.703 1.00 0.00 H new ATOM 0 HB2 LYS A 41 15.800 3.752 -13.811 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.081 2.075 -13.386 1.00 0.00 H new ATOM 0 HG2 LYS A 41 15.792 2.802 -16.301 1.00 0.00 H new ATOM 0 HG3 LYS A 41 17.287 3.197 -15.477 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.447 0.736 -14.774 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.076 0.414 -15.817 1.00 0.00 H new ATOM 0 HE2 LYS A 41 17.304 1.292 -17.782 1.00 0.00 H new ATOM 0 HE3 LYS A 41 18.648 1.776 -16.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 19.375 -0.209 -17.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.690 -0.733 -16.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.836 -0.927 -17.598 1.00 0.00 H new ATOM 636 N LEU A 42 13.221 3.579 -12.272 1.00 0.00 N ATOM 637 CA LEU A 42 12.605 3.668 -10.950 1.00 0.00 C ATOM 638 C LEU A 42 11.204 3.070 -10.900 1.00 0.00 C ATOM 639 O LEU A 42 10.758 2.643 -9.838 1.00 0.00 O ATOM 640 CB LEU A 42 12.677 5.086 -10.371 1.00 0.00 C ATOM 641 CG LEU A 42 12.783 6.304 -11.291 1.00 0.00 C ATOM 642 CD1 LEU A 42 11.434 6.558 -11.936 1.00 0.00 C ATOM 643 CD2 LEU A 42 13.227 7.540 -10.510 1.00 0.00 C ATOM 0 H LEU A 42 13.378 4.483 -12.718 1.00 0.00 H new ATOM 0 HA LEU A 42 13.205 3.040 -10.292 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.788 5.226 -9.756 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.536 5.115 -9.701 1.00 0.00 H new ATOM 0 HG LEU A 42 13.530 6.102 -12.059 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.502 7.425 -12.593 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.138 5.685 -12.517 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.690 6.747 -11.162 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.295 8.392 -11.186 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.501 7.755 -9.726 1.00 0.00 H new ATOM 0 HD23 LEU A 42 14.202 7.355 -10.060 1.00 0.00 H new ATOM 655 N MET A 43 10.536 2.931 -12.039 1.00 0.00 N ATOM 656 CA MET A 43 9.282 2.185 -12.176 1.00 0.00 C ATOM 657 C MET A 43 9.450 0.687 -11.863 1.00 0.00 C ATOM 658 O MET A 43 8.458 -0.009 -11.673 1.00 0.00 O ATOM 659 CB MET A 43 8.571 2.525 -13.509 1.00 0.00 C ATOM 660 CG MET A 43 8.538 1.441 -14.597 1.00 0.00 C ATOM 661 SD MET A 43 7.416 1.751 -16.000 1.00 0.00 S ATOM 662 CE MET A 43 7.566 3.544 -16.249 1.00 0.00 C ATOM 0 H MET A 43 10.855 3.342 -12.916 1.00 0.00 H new ATOM 0 HA MET A 43 8.590 2.520 -11.404 1.00 0.00 H new ATOM 0 HB2 MET A 43 7.542 2.801 -13.279 1.00 0.00 H new ATOM 0 HB3 MET A 43 9.052 3.408 -13.930 1.00 0.00 H new ATOM 0 HG2 MET A 43 9.548 1.314 -14.986 1.00 0.00 H new ATOM 0 HG3 MET A 43 8.255 0.497 -14.133 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.371 3.784 -17.294 1.00 0.00 H new ATOM 0 HE2 MET A 43 6.844 4.061 -15.617 1.00 0.00 H new ATOM 0 HE3 MET A 43 8.574 3.865 -15.985 1.00 0.00 H new ATOM 672 N GLU A 44 10.681 0.174 -11.756 1.00 0.00 N ATOM 673 CA GLU A 44 10.942 -1.198 -11.325 1.00 0.00 C ATOM 674 C GLU A 44 10.712 -1.342 -9.814 1.00 0.00 C ATOM 675 O GLU A 44 10.369 -2.433 -9.362 1.00 0.00 O ATOM 676 CB GLU A 44 12.369 -1.623 -11.710 1.00 0.00 C ATOM 677 CG GLU A 44 12.582 -1.618 -13.231 1.00 0.00 C ATOM 678 CD GLU A 44 14.011 -2.048 -13.604 1.00 0.00 C ATOM 679 OE1 GLU A 44 14.972 -1.264 -13.419 1.00 0.00 O1- ATOM 680 OE2 GLU A 44 14.167 -3.182 -14.111 1.00 0.00 O ATOM 0 H GLU A 44 11.526 0.704 -11.968 1.00 0.00 H new ATOM 0 HA GLU A 44 10.244 -1.860 -11.836 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.086 -0.949 -11.242 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.567 -2.621 -11.320 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.865 -2.290 -13.702 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.388 -0.620 -13.623 1.00 0.00 H new ATOM 687 N GLN A 45 10.852 -0.262 -9.030 1.00 0.00 N ATOM 688 CA GLN A 45 10.762 -0.321 -7.569 1.00 0.00 C ATOM 689 C GLN A 45 9.302 -0.419 -7.137 1.00 0.00 C ATOM 690 O GLN A 45 8.929 -1.261 -6.319 1.00 0.00 O ATOM 691 CB GLN A 45 11.368 0.920 -6.888 1.00 0.00 C ATOM 692 CG GLN A 45 12.673 1.465 -7.482 1.00 0.00 C ATOM 693 CD GLN A 45 12.864 2.920 -7.059 1.00 0.00 C ATOM 694 OE1 GLN A 45 13.782 3.267 -6.320 1.00 0.00 O ATOM 695 NE2 GLN A 45 11.979 3.793 -7.524 1.00 0.00 N ATOM 0 H GLN A 45 11.030 0.674 -9.394 1.00 0.00 H new ATOM 0 HA GLN A 45 11.327 -1.201 -7.263 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.625 1.717 -6.911 1.00 0.00 H new ATOM 0 HB3 GLN A 45 11.546 0.680 -5.840 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.517 0.864 -7.143 1.00 0.00 H new ATOM 0 HG3 GLN A 45 12.647 1.393 -8.569 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.226 3.479 -8.136 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.052 4.778 -7.269 1.00 0.00 H new ATOM 704 N TYR A 46 8.494 0.492 -7.688 1.00 0.00 N ATOM 705 CA TYR A 46 7.123 0.734 -7.276 1.00 0.00 C ATOM 706 C TYR A 46 6.294 -0.500 -7.595 1.00 0.00 C ATOM 707 O TYR A 46 6.525 -1.189 -8.588 1.00 0.00 O ATOM 708 CB TYR A 46 6.568 1.992 -7.963 1.00 0.00 C ATOM 709 CG TYR A 46 7.284 3.289 -7.640 1.00 0.00 C ATOM 710 CD1 TYR A 46 7.066 3.949 -6.417 1.00 0.00 C ATOM 711 CD2 TYR A 46 8.165 3.848 -8.583 1.00 0.00 C ATOM 712 CE1 TYR A 46 7.749 5.144 -6.128 1.00 0.00 C ATOM 713 CE2 TYR A 46 8.854 5.039 -8.307 1.00 0.00 C ATOM 714 CZ TYR A 46 8.654 5.691 -7.070 1.00 0.00 C ATOM 715 OH TYR A 46 9.321 6.851 -6.808 1.00 0.00 O ATOM 0 H TYR A 46 8.792 1.095 -8.455 1.00 0.00 H new ATOM 0 HA TYR A 46 7.080 0.916 -6.202 1.00 0.00 H new ATOM 0 HB2 TYR A 46 6.602 1.839 -9.042 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.519 2.100 -7.689 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.373 3.537 -5.699 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.313 3.354 -9.532 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.583 5.645 -5.186 1.00 0.00 H new ATOM 0 HE2 TYR A 46 9.533 5.455 -9.036 1.00 0.00 H new ATOM 0 HH TYR A 46 9.222 7.464 -7.566 1.00 0.00 H new ATOM 725 N ASP A 47 5.311 -0.776 -6.754 1.00 0.00 N ATOM 726 CA ASP A 47 4.500 -1.995 -6.848 1.00 0.00 C ATOM 727 C ASP A 47 3.476 -1.876 -7.979 1.00 0.00 C ATOM 728 O ASP A 47 3.020 -2.872 -8.541 1.00 0.00 O ATOM 729 CB ASP A 47 3.785 -2.230 -5.509 1.00 0.00 C ATOM 730 CG ASP A 47 4.765 -2.580 -4.377 1.00 0.00 C ATOM 731 OD1 ASP A 47 5.250 -3.735 -4.319 1.00 0.00 O1- ATOM 732 OD2 ASP A 47 5.049 -1.689 -3.543 1.00 0.00 O ATOM 0 H ASP A 47 5.046 -0.164 -5.982 1.00 0.00 H new ATOM 0 HA ASP A 47 5.151 -2.841 -7.068 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.224 -1.336 -5.237 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.062 -3.037 -5.623 1.00 0.00 H new ATOM 737 N VAL A 48 3.096 -0.643 -8.313 1.00 0.00 N ATOM 738 CA VAL A 48 1.987 -0.300 -9.186 1.00 0.00 C ATOM 739 C VAL A 48 2.416 0.944 -9.935 1.00 0.00 C ATOM 740 O VAL A 48 3.001 1.836 -9.319 1.00 0.00 O ATOM 741 CB VAL A 48 0.774 -0.009 -8.292 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.378 0.584 -9.089 1.00 0.00 C ATOM 743 CG2 VAL A 48 0.315 -1.269 -7.557 1.00 0.00 C ATOM 0 H VAL A 48 3.582 0.182 -7.961 1.00 0.00 H new ATOM 0 HA VAL A 48 1.725 -1.091 -9.889 1.00 0.00 H new ATOM 0 HB VAL A 48 1.089 0.728 -7.553 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.219 0.777 -8.424 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.058 1.518 -9.550 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.683 -0.118 -9.865 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.546 -1.032 -6.931 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.037 -2.033 -8.283 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.126 -1.641 -6.932 1.00 0.00 H new ATOM 753 N LEU A 49 2.102 1.053 -11.223 1.00 0.00 N ATOM 754 CA LEU A 49 2.349 2.260 -11.983 1.00 0.00 C ATOM 755 C LEU A 49 1.080 2.739 -12.658 1.00 0.00 C ATOM 756 O LEU A 49 0.200 1.940 -12.968 1.00 0.00 O ATOM 757 CB LEU A 49 3.443 2.087 -13.048 1.00 0.00 C ATOM 758 CG LEU A 49 4.794 1.416 -12.753 1.00 0.00 C ATOM 759 CD1 LEU A 49 5.396 1.777 -11.396 1.00 0.00 C ATOM 760 CD2 LEU A 49 4.759 -0.104 -12.908 1.00 0.00 C ATOM 0 H LEU A 49 1.670 0.303 -11.763 1.00 0.00 H new ATOM 0 HA LEU A 49 2.697 3.000 -11.262 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.992 1.529 -13.868 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.668 3.084 -13.427 1.00 0.00 H new ATOM 0 HG LEU A 49 5.449 1.831 -13.520 1.00 0.00 H new ATOM 0 HD11 LEU A 49 6.347 1.260 -11.271 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.559 2.854 -11.345 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.712 1.475 -10.603 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.744 -0.515 -12.686 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.026 -0.523 -12.218 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.482 -0.359 -13.931 1.00 0.00 H new ATOM 772 N ILE A 50 1.014 4.032 -12.957 1.00 0.00 N ATOM 773 CA ILE A 50 -0.013 4.610 -13.811 1.00 0.00 C ATOM 774 C ILE A 50 0.755 5.387 -14.868 1.00 0.00 C ATOM 775 O ILE A 50 1.576 6.224 -14.504 1.00 0.00 O ATOM 776 CB ILE A 50 -0.991 5.458 -12.988 1.00 0.00 C ATOM 777 CG1 ILE A 50 -1.730 4.584 -11.953 1.00 0.00 C ATOM 778 CG2 ILE A 50 -2.024 6.156 -13.881 1.00 0.00 C ATOM 779 CD1 ILE A 50 -1.289 4.997 -10.557 1.00 0.00 C ATOM 0 H ILE A 50 1.684 4.717 -12.607 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.652 3.867 -14.288 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.402 6.218 -12.475 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.808 4.704 -12.059 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.509 3.530 -12.122 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.699 6.747 -13.263 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.512 6.810 -14.587 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.596 5.407 -14.429 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.805 4.386 -9.817 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.213 4.855 -10.458 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.533 6.047 -10.394 1.00 0.00 H new ATOM 791 N LEU A 51 0.565 5.072 -16.146 1.00 0.00 N ATOM 792 CA LEU A 51 1.367 5.610 -17.248 1.00 0.00 C ATOM 793 C LEU A 51 0.443 6.339 -18.208 1.00 0.00 C ATOM 794 O LEU A 51 -0.632 5.825 -18.514 1.00 0.00 O ATOM 795 CB LEU A 51 2.115 4.483 -17.983 1.00 0.00 C ATOM 796 CG LEU A 51 3.483 4.117 -17.398 1.00 0.00 C ATOM 797 CD1 LEU A 51 3.415 3.727 -15.930 1.00 0.00 C ATOM 798 CD2 LEU A 51 4.033 2.912 -18.154 1.00 0.00 C ATOM 0 H LEU A 51 -0.162 4.425 -16.453 1.00 0.00 H new ATOM 0 HA LEU A 51 2.112 6.299 -16.850 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.487 3.592 -17.982 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.250 4.777 -19.024 1.00 0.00 H new ATOM 0 HG LEU A 51 4.114 5.001 -17.494 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.414 3.479 -15.573 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.019 4.561 -15.350 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.763 2.862 -15.813 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.007 2.641 -17.747 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.348 2.071 -18.046 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.137 3.162 -19.210 1.00 0.00 H new ATOM 810 N GLY A 52 0.871 7.500 -18.702 1.00 0.00 N ATOM 811 CA GLY A 52 0.037 8.343 -19.548 1.00 0.00 C ATOM 812 C GLY A 52 0.747 8.792 -20.804 1.00 0.00 C ATOM 813 O GLY A 52 1.793 9.427 -20.682 1.00 0.00 O ATOM 0 H GLY A 52 1.802 7.879 -18.526 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.866 7.797 -19.821 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.280 9.219 -18.982 1.00 0.00 H new ATOM 817 N ILE A 53 0.196 8.503 -21.987 1.00 0.00 N ATOM 818 CA ILE A 53 0.743 8.915 -23.286 1.00 0.00 C ATOM 819 C ILE A 53 -0.303 9.708 -24.076 1.00 0.00 C ATOM 820 O ILE A 53 -1.434 9.245 -24.224 1.00 0.00 O ATOM 821 CB ILE A 53 1.292 7.753 -24.156 1.00 0.00 C ATOM 822 CG1 ILE A 53 0.301 6.647 -24.547 1.00 0.00 C ATOM 823 CG2 ILE A 53 2.540 7.095 -23.558 1.00 0.00 C ATOM 824 CD1 ILE A 53 -0.264 5.864 -23.368 1.00 0.00 C ATOM 0 H ILE A 53 -0.665 7.962 -22.071 1.00 0.00 H new ATOM 0 HA ILE A 53 1.603 9.542 -23.051 1.00 0.00 H new ATOM 0 HB ILE A 53 1.536 8.283 -25.077 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.525 7.095 -25.100 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.799 5.953 -25.224 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.876 6.290 -24.212 1.00 0.00 H new ATOM 0 HG22 ILE A 53 3.332 7.838 -23.461 1.00 0.00 H new ATOM 0 HG23 ILE A 53 2.301 6.688 -22.575 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.954 5.104 -23.733 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.551 5.384 -22.826 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.793 6.544 -22.700 1.00 0.00 H new ATOM 836 N PRO A 54 0.035 10.884 -24.614 1.00 0.00 N ATOM 837 CA PRO A 54 -0.801 11.561 -25.595 1.00 0.00 C ATOM 838 C PRO A 54 -0.519 10.948 -26.978 1.00 0.00 C ATOM 839 O PRO A 54 0.619 10.558 -27.258 1.00 0.00 O ATOM 840 CB PRO A 54 -0.390 13.028 -25.495 1.00 0.00 C ATOM 841 CG PRO A 54 1.106 12.940 -25.150 1.00 0.00 C ATOM 842 CD PRO A 54 1.216 11.679 -24.303 1.00 0.00 C ATOM 0 HA PRO A 54 -1.873 11.459 -25.428 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.559 13.560 -26.431 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.953 13.554 -24.724 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.719 12.872 -26.048 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.441 13.820 -24.601 1.00 0.00 H new ATOM 0 HD2 PRO A 54 2.129 11.130 -24.536 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.254 11.924 -23.241 1.00 0.00 H new ATOM 850 N THR A 55 -1.525 10.873 -27.852 1.00 0.00 N ATOM 851 CA THR A 55 -1.310 10.472 -29.237 1.00 0.00 C ATOM 852 C THR A 55 -1.111 11.743 -30.072 1.00 0.00 C ATOM 853 O THR A 55 -1.939 12.654 -30.009 1.00 0.00 O ATOM 854 CB THR A 55 -2.471 9.608 -29.730 1.00 0.00 C ATOM 855 OG1 THR A 55 -2.696 8.523 -28.840 1.00 0.00 O ATOM 856 CG2 THR A 55 -2.134 8.998 -31.084 1.00 0.00 C ATOM 0 H THR A 55 -2.496 11.086 -27.622 1.00 0.00 H new ATOM 0 HA THR A 55 -0.418 9.853 -29.332 1.00 0.00 H new ATOM 0 HB THR A 55 -3.351 10.249 -29.794 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.208 8.836 -28.066 1.00 0.00 H new ATOM 0 HG21 THR A 55 -2.968 8.385 -31.425 1.00 0.00 H new ATOM 0 HG22 THR A 55 -1.950 9.794 -31.806 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.242 8.378 -30.992 1.00 0.00 H new ATOM 864 N TRP A 56 -0.050 11.798 -30.871 1.00 0.00 N ATOM 865 CA TRP A 56 0.307 12.898 -31.744 1.00 0.00 C ATOM 866 C TRP A 56 0.420 12.410 -33.192 1.00 0.00 C ATOM 867 O TRP A 56 0.334 11.211 -33.444 1.00 0.00 O ATOM 868 CB TRP A 56 1.614 13.537 -31.247 1.00 0.00 C ATOM 869 CG TRP A 56 1.472 14.499 -30.109 1.00 0.00 C ATOM 870 CD1 TRP A 56 1.722 14.237 -28.807 1.00 0.00 C ATOM 871 CD2 TRP A 56 1.107 15.913 -30.168 1.00 0.00 C ATOM 872 NE1 TRP A 56 1.582 15.396 -28.065 1.00 0.00 N ATOM 873 CE2 TRP A 56 1.170 16.451 -28.853 1.00 0.00 C ATOM 874 CE3 TRP A 56 0.759 16.800 -31.210 1.00 0.00 C ATOM 875 CZ2 TRP A 56 0.889 17.797 -28.583 1.00 0.00 C ATOM 876 CZ3 TRP A 56 0.495 18.160 -30.948 1.00 0.00 C ATOM 877 CH2 TRP A 56 0.549 18.659 -29.636 1.00 0.00 C ATOM 0 H TRP A 56 0.618 11.029 -30.926 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.472 13.660 -31.722 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.294 12.741 -30.944 1.00 0.00 H new ATOM 0 HB3 TRP A 56 2.084 14.057 -32.082 1.00 0.00 H new ATOM 0 HD1 TRP A 56 1.990 13.270 -28.407 1.00 0.00 H new ATOM 0 HE1 TRP A 56 1.761 15.462 -27.063 1.00 0.00 H new ATOM 0 HE3 TRP A 56 0.694 16.431 -32.223 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 0.934 18.169 -27.570 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 0.249 18.824 -31.763 1.00 0.00 H new ATOM 0 HH2 TRP A 56 0.330 19.698 -29.440 1.00 0.00 H new ATOM 888 N ASP A 57 0.586 13.356 -34.121 1.00 0.00 N ATOM 889 CA ASP A 57 0.944 13.202 -35.540 1.00 0.00 C ATOM 890 C ASP A 57 0.557 11.859 -36.184 1.00 0.00 C ATOM 891 O ASP A 57 1.405 11.138 -36.718 1.00 0.00 O ATOM 892 CB ASP A 57 2.423 13.562 -35.740 1.00 0.00 C ATOM 893 CG ASP A 57 2.808 13.651 -37.230 1.00 0.00 C ATOM 894 OD1 ASP A 57 2.003 14.163 -38.046 1.00 0.00 O1- ATOM 895 OD2 ASP A 57 3.956 13.286 -37.584 1.00 0.00 O ATOM 0 H ASP A 57 0.463 14.339 -33.880 1.00 0.00 H new ATOM 0 HA ASP A 57 0.323 13.909 -36.091 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.631 14.516 -35.256 1.00 0.00 H new ATOM 0 HB3 ASP A 57 3.046 12.814 -35.250 1.00 0.00 H new ATOM 900 N PHE A 58 -0.742 11.539 -36.139 1.00 0.00 N ATOM 901 CA PHE A 58 -1.331 10.308 -36.668 1.00 0.00 C ATOM 902 C PHE A 58 -0.702 9.057 -36.032 1.00 0.00 C ATOM 903 O PHE A 58 0.080 8.333 -36.662 1.00 0.00 O ATOM 904 CB PHE A 58 -1.327 10.274 -38.209 1.00 0.00 C ATOM 905 CG PHE A 58 -2.042 11.378 -38.986 1.00 0.00 C ATOM 906 CD1 PHE A 58 -2.796 12.400 -38.365 1.00 0.00 C ATOM 907 CD2 PHE A 58 -1.961 11.345 -40.393 1.00 0.00 C ATOM 908 CE1 PHE A 58 -3.437 13.377 -39.150 1.00 0.00 C ATOM 909 CE2 PHE A 58 -2.612 12.316 -41.174 1.00 0.00 C ATOM 910 CZ PHE A 58 -3.350 13.335 -40.552 1.00 0.00 C ATOM 0 H PHE A 58 -1.436 12.156 -35.716 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.382 10.301 -36.378 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -0.286 10.267 -38.533 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.763 9.323 -38.516 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -2.880 12.431 -37.289 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.392 10.565 -40.877 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -4.000 14.165 -38.671 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.544 12.278 -42.251 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.849 14.084 -41.149 1.00 0.00 H new ATOM 920 N GLY A 59 -1.086 8.755 -34.783 1.00 0.00 N ATOM 921 CA GLY A 59 -0.647 7.549 -34.091 1.00 0.00 C ATOM 922 C GLY A 59 0.833 7.523 -33.699 1.00 0.00 C ATOM 923 O GLY A 59 1.384 6.459 -33.412 1.00 0.00 O ATOM 0 H GLY A 59 -1.709 9.344 -34.230 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.247 7.428 -33.189 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -0.853 6.689 -34.728 1.00 0.00 H new ATOM 927 N GLU A 60 1.483 8.679 -33.668 1.00 0.00 N ATOM 928 CA GLU A 60 2.807 8.867 -33.118 1.00 0.00 C ATOM 929 C GLU A 60 2.712 9.070 -31.601 1.00 0.00 C ATOM 930 O GLU A 60 1.673 9.459 -31.053 1.00 0.00 O ATOM 931 CB GLU A 60 3.556 10.018 -33.813 1.00 0.00 C ATOM 932 CG GLU A 60 3.939 9.696 -35.265 1.00 0.00 C ATOM 933 CD GLU A 60 5.148 8.746 -35.360 1.00 0.00 C ATOM 934 OE1 GLU A 60 4.973 7.508 -35.248 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 6.287 9.230 -35.576 1.00 0.00 O ATOM 0 H GLU A 60 1.082 9.540 -34.041 1.00 0.00 H new ATOM 0 HA GLU A 60 3.395 7.969 -33.306 1.00 0.00 H new ATOM 0 HB2 GLU A 60 2.932 10.912 -33.798 1.00 0.00 H new ATOM 0 HB3 GLU A 60 4.459 10.250 -33.248 1.00 0.00 H new ATOM 0 HG2 GLU A 60 3.086 9.244 -35.771 1.00 0.00 H new ATOM 0 HG3 GLU A 60 4.167 10.623 -35.791 1.00 0.00 H new ATOM 942 N ILE A 61 3.826 8.808 -30.923 1.00 0.00 N ATOM 943 CA ILE A 61 4.027 9.009 -29.497 1.00 0.00 C ATOM 944 C ILE A 61 4.747 10.364 -29.352 1.00 0.00 C ATOM 945 O ILE A 61 5.495 10.766 -30.250 1.00 0.00 O ATOM 946 CB ILE A 61 4.876 7.834 -28.958 1.00 0.00 C ATOM 947 CG1 ILE A 61 4.307 6.426 -29.256 1.00 0.00 C ATOM 948 CG2 ILE A 61 5.096 7.938 -27.441 1.00 0.00 C ATOM 949 CD1 ILE A 61 5.431 5.383 -29.316 1.00 0.00 C ATOM 0 H ILE A 61 4.655 8.430 -31.381 1.00 0.00 H new ATOM 0 HA ILE A 61 3.098 9.029 -28.927 1.00 0.00 H new ATOM 0 HB ILE A 61 5.816 7.934 -29.500 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.589 6.149 -28.484 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.768 6.440 -30.203 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.697 7.094 -27.102 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.615 8.869 -27.212 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.132 7.925 -26.932 1.00 0.00 H new ATOM 0 HD11 ILE A 61 5.006 4.402 -29.527 1.00 0.00 H new ATOM 0 HD12 ILE A 61 6.134 5.651 -30.105 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.953 5.355 -28.359 1.00 0.00 H new ATOM 961 N GLN A 62 4.557 11.068 -28.228 1.00 0.00 N ATOM 962 CA GLN A 62 5.353 12.245 -27.930 1.00 0.00 C ATOM 963 C GLN A 62 6.802 11.810 -27.710 1.00 0.00 C ATOM 964 O GLN A 62 7.080 10.777 -27.102 1.00 0.00 O ATOM 965 CB GLN A 62 4.776 13.050 -26.753 1.00 0.00 C ATOM 966 CG GLN A 62 5.664 14.191 -26.215 1.00 0.00 C ATOM 967 CD GLN A 62 6.203 15.213 -27.230 1.00 0.00 C ATOM 968 OE1 GLN A 62 5.942 15.162 -28.431 1.00 0.00 O ATOM 969 NE2 GLN A 62 7.051 16.121 -26.772 1.00 0.00 N ATOM 0 H GLN A 62 3.861 10.837 -27.519 1.00 0.00 H new ATOM 0 HA GLN A 62 5.324 12.932 -28.776 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.821 13.475 -27.062 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.568 12.361 -25.934 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.093 14.734 -25.462 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.517 13.742 -25.706 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.266 16.161 -25.776 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.489 16.780 -27.415 1.00 0.00 H new ATOM 978 N GLU A 63 7.735 12.641 -28.154 1.00 0.00 N ATOM 979 CA GLU A 63 9.150 12.277 -28.227 1.00 0.00 C ATOM 980 C GLU A 63 9.753 12.019 -26.840 1.00 0.00 C ATOM 981 O GLU A 63 10.678 11.220 -26.705 1.00 0.00 O ATOM 982 CB GLU A 63 9.953 13.322 -29.020 1.00 0.00 C ATOM 983 CG GLU A 63 10.134 14.652 -28.272 1.00 0.00 C ATOM 984 CD GLU A 63 10.866 15.693 -29.139 1.00 0.00 C ATOM 985 OE1 GLU A 63 12.121 15.675 -29.186 1.00 0.00 O ATOM 986 OE2 GLU A 63 10.194 16.544 -29.769 1.00 0.00 O1- ATOM 0 H GLU A 63 7.536 13.588 -28.475 1.00 0.00 H new ATOM 0 HA GLU A 63 9.215 11.334 -28.771 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.934 12.911 -29.257 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.450 13.513 -29.968 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.159 15.042 -27.980 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.697 14.481 -27.354 1.00 0.00 H new ATOM 993 N ASP A 64 9.198 12.639 -25.795 1.00 0.00 N ATOM 994 CA ASP A 64 9.646 12.454 -24.414 1.00 0.00 C ATOM 995 C ASP A 64 9.363 11.027 -23.939 1.00 0.00 C ATOM 996 O ASP A 64 10.072 10.505 -23.079 1.00 0.00 O ATOM 997 CB ASP A 64 8.947 13.455 -23.481 1.00 0.00 C ATOM 998 CG ASP A 64 9.228 14.915 -23.864 1.00 0.00 C ATOM 999 OD1 ASP A 64 10.391 15.368 -23.740 1.00 0.00 O1- ATOM 1000 OD2 ASP A 64 8.274 15.595 -24.313 1.00 0.00 O ATOM 0 H ASP A 64 8.418 13.290 -25.886 1.00 0.00 H new ATOM 0 HA ASP A 64 10.721 12.630 -24.384 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.872 13.278 -23.504 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.277 13.282 -22.456 1.00 0.00 H new ATOM 1005 N TRP A 65 8.346 10.385 -24.524 1.00 0.00 N ATOM 1006 CA TRP A 65 8.035 8.990 -24.308 1.00 0.00 C ATOM 1007 C TRP A 65 8.867 8.106 -25.223 1.00 0.00 C ATOM 1008 O TRP A 65 9.405 7.106 -24.756 1.00 0.00 O ATOM 1009 CB TRP A 65 6.534 8.737 -24.460 1.00 0.00 C ATOM 1010 CG TRP A 65 5.806 8.632 -23.171 1.00 0.00 C ATOM 1011 CD1 TRP A 65 4.913 9.517 -22.683 1.00 0.00 C ATOM 1012 CD2 TRP A 65 5.850 7.527 -22.227 1.00 0.00 C ATOM 1013 NE1 TRP A 65 4.357 9.000 -21.532 1.00 0.00 N ATOM 1014 CE2 TRP A 65 4.888 7.775 -21.206 1.00 0.00 C ATOM 1015 CE3 TRP A 65 6.582 6.325 -22.154 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 4.646 6.863 -20.172 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 6.378 5.422 -21.097 1.00 0.00 C ATOM 1018 CH2 TRP A 65 5.419 5.691 -20.111 1.00 0.00 C ATOM 0 H TRP A 65 7.708 10.843 -25.175 1.00 0.00 H new ATOM 0 HA TRP A 65 8.298 8.727 -23.283 1.00 0.00 H new ATOM 0 HB2 TRP A 65 6.097 9.545 -25.047 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.386 7.817 -25.025 1.00 0.00 H new ATOM 0 HD1 TRP A 65 4.673 10.474 -23.122 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.636 9.472 -20.986 1.00 0.00 H new ATOM 0 HE3 TRP A 65 7.308 6.095 -22.920 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 3.880 7.056 -19.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 6.963 4.516 -21.044 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.273 4.993 -19.299 1.00 0.00 H new ATOM 1029 N GLU A 66 9.026 8.485 -26.492 1.00 0.00 N ATOM 1030 CA GLU A 66 9.862 7.745 -27.442 1.00 0.00 C ATOM 1031 C GLU A 66 11.290 7.579 -26.906 1.00 0.00 C ATOM 1032 O GLU A 66 11.911 6.534 -27.103 1.00 0.00 O ATOM 1033 CB GLU A 66 9.913 8.443 -28.809 1.00 0.00 C ATOM 1034 CG GLU A 66 8.551 8.508 -29.503 1.00 0.00 C ATOM 1035 CD GLU A 66 8.686 8.990 -30.959 1.00 0.00 C ATOM 1036 OE1 GLU A 66 9.177 10.121 -31.195 1.00 0.00 O1- ATOM 1037 OE2 GLU A 66 8.305 8.229 -31.883 1.00 0.00 O ATOM 0 H GLU A 66 8.581 9.311 -26.891 1.00 0.00 H new ATOM 0 HA GLU A 66 9.407 6.762 -27.566 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.296 9.455 -28.679 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.617 7.916 -29.453 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.085 7.523 -29.486 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.893 9.182 -28.954 1.00 0.00 H new ATOM 1044 N ALA A 67 11.778 8.584 -26.174 1.00 0.00 N ATOM 1045 CA ALA A 67 13.108 8.597 -25.584 1.00 0.00 C ATOM 1046 C ALA A 67 13.297 7.473 -24.560 1.00 0.00 C ATOM 1047 O ALA A 67 14.416 6.980 -24.403 1.00 0.00 O ATOM 1048 CB ALA A 67 13.355 9.961 -24.925 1.00 0.00 C ATOM 0 H ALA A 67 11.242 9.428 -25.974 1.00 0.00 H new ATOM 0 HA ALA A 67 13.833 8.429 -26.381 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.351 9.976 -24.481 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.281 10.747 -25.677 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.609 10.130 -24.148 1.00 0.00 H new ATOM 1054 N VAL A 68 12.227 7.056 -23.872 1.00 0.00 N ATOM 1055 CA VAL A 68 12.284 6.005 -22.859 1.00 0.00 C ATOM 1056 C VAL A 68 11.633 4.699 -23.316 1.00 0.00 C ATOM 1057 O VAL A 68 11.825 3.678 -22.665 1.00 0.00 O ATOM 1058 CB VAL A 68 11.748 6.516 -21.513 1.00 0.00 C ATOM 1059 CG1 VAL A 68 12.435 7.813 -21.060 1.00 0.00 C ATOM 1060 CG2 VAL A 68 10.224 6.687 -21.472 1.00 0.00 C ATOM 0 H VAL A 68 11.293 7.443 -24.006 1.00 0.00 H new ATOM 0 HA VAL A 68 13.333 5.750 -22.709 1.00 0.00 H new ATOM 0 HB VAL A 68 11.999 5.724 -20.808 1.00 0.00 H new ATOM 0 HG11 VAL A 68 12.019 8.130 -20.104 1.00 0.00 H new ATOM 0 HG12 VAL A 68 13.505 7.639 -20.950 1.00 0.00 H new ATOM 0 HG13 VAL A 68 12.269 8.592 -21.804 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.925 7.051 -20.489 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.918 7.405 -22.233 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.745 5.727 -21.665 1.00 0.00 H new ATOM 1070 N TRP A 69 10.911 4.706 -24.439 1.00 0.00 N ATOM 1071 CA TRP A 69 10.220 3.549 -25.018 1.00 0.00 C ATOM 1072 C TRP A 69 11.164 2.361 -25.213 1.00 0.00 C ATOM 1073 O TRP A 69 10.753 1.206 -25.129 1.00 0.00 O ATOM 1074 CB TRP A 69 9.596 3.976 -26.353 1.00 0.00 C ATOM 1075 CG TRP A 69 8.313 3.296 -26.713 1.00 0.00 C ATOM 1076 CD1 TRP A 69 8.162 2.215 -27.512 1.00 0.00 C ATOM 1077 CD2 TRP A 69 6.959 3.709 -26.360 1.00 0.00 C ATOM 1078 NE1 TRP A 69 6.817 1.903 -27.608 1.00 0.00 N ATOM 1079 CE2 TRP A 69 6.037 2.841 -27.004 1.00 0.00 C ATOM 1080 CE3 TRP A 69 6.412 4.759 -25.603 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 4.657 3.017 -26.960 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 5.020 4.946 -25.531 1.00 0.00 C ATOM 1083 CH2 TRP A 69 4.148 4.105 -26.250 1.00 0.00 C ATOM 0 H TRP A 69 10.786 5.553 -24.994 1.00 0.00 H new ATOM 0 HA TRP A 69 9.442 3.217 -24.330 1.00 0.00 H new ATOM 0 HB2 TRP A 69 9.421 5.051 -26.324 1.00 0.00 H new ATOM 0 HB3 TRP A 69 10.319 3.792 -27.147 1.00 0.00 H new ATOM 0 HD1 TRP A 69 8.964 1.680 -27.998 1.00 0.00 H new ATOM 0 HE1 TRP A 69 6.454 1.072 -28.074 1.00 0.00 H new ATOM 0 HE3 TRP A 69 7.069 5.431 -25.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 3.996 2.328 -27.464 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.617 5.740 -24.920 1.00 0.00 H new ATOM 0 HH2 TRP A 69 3.086 4.302 -26.252 1.00 0.00 H new ATOM 1094 N ASP A 70 12.442 2.660 -25.429 1.00 0.00 N ATOM 1095 CA ASP A 70 13.510 1.685 -25.603 1.00 0.00 C ATOM 1096 C ASP A 70 13.827 0.968 -24.290 1.00 0.00 C ATOM 1097 O ASP A 70 13.935 -0.256 -24.249 1.00 0.00 O ATOM 1098 CB ASP A 70 14.758 2.384 -26.148 1.00 0.00 C ATOM 1099 CG ASP A 70 15.937 1.402 -26.241 1.00 0.00 C ATOM 1100 OD1 ASP A 70 15.962 0.578 -27.187 1.00 0.00 O1- ATOM 1101 OD2 ASP A 70 16.851 1.468 -25.382 1.00 0.00 O ATOM 0 H ASP A 70 12.772 3.623 -25.490 1.00 0.00 H new ATOM 0 HA ASP A 70 13.178 0.931 -26.317 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.546 2.800 -27.133 1.00 0.00 H new ATOM 0 HB3 ASP A 70 15.025 3.219 -25.500 1.00 0.00 H new ATOM 1106 N GLN A 71 13.891 1.733 -23.197 1.00 0.00 N ATOM 1107 CA GLN A 71 14.171 1.230 -21.860 1.00 0.00 C ATOM 1108 C GLN A 71 13.039 0.400 -21.305 1.00 0.00 C ATOM 1109 O GLN A 71 13.322 -0.495 -20.525 1.00 0.00 O ATOM 1110 CB GLN A 71 14.479 2.386 -20.893 1.00 0.00 C ATOM 1111 CG GLN A 71 15.948 2.809 -20.950 1.00 0.00 C ATOM 1112 CD GLN A 71 16.157 4.121 -20.196 1.00 0.00 C ATOM 1113 OE1 GLN A 71 16.383 4.140 -18.989 1.00 0.00 O ATOM 1114 NE2 GLN A 71 16.016 5.245 -20.885 1.00 0.00 N ATOM 0 H GLN A 71 13.745 2.742 -23.223 1.00 0.00 H new ATOM 0 HA GLN A 71 15.045 0.585 -21.952 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.847 3.240 -21.137 1.00 0.00 H new ATOM 0 HB3 GLN A 71 14.229 2.084 -19.876 1.00 0.00 H new ATOM 0 HG2 GLN A 71 16.574 2.030 -20.516 1.00 0.00 H new ATOM 0 HG3 GLN A 71 16.259 2.926 -21.988 1.00 0.00 H new ATOM 0 HE21 GLN A 71 15.829 5.209 -21.887 1.00 0.00 H new ATOM 0 HE22 GLN A 71 16.095 6.146 -20.413 1.00 0.00 H new ATOM 1123 N LEU A 72 11.781 0.643 -21.682 1.00 0.00 N ATOM 1124 CA LEU A 72 10.638 -0.090 -21.108 1.00 0.00 C ATOM 1125 C LEU A 72 10.795 -1.594 -21.326 1.00 0.00 C ATOM 1126 O LEU A 72 10.405 -2.397 -20.484 1.00 0.00 O ATOM 1127 CB LEU A 72 9.307 0.361 -21.729 1.00 0.00 C ATOM 1128 CG LEU A 72 9.083 1.876 -21.812 1.00 0.00 C ATOM 1129 CD1 LEU A 72 7.723 2.165 -22.445 1.00 0.00 C ATOM 1130 CD2 LEU A 72 9.228 2.582 -20.463 1.00 0.00 C ATOM 0 H LEU A 72 11.523 1.340 -22.381 1.00 0.00 H new ATOM 0 HA LEU A 72 10.625 0.131 -20.041 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.240 -0.052 -22.736 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.493 -0.076 -21.151 1.00 0.00 H new ATOM 0 HG LEU A 72 9.871 2.285 -22.445 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.569 3.243 -22.501 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.691 1.741 -23.449 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.936 1.718 -21.837 1.00 0.00 H new ATOM 0 HD21 LEU A 72 9.057 3.651 -20.592 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.497 2.180 -19.761 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.233 2.419 -20.073 1.00 0.00 H new ATOM 1142 N ASP A 73 11.404 -1.965 -22.452 1.00 0.00 N ATOM 1143 CA ASP A 73 11.702 -3.353 -22.799 1.00 0.00 C ATOM 1144 C ASP A 73 12.743 -3.960 -21.863 1.00 0.00 C ATOM 1145 O ASP A 73 12.690 -5.158 -21.589 1.00 0.00 O ATOM 1146 CB ASP A 73 12.207 -3.444 -24.240 1.00 0.00 C ATOM 1147 CG ASP A 73 12.508 -4.904 -24.627 1.00 0.00 C ATOM 1148 OD1 ASP A 73 11.548 -5.705 -24.725 1.00 0.00 O1- ATOM 1149 OD2 ASP A 73 13.692 -5.243 -24.868 1.00 0.00 O ATOM 0 H ASP A 73 11.709 -1.297 -23.160 1.00 0.00 H new ATOM 0 HA ASP A 73 10.775 -3.917 -22.694 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.460 -3.031 -24.918 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.108 -2.841 -24.352 1.00 0.00 H new ATOM 1154 N ASP A 74 13.644 -3.144 -21.313 1.00 0.00 N ATOM 1155 CA ASP A 74 14.717 -3.616 -20.443 1.00 0.00 C ATOM 1156 C ASP A 74 14.215 -3.839 -19.013 1.00 0.00 C ATOM 1157 O ASP A 74 14.775 -4.649 -18.269 1.00 0.00 O ATOM 1158 CB ASP A 74 15.879 -2.614 -20.453 1.00 0.00 C ATOM 1159 CG ASP A 74 16.985 -3.012 -19.463 1.00 0.00 C ATOM 1160 OD1 ASP A 74 17.725 -3.987 -19.739 1.00 0.00 O ATOM 1161 OD2 ASP A 74 17.151 -2.310 -18.435 1.00 0.00 O1- ATOM 0 H ASP A 74 13.648 -2.135 -21.460 1.00 0.00 H new ATOM 0 HA ASP A 74 15.069 -4.574 -20.825 1.00 0.00 H new ATOM 0 HB2 ASP A 74 16.296 -2.551 -21.458 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.505 -1.622 -20.201 1.00 0.00 H new ATOM 1166 N LEU A 75 13.136 -3.145 -18.631 1.00 0.00 N ATOM 1167 CA LEU A 75 12.704 -3.077 -17.243 1.00 0.00 C ATOM 1168 C LEU A 75 12.057 -4.367 -16.780 1.00 0.00 C ATOM 1169 O LEU A 75 11.545 -5.174 -17.555 1.00 0.00 O ATOM 1170 CB LEU A 75 11.734 -1.911 -16.979 1.00 0.00 C ATOM 1171 CG LEU A 75 12.177 -0.588 -17.580 1.00 0.00 C ATOM 1172 CD1 LEU A 75 11.227 0.552 -17.250 1.00 0.00 C ATOM 1173 CD2 LEU A 75 13.618 -0.144 -17.319 1.00 0.00 C ATOM 0 H LEU A 75 12.546 -2.620 -19.276 1.00 0.00 H new ATOM 0 HA LEU A 75 13.616 -2.908 -16.671 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.754 -2.170 -17.380 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.616 -1.787 -15.903 1.00 0.00 H new ATOM 0 HG LEU A 75 12.143 -0.818 -18.645 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.592 1.473 -17.704 1.00 0.00 H new ATOM 0 HD12 LEU A 75 10.235 0.323 -17.640 1.00 0.00 H new ATOM 0 HD13 LEU A 75 11.172 0.678 -16.169 1.00 0.00 H new ATOM 0 HD21 LEU A 75 13.797 0.815 -17.805 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.779 -0.042 -16.246 1.00 0.00 H new ATOM 0 HD23 LEU A 75 14.306 -0.888 -17.720 1.00 0.00 H new ATOM 1185 N ASN A 76 11.991 -4.469 -15.468 1.00 0.00 N ATOM 1186 CA ASN A 76 11.312 -5.508 -14.714 1.00 0.00 C ATOM 1187 C ASN A 76 9.946 -4.987 -14.277 1.00 0.00 C ATOM 1188 O ASN A 76 9.877 -4.263 -13.284 1.00 0.00 O ATOM 1189 CB ASN A 76 12.173 -5.929 -13.508 1.00 0.00 C ATOM 1190 CG ASN A 76 11.430 -6.902 -12.596 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.386 -8.100 -12.857 1.00 0.00 O ATOM 1192 ND2 ASN A 76 10.799 -6.413 -11.536 1.00 0.00 N ATOM 0 H ASN A 76 12.439 -3.784 -14.859 1.00 0.00 H new ATOM 0 HA ASN A 76 11.164 -6.392 -15.334 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.093 -6.393 -13.862 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.460 -5.044 -12.939 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.269 -7.035 -10.926 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.844 -5.415 -11.331 1.00 0.00 H new ATOM 1199 N LEU A 77 8.861 -5.333 -14.991 1.00 0.00 N ATOM 1200 CA LEU A 77 7.490 -5.023 -14.565 1.00 0.00 C ATOM 1201 C LEU A 77 6.651 -6.254 -14.273 1.00 0.00 C ATOM 1202 O LEU A 77 5.439 -6.160 -14.111 1.00 0.00 O ATOM 1203 CB LEU A 77 6.725 -4.113 -15.549 1.00 0.00 C ATOM 1204 CG LEU A 77 7.487 -3.029 -16.303 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.530 -2.259 -17.212 1.00 0.00 C ATOM 1206 CD2 LEU A 77 8.195 -2.016 -15.403 1.00 0.00 C ATOM 0 H LEU A 77 8.912 -5.834 -15.878 1.00 0.00 H new ATOM 0 HA LEU A 77 7.636 -4.476 -13.634 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.250 -4.756 -16.290 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.926 -3.625 -14.991 1.00 0.00 H new ATOM 0 HG LEU A 77 8.255 -3.557 -16.869 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.080 -1.486 -17.748 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.077 -2.945 -17.928 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.749 -1.796 -16.609 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.712 -1.281 -16.019 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.461 -1.511 -14.775 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.918 -2.533 -14.772 1.00 0.00 H new ATOM 1218 N GLU A 78 7.287 -7.406 -14.224 1.00 0.00 N ATOM 1219 CA GLU A 78 6.576 -8.676 -14.176 1.00 0.00 C ATOM 1220 C GLU A 78 5.751 -8.738 -12.887 1.00 0.00 C ATOM 1221 O GLU A 78 6.283 -8.613 -11.781 1.00 0.00 O ATOM 1222 CB GLU A 78 7.536 -9.866 -14.313 1.00 0.00 C ATOM 1223 CG GLU A 78 8.091 -9.993 -15.738 1.00 0.00 C ATOM 1224 CD GLU A 78 9.039 -11.198 -15.874 1.00 0.00 C ATOM 1225 OE1 GLU A 78 8.551 -12.348 -15.989 1.00 0.00 O ATOM 1226 OE2 GLU A 78 10.279 -11.007 -15.888 1.00 0.00 O1- ATOM 0 H GLU A 78 8.303 -7.494 -14.216 1.00 0.00 H new ATOM 0 HA GLU A 78 5.897 -8.743 -15.026 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.362 -9.749 -13.611 1.00 0.00 H new ATOM 0 HB3 GLU A 78 7.016 -10.785 -14.043 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.266 -10.098 -16.442 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.623 -9.080 -16.004 1.00 0.00 H new ATOM 1233 N GLY A 79 4.437 -8.900 -13.052 1.00 0.00 N ATOM 1234 CA GLY A 79 3.454 -8.979 -11.984 1.00 0.00 C ATOM 1235 C GLY A 79 2.964 -7.639 -11.455 1.00 0.00 C ATOM 1236 O GLY A 79 2.085 -7.616 -10.592 1.00 0.00 O ATOM 0 H GLY A 79 4.016 -8.983 -13.977 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.595 -9.546 -12.343 1.00 0.00 H new ATOM 0 HA3 GLY A 79 3.884 -9.543 -11.156 1.00 0.00 H new ATOM 1240 N LYS A 80 3.473 -6.529 -11.984 1.00 0.00 N ATOM 1241 CA LYS A 80 3.086 -5.189 -11.571 1.00 0.00 C ATOM 1242 C LYS A 80 1.719 -4.873 -12.099 1.00 0.00 C ATOM 1243 O LYS A 80 1.313 -5.381 -13.141 1.00 0.00 O ATOM 1244 CB LYS A 80 4.067 -4.103 -12.050 1.00 0.00 C ATOM 1245 CG LYS A 80 5.378 -4.251 -11.304 1.00 0.00 C ATOM 1246 CD LYS A 80 6.244 -3.000 -11.476 1.00 0.00 C ATOM 1247 CE LYS A 80 7.680 -3.215 -10.986 1.00 0.00 C ATOM 1248 NZ LYS A 80 7.785 -3.494 -9.524 1.00 0.00 N1+ ATOM 0 H LYS A 80 4.176 -6.539 -12.723 1.00 0.00 H new ATOM 0 HA LYS A 80 3.096 -5.183 -10.481 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.233 -4.194 -13.123 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.646 -3.113 -11.876 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.182 -4.421 -10.245 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.915 -5.125 -11.673 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.260 -2.714 -12.528 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.795 -2.172 -10.927 1.00 0.00 H new ATOM 0 HE2 LYS A 80 8.121 -4.046 -11.537 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.270 -2.329 -11.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.775 -3.394 -9.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.192 -2.820 -8.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.461 -4.463 -9.331 1.00 0.00 H new ATOM 1262 N ILE A 81 1.043 -3.977 -11.402 1.00 0.00 N ATOM 1263 CA ILE A 81 -0.191 -3.413 -11.921 1.00 0.00 C ATOM 1264 C ILE A 81 0.155 -2.155 -12.695 1.00 0.00 C ATOM 1265 O ILE A 81 1.009 -1.379 -12.263 1.00 0.00 O ATOM 1266 CB ILE A 81 -1.230 -3.175 -10.826 1.00 0.00 C ATOM 1267 CG1 ILE A 81 -1.502 -4.475 -10.048 1.00 0.00 C ATOM 1268 CG2 ILE A 81 -2.549 -2.740 -11.484 1.00 0.00 C ATOM 1269 CD1 ILE A 81 -1.599 -4.254 -8.554 1.00 0.00 C ATOM 0 H ILE A 81 1.323 -3.627 -10.486 1.00 0.00 H new ATOM 0 HA ILE A 81 -0.666 -4.126 -12.595 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.852 -2.412 -10.146 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.430 -4.920 -10.406 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -0.706 -5.190 -10.254 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -3.300 -2.567 -10.713 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.389 -1.821 -12.048 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -2.895 -3.523 -12.158 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.792 -5.205 -8.057 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -0.662 -3.836 -8.186 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.414 -3.562 -8.341 1.00 0.00 H new ATOM 1281 N VAL A 82 -0.524 -1.949 -13.817 1.00 0.00 N ATOM 1282 CA VAL A 82 -0.385 -0.787 -14.659 1.00 0.00 C ATOM 1283 C VAL A 82 -1.770 -0.255 -15.003 1.00 0.00 C ATOM 1284 O VAL A 82 -2.626 -1.010 -15.447 1.00 0.00 O ATOM 1285 CB VAL A 82 0.451 -1.137 -15.906 1.00 0.00 C ATOM 1286 CG1 VAL A 82 0.642 0.084 -16.816 1.00 0.00 C ATOM 1287 CG2 VAL A 82 1.832 -1.672 -15.502 1.00 0.00 C ATOM 0 H VAL A 82 -1.209 -2.616 -14.171 1.00 0.00 H new ATOM 0 HA VAL A 82 0.152 0.005 -14.137 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.098 -1.905 -16.452 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.236 -0.199 -17.685 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.331 0.449 -17.145 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.157 0.871 -16.265 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.405 -1.913 -16.397 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.361 -0.914 -14.925 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.711 -2.570 -14.896 1.00 0.00 H new ATOM 1297 N ALA A 83 -2.010 1.039 -14.828 1.00 0.00 N ATOM 1298 CA ALA A 83 -3.173 1.711 -15.354 1.00 0.00 C ATOM 1299 C ALA A 83 -2.713 2.629 -16.480 1.00 0.00 C ATOM 1300 O ALA A 83 -1.959 3.562 -16.217 1.00 0.00 O ATOM 1301 CB ALA A 83 -3.891 2.455 -14.229 1.00 0.00 C ATOM 0 H ALA A 83 -1.386 1.654 -14.306 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.895 1.005 -15.764 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.769 2.961 -14.630 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.200 1.745 -13.462 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.216 3.191 -13.791 1.00 0.00 H new ATOM 1307 N LEU A 84 -3.131 2.384 -17.721 1.00 0.00 N ATOM 1308 CA LEU A 84 -2.861 3.311 -18.815 1.00 0.00 C ATOM 1309 C LEU A 84 -3.930 4.384 -18.910 1.00 0.00 C ATOM 1310 O LEU A 84 -5.121 4.110 -18.784 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.777 2.593 -20.172 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.568 1.675 -20.370 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -1.566 1.149 -21.805 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -0.262 2.435 -20.098 1.00 0.00 C ATOM 0 H LEU A 84 -3.657 1.553 -17.992 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.897 3.767 -18.589 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.683 2.002 -20.305 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.769 3.346 -20.960 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.637 0.843 -19.669 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.707 0.495 -21.951 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.483 0.590 -21.989 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.506 1.987 -22.500 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.586 1.766 -20.244 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.182 3.278 -20.785 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.262 2.802 -19.072 1.00 0.00 H new ATOM 1326 N TYR A 85 -3.505 5.596 -19.245 1.00 0.00 N ATOM 1327 CA TYR A 85 -4.379 6.692 -19.634 1.00 0.00 C ATOM 1328 C TYR A 85 -3.748 7.404 -20.824 1.00 0.00 C ATOM 1329 O TYR A 85 -2.560 7.233 -21.094 1.00 0.00 O ATOM 1330 CB TYR A 85 -4.657 7.630 -18.452 1.00 0.00 C ATOM 1331 CG TYR A 85 -3.538 8.544 -17.997 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -2.517 8.056 -17.163 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -3.557 9.903 -18.365 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -1.510 8.921 -16.700 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -2.555 10.772 -17.903 1.00 0.00 C ATOM 1336 CZ TYR A 85 -1.532 10.285 -17.065 1.00 0.00 C ATOM 1337 OH TYR A 85 -0.549 11.132 -16.662 1.00 0.00 O ATOM 0 H TYR A 85 -2.517 5.849 -19.253 1.00 0.00 H new ATOM 0 HA TYR A 85 -5.355 6.311 -19.934 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.513 8.253 -18.713 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.956 7.017 -17.601 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -2.506 7.015 -16.877 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -4.343 10.278 -19.004 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -0.721 8.543 -16.066 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.568 11.813 -18.190 1.00 0.00 H new ATOM 0 HH TYR A 85 -0.729 12.031 -17.009 1.00 0.00 H new ATOM 1347 N GLY A 86 -4.512 8.177 -21.581 1.00 0.00 N ATOM 1348 CA GLY A 86 -3.926 8.951 -22.657 1.00 0.00 C ATOM 1349 C GLY A 86 -4.835 10.051 -23.139 1.00 0.00 C ATOM 1350 O GLY A 86 -5.974 10.185 -22.681 1.00 0.00 O ATOM 0 H GLY A 86 -5.521 8.283 -21.471 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.985 9.384 -22.318 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.690 8.288 -23.490 1.00 0.00 H new ATOM 1354 N LEU A 87 -4.311 10.834 -24.076 1.00 0.00 N ATOM 1355 CA LEU A 87 -4.996 11.973 -24.665 1.00 0.00 C ATOM 1356 C LEU A 87 -5.094 11.738 -26.163 1.00 0.00 C ATOM 1357 O LEU A 87 -4.218 11.087 -26.738 1.00 0.00 O ATOM 1358 CB LEU A 87 -4.255 13.299 -24.414 1.00 0.00 C ATOM 1359 CG LEU A 87 -3.639 13.524 -23.024 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -3.082 14.940 -22.997 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -4.620 13.415 -21.857 1.00 0.00 C ATOM 0 H LEU A 87 -3.375 10.688 -24.454 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.979 12.058 -24.202 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.457 13.381 -25.151 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.952 14.114 -24.607 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.894 12.740 -22.888 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.635 15.137 -22.022 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.323 15.047 -23.772 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.888 15.651 -23.177 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.091 13.589 -20.920 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.408 14.159 -21.973 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.062 12.418 -21.845 1.00 0.00 H new ATOM 1373 N GLY A 88 -6.098 12.322 -26.801 1.00 0.00 N ATOM 1374 CA GLY A 88 -6.208 12.368 -28.246 1.00 0.00 C ATOM 1375 C GLY A 88 -7.345 13.296 -28.654 1.00 0.00 C ATOM 1376 O GLY A 88 -7.705 14.205 -27.906 1.00 0.00 O ATOM 0 H GLY A 88 -6.869 12.783 -26.319 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.270 12.716 -28.679 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.387 11.366 -28.637 1.00 0.00 H new ATOM 1380 N ASP A 89 -7.925 13.062 -29.829 1.00 0.00 N ATOM 1381 CA ASP A 89 -9.163 13.663 -30.307 1.00 0.00 C ATOM 1382 C ASP A 89 -9.795 12.708 -31.316 1.00 0.00 C ATOM 1383 O ASP A 89 -9.087 12.060 -32.086 1.00 0.00 O ATOM 1384 CB ASP A 89 -8.936 15.030 -30.955 1.00 0.00 C ATOM 1385 CG ASP A 89 -10.150 15.393 -31.826 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -11.302 15.371 -31.315 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -9.951 15.602 -33.041 1.00 0.00 O1- ATOM 0 H ASP A 89 -7.522 12.415 -30.506 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.822 13.826 -29.454 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.787 15.788 -30.186 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.032 15.010 -31.563 1.00 0.00 H new ATOM 1392 N GLN A 90 -11.124 12.606 -31.304 1.00 0.00 N ATOM 1393 CA GLN A 90 -11.885 11.821 -32.250 1.00 0.00 C ATOM 1394 C GLN A 90 -12.327 12.580 -33.505 1.00 0.00 C ATOM 1395 O GLN A 90 -12.578 11.935 -34.521 1.00 0.00 O ATOM 1396 CB GLN A 90 -13.082 11.177 -31.537 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.067 12.154 -30.857 1.00 0.00 C ATOM 1398 CD GLN A 90 -13.762 12.372 -29.370 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -13.162 13.491 -28.991 1.00 0.00 O flip ATOM 1400 NE2 GLN A 90 -14.081 11.536 -28.529 1.00 0.00 N flip ATOM 0 H GLN A 90 -11.707 13.082 -30.615 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.210 11.051 -32.623 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.635 10.581 -32.263 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.703 10.489 -30.781 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.034 13.113 -31.374 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.082 11.770 -30.962 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -14.543 10.673 -28.817 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -13.884 11.704 -27.542 1.00 0.00 H new ATOM 1409 N LEU A 91 -12.433 13.911 -33.473 1.00 0.00 N ATOM 1410 CA LEU A 91 -13.005 14.670 -34.580 1.00 0.00 C ATOM 1411 C LEU A 91 -12.120 14.628 -35.819 1.00 0.00 C ATOM 1412 O LEU A 91 -12.627 14.601 -36.943 1.00 0.00 O ATOM 1413 CB LEU A 91 -13.187 16.139 -34.189 1.00 0.00 C ATOM 1414 CG LEU A 91 -14.177 16.382 -33.043 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -14.193 17.878 -32.697 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -15.595 15.906 -33.395 1.00 0.00 C ATOM 0 H LEU A 91 -12.128 14.484 -32.687 1.00 0.00 H new ATOM 0 HA LEU A 91 -13.966 14.207 -34.806 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -12.217 16.548 -33.905 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.523 16.694 -35.065 1.00 0.00 H new ATOM 0 HG LEU A 91 -13.847 15.801 -32.182 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -14.895 18.056 -31.883 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -13.195 18.191 -32.390 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -14.500 18.451 -33.572 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.262 16.098 -32.555 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -15.952 16.445 -34.273 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -15.578 14.837 -33.608 1.00 0.00 H new ATOM 1428 N GLY A 92 -10.807 14.654 -35.610 1.00 0.00 N ATOM 1429 CA GLY A 92 -9.840 14.814 -36.677 1.00 0.00 C ATOM 1430 C GLY A 92 -9.638 13.520 -37.448 1.00 0.00 C ATOM 1431 O GLY A 92 -9.294 13.558 -38.632 1.00 0.00 O ATOM 0 H GLY A 92 -10.387 14.563 -34.685 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.175 15.596 -37.359 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -8.888 15.142 -36.260 1.00 0.00 H new ATOM 1435 N TYR A 93 -9.858 12.383 -36.779 1.00 0.00 N ATOM 1436 CA TYR A 93 -9.459 11.083 -37.296 1.00 0.00 C ATOM 1437 C TYR A 93 -10.448 10.000 -36.857 1.00 0.00 C ATOM 1438 O TYR A 93 -11.169 9.436 -37.677 1.00 0.00 O ATOM 1439 CB TYR A 93 -7.991 10.778 -36.888 1.00 0.00 C ATOM 1440 CG TYR A 93 -7.241 11.919 -36.206 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -7.419 12.161 -34.829 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -6.473 12.817 -36.971 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -6.884 13.317 -34.232 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -5.928 13.969 -36.376 1.00 0.00 C ATOM 1445 CZ TYR A 93 -6.147 14.238 -35.010 1.00 0.00 C ATOM 1446 OH TYR A 93 -5.664 15.392 -34.468 1.00 0.00 O ATOM 0 H TYR A 93 -10.316 12.345 -35.868 1.00 0.00 H new ATOM 0 HA TYR A 93 -9.488 11.095 -38.386 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -7.991 9.917 -36.219 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -7.438 10.488 -37.781 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -7.970 11.453 -34.228 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -6.302 12.621 -38.019 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -7.037 13.501 -33.179 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -5.338 14.652 -36.970 1.00 0.00 H new ATOM 0 HH TYR A 93 -5.182 15.899 -35.154 1.00 0.00 H new ATOM 1456 N GLY A 94 -10.451 9.697 -35.555 1.00 0.00 N ATOM 1457 CA GLY A 94 -11.244 8.638 -34.929 1.00 0.00 C ATOM 1458 C GLY A 94 -10.465 7.337 -34.908 1.00 0.00 C ATOM 1459 O GLY A 94 -10.404 6.666 -33.881 1.00 0.00 O ATOM 0 H GLY A 94 -9.877 10.205 -34.882 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.510 8.927 -33.912 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.177 8.502 -35.476 1.00 0.00 H new ATOM 1463 N GLU A 95 -9.738 7.047 -35.984 1.00 0.00 N ATOM 1464 CA GLU A 95 -8.990 5.828 -36.146 1.00 0.00 C ATOM 1465 C GLU A 95 -7.727 5.974 -35.287 1.00 0.00 C ATOM 1466 O GLU A 95 -7.211 5.019 -34.715 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.636 5.693 -37.632 1.00 0.00 C ATOM 1468 CG GLU A 95 -9.760 5.557 -38.657 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.231 4.101 -38.838 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -10.577 3.436 -37.833 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -10.268 3.616 -39.997 1.00 0.00 O ATOM 0 H GLU A 95 -9.658 7.678 -36.782 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.545 4.942 -35.838 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.044 6.565 -37.909 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.989 4.822 -37.737 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.605 6.171 -38.346 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.419 5.946 -39.617 1.00 0.00 H new ATOM 1478 N TRP A 96 -7.213 7.212 -35.234 1.00 0.00 N ATOM 1479 CA TRP A 96 -5.959 7.588 -34.600 1.00 0.00 C ATOM 1480 C TRP A 96 -6.131 7.791 -33.086 1.00 0.00 C ATOM 1481 O TRP A 96 -5.160 8.003 -32.366 1.00 0.00 O ATOM 1482 CB TRP A 96 -5.417 8.820 -35.240 1.00 0.00 C ATOM 1483 CG TRP A 96 -5.247 8.787 -36.720 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -4.810 9.880 -37.322 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -5.381 7.791 -37.788 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -4.826 9.728 -38.686 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -5.204 8.456 -39.035 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -5.684 6.420 -37.868 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -5.433 7.823 -40.266 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -5.770 5.734 -39.097 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -5.678 6.445 -40.303 1.00 0.00 C ATOM 0 H TRP A 96 -7.690 8.010 -35.655 1.00 0.00 H new ATOM 0 HA TRP A 96 -5.249 6.773 -34.739 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -6.078 9.651 -34.992 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -4.448 9.038 -34.791 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -4.484 10.773 -36.809 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -4.588 10.463 -39.352 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -5.857 5.872 -36.954 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -5.420 8.396 -41.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -5.907 4.663 -39.110 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -5.795 5.936 -41.248 1.00 0.00 H new ATOM 1502 N PHE A 97 -7.384 7.875 -32.635 1.00 0.00 N ATOM 1503 CA PHE A 97 -7.797 8.126 -31.264 1.00 0.00 C ATOM 1504 C PHE A 97 -7.077 7.166 -30.340 1.00 0.00 C ATOM 1505 O PHE A 97 -7.177 5.957 -30.530 1.00 0.00 O ATOM 1506 CB PHE A 97 -9.324 8.004 -31.115 1.00 0.00 C ATOM 1507 CG PHE A 97 -9.928 8.658 -29.884 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.592 9.985 -29.548 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -10.893 7.981 -29.114 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -10.245 10.644 -28.494 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.548 8.640 -28.058 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.244 9.983 -27.766 1.00 0.00 C ATOM 0 H PHE A 97 -8.182 7.762 -33.260 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.529 9.147 -30.992 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -9.791 8.438 -31.999 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.585 6.946 -31.104 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -8.825 10.500 -30.107 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -11.131 6.951 -29.335 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -9.978 11.660 -28.244 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -12.286 8.114 -27.470 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.778 10.502 -26.984 1.00 0.00 H new ATOM 1522 N LEU A 98 -6.365 7.711 -29.349 1.00 0.00 N ATOM 1523 CA LEU A 98 -5.680 6.943 -28.307 1.00 0.00 C ATOM 1524 C LEU A 98 -4.754 5.866 -28.882 1.00 0.00 C ATOM 1525 O LEU A 98 -4.478 4.859 -28.239 1.00 0.00 O ATOM 1526 CB LEU A 98 -6.687 6.389 -27.290 1.00 0.00 C ATOM 1527 CG LEU A 98 -7.193 7.370 -26.227 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -6.086 8.055 -25.422 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -8.116 8.461 -26.762 1.00 0.00 C ATOM 0 H LEU A 98 -6.247 8.719 -29.247 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.022 7.626 -27.770 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.548 6.004 -27.837 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.227 5.541 -26.781 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.760 6.709 -25.571 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.532 8.732 -24.693 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.494 7.301 -24.903 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.443 8.621 -26.096 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.426 9.109 -25.943 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.587 9.050 -27.511 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.995 8.004 -27.215 1.00 0.00 H new ATOM 1541 N ASP A 99 -4.246 6.057 -30.089 1.00 0.00 N ATOM 1542 CA ASP A 99 -3.468 5.024 -30.775 1.00 0.00 C ATOM 1543 C ASP A 99 -2.191 4.703 -29.994 1.00 0.00 C ATOM 1544 O ASP A 99 -1.854 3.529 -29.808 1.00 0.00 O ATOM 1545 CB ASP A 99 -3.184 5.421 -32.222 1.00 0.00 C ATOM 1546 CG ASP A 99 -2.403 4.312 -32.947 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -1.153 4.330 -32.912 1.00 0.00 O1- ATOM 1548 OD2 ASP A 99 -3.047 3.455 -33.597 1.00 0.00 O ATOM 0 H ASP A 99 -4.356 6.921 -30.621 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.059 4.109 -30.813 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.122 5.612 -32.743 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.613 6.349 -32.244 1.00 0.00 H new ATOM 1553 N ALA A 100 -1.567 5.724 -29.394 1.00 0.00 N ATOM 1554 CA ALA A 100 -0.416 5.542 -28.519 1.00 0.00 C ATOM 1555 C ALA A 100 -0.770 4.711 -27.279 1.00 0.00 C ATOM 1556 O ALA A 100 0.065 3.949 -26.791 1.00 0.00 O ATOM 1557 CB ALA A 100 0.146 6.911 -28.115 1.00 0.00 C ATOM 0 H ALA A 100 -1.850 6.697 -29.505 1.00 0.00 H new ATOM 0 HA ALA A 100 0.346 4.988 -29.068 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.007 6.772 -27.461 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.453 7.456 -29.008 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.622 7.479 -27.589 1.00 0.00 H new ATOM 1563 N LEU A 101 -2.006 4.824 -26.779 1.00 0.00 N ATOM 1564 CA LEU A 101 -2.509 4.046 -25.656 1.00 0.00 C ATOM 1565 C LEU A 101 -2.480 2.568 -25.984 1.00 0.00 C ATOM 1566 O LEU A 101 -1.966 1.775 -25.201 1.00 0.00 O ATOM 1567 CB LEU A 101 -3.944 4.497 -25.333 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.444 4.153 -23.933 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -3.737 4.996 -22.893 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -5.949 4.443 -23.841 1.00 0.00 C ATOM 0 H LEU A 101 -2.694 5.475 -27.157 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.874 4.212 -24.786 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.005 5.577 -25.466 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.619 4.048 -26.061 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.242 3.098 -23.748 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.107 4.736 -21.901 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.664 4.809 -22.941 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.930 6.051 -23.087 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.306 4.197 -22.841 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.129 5.499 -24.041 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.482 3.839 -24.575 1.00 0.00 H new ATOM 1582 N GLY A 102 -2.986 2.214 -27.166 1.00 0.00 N ATOM 1583 CA GLY A 102 -2.948 0.843 -27.652 1.00 0.00 C ATOM 1584 C GLY A 102 -1.505 0.363 -27.760 1.00 0.00 C ATOM 1585 O GLY A 102 -1.200 -0.750 -27.335 1.00 0.00 O ATOM 0 H GLY A 102 -3.431 2.870 -27.808 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -3.505 0.194 -26.976 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.434 0.781 -28.626 1.00 0.00 H new ATOM 1589 N MET A 103 -0.594 1.222 -28.238 1.00 0.00 N ATOM 1590 CA MET A 103 0.803 0.831 -28.385 1.00 0.00 C ATOM 1591 C MET A 103 1.471 0.556 -27.047 1.00 0.00 C ATOM 1592 O MET A 103 2.136 -0.469 -26.909 1.00 0.00 O ATOM 1593 CB MET A 103 1.604 1.818 -29.244 1.00 0.00 C ATOM 1594 CG MET A 103 1.075 1.908 -30.680 1.00 0.00 C ATOM 1595 SD MET A 103 2.332 2.283 -31.930 1.00 0.00 S ATOM 1596 CE MET A 103 2.786 3.950 -31.395 1.00 0.00 C ATOM 0 H MET A 103 -0.801 2.179 -28.524 1.00 0.00 H new ATOM 0 HA MET A 103 0.799 -0.114 -28.929 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.569 2.806 -28.785 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.650 1.512 -29.264 1.00 0.00 H new ATOM 0 HG2 MET A 103 0.598 0.962 -30.937 1.00 0.00 H new ATOM 0 HG3 MET A 103 0.302 2.676 -30.720 1.00 0.00 H new ATOM 0 HE1 MET A 103 3.722 4.242 -31.871 1.00 0.00 H new ATOM 0 HE2 MET A 103 2.000 4.650 -31.679 1.00 0.00 H new ATOM 0 HE3 MET A 103 2.910 3.964 -30.312 1.00 0.00 H new ATOM 1606 N LEU A 104 1.258 1.396 -26.031 1.00 0.00 N ATOM 1607 CA LEU A 104 1.793 1.073 -24.720 1.00 0.00 C ATOM 1608 C LEU A 104 1.173 -0.188 -24.162 1.00 0.00 C ATOM 1609 O LEU A 104 1.840 -0.920 -23.444 1.00 0.00 O ATOM 1610 CB LEU A 104 1.602 2.186 -23.682 1.00 0.00 C ATOM 1611 CG LEU A 104 2.875 2.991 -23.394 1.00 0.00 C ATOM 1612 CD1 LEU A 104 2.717 3.764 -22.091 1.00 0.00 C ATOM 1613 CD2 LEU A 104 4.168 2.183 -23.352 1.00 0.00 C ATOM 0 H LEU A 104 0.738 2.272 -26.091 1.00 0.00 H new ATOM 0 HA LEU A 104 2.861 0.938 -24.889 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.825 2.866 -24.031 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.245 1.745 -22.752 1.00 0.00 H new ATOM 0 HG LEU A 104 2.981 3.662 -24.246 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.625 4.333 -21.893 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.871 4.447 -22.173 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.541 3.066 -21.273 1.00 0.00 H new ATOM 0 HD21 LEU A 104 5.006 2.848 -23.142 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.099 1.427 -22.570 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.324 1.696 -24.315 1.00 0.00 H new ATOM 1625 N HIS A 105 -0.092 -0.444 -24.452 1.00 0.00 N ATOM 1626 CA HIS A 105 -0.757 -1.595 -23.871 1.00 0.00 C ATOM 1627 C HIS A 105 -0.138 -2.887 -24.401 1.00 0.00 C ATOM 1628 O HIS A 105 0.104 -3.813 -23.636 1.00 0.00 O ATOM 1629 CB HIS A 105 -2.262 -1.494 -24.127 1.00 0.00 C ATOM 1630 CG HIS A 105 -3.062 -2.152 -23.044 1.00 0.00 C ATOM 1631 ND1 HIS A 105 -3.286 -1.639 -21.771 1.00 0.00 N ATOM 1632 CD2 HIS A 105 -3.736 -3.319 -23.176 1.00 0.00 C ATOM 1633 CE1 HIS A 105 -4.097 -2.518 -21.168 1.00 0.00 C ATOM 1634 NE2 HIS A 105 -4.391 -3.540 -21.987 1.00 0.00 N ATOM 0 H HIS A 105 -0.670 0.120 -25.076 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.615 -1.611 -22.790 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -2.547 -0.445 -24.202 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.499 -1.957 -25.085 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.756 -3.955 -24.049 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -4.465 -2.418 -20.158 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -4.991 -4.335 -21.768 1.00 0.00 H new ATOM 1642 N ASP A 106 0.220 -2.901 -25.685 1.00 0.00 N ATOM 1643 CA ASP A 106 0.895 -3.979 -26.398 1.00 0.00 C ATOM 1644 C ASP A 106 2.365 -4.103 -25.992 1.00 0.00 C ATOM 1645 O ASP A 106 2.933 -5.196 -25.980 1.00 0.00 O ATOM 1646 CB ASP A 106 0.796 -3.725 -27.901 1.00 0.00 C ATOM 1647 CG ASP A 106 1.531 -4.812 -28.697 1.00 0.00 C ATOM 1648 OD1 ASP A 106 0.989 -5.937 -28.822 1.00 0.00 O1- ATOM 1649 OD2 ASP A 106 2.625 -4.533 -29.242 1.00 0.00 O ATOM 0 H ASP A 106 0.032 -2.104 -26.293 1.00 0.00 H new ATOM 0 HA ASP A 106 0.403 -4.916 -26.137 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -0.252 -3.698 -28.200 1.00 0.00 H new ATOM 0 HB3 ASP A 106 1.220 -2.749 -28.136 1.00 0.00 H new ATOM 1654 N LYS A 107 2.988 -2.980 -25.619 1.00 0.00 N ATOM 1655 CA LYS A 107 4.298 -2.985 -24.993 1.00 0.00 C ATOM 1656 C LYS A 107 4.191 -3.706 -23.663 1.00 0.00 C ATOM 1657 O LYS A 107 4.836 -4.724 -23.429 1.00 0.00 O ATOM 1658 CB LYS A 107 4.819 -1.550 -24.759 1.00 0.00 C ATOM 1659 CG LYS A 107 5.722 -1.006 -25.863 1.00 0.00 C ATOM 1660 CD LYS A 107 7.101 -1.690 -25.861 1.00 0.00 C ATOM 1661 CE LYS A 107 8.255 -0.684 -25.683 1.00 0.00 C ATOM 1662 NZ LYS A 107 9.477 -1.065 -26.458 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.593 -2.048 -25.746 1.00 0.00 H new ATOM 0 HA LYS A 107 5.001 -3.491 -25.654 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.965 -0.883 -24.647 1.00 0.00 H new ATOM 0 HB3 LYS A 107 5.367 -1.527 -23.817 1.00 0.00 H new ATOM 0 HG2 LYS A 107 5.243 -1.155 -26.831 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.849 0.069 -25.733 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.137 -2.426 -25.058 1.00 0.00 H new ATOM 0 HD3 LYS A 107 7.236 -2.232 -26.797 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.922 0.304 -26.000 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.508 -0.611 -24.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 10.253 -0.414 -26.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.755 -2.037 -26.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 9.273 -1.010 -27.476 1.00 0.00 H new ATOM 1676 N LEU A 108 3.381 -3.161 -22.763 1.00 0.00 N ATOM 1677 CA LEU A 108 3.408 -3.573 -21.373 1.00 0.00 C ATOM 1678 C LEU A 108 2.730 -4.911 -21.149 1.00 0.00 C ATOM 1679 O LEU A 108 3.087 -5.585 -20.186 1.00 0.00 O ATOM 1680 CB LEU A 108 2.934 -2.435 -20.458 1.00 0.00 C ATOM 1681 CG LEU A 108 3.702 -1.119 -20.704 1.00 0.00 C ATOM 1682 CD1 LEU A 108 3.194 -0.064 -19.723 1.00 0.00 C ATOM 1683 CD2 LEU A 108 5.237 -1.256 -20.669 1.00 0.00 C ATOM 0 H LEU A 108 2.699 -2.433 -22.975 1.00 0.00 H new ATOM 0 HA LEU A 108 4.442 -3.764 -21.086 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.869 -2.265 -20.617 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.057 -2.735 -19.417 1.00 0.00 H new ATOM 0 HG LEU A 108 3.496 -0.807 -21.728 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.729 0.872 -19.886 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.127 0.095 -19.880 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.363 -0.405 -18.702 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.693 -0.283 -20.852 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.547 -1.625 -19.691 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.557 -1.957 -21.439 1.00 0.00 H new ATOM 1695 N SER A 109 1.880 -5.382 -22.060 1.00 0.00 N ATOM 1696 CA SER A 109 1.384 -6.749 -21.993 1.00 0.00 C ATOM 1697 C SER A 109 2.537 -7.761 -22.075 1.00 0.00 C ATOM 1698 O SER A 109 2.474 -8.812 -21.435 1.00 0.00 O ATOM 1699 CB SER A 109 0.364 -6.980 -23.113 1.00 0.00 C ATOM 1700 OG SER A 109 0.939 -6.776 -24.390 1.00 0.00 O ATOM 0 H SER A 109 1.524 -4.839 -22.847 1.00 0.00 H new ATOM 0 HA SER A 109 0.892 -6.899 -21.032 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.026 -7.996 -23.047 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.481 -6.304 -22.982 1.00 0.00 H new ATOM 0 HG SER A 109 0.263 -6.932 -25.082 1.00 0.00 H new ATOM 1706 N THR A 110 3.622 -7.435 -22.790 1.00 0.00 N ATOM 1707 CA THR A 110 4.746 -8.344 -22.975 1.00 0.00 C ATOM 1708 C THR A 110 5.618 -8.343 -21.707 1.00 0.00 C ATOM 1709 O THR A 110 6.298 -9.329 -21.419 1.00 0.00 O ATOM 1710 CB THR A 110 5.466 -7.982 -24.298 1.00 0.00 C ATOM 1711 OG1 THR A 110 5.725 -9.147 -25.064 1.00 0.00 O ATOM 1712 CG2 THR A 110 6.791 -7.226 -24.124 1.00 0.00 C ATOM 0 H THR A 110 3.739 -6.534 -23.253 1.00 0.00 H new ATOM 0 HA THR A 110 4.432 -9.381 -23.092 1.00 0.00 H new ATOM 0 HB THR A 110 4.774 -7.311 -24.807 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.178 -8.897 -25.896 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.221 -7.016 -25.103 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.609 -6.288 -23.599 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.485 -7.836 -23.546 1.00 0.00 H new ATOM 1720 N LYS A 111 5.554 -7.271 -20.899 1.00 0.00 N ATOM 1721 CA LYS A 111 6.249 -7.151 -19.627 1.00 0.00 C ATOM 1722 C LYS A 111 5.551 -7.927 -18.504 1.00 0.00 C ATOM 1723 O LYS A 111 6.009 -7.856 -17.369 1.00 0.00 O ATOM 1724 CB LYS A 111 6.407 -5.656 -19.291 1.00 0.00 C ATOM 1725 CG LYS A 111 7.034 -4.807 -20.404 1.00 0.00 C ATOM 1726 CD LYS A 111 8.432 -5.284 -20.811 1.00 0.00 C ATOM 1727 CE LYS A 111 9.436 -5.409 -19.640 1.00 0.00 C ATOM 1728 NZ LYS A 111 10.646 -6.210 -19.989 1.00 0.00 N1+ ATOM 0 H LYS A 111 4.999 -6.446 -21.128 1.00 0.00 H new ATOM 0 HA LYS A 111 7.236 -7.605 -19.717 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.426 -5.247 -19.051 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.019 -5.563 -18.394 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.382 -4.826 -21.277 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.093 -3.770 -20.072 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.342 -6.254 -21.301 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.838 -4.591 -21.548 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.746 -4.412 -19.327 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.936 -5.870 -18.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 11.256 -6.301 -19.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.356 -7.156 -20.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 11.171 -5.732 -20.749 1.00 0.00 H new ATOM 1742 N GLY A 112 4.458 -8.638 -18.791 1.00 0.00 N ATOM 1743 CA GLY A 112 3.821 -9.547 -17.844 1.00 0.00 C ATOM 1744 C GLY A 112 3.127 -8.801 -16.711 1.00 0.00 C ATOM 1745 O GLY A 112 3.130 -9.274 -15.574 1.00 0.00 O ATOM 0 H GLY A 112 3.989 -8.596 -19.696 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.093 -10.165 -18.369 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.571 -10.220 -17.428 1.00 0.00 H new ATOM 1749 N VAL A 113 2.587 -7.612 -16.988 1.00 0.00 N ATOM 1750 CA VAL A 113 1.869 -6.801 -16.015 1.00 0.00 C ATOM 1751 C VAL A 113 0.402 -7.255 -15.942 1.00 0.00 C ATOM 1752 O VAL A 113 -0.026 -8.114 -16.720 1.00 0.00 O ATOM 1753 CB VAL A 113 2.037 -5.297 -16.342 1.00 0.00 C ATOM 1754 CG1 VAL A 113 3.492 -4.982 -16.704 1.00 0.00 C ATOM 1755 CG2 VAL A 113 1.118 -4.763 -17.449 1.00 0.00 C ATOM 0 H VAL A 113 2.640 -7.183 -17.912 1.00 0.00 H new ATOM 0 HA VAL A 113 2.291 -6.943 -15.020 1.00 0.00 H new ATOM 0 HB VAL A 113 1.740 -4.785 -15.427 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.589 -3.920 -16.930 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.139 -5.234 -15.864 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.785 -5.567 -17.576 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.312 -3.702 -17.603 1.00 0.00 H new ATOM 0 HG22 VAL A 113 1.311 -5.305 -18.375 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.077 -4.902 -17.157 1.00 0.00 H new ATOM 1765 N LYS A 114 -0.379 -6.659 -15.036 1.00 0.00 N ATOM 1766 CA LYS A 114 -1.839 -6.772 -15.052 1.00 0.00 C ATOM 1767 C LYS A 114 -2.390 -5.355 -15.124 1.00 0.00 C ATOM 1768 O LYS A 114 -1.746 -4.440 -14.610 1.00 0.00 O ATOM 1769 CB LYS A 114 -2.401 -7.674 -13.931 1.00 0.00 C ATOM 1770 CG LYS A 114 -2.437 -7.117 -12.494 1.00 0.00 C ATOM 1771 CD LYS A 114 -1.288 -7.501 -11.541 1.00 0.00 C ATOM 1772 CE LYS A 114 -1.043 -9.014 -11.403 1.00 0.00 C ATOM 1773 NZ LYS A 114 -0.226 -9.335 -10.194 1.00 0.00 N1+ ATOM 0 H LYS A 114 -0.017 -6.086 -14.273 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.185 -7.314 -15.932 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.419 -7.951 -14.206 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.814 -8.592 -13.917 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.469 -6.029 -12.558 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.373 -7.437 -12.035 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.370 -7.029 -11.892 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.500 -7.090 -10.554 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.000 -9.533 -11.344 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -0.535 -9.383 -12.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.004 -10.349 -10.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 0.654 -8.781 -10.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.766 -9.099 -9.337 1.00 0.00 H new ATOM 1787 N PHE A 115 -3.521 -5.137 -15.785 1.00 0.00 N ATOM 1788 CA PHE A 115 -4.003 -3.810 -16.100 1.00 0.00 C ATOM 1789 C PHE A 115 -5.252 -3.458 -15.303 1.00 0.00 C ATOM 1790 O PHE A 115 -6.062 -4.337 -15.000 1.00 0.00 O ATOM 1791 CB PHE A 115 -4.210 -3.649 -17.608 1.00 0.00 C ATOM 1792 CG PHE A 115 -2.931 -3.670 -18.426 1.00 0.00 C ATOM 1793 CD1 PHE A 115 -2.121 -2.518 -18.492 1.00 0.00 C ATOM 1794 CD2 PHE A 115 -2.605 -4.796 -19.206 1.00 0.00 C ATOM 1795 CE1 PHE A 115 -1.021 -2.476 -19.370 1.00 0.00 C ATOM 1796 CE2 PHE A 115 -1.508 -4.749 -20.087 1.00 0.00 C ATOM 1797 CZ PHE A 115 -0.730 -3.585 -20.183 1.00 0.00 C ATOM 0 H PHE A 115 -4.129 -5.886 -16.117 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.237 -3.095 -15.800 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.864 -4.447 -17.959 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -4.728 -2.708 -17.792 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.345 -1.666 -17.868 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.197 -5.696 -19.128 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.402 -1.593 -19.419 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.265 -5.611 -20.691 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.092 -3.541 -20.882 1.00 0.00 H new ATOM 1807 N VAL A 116 -5.421 -2.168 -14.998 1.00 0.00 N ATOM 1808 CA VAL A 116 -6.646 -1.609 -14.440 1.00 0.00 C ATOM 1809 C VAL A 116 -7.087 -0.422 -15.298 1.00 0.00 C ATOM 1810 O VAL A 116 -6.392 -0.057 -16.254 1.00 0.00 O ATOM 1811 CB VAL A 116 -6.460 -1.244 -12.954 1.00 0.00 C ATOM 1812 CG1 VAL A 116 -5.994 -2.451 -12.136 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -5.523 -0.053 -12.725 1.00 0.00 C ATOM 0 H VAL A 116 -4.690 -1.471 -15.137 1.00 0.00 H new ATOM 0 HA VAL A 116 -7.442 -2.353 -14.464 1.00 0.00 H new ATOM 0 HB VAL A 116 -7.446 -0.936 -12.606 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -5.873 -2.159 -11.093 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -6.736 -3.246 -12.206 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -5.041 -2.809 -12.526 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.441 0.145 -11.656 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.537 -0.283 -13.128 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -5.924 0.827 -13.227 1.00 0.00 H new ATOM 1823 N GLY A 117 -8.194 0.230 -14.943 1.00 0.00 N ATOM 1824 CA GLY A 117 -8.592 1.452 -15.592 1.00 0.00 C ATOM 1825 C GLY A 117 -9.219 1.248 -16.966 1.00 0.00 C ATOM 1826 O GLY A 117 -9.049 2.116 -17.821 1.00 0.00 O ATOM 0 H GLY A 117 -8.825 -0.080 -14.204 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.303 1.976 -14.953 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.720 2.098 -15.694 1.00 0.00 H new ATOM 1830 N TYR A 118 -9.951 0.164 -17.203 1.00 0.00 N ATOM 1831 CA TYR A 118 -10.724 0.030 -18.431 1.00 0.00 C ATOM 1832 C TYR A 118 -11.997 0.867 -18.296 1.00 0.00 C ATOM 1833 O TYR A 118 -12.572 0.954 -17.211 1.00 0.00 O ATOM 1834 CB TYR A 118 -11.011 -1.452 -18.732 1.00 0.00 C ATOM 1835 CG TYR A 118 -9.805 -2.340 -19.028 1.00 0.00 C ATOM 1836 CD1 TYR A 118 -8.579 -1.800 -19.470 1.00 0.00 C ATOM 1837 CD2 TYR A 118 -9.932 -3.740 -18.915 1.00 0.00 C ATOM 1838 CE1 TYR A 118 -7.512 -2.642 -19.820 1.00 0.00 C ATOM 1839 CE2 TYR A 118 -8.866 -4.589 -19.267 1.00 0.00 C ATOM 1840 CZ TYR A 118 -7.650 -4.041 -19.733 1.00 0.00 C ATOM 1841 OH TYR A 118 -6.611 -4.838 -20.119 1.00 0.00 O ATOM 0 H TYR A 118 -10.025 -0.629 -16.565 1.00 0.00 H new ATOM 0 HA TYR A 118 -10.158 0.405 -19.284 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -11.543 -1.875 -17.880 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -11.687 -1.501 -19.586 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.460 -0.729 -19.540 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -10.857 -4.165 -18.555 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -6.580 -2.215 -20.158 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -8.978 -5.660 -19.181 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.858 -5.779 -19.999 1.00 0.00 H new ATOM 1851 N TRP A 119 -12.437 1.478 -19.392 1.00 0.00 N ATOM 1852 CA TRP A 119 -13.727 2.166 -19.491 1.00 0.00 C ATOM 1853 C TRP A 119 -14.554 1.494 -20.571 1.00 0.00 C ATOM 1854 O TRP A 119 -13.965 1.119 -21.581 1.00 0.00 O ATOM 1855 CB TRP A 119 -13.567 3.624 -19.903 1.00 0.00 C ATOM 1856 CG TRP A 119 -13.288 4.620 -18.836 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -12.552 5.718 -19.080 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -13.808 4.763 -17.468 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -12.530 6.504 -17.957 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -13.312 5.994 -16.946 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -14.672 4.030 -16.619 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -13.635 6.464 -15.665 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -15.000 4.485 -15.327 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -14.481 5.698 -14.846 1.00 0.00 C ATOM 0 H TRP A 119 -11.897 1.511 -20.257 1.00 0.00 H new ATOM 0 HA TRP A 119 -14.199 2.118 -18.510 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -12.758 3.679 -20.632 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -14.479 3.929 -20.415 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -12.057 5.945 -20.013 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -11.995 7.369 -17.880 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.090 3.098 -16.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -13.238 7.404 -15.312 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.655 3.897 -14.702 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.731 6.040 -13.852 1.00 0.00 H new ATOM 1875 N PRO A 120 -15.886 1.396 -20.452 1.00 0.00 N ATOM 1876 CA PRO A 120 -16.710 0.979 -21.570 1.00 0.00 C ATOM 1877 C PRO A 120 -16.685 2.072 -22.653 1.00 0.00 C ATOM 1878 O PRO A 120 -16.756 3.267 -22.356 1.00 0.00 O ATOM 1879 CB PRO A 120 -18.097 0.724 -20.982 1.00 0.00 C ATOM 1880 CG PRO A 120 -18.160 1.703 -19.805 1.00 0.00 C ATOM 1881 CD PRO A 120 -16.710 1.776 -19.313 1.00 0.00 C ATOM 0 HA PRO A 120 -16.357 0.073 -22.063 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.885 0.917 -21.710 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.212 -0.309 -20.654 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.526 2.681 -20.117 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -18.830 1.346 -19.023 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.463 2.781 -18.970 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -16.548 1.103 -18.471 1.00 0.00 H new ATOM 1889 N THR A 121 -16.587 1.658 -23.913 1.00 0.00 N ATOM 1890 CA THR A 121 -16.511 2.516 -25.083 1.00 0.00 C ATOM 1891 C THR A 121 -17.851 3.178 -25.449 1.00 0.00 C ATOM 1892 O THR A 121 -17.895 4.024 -26.347 1.00 0.00 O ATOM 1893 CB THR A 121 -15.920 1.706 -26.253 1.00 0.00 C ATOM 1894 OG1 THR A 121 -16.765 0.615 -26.570 1.00 0.00 O ATOM 1895 CG2 THR A 121 -14.521 1.150 -25.961 1.00 0.00 C ATOM 0 H THR A 121 -16.557 0.667 -24.153 1.00 0.00 H new ATOM 0 HA THR A 121 -15.853 3.353 -24.849 1.00 0.00 H new ATOM 0 HB THR A 121 -15.842 2.404 -27.087 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.254 -0.064 -27.058 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.164 0.590 -26.826 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.838 1.974 -25.755 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.565 0.490 -25.095 1.00 0.00 H new ATOM 1946 N GLU A 125 -17.360 8.201 -29.791 1.00 0.00 N ATOM 1947 CA GLU A 125 -17.287 8.031 -31.232 1.00 0.00 C ATOM 1948 C GLU A 125 -15.795 7.951 -31.554 1.00 0.00 C ATOM 1949 O GLU A 125 -15.045 8.824 -31.118 1.00 0.00 O ATOM 1950 CB GLU A 125 -17.978 9.203 -31.955 1.00 0.00 C ATOM 1951 CG GLU A 125 -19.404 9.451 -31.440 1.00 0.00 C ATOM 1952 CD GLU A 125 -20.114 10.554 -32.245 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -20.774 10.239 -33.265 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -20.034 11.744 -31.855 1.00 0.00 O ATOM 0 HA GLU A 125 -17.806 7.134 -31.571 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.385 10.108 -31.823 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -18.012 8.997 -33.025 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -19.979 8.527 -31.502 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -19.367 9.734 -30.388 1.00 0.00 H new ATOM 1961 N PHE A 126 -15.335 6.889 -32.229 1.00 0.00 N ATOM 1962 CA PHE A 126 -13.907 6.656 -32.467 1.00 0.00 C ATOM 1963 C PHE A 126 -13.732 5.603 -33.563 1.00 0.00 C ATOM 1964 O PHE A 126 -13.072 5.868 -34.559 1.00 0.00 O ATOM 1965 CB PHE A 126 -13.182 6.231 -31.165 1.00 0.00 C ATOM 1966 CG PHE A 126 -13.641 4.929 -30.529 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -14.901 4.856 -29.904 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -12.854 3.764 -30.637 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -15.398 3.624 -29.447 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -13.353 2.533 -30.177 1.00 0.00 C ATOM 1971 CZ PHE A 126 -14.628 2.459 -29.596 1.00 0.00 C ATOM 0 H PHE A 126 -15.941 6.170 -32.624 1.00 0.00 H new ATOM 0 HA PHE A 126 -13.452 7.589 -32.799 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -12.116 6.150 -31.379 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -13.300 7.029 -30.432 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -15.489 5.753 -29.775 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.867 3.817 -31.073 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -16.371 3.573 -28.982 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -12.752 1.640 -30.271 1.00 0.00 H new ATOM 0 HZ PHE A 126 -15.017 1.508 -29.264 1.00 0.00 H new ATOM 1981 N THR A 127 -14.345 4.425 -33.380 1.00 0.00 N ATOM 1982 CA THR A 127 -14.334 3.252 -34.258 1.00 0.00 C ATOM 1983 C THR A 127 -12.923 2.685 -34.561 1.00 0.00 C ATOM 1984 O THR A 127 -12.783 1.738 -35.341 1.00 0.00 O ATOM 1985 CB THR A 127 -15.303 3.483 -35.446 1.00 0.00 C ATOM 1986 OG1 THR A 127 -15.700 2.284 -36.094 1.00 0.00 O ATOM 1987 CG2 THR A 127 -14.799 4.479 -36.496 1.00 0.00 C ATOM 0 H THR A 127 -14.906 4.257 -32.545 1.00 0.00 H new ATOM 0 HA THR A 127 -14.742 2.393 -33.725 1.00 0.00 H new ATOM 0 HB THR A 127 -16.173 3.926 -34.962 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.952 1.650 -36.096 1.00 0.00 H new ATOM 0 HG21 THR A 127 -15.540 4.578 -37.289 1.00 0.00 H new ATOM 0 HG22 THR A 127 -14.636 5.450 -36.028 1.00 0.00 H new ATOM 0 HG23 THR A 127 -13.861 4.118 -36.919 1.00 0.00 H new ATOM 1995 N SER A 128 -11.879 3.186 -33.885 1.00 0.00 N ATOM 1996 CA SER A 128 -10.544 2.592 -33.920 1.00 0.00 C ATOM 1997 C SER A 128 -10.591 1.189 -33.304 1.00 0.00 C ATOM 1998 O SER A 128 -11.229 1.014 -32.263 1.00 0.00 O ATOM 1999 CB SER A 128 -9.531 3.445 -33.145 1.00 0.00 C ATOM 2000 OG SER A 128 -8.247 2.842 -33.199 1.00 0.00 O ATOM 0 H SER A 128 -11.942 4.018 -33.298 1.00 0.00 H new ATOM 0 HA SER A 128 -10.226 2.539 -34.961 1.00 0.00 H new ATOM 0 HB2 SER A 128 -9.489 4.449 -33.568 1.00 0.00 H new ATOM 0 HB3 SER A 128 -9.849 3.550 -32.108 1.00 0.00 H new ATOM 0 HG SER A 128 -7.632 3.426 -33.690 1.00 0.00 H new ATOM 2006 N PRO A 129 -9.871 0.202 -33.864 1.00 0.00 N ATOM 2007 CA PRO A 129 -9.689 -1.097 -33.234 1.00 0.00 C ATOM 2008 C PRO A 129 -8.509 -1.122 -32.244 1.00 0.00 C ATOM 2009 O PRO A 129 -8.370 -2.101 -31.509 1.00 0.00 O ATOM 2010 CB PRO A 129 -9.452 -2.049 -34.412 1.00 0.00 C ATOM 2011 CG PRO A 129 -8.676 -1.177 -35.402 1.00 0.00 C ATOM 2012 CD PRO A 129 -9.285 0.209 -35.200 1.00 0.00 C ATOM 0 HA PRO A 129 -10.552 -1.374 -32.628 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -8.881 -2.928 -34.113 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -10.389 -2.408 -34.837 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -7.607 -1.182 -35.190 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -8.799 -1.525 -36.428 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -8.525 0.985 -35.288 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -10.042 0.416 -35.957 1.00 0.00 H new ATOM 2020 N LYS A 130 -7.637 -0.096 -32.212 1.00 0.00 N ATOM 2021 CA LYS A 130 -6.368 -0.184 -31.484 1.00 0.00 C ATOM 2022 C LYS A 130 -6.510 -0.065 -29.957 1.00 0.00 C ATOM 2023 O LYS A 130 -5.979 -0.930 -29.263 1.00 0.00 O ATOM 2024 CB LYS A 130 -5.317 0.784 -32.078 1.00 0.00 C ATOM 2025 CG LYS A 130 -3.865 0.338 -31.839 1.00 0.00 C ATOM 2026 CD LYS A 130 -3.464 -0.834 -32.754 1.00 0.00 C ATOM 2027 CE LYS A 130 -1.943 -1.024 -32.711 1.00 0.00 C ATOM 2028 NZ LYS A 130 -1.485 -2.130 -33.601 1.00 0.00 N1+ ATOM 0 H LYS A 130 -7.792 0.797 -32.681 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.997 -1.198 -31.633 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.487 0.878 -33.150 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.460 1.774 -31.644 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.194 1.179 -32.012 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.743 0.043 -30.797 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -3.964 -1.747 -32.432 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.787 -0.637 -33.776 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -1.455 -0.096 -33.008 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.634 -1.233 -31.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -0.451 -2.220 -33.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -1.929 -3.022 -33.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.755 -1.920 -34.583 1.00 0.00 H new ATOM 2042 N PRO A 131 -7.171 0.960 -29.379 1.00 0.00 N ATOM 2043 CA PRO A 131 -7.123 1.192 -27.933 1.00 0.00 C ATOM 2044 C PRO A 131 -8.250 0.447 -27.203 1.00 0.00 C ATOM 2045 O PRO A 131 -8.874 1.006 -26.302 1.00 0.00 O ATOM 2046 CB PRO A 131 -7.218 2.715 -27.794 1.00 0.00 C ATOM 2047 CG PRO A 131 -8.190 3.080 -28.914 1.00 0.00 C ATOM 2048 CD PRO A 131 -7.837 2.091 -30.029 1.00 0.00 C ATOM 0 HA PRO A 131 -6.214 0.807 -27.471 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -7.594 3.012 -26.815 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -6.249 3.197 -27.923 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -9.227 2.973 -28.596 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -8.060 4.113 -29.237 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -8.733 1.764 -30.557 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -7.183 2.555 -30.768 1.00 0.00 H new ATOM 2056 N VAL A 132 -8.544 -0.799 -27.564 1.00 0.00 N ATOM 2057 CA VAL A 132 -9.743 -1.510 -27.144 1.00 0.00 C ATOM 2058 C VAL A 132 -9.409 -2.976 -26.841 1.00 0.00 C ATOM 2059 O VAL A 132 -8.480 -3.525 -27.440 1.00 0.00 O ATOM 2060 CB VAL A 132 -10.872 -1.372 -28.188 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -12.200 -1.010 -27.516 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -10.659 -0.320 -29.291 1.00 0.00 C ATOM 0 H VAL A 132 -7.940 -1.353 -28.171 1.00 0.00 H new ATOM 0 HA VAL A 132 -10.115 -1.057 -26.225 1.00 0.00 H new ATOM 0 HB VAL A 132 -10.875 -2.355 -28.659 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.978 -0.919 -28.274 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.474 -1.791 -26.807 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -12.094 -0.062 -26.989 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -11.518 -0.317 -29.962 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -10.549 0.665 -28.838 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -9.758 -0.562 -29.855 1.00 0.00 H new ATOM 2072 N ILE A 133 -10.152 -3.601 -25.920 1.00 0.00 N ATOM 2073 CA ILE A 133 -10.031 -4.994 -25.523 1.00 0.00 C ATOM 2074 C ILE A 133 -11.385 -5.675 -25.607 1.00 0.00 C ATOM 2075 O ILE A 133 -12.379 -5.068 -26.010 1.00 0.00 O ATOM 2076 CB ILE A 133 -9.377 -5.190 -24.134 1.00 0.00 C ATOM 2077 CG1 ILE A 133 -10.225 -4.663 -22.958 1.00 0.00 C ATOM 2078 CG2 ILE A 133 -7.979 -4.595 -24.199 1.00 0.00 C ATOM 2079 CD1 ILE A 133 -9.984 -3.192 -22.671 1.00 0.00 C ATOM 0 H ILE A 133 -10.890 -3.116 -25.410 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.347 -5.468 -26.227 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.311 -6.255 -23.914 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -11.281 -4.817 -23.180 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -9.999 -5.245 -22.064 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.487 -4.716 -23.234 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -7.401 -5.108 -24.968 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.046 -3.535 -24.442 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -10.608 -2.878 -21.834 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -8.935 -3.037 -22.420 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -10.236 -2.603 -23.553 1.00 0.00 H new ATOM 2091 N ALA A 134 -11.426 -6.910 -25.116 1.00 0.00 N ATOM 2092 CA ALA A 134 -12.591 -7.757 -25.074 1.00 0.00 C ATOM 2093 C ALA A 134 -13.071 -7.951 -26.515 1.00 0.00 C ATOM 2094 O ALA A 134 -12.321 -8.475 -27.342 1.00 0.00 O ATOM 2095 CB ALA A 134 -13.578 -7.189 -24.040 1.00 0.00 C ATOM 0 H ALA A 134 -10.601 -7.360 -24.719 1.00 0.00 H new ATOM 0 HA ALA A 134 -12.412 -8.769 -24.711 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -14.465 -7.821 -23.998 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -13.103 -7.164 -23.059 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -13.866 -6.178 -24.329 1.00 0.00 H new ATOM 2101 N ASP A 135 -14.275 -7.481 -26.829 1.00 0.00 N ATOM 2102 CA ASP A 135 -14.853 -7.498 -28.168 1.00 0.00 C ATOM 2103 C ASP A 135 -14.837 -6.104 -28.813 1.00 0.00 C ATOM 2104 O ASP A 135 -15.460 -5.864 -29.848 1.00 0.00 O ATOM 2105 CB ASP A 135 -16.262 -8.076 -28.095 1.00 0.00 C ATOM 2106 CG ASP A 135 -16.858 -8.397 -29.477 1.00 0.00 C ATOM 2107 OD1 ASP A 135 -16.209 -9.118 -30.273 1.00 0.00 O ATOM 2108 OD2 ASP A 135 -18.014 -7.987 -29.750 1.00 0.00 O ATOM 0 H ASP A 135 -14.895 -7.064 -26.135 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.244 -8.134 -28.811 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -16.244 -8.985 -27.494 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -16.912 -7.368 -27.582 1.00 0.00 H new ATOM 2113 N GLY A 136 -14.155 -5.148 -28.170 1.00 0.00 N ATOM 2114 CA GLY A 136 -14.130 -3.743 -28.554 1.00 0.00 C ATOM 2115 C GLY A 136 -15.132 -2.903 -27.763 1.00 0.00 C ATOM 2116 O GLY A 136 -15.518 -1.823 -28.208 1.00 0.00 O ATOM 0 H GLY A 136 -13.590 -5.344 -27.344 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -13.127 -3.346 -28.401 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.348 -3.656 -29.618 1.00 0.00 H new ATOM 2120 N GLN A 137 -15.560 -3.393 -26.591 1.00 0.00 N ATOM 2121 CA GLN A 137 -16.613 -2.803 -25.777 1.00 0.00 C ATOM 2122 C GLN A 137 -16.015 -1.973 -24.646 1.00 0.00 C ATOM 2123 O GLN A 137 -16.714 -1.170 -24.032 1.00 0.00 O ATOM 2124 CB GLN A 137 -17.532 -3.896 -25.204 1.00 0.00 C ATOM 2125 CG GLN A 137 -17.689 -5.100 -26.128 1.00 0.00 C ATOM 2126 CD GLN A 137 -18.599 -6.168 -25.517 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -19.770 -6.303 -25.864 1.00 0.00 O ATOM 2128 NE2 GLN A 137 -18.064 -6.934 -24.576 1.00 0.00 N ATOM 0 H GLN A 137 -15.165 -4.238 -26.177 1.00 0.00 H new ATOM 0 HA GLN A 137 -17.207 -2.148 -26.414 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -17.133 -4.231 -24.247 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -18.515 -3.468 -25.007 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -18.101 -4.774 -27.083 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -16.709 -5.531 -26.334 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -17.089 -6.803 -24.305 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -18.627 -7.654 -24.123 1.00 0.00 H new ATOM 2137 N LEU A 138 -14.734 -2.203 -24.332 1.00 0.00 N ATOM 2138 CA LEU A 138 -13.995 -1.417 -23.334 1.00 0.00 C ATOM 2139 C LEU A 138 -12.630 -0.993 -23.863 1.00 0.00 C ATOM 2140 O LEU A 138 -11.980 -1.762 -24.562 1.00 0.00 O ATOM 2141 CB LEU A 138 -13.868 -2.088 -21.942 1.00 0.00 C ATOM 2142 CG LEU A 138 -13.975 -3.622 -21.861 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -13.259 -4.165 -20.619 1.00 0.00 C ATOM 2144 CD2 LEU A 138 -15.441 -4.052 -21.763 1.00 0.00 C ATOM 0 H LEU A 138 -14.179 -2.942 -24.764 1.00 0.00 H new ATOM 0 HA LEU A 138 -14.606 -0.530 -23.169 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -12.906 -1.799 -21.520 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -14.639 -1.666 -21.297 1.00 0.00 H new ATOM 0 HG LEU A 138 -13.512 -4.019 -22.764 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -13.353 -5.251 -20.591 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -12.204 -3.893 -20.659 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -13.710 -3.738 -19.723 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -15.498 -5.139 -21.707 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -15.888 -3.618 -20.869 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -15.981 -3.705 -22.644 1.00 0.00 H new ATOM 2156 N PHE A 139 -12.197 0.222 -23.523 1.00 0.00 N ATOM 2157 CA PHE A 139 -10.905 0.777 -23.875 1.00 0.00 C ATOM 2158 C PHE A 139 -9.828 0.190 -22.979 1.00 0.00 C ATOM 2159 O PHE A 139 -10.084 -0.137 -21.821 1.00 0.00 O ATOM 2160 CB PHE A 139 -10.872 2.303 -23.701 1.00 0.00 C ATOM 2161 CG PHE A 139 -11.806 3.080 -24.592 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -11.644 3.045 -25.991 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -12.844 3.841 -24.026 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -12.503 3.787 -26.817 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -13.716 4.555 -24.858 1.00 0.00 C ATOM 2166 CZ PHE A 139 -13.542 4.544 -26.253 1.00 0.00 C ATOM 0 H PHE A 139 -12.766 0.866 -22.973 1.00 0.00 H new ATOM 0 HA PHE A 139 -10.727 0.529 -24.921 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -11.109 2.538 -22.663 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -9.854 2.649 -23.881 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -10.858 2.447 -26.428 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -12.969 3.875 -22.954 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.364 3.775 -27.888 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -14.529 5.119 -24.424 1.00 0.00 H new ATOM 0 HZ PHE A 139 -14.204 5.115 -26.887 1.00 0.00 H new ATOM 2176 N VAL A 140 -8.595 0.194 -23.477 1.00 0.00 N ATOM 2177 CA VAL A 140 -7.409 -0.208 -22.744 1.00 0.00 C ATOM 2178 C VAL A 140 -7.093 0.741 -21.570 1.00 0.00 C ATOM 2179 O VAL A 140 -6.237 0.413 -20.751 1.00 0.00 O ATOM 2180 CB VAL A 140 -6.216 -0.309 -23.718 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -6.357 -1.421 -24.760 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -5.927 1.019 -24.420 1.00 0.00 C ATOM 0 H VAL A 140 -8.392 0.487 -24.433 1.00 0.00 H new ATOM 0 HA VAL A 140 -7.599 -1.186 -22.301 1.00 0.00 H new ATOM 0 HB VAL A 140 -5.370 -0.568 -23.081 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.479 -1.427 -25.406 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.443 -2.383 -24.256 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -7.249 -1.245 -25.361 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.080 0.897 -25.095 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -6.803 1.327 -24.990 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.692 1.780 -23.676 1.00 0.00 H new ATOM 2192 N GLY A 141 -7.717 1.927 -21.481 1.00 0.00 N ATOM 2193 CA GLY A 141 -7.332 2.918 -20.479 1.00 0.00 C ATOM 2194 C GLY A 141 -8.277 4.113 -20.454 1.00 0.00 C ATOM 2195 O GLY A 141 -9.227 4.164 -21.238 1.00 0.00 O ATOM 0 H GLY A 141 -8.484 2.216 -22.089 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.317 2.449 -19.495 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.319 3.263 -20.684 1.00 0.00 H new ATOM 2199 N LEU A 142 -7.996 5.092 -19.583 1.00 0.00 N ATOM 2200 CA LEU A 142 -8.706 6.374 -19.557 1.00 0.00 C ATOM 2201 C LEU A 142 -8.406 7.111 -20.850 1.00 0.00 C ATOM 2202 O LEU A 142 -7.244 7.267 -21.224 1.00 0.00 O ATOM 2203 CB LEU A 142 -8.306 7.205 -18.323 1.00 0.00 C ATOM 2204 CG LEU A 142 -8.622 8.716 -18.281 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.131 8.985 -18.286 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -8.047 9.330 -17.005 1.00 0.00 C ATOM 0 H LEU A 142 -7.266 5.015 -18.874 1.00 0.00 H new ATOM 0 HA LEU A 142 -9.780 6.203 -19.479 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -8.782 6.749 -17.455 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.230 7.094 -18.191 1.00 0.00 H new ATOM 0 HG LEU A 142 -8.176 9.160 -19.171 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.309 10.060 -18.256 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -10.572 8.570 -19.192 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -10.587 8.517 -17.414 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.273 10.396 -16.980 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -8.491 8.845 -16.136 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.966 9.187 -16.988 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.467 7.582 -21.494 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.397 8.315 -22.745 1.00 0.00 C ATOM 2220 C ALA A 143 -9.819 9.755 -22.473 1.00 0.00 C ATOM 2221 O ALA A 143 -10.954 9.977 -22.051 1.00 0.00 O ATOM 2222 CB ALA A 143 -10.296 7.608 -23.772 1.00 0.00 C ATOM 0 H ALA A 143 -10.420 7.460 -21.150 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.388 8.338 -23.157 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.257 8.144 -24.720 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -9.947 6.586 -23.919 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -11.323 7.592 -23.406 1.00 0.00 H new ATOM 2228 N LEU A 144 -8.920 10.717 -22.688 1.00 0.00 N ATOM 2229 CA LEU A 144 -9.208 12.145 -22.565 1.00 0.00 C ATOM 2230 C LEU A 144 -9.099 12.786 -23.942 1.00 0.00 C ATOM 2231 O LEU A 144 -8.326 12.337 -24.786 1.00 0.00 O ATOM 2232 CB LEU A 144 -8.226 12.836 -21.601 1.00 0.00 C ATOM 2233 CG LEU A 144 -8.204 12.307 -20.160 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -7.262 13.147 -19.297 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -9.600 12.335 -19.527 1.00 0.00 C ATOM 0 H LEU A 144 -7.956 10.521 -22.957 1.00 0.00 H new ATOM 0 HA LEU A 144 -10.214 12.264 -22.163 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.221 12.747 -22.014 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.466 13.899 -21.572 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.855 11.275 -20.204 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.258 12.759 -18.279 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -6.253 13.100 -19.707 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.602 14.183 -19.289 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.545 11.953 -18.507 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -9.972 13.359 -19.511 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.277 11.712 -20.111 1.00 0.00 H new ATOM 2247 N ASP A 145 -9.841 13.868 -24.152 1.00 0.00 N ATOM 2248 CA ASP A 145 -9.771 14.678 -25.357 1.00 0.00 C ATOM 2249 C ASP A 145 -10.014 16.127 -24.949 1.00 0.00 C ATOM 2250 O ASP A 145 -10.970 16.428 -24.233 1.00 0.00 O ATOM 2251 CB ASP A 145 -10.714 14.123 -26.430 1.00 0.00 C ATOM 2252 CG ASP A 145 -11.881 15.038 -26.712 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -11.675 16.104 -27.327 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -13.019 14.628 -26.407 1.00 0.00 O ATOM 0 H ASP A 145 -10.521 14.211 -23.474 1.00 0.00 H new ATOM 0 HA ASP A 145 -8.790 14.641 -25.830 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -10.154 13.961 -27.351 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -11.089 13.151 -26.110 1.00 0.00 H new ATOM 2259 N GLU A 146 -9.105 17.002 -25.370 1.00 0.00 N ATOM 2260 CA GLU A 146 -9.040 18.394 -24.948 1.00 0.00 C ATOM 2261 C GLU A 146 -9.610 19.312 -26.040 1.00 0.00 C ATOM 2262 O GLU A 146 -9.349 20.515 -26.028 1.00 0.00 O ATOM 2263 CB GLU A 146 -7.594 18.750 -24.543 1.00 0.00 C ATOM 2264 CG GLU A 146 -7.141 18.060 -23.248 1.00 0.00 C ATOM 2265 CD GLU A 146 -7.954 18.532 -22.026 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -7.822 19.711 -21.619 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -8.721 17.720 -21.455 1.00 0.00 O1- ATOM 0 H GLU A 146 -8.372 16.752 -26.034 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.663 18.547 -24.066 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.918 18.471 -25.351 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.514 19.830 -24.419 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -7.245 16.980 -23.357 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -6.083 18.263 -23.080 1.00 0.00 H new ATOM 2274 N THR A 147 -10.386 18.763 -26.990 1.00 0.00 N ATOM 2275 CA THR A 147 -10.999 19.555 -28.059 1.00 0.00 C ATOM 2276 C THR A 147 -12.536 19.433 -28.110 1.00 0.00 C ATOM 2277 O THR A 147 -13.202 20.347 -28.598 1.00 0.00 O ATOM 2278 CB THR A 147 -10.254 19.290 -29.383 1.00 0.00 C ATOM 2279 OG1 THR A 147 -10.307 20.403 -30.261 1.00 0.00 O ATOM 2280 CG2 THR A 147 -10.786 18.072 -30.129 1.00 0.00 C ATOM 0 H THR A 147 -10.602 17.767 -27.035 1.00 0.00 H new ATOM 0 HA THR A 147 -10.872 20.616 -27.842 1.00 0.00 H new ATOM 0 HB THR A 147 -9.222 19.103 -29.086 1.00 0.00 H new ATOM 0 HG1 THR A 147 -9.822 20.192 -31.086 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.223 17.936 -31.052 1.00 0.00 H new ATOM 0 HG22 THR A 147 -10.677 17.186 -29.504 1.00 0.00 H new ATOM 0 HG23 THR A 147 -11.840 18.222 -30.365 1.00 0.00 H new ATOM 2288 N ASN A 148 -13.119 18.367 -27.548 1.00 0.00 N ATOM 2289 CA ASN A 148 -14.558 18.191 -27.379 1.00 0.00 C ATOM 2290 C ASN A 148 -14.872 18.230 -25.887 1.00 0.00 C ATOM 2291 O ASN A 148 -15.773 18.946 -25.452 1.00 0.00 O ATOM 2292 CB ASN A 148 -15.071 16.846 -27.945 1.00 0.00 C ATOM 2293 CG ASN A 148 -14.636 16.460 -29.349 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -15.478 16.260 -30.212 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -13.349 16.261 -29.580 1.00 0.00 N ATOM 0 H ASN A 148 -12.580 17.580 -27.188 1.00 0.00 H new ATOM 0 HA ASN A 148 -15.054 18.991 -27.928 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -14.755 16.054 -27.266 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -16.161 16.867 -27.925 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -13.040 15.933 -30.495 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -12.666 16.435 -28.843 1.00 0.00 H new ATOM 2302 N GLN A 149 -14.111 17.452 -25.108 1.00 0.00 N ATOM 2303 CA GLN A 149 -14.373 17.159 -23.706 1.00 0.00 C ATOM 2304 C GLN A 149 -13.461 17.916 -22.740 1.00 0.00 C ATOM 2305 O GLN A 149 -13.387 17.555 -21.567 1.00 0.00 O ATOM 2306 CB GLN A 149 -14.309 15.644 -23.488 1.00 0.00 C ATOM 2307 CG GLN A 149 -15.396 14.902 -24.278 1.00 0.00 C ATOM 2308 CD GLN A 149 -15.289 13.412 -24.002 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -16.008 12.844 -23.183 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -14.325 12.771 -24.626 1.00 0.00 N ATOM 0 H GLN A 149 -13.267 16.996 -25.455 1.00 0.00 H new ATOM 0 HA GLN A 149 -15.376 17.518 -23.475 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -13.328 15.276 -23.788 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -14.420 15.426 -22.426 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -16.383 15.267 -23.992 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -15.282 15.095 -25.345 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -13.740 13.262 -25.302 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -14.162 11.783 -24.434 1.00 0.00 H new ATOM 2319 N TYR A 150 -12.833 19.005 -23.188 1.00 0.00 N ATOM 2320 CA TYR A 150 -12.006 19.870 -22.335 1.00 0.00 C ATOM 2321 C TYR A 150 -12.739 20.348 -21.069 1.00 0.00 C ATOM 2322 O TYR A 150 -12.100 20.734 -20.086 1.00 0.00 O ATOM 2323 CB TYR A 150 -11.523 21.089 -23.141 1.00 0.00 C ATOM 2324 CG TYR A 150 -12.602 21.869 -23.887 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -13.539 22.655 -23.186 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -12.667 21.809 -25.293 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -14.547 23.352 -23.876 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -13.666 22.512 -25.991 1.00 0.00 C ATOM 2329 CZ TYR A 150 -14.619 23.280 -25.284 1.00 0.00 C ATOM 2330 OH TYR A 150 -15.597 23.967 -25.945 1.00 0.00 O ATOM 0 H TYR A 150 -12.882 19.316 -24.158 1.00 0.00 H new ATOM 0 HA TYR A 150 -11.158 19.269 -22.006 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.015 21.772 -22.460 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -10.782 20.750 -23.865 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -13.482 22.723 -22.110 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.945 21.219 -25.839 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -15.266 23.943 -23.328 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -13.705 22.465 -27.069 1.00 0.00 H new ATOM 0 HH TYR A 150 -15.509 23.815 -26.909 1.00 0.00 H new ATOM 2340 N ASP A 151 -14.079 20.360 -21.091 1.00 0.00 N ATOM 2341 CA ASP A 151 -14.908 20.882 -20.003 1.00 0.00 C ATOM 2342 C ASP A 151 -15.121 19.843 -18.900 1.00 0.00 C ATOM 2343 O ASP A 151 -15.344 20.200 -17.741 1.00 0.00 O ATOM 2344 CB ASP A 151 -16.257 21.339 -20.570 1.00 0.00 C ATOM 2345 CG ASP A 151 -17.178 21.892 -19.467 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -16.902 22.999 -18.944 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -18.207 21.244 -19.155 1.00 0.00 O ATOM 0 H ASP A 151 -14.622 20.002 -21.877 1.00 0.00 H new ATOM 0 HA ASP A 151 -14.388 21.728 -19.553 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -16.093 22.106 -21.326 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -16.746 20.501 -21.067 1.00 0.00 H new ATOM 2352 N LEU A 152 -15.028 18.553 -19.248 1.00 0.00 N ATOM 2353 CA LEU A 152 -15.371 17.436 -18.374 1.00 0.00 C ATOM 2354 C LEU A 152 -14.195 16.506 -18.136 1.00 0.00 C ATOM 2355 O LEU A 152 -14.302 15.626 -17.289 1.00 0.00 O ATOM 2356 CB LEU A 152 -16.577 16.686 -18.961 1.00 0.00 C ATOM 2357 CG LEU A 152 -16.252 15.861 -20.223 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -15.837 14.409 -19.940 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -17.446 15.877 -21.175 1.00 0.00 C ATOM 0 H LEU A 152 -14.704 18.256 -20.168 1.00 0.00 H new ATOM 0 HA LEU A 152 -15.638 17.834 -17.395 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -16.983 16.020 -18.199 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -17.357 17.408 -19.203 1.00 0.00 H new ATOM 0 HG LEU A 152 -15.385 16.341 -20.678 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -15.627 13.901 -20.881 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -14.944 14.401 -19.316 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -16.646 13.894 -19.422 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -17.210 15.293 -22.064 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.314 15.445 -20.677 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -17.667 16.904 -21.464 1.00 0.00 H new ATOM 2371 N SER A 153 -13.082 16.640 -18.854 1.00 0.00 N ATOM 2372 CA SER A 153 -11.961 15.707 -18.747 1.00 0.00 C ATOM 2373 C SER A 153 -11.482 15.594 -17.296 1.00 0.00 C ATOM 2374 O SER A 153 -11.147 14.504 -16.834 1.00 0.00 O ATOM 2375 CB SER A 153 -10.845 16.136 -19.717 1.00 0.00 C ATOM 2376 OG SER A 153 -10.578 17.523 -19.675 1.00 0.00 O ATOM 0 H SER A 153 -12.931 17.395 -19.524 1.00 0.00 H new ATOM 0 HA SER A 153 -12.283 14.707 -19.036 1.00 0.00 H new ATOM 0 HB2 SER A 153 -9.933 15.589 -19.477 1.00 0.00 H new ATOM 0 HB3 SER A 153 -11.127 15.857 -20.732 1.00 0.00 H new ATOM 0 HG SER A 153 -10.073 17.783 -20.473 1.00 0.00 H new ATOM 2382 N ASP A 154 -11.589 16.686 -16.539 1.00 0.00 N ATOM 2383 CA ASP A 154 -11.280 16.740 -15.117 1.00 0.00 C ATOM 2384 C ASP A 154 -12.124 15.753 -14.318 1.00 0.00 C ATOM 2385 O ASP A 154 -11.611 15.051 -13.444 1.00 0.00 O ATOM 2386 CB ASP A 154 -11.521 18.164 -14.613 1.00 0.00 C ATOM 2387 CG ASP A 154 -11.233 18.270 -13.109 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -10.034 18.263 -12.745 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -12.191 18.391 -12.310 1.00 0.00 O ATOM 0 H ASP A 154 -11.903 17.582 -16.913 1.00 0.00 H new ATOM 0 HA ASP A 154 -10.236 16.461 -14.978 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -10.884 18.860 -15.159 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.553 18.454 -14.811 1.00 0.00 H new ATOM 2394 N GLU A 155 -13.405 15.629 -14.662 1.00 0.00 N ATOM 2395 CA GLU A 155 -14.361 14.789 -13.965 1.00 0.00 C ATOM 2396 C GLU A 155 -14.104 13.320 -14.305 1.00 0.00 C ATOM 2397 O GLU A 155 -14.285 12.421 -13.484 1.00 0.00 O ATOM 2398 CB GLU A 155 -15.795 15.266 -14.272 1.00 0.00 C ATOM 2399 CG GLU A 155 -16.578 14.404 -15.275 1.00 0.00 C ATOM 2400 CD GLU A 155 -18.024 14.903 -15.489 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -18.250 16.122 -15.690 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -18.960 14.068 -15.455 1.00 0.00 O ATOM 0 H GLU A 155 -13.811 16.126 -15.455 1.00 0.00 H new ATOM 0 HA GLU A 155 -14.238 14.875 -12.885 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -16.355 15.304 -13.337 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -15.746 16.285 -14.656 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -16.054 14.400 -16.231 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -16.602 13.373 -14.921 1.00 0.00 H new ATOM 2409 N ARG A 156 -13.627 13.072 -15.522 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.397 11.725 -16.013 1.00 0.00 C ATOM 2411 C ARG A 156 -12.098 11.202 -15.435 1.00 0.00 C ATOM 2412 O ARG A 156 -11.995 10.004 -15.199 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.434 11.769 -17.544 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.593 10.359 -18.119 1.00 0.00 C ATOM 2415 CD ARG A 156 -13.419 10.395 -19.636 1.00 0.00 C ATOM 2416 NE ARG A 156 -14.614 10.885 -20.364 1.00 0.00 N ATOM 2417 CZ ARG A 156 -15.763 10.225 -20.597 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -15.998 9.036 -20.045 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -16.687 10.764 -21.384 1.00 0.00 N ATOM 0 H ARG A 156 -13.390 13.803 -16.193 1.00 0.00 H new ATOM 0 HA ARG A 156 -14.169 11.026 -15.693 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.260 12.398 -17.875 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.517 12.221 -17.923 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.855 9.690 -17.675 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.576 9.962 -17.866 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -12.570 11.033 -19.880 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.176 9.393 -19.988 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.558 11.835 -20.732 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.301 8.611 -19.434 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.875 8.551 -20.233 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -16.525 11.676 -21.810 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -17.559 10.266 -21.562 1.00 0.00 H new ATOM 2433 N ILE A 157 -11.137 12.079 -15.135 1.00 0.00 N ATOM 2434 CA ILE A 157 -9.911 11.666 -14.480 1.00 0.00 C ATOM 2435 C ILE A 157 -10.285 11.122 -13.113 1.00 0.00 C ATOM 2436 O ILE A 157 -9.996 9.975 -12.809 1.00 0.00 O ATOM 2437 CB ILE A 157 -8.877 12.813 -14.381 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -8.290 13.201 -15.750 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -7.749 12.333 -13.445 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -7.595 14.572 -15.742 1.00 0.00 C ATOM 0 H ILE A 157 -11.192 13.077 -15.338 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.421 10.894 -15.073 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.372 13.704 -13.995 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.575 12.440 -16.061 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -9.089 13.210 -16.492 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -6.998 13.117 -13.349 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -8.163 12.106 -12.463 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -7.288 11.437 -13.861 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -7.203 14.787 -16.736 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -8.313 15.342 -15.461 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -6.776 14.560 -15.023 1.00 0.00 H new ATOM 2452 N GLN A 158 -10.925 11.935 -12.285 1.00 0.00 N ATOM 2453 CA GLN A 158 -11.264 11.546 -10.922 1.00 0.00 C ATOM 2454 C GLN A 158 -12.121 10.301 -10.884 1.00 0.00 C ATOM 2455 O GLN A 158 -11.835 9.391 -10.113 1.00 0.00 O ATOM 2456 CB GLN A 158 -11.901 12.688 -10.123 1.00 0.00 C ATOM 2457 CG GLN A 158 -13.069 13.386 -10.803 1.00 0.00 C ATOM 2458 CD GLN A 158 -13.272 14.795 -10.263 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -13.951 15.025 -9.266 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.654 15.750 -10.930 1.00 0.00 N ATOM 0 H GLN A 158 -11.223 12.878 -12.536 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.320 11.308 -10.432 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -12.243 12.293 -9.166 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -11.133 13.430 -9.906 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -12.892 13.430 -11.878 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -13.978 12.804 -10.653 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.099 15.519 -11.754 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -12.731 16.719 -10.622 1.00 0.00 H new ATOM 2469 N SER A 159 -13.084 10.215 -11.785 1.00 0.00 N ATOM 2470 CA SER A 159 -13.915 9.017 -11.850 1.00 0.00 C ATOM 2471 C SER A 159 -13.072 7.790 -12.211 1.00 0.00 C ATOM 2472 O SER A 159 -13.285 6.712 -11.656 1.00 0.00 O ATOM 2473 CB SER A 159 -15.041 9.191 -12.862 1.00 0.00 C ATOM 2474 OG SER A 159 -15.842 10.333 -12.582 1.00 0.00 O ATOM 0 H SER A 159 -13.310 10.938 -12.468 1.00 0.00 H new ATOM 0 HA SER A 159 -14.354 8.863 -10.864 1.00 0.00 H new ATOM 0 HB2 SER A 159 -14.618 9.282 -13.862 1.00 0.00 H new ATOM 0 HB3 SER A 159 -15.669 8.300 -12.862 1.00 0.00 H new ATOM 0 HG SER A 159 -15.363 11.143 -12.854 1.00 0.00 H new ATOM 2480 N TRP A 160 -12.073 7.943 -13.090 1.00 0.00 N ATOM 2481 CA TRP A 160 -11.185 6.848 -13.448 1.00 0.00 C ATOM 2482 C TRP A 160 -10.333 6.454 -12.258 1.00 0.00 C ATOM 2483 O TRP A 160 -10.200 5.283 -11.920 1.00 0.00 O ATOM 2484 CB TRP A 160 -10.290 7.304 -14.595 1.00 0.00 C ATOM 2485 CG TRP A 160 -9.433 6.216 -15.117 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -9.886 5.162 -15.827 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -7.982 6.097 -15.084 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -8.816 4.406 -16.238 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -7.621 4.927 -15.805 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.931 6.902 -14.601 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -6.296 4.553 -16.014 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -5.585 6.558 -14.839 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.270 5.382 -15.540 1.00 0.00 C ATOM 0 H TRP A 160 -11.865 8.822 -13.564 1.00 0.00 H new ATOM 0 HA TRP A 160 -11.774 5.983 -13.753 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -10.911 7.692 -15.403 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.660 8.126 -14.255 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -10.923 4.947 -16.038 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -8.899 3.558 -16.799 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.160 7.796 -14.040 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -6.062 3.636 -16.535 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.794 7.200 -14.481 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.238 5.117 -15.714 1.00 0.00 H new ATOM 2504 N CYS A 161 -9.811 7.465 -11.579 1.00 0.00 N ATOM 2505 CA CYS A 161 -9.025 7.313 -10.382 1.00 0.00 C ATOM 2506 C CYS A 161 -9.831 6.556 -9.338 1.00 0.00 C ATOM 2507 O CYS A 161 -9.257 5.717 -8.650 1.00 0.00 O ATOM 2508 CB CYS A 161 -8.609 8.690 -9.866 1.00 0.00 C ATOM 2509 SG CYS A 161 -7.486 9.450 -11.068 1.00 0.00 S ATOM 0 H CYS A 161 -9.931 8.438 -11.861 1.00 0.00 H new ATOM 0 HA CYS A 161 -8.122 6.742 -10.599 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -9.487 9.319 -9.720 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.118 8.597 -8.897 1.00 0.00 H new ATOM 0 HG CYS A 161 -8.164 9.849 -12.103 1.00 0.00 H new ATOM 2515 N GLU A 162 -11.146 6.783 -9.273 1.00 0.00 N ATOM 2516 CA GLU A 162 -11.961 6.155 -8.248 1.00 0.00 C ATOM 2517 C GLU A 162 -12.093 4.655 -8.486 1.00 0.00 C ATOM 2518 O GLU A 162 -12.189 3.902 -7.516 1.00 0.00 O ATOM 2519 CB GLU A 162 -13.333 6.823 -8.102 1.00 0.00 C ATOM 2520 CG GLU A 162 -13.244 8.106 -7.273 1.00 0.00 C ATOM 2521 CD GLU A 162 -14.618 8.787 -7.139 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -15.391 8.424 -6.218 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -14.932 9.700 -7.942 1.00 0.00 O ATOM 0 H GLU A 162 -11.657 7.391 -9.913 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.441 6.298 -7.301 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.734 7.053 -9.089 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -14.028 6.130 -7.629 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -12.854 7.874 -6.282 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -12.540 8.794 -7.740 1.00 0.00 H new ATOM 2530 N GLN A 163 -12.031 4.196 -9.738 1.00 0.00 N ATOM 2531 CA GLN A 163 -11.952 2.767 -9.990 1.00 0.00 C ATOM 2532 C GLN A 163 -10.535 2.250 -9.801 1.00 0.00 C ATOM 2533 O GLN A 163 -10.373 1.269 -9.085 1.00 0.00 O ATOM 2534 CB GLN A 163 -12.596 2.345 -11.308 1.00 0.00 C ATOM 2535 CG GLN A 163 -12.040 2.996 -12.577 1.00 0.00 C ATOM 2536 CD GLN A 163 -12.581 2.325 -13.845 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -13.575 1.600 -13.836 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -11.926 2.545 -14.973 1.00 0.00 N ATOM 0 H GLN A 163 -12.034 4.783 -10.572 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.563 2.276 -9.232 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.496 1.264 -11.407 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -13.663 2.562 -11.252 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -12.300 4.054 -12.587 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -10.952 2.935 -12.570 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -11.102 3.147 -14.975 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -12.244 2.113 -15.840 1.00 0.00 H new ATOM 2547 N ILE A 164 -9.493 2.893 -10.332 1.00 0.00 N ATOM 2548 CA ILE A 164 -8.170 2.280 -10.305 1.00 0.00 C ATOM 2549 C ILE A 164 -7.688 2.124 -8.863 1.00 0.00 C ATOM 2550 O ILE A 164 -7.140 1.082 -8.514 1.00 0.00 O ATOM 2551 CB ILE A 164 -7.158 2.996 -11.223 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -6.520 4.296 -10.686 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -7.713 3.143 -12.644 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.605 5.017 -11.695 1.00 0.00 C ATOM 0 H ILE A 164 -9.538 3.812 -10.773 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.252 1.278 -10.727 1.00 0.00 H new ATOM 0 HB ILE A 164 -6.300 2.324 -11.245 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.314 4.978 -10.382 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -5.942 4.061 -9.792 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -6.980 3.651 -13.270 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -7.922 2.156 -13.057 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -8.633 3.727 -12.617 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.199 5.919 -11.238 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.787 4.356 -11.982 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -6.181 5.287 -12.580 1.00 0.00 H new ATOM 2566 N LEU A 165 -7.965 3.107 -8.001 1.00 0.00 N ATOM 2567 CA LEU A 165 -7.568 3.074 -6.591 1.00 0.00 C ATOM 2568 C LEU A 165 -8.252 1.939 -5.829 1.00 0.00 C ATOM 2569 O LEU A 165 -7.813 1.593 -4.737 1.00 0.00 O ATOM 2570 CB LEU A 165 -7.798 4.450 -5.924 1.00 0.00 C ATOM 2571 CG LEU A 165 -9.260 4.872 -5.632 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -9.852 4.290 -4.340 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -9.344 6.402 -5.491 1.00 0.00 C ATOM 0 H LEU A 165 -8.473 3.952 -8.263 1.00 0.00 H new ATOM 0 HA LEU A 165 -6.499 2.865 -6.551 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.251 4.462 -4.981 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.350 5.212 -6.562 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.831 4.483 -6.476 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.877 4.640 -4.220 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.844 3.201 -4.394 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -9.255 4.615 -3.488 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.374 6.692 -5.286 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.705 6.727 -4.670 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -9.012 6.871 -6.417 1.00 0.00 H new ATOM 2585 N ASN A 166 -9.311 1.358 -6.402 1.00 0.00 N ATOM 2586 CA ASN A 166 -9.987 0.190 -5.872 1.00 0.00 C ATOM 2587 C ASN A 166 -9.419 -1.020 -6.576 1.00 0.00 C ATOM 2588 O ASN A 166 -9.032 -1.963 -5.907 1.00 0.00 O ATOM 2589 CB ASN A 166 -11.508 0.288 -6.067 1.00 0.00 C ATOM 2590 CG ASN A 166 -12.184 1.098 -4.964 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -12.326 0.627 -3.840 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -12.604 2.325 -5.238 1.00 0.00 N ATOM 0 H ASN A 166 -9.725 1.702 -7.268 1.00 0.00 H new ATOM 0 HA ASN A 166 -9.821 0.113 -4.797 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -11.719 0.747 -7.033 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -11.934 -0.715 -6.091 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -13.049 2.886 -4.512 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -12.482 2.708 -6.175 1.00 0.00 H new ATOM 2599 N GLU A 167 -9.282 -0.984 -7.899 1.00 0.00 N ATOM 2600 CA GLU A 167 -8.886 -2.140 -8.688 1.00 0.00 C ATOM 2601 C GLU A 167 -7.527 -2.646 -8.215 1.00 0.00 C ATOM 2602 O GLU A 167 -7.335 -3.847 -8.074 1.00 0.00 O ATOM 2603 CB GLU A 167 -8.826 -1.788 -10.185 1.00 0.00 C ATOM 2604 CG GLU A 167 -10.184 -1.590 -10.867 1.00 0.00 C ATOM 2605 CD GLU A 167 -10.002 -1.125 -12.324 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -9.820 0.092 -12.556 1.00 0.00 O ATOM 2607 OE2 GLU A 167 -10.001 -1.977 -13.244 1.00 0.00 O ATOM 0 H GLU A 167 -9.445 -0.144 -8.455 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.631 -2.924 -8.552 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.242 -0.875 -10.303 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.288 -2.580 -10.706 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.746 -2.524 -10.846 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.769 -0.854 -10.316 1.00 0.00 H new ATOM 2614 N MET A 168 -6.605 -1.728 -7.909 1.00 0.00 N ATOM 2615 CA MET A 168 -5.230 -2.052 -7.535 1.00 0.00 C ATOM 2616 C MET A 168 -5.151 -2.498 -6.081 1.00 0.00 C ATOM 2617 O MET A 168 -4.408 -3.418 -5.749 1.00 0.00 O ATOM 2618 CB MET A 168 -4.327 -0.830 -7.804 1.00 0.00 C ATOM 2619 CG MET A 168 -4.365 -0.549 -9.303 1.00 0.00 C ATOM 2620 SD MET A 168 -3.400 0.816 -9.995 1.00 0.00 S ATOM 2621 CE MET A 168 -4.205 2.200 -9.175 1.00 0.00 C ATOM 0 H MET A 168 -6.798 -0.726 -7.915 1.00 0.00 H new ATOM 0 HA MET A 168 -4.878 -2.886 -8.142 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.678 0.036 -7.243 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.306 -1.029 -7.478 1.00 0.00 H new ATOM 0 HG2 MET A 168 -4.048 -1.460 -9.811 1.00 0.00 H new ATOM 0 HG3 MET A 168 -5.407 -0.379 -9.574 1.00 0.00 H new ATOM 0 HE1 MET A 168 -3.820 3.136 -9.579 1.00 0.00 H new ATOM 0 HE2 MET A 168 -5.281 2.147 -9.344 1.00 0.00 H new ATOM 0 HE3 MET A 168 -4.003 2.156 -8.105 1.00 0.00 H new ATOM 2631 N ALA A 169 -5.941 -1.858 -5.222 1.00 0.00 N ATOM 2632 CA ALA A 169 -5.982 -2.133 -3.794 1.00 0.00 C ATOM 2633 C ALA A 169 -6.574 -3.514 -3.549 1.00 0.00 C ATOM 2634 O ALA A 169 -6.020 -4.321 -2.806 1.00 0.00 O ATOM 2635 CB ALA A 169 -6.820 -1.061 -3.087 1.00 0.00 C ATOM 0 H ALA A 169 -6.583 -1.119 -5.509 1.00 0.00 H new ATOM 0 HA ALA A 169 -4.969 -2.112 -3.392 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -6.849 -1.269 -2.017 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -6.373 -0.081 -3.254 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -7.834 -1.070 -3.486 1.00 0.00 H new ATOM 2641 N GLU A 170 -7.686 -3.786 -4.222 1.00 0.00 N ATOM 2642 CA GLU A 170 -8.419 -5.038 -4.153 1.00 0.00 C ATOM 2643 C GLU A 170 -7.584 -6.164 -4.779 1.00 0.00 C ATOM 2644 O GLU A 170 -7.677 -7.310 -4.334 1.00 0.00 O ATOM 2645 CB GLU A 170 -9.767 -4.860 -4.871 1.00 0.00 C ATOM 2646 CG GLU A 170 -10.692 -3.823 -4.193 1.00 0.00 C ATOM 2647 CD GLU A 170 -11.428 -4.418 -2.978 1.00 0.00 C ATOM 2648 OE1 GLU A 170 -10.896 -4.350 -1.845 1.00 0.00 O ATOM 2649 OE2 GLU A 170 -12.554 -4.949 -3.146 1.00 0.00 O ATOM 0 H GLU A 170 -8.116 -3.112 -4.855 1.00 0.00 H new ATOM 0 HA GLU A 170 -8.612 -5.313 -3.116 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -9.584 -4.554 -5.901 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -10.279 -5.821 -4.910 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -10.102 -2.963 -3.875 1.00 0.00 H new ATOM 0 HG3 GLU A 170 -11.421 -3.459 -4.917 1.00 0.00 H new ATOM 2656 N HIS A 171 -6.727 -5.855 -5.767 1.00 0.00 N ATOM 2657 CA HIS A 171 -5.782 -6.817 -6.323 1.00 0.00 C ATOM 2658 C HIS A 171 -4.779 -7.259 -5.258 1.00 0.00 C ATOM 2659 O HIS A 171 -4.546 -8.454 -5.063 1.00 0.00 O ATOM 2660 CB HIS A 171 -5.023 -6.221 -7.521 1.00 0.00 C ATOM 2661 CG HIS A 171 -4.682 -7.289 -8.523 1.00 0.00 C ATOM 2662 ND1 HIS A 171 -3.818 -8.369 -8.310 1.00 0.00 N ATOM 2663 CD2 HIS A 171 -5.344 -7.470 -9.703 1.00 0.00 C ATOM 2664 CE1 HIS A 171 -4.007 -9.191 -9.358 1.00 0.00 C ATOM 2665 NE2 HIS A 171 -4.910 -8.673 -10.212 1.00 0.00 N ATOM 0 H HIS A 171 -6.676 -4.931 -6.197 1.00 0.00 H new ATOM 0 HA HIS A 171 -6.354 -7.680 -6.664 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -5.631 -5.451 -7.996 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -4.110 -5.737 -7.174 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -6.066 -6.802 -10.149 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -3.504 -10.137 -9.495 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -5.219 -9.099 -11.086 1.00 0.00 H new ATOM 2673 N TYR A 172 -4.205 -6.277 -4.556 1.00 0.00 N ATOM 2674 CA TYR A 172 -3.166 -6.478 -3.562 1.00 0.00 C ATOM 2675 C TYR A 172 -3.697 -6.931 -2.197 1.00 0.00 C ATOM 2676 O TYR A 172 -2.891 -7.209 -1.300 1.00 0.00 O ATOM 2677 CB TYR A 172 -2.283 -5.217 -3.491 1.00 0.00 C ATOM 2678 CG TYR A 172 -0.924 -5.373 -4.142 1.00 0.00 C ATOM 2679 CD1 TYR A 172 -0.004 -6.325 -3.664 1.00 0.00 C ATOM 2680 CD2 TYR A 172 -0.576 -4.546 -5.227 1.00 0.00 C ATOM 2681 CE1 TYR A 172 1.255 -6.466 -4.274 1.00 0.00 C ATOM 2682 CE2 TYR A 172 0.691 -4.660 -5.821 1.00 0.00 C ATOM 2683 CZ TYR A 172 1.609 -5.633 -5.362 1.00 0.00 C ATOM 2684 OH TYR A 172 2.821 -5.763 -5.976 1.00 0.00 O ATOM 0 H TYR A 172 -4.463 -5.297 -4.672 1.00 0.00 H new ATOM 0 HA TYR A 172 -2.546 -7.316 -3.881 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -2.810 -4.391 -3.969 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -2.143 -4.943 -2.445 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -0.267 -6.951 -2.824 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -1.285 -3.823 -5.603 1.00 0.00 H new ATOM 0 HE1 TYR A 172 1.951 -7.209 -3.913 1.00 0.00 H new ATOM 0 HE2 TYR A 172 0.966 -4.002 -6.632 1.00 0.00 H new ATOM 0 HH TYR A 172 2.891 -5.110 -6.703 1.00 0.00 H new ATOM 2694 N ALA A 173 -5.018 -7.025 -2.028 1.00 0.00 N ATOM 2695 CA ALA A 173 -5.617 -7.467 -0.786 1.00 0.00 C ATOM 2696 C ALA A 173 -5.369 -8.964 -0.574 1.00 0.00 C ATOM 2697 O ALA A 173 -5.057 -9.359 0.572 1.00 0.00 O ATOM 2698 CB ALA A 173 -7.111 -7.132 -0.747 1.00 0.00 C ATOM 2699 OXT ALA A 173 -5.517 -9.753 -1.537 1.00 0.00 O1- ATOM 0 H ALA A 173 -5.695 -6.794 -2.755 1.00 0.00 H new ATOM 0 HA ALA A 173 -5.143 -6.930 0.036 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.536 -7.475 0.196 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -7.245 -6.054 -0.835 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.617 -7.629 -1.575 1.00 0.00 H new