USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1045 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 129 GLN : amide:sc= 0.307 K(o=0.91,f=-0.32) USER MOD Set 1.2: A 139 THR OG1 : rot 180:sc= 0.601 USER MOD Set 2.1: A 110 ASN : amide:sc= 0.344 X(o=1.5,f=1.1) USER MOD Set 2.2: A 113 THR OG1 : rot -58:sc= 1.17 USER MOD Set 2.3: A 114 HIS : no HD1:sc= 0 X(o=1.5,f=1.4) USER MOD Set 3.1: A 93 THR OG1 : rot -120:sc= 0.0149 USER MOD Set 3.2: A 95 MET CE :methyl 166:sc= 0 (180deg=-0.0304) USER MOD Set 4.1: A 69 SER OG : rot 27:sc= 2.23 USER MOD Set 4.2: A 108 TYR OH : rot -24:sc= 0.432 USER MOD Set 5.1: A 35 GLN : amide:sc= -0.0375 X(o=-0.015,f=-0.51) USER MOD Set 5.2: A 39 THR OG1 : rot -160:sc= 0.0223 USER MOD Single : A 1 ILE N :NH3+ 142:sc= -0.106 (180deg=-1.19) USER MOD Single : A 3 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0391) USER MOD Single : A 4 HIS : no HD1:sc= -0.185 X(o=-0.19,f=-0.17) USER MOD Single : A 7 SER OG : rot 70:sc= 1.22 USER MOD Single : A 16 ASN : amide:sc= -0.513 X(o=-0.51,f=-0.084) USER MOD Single : A 20 THR OG1 : rot 163:sc= 1.23 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 26 THR OG1 : rot -4:sc= -0.602 USER MOD Single : A 27 SER OG : rot -57:sc= 0.0361 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 132:sc= 1.49 USER MOD Single : A 48 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.18) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -1.03 X(o=-1,f=-0.92) USER MOD Single : A 64 HIS : no HD1:sc=-0.00836 X(o=-0.0084,f=0) USER MOD Single : A 66 SER OG : rot 60:sc= 0.012 USER MOD Single : A 72 ASN :FLIP amide:sc= -0.482 F(o=-1.1,f=-0.48) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.306 USER MOD Single : A 75 MET CE :methyl -175:sc= -0.288 (180deg=-0.321) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 130:sc= -0.221 USER MOD Single : A 81 LYS NZ :NH3+ 149:sc= -0.328 (180deg=-1.6!) USER MOD Single : A 84 LYS NZ :NH3+ -155:sc= 2.43 (180deg=1.51) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0291 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 THR OG1 : rot 12:sc= 0.847 USER MOD Single : A 121 GLN : amide:sc= 1.1 K(o=1.1,f=-6!) USER MOD Single : A 122 MET CE :methyl -150:sc= -1.14 (180deg=-3.17!) USER MOD Single : A 126 GLN : amide:sc= -0.0832 X(o=-0.083,f=0) USER MOD Single : A 127 GLN : amide:sc= -0.0229 X(o=-0.023,f=-0.063) USER MOD Single : A 128 MET CE :methyl -152:sc= -0.324 (180deg=-1.18) USER MOD Single : A 134 ASN : amide:sc= -0.103 X(o=-0.1,f=-0.098) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.377 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 11.398 -12.542 14.514 1.00 0.00 N ATOM 2 CA ILE A 1 12.809 -12.892 14.300 1.00 0.00 C ATOM 3 C ILE A 1 12.980 -14.392 13.999 1.00 0.00 C ATOM 4 O ILE A 1 13.572 -15.113 14.806 1.00 0.00 O ATOM 5 CB ILE A 1 13.674 -12.421 15.492 1.00 0.00 C ATOM 6 CG1 ILE A 1 13.097 -12.856 16.866 1.00 0.00 C ATOM 7 CG2 ILE A 1 13.835 -10.894 15.421 1.00 0.00 C ATOM 8 CD1 ILE A 1 14.145 -12.883 17.982 1.00 0.00 C ATOM 0 H1 ILE A 1 11.327 -11.834 15.272 1.00 0.00 H new ATOM 0 H2 ILE A 1 11.001 -12.150 13.636 1.00 0.00 H new ATOM 0 H3 ILE A 1 10.866 -13.394 14.785 1.00 0.00 H new ATOM 0 HA ILE A 1 13.164 -12.363 13.416 1.00 0.00 H new ATOM 0 HB ILE A 1 14.648 -12.903 15.412 1.00 0.00 H new ATOM 0 HG12 ILE A 1 12.294 -12.174 17.147 1.00 0.00 H new ATOM 0 HG13 ILE A 1 12.654 -13.847 16.769 1.00 0.00 H new ATOM 0 HG21 ILE A 1 14.444 -10.553 16.258 1.00 0.00 H new ATOM 0 HG22 ILE A 1 14.322 -10.623 14.484 1.00 0.00 H new ATOM 0 HG23 ILE A 1 12.854 -10.422 15.470 1.00 0.00 H new ATOM 0 HD11 ILE A 1 13.675 -13.195 18.915 1.00 0.00 H new ATOM 0 HD12 ILE A 1 14.936 -13.586 17.721 1.00 0.00 H new ATOM 0 HD13 ILE A 1 14.571 -11.887 18.106 1.00 0.00 H new ATOM 20 N PRO A 2 12.483 -14.923 12.867 1.00 0.00 N ATOM 21 CA PRO A 2 12.564 -16.352 12.574 1.00 0.00 C ATOM 22 C PRO A 2 13.949 -16.726 12.032 1.00 0.00 C ATOM 23 O PRO A 2 14.075 -17.264 10.930 1.00 0.00 O ATOM 24 CB PRO A 2 11.453 -16.571 11.549 1.00 0.00 C ATOM 25 CG PRO A 2 11.493 -15.285 10.736 1.00 0.00 C ATOM 26 CD PRO A 2 11.722 -14.243 11.828 1.00 0.00 C ATOM 0 HA PRO A 2 12.436 -16.983 13.454 1.00 0.00 H new ATOM 0 HB2 PRO A 2 11.640 -17.448 10.930 1.00 0.00 H new ATOM 0 HB3 PRO A 2 10.484 -16.719 12.026 1.00 0.00 H new ATOM 0 HG2 PRO A 2 12.296 -15.290 9.999 1.00 0.00 H new ATOM 0 HG3 PRO A 2 10.563 -15.113 10.193 1.00 0.00 H new ATOM 0 HD2 PRO A 2 12.269 -13.384 11.441 1.00 0.00 H new ATOM 0 HD3 PRO A 2 10.775 -13.869 12.217 1.00 0.00 H new ATOM 34 N LYS A 3 14.980 -16.550 12.866 1.00 0.00 N ATOM 35 CA LYS A 3 16.402 -16.608 12.525 1.00 0.00 C ATOM 36 C LYS A 3 16.726 -15.497 11.515 1.00 0.00 C ATOM 37 O LYS A 3 16.201 -15.489 10.399 1.00 0.00 O ATOM 38 CB LYS A 3 16.832 -18.019 12.061 1.00 0.00 C ATOM 39 CG LYS A 3 16.135 -19.203 12.761 1.00 0.00 C ATOM 40 CD LYS A 3 16.335 -19.259 14.285 1.00 0.00 C ATOM 41 CE LYS A 3 15.314 -20.191 14.954 1.00 0.00 C ATOM 42 NZ LYS A 3 15.336 -21.556 14.398 1.00 0.00 N ATOM 0 H LYS A 3 14.833 -16.352 13.856 1.00 0.00 H new ATOM 0 HA LYS A 3 16.998 -16.423 13.419 1.00 0.00 H new ATOM 0 HB2 LYS A 3 16.650 -18.098 10.989 1.00 0.00 H new ATOM 0 HB3 LYS A 3 17.907 -18.117 12.210 1.00 0.00 H new ATOM 0 HG2 LYS A 3 15.067 -19.154 12.550 1.00 0.00 H new ATOM 0 HG3 LYS A 3 16.503 -20.132 12.326 1.00 0.00 H new ATOM 0 HD2 LYS A 3 17.345 -19.604 14.508 1.00 0.00 H new ATOM 0 HD3 LYS A 3 16.242 -18.256 14.702 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.517 -20.236 16.024 1.00 0.00 H new ATOM 0 HE3 LYS A 3 14.315 -19.772 14.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 14.702 -22.167 14.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 15.017 -21.533 13.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 16.304 -21.933 14.441 1.00 0.00 H new ATOM 56 N HIS A 4 17.522 -14.509 11.934 1.00 0.00 N ATOM 57 CA HIS A 4 17.883 -13.357 11.104 1.00 0.00 C ATOM 58 C HIS A 4 18.558 -13.796 9.798 1.00 0.00 C ATOM 59 O HIS A 4 19.120 -14.892 9.750 1.00 0.00 O ATOM 60 CB HIS A 4 18.779 -12.388 11.902 1.00 0.00 C ATOM 61 CG HIS A 4 19.890 -13.011 12.716 1.00 0.00 C ATOM 62 ND1 HIS A 4 20.228 -12.619 13.988 1.00 0.00 N ATOM 63 CD2 HIS A 4 20.750 -14.017 12.353 1.00 0.00 C ATOM 64 CE1 HIS A 4 21.245 -13.393 14.399 1.00 0.00 C ATOM 65 NE2 HIS A 4 21.576 -14.286 13.449 1.00 0.00 N ATOM 0 H HIS A 4 17.937 -14.486 12.866 1.00 0.00 H new ATOM 0 HA HIS A 4 16.968 -12.832 10.829 1.00 0.00 H new ATOM 0 HB2 HIS A 4 19.224 -11.681 11.202 1.00 0.00 H new ATOM 0 HB3 HIS A 4 18.144 -11.813 12.576 1.00 0.00 H new ATOM 0 HD2 HIS A 4 20.783 -14.512 11.394 1.00 0.00 H new ATOM 0 HE1 HIS A 4 21.731 -13.310 15.360 1.00 0.00 H new ATOM 0 HE2 HIS A 4 22.287 -15.014 13.515 1.00 0.00 H new ATOM 73 N PRO A 5 18.595 -12.938 8.765 1.00 0.00 N ATOM 74 CA PRO A 5 19.345 -13.223 7.546 1.00 0.00 C ATOM 75 C PRO A 5 20.864 -13.155 7.746 1.00 0.00 C ATOM 76 O PRO A 5 21.599 -13.544 6.844 1.00 0.00 O ATOM 77 CB PRO A 5 18.864 -12.195 6.527 1.00 0.00 C ATOM 78 CG PRO A 5 18.477 -11.001 7.394 1.00 0.00 C ATOM 79 CD PRO A 5 17.923 -11.649 8.661 1.00 0.00 C ATOM 0 HA PRO A 5 19.165 -14.245 7.213 1.00 0.00 H new ATOM 0 HB2 PRO A 5 19.647 -11.938 5.814 1.00 0.00 H new ATOM 0 HB3 PRO A 5 18.017 -12.566 5.950 1.00 0.00 H new ATOM 0 HG2 PRO A 5 19.336 -10.366 7.610 1.00 0.00 H new ATOM 0 HG3 PRO A 5 17.732 -10.374 6.905 1.00 0.00 H new ATOM 0 HD2 PRO A 5 18.122 -11.031 9.537 1.00 0.00 H new ATOM 0 HD3 PRO A 5 16.842 -11.774 8.597 1.00 0.00 H new ATOM 87 N ASP A 6 21.306 -12.710 8.930 1.00 0.00 N ATOM 88 CA ASP A 6 22.680 -12.649 9.410 1.00 0.00 C ATOM 89 C ASP A 6 23.475 -11.511 8.749 1.00 0.00 C ATOM 90 O ASP A 6 23.058 -10.908 7.756 1.00 0.00 O ATOM 91 CB ASP A 6 23.357 -14.034 9.337 1.00 0.00 C ATOM 92 CG ASP A 6 24.801 -13.956 9.805 1.00 0.00 C ATOM 93 OD1 ASP A 6 25.006 -13.553 10.972 1.00 0.00 O ATOM 94 OD2 ASP A 6 25.695 -14.153 8.955 1.00 0.00 O ATOM 0 H ASP A 6 20.653 -12.356 9.629 1.00 0.00 H new ATOM 0 HA ASP A 6 22.664 -12.388 10.468 1.00 0.00 H new ATOM 0 HB2 ASP A 6 22.808 -14.745 9.955 1.00 0.00 H new ATOM 0 HB3 ASP A 6 23.322 -14.407 8.314 1.00 0.00 H new ATOM 99 N SER A 7 24.602 -11.168 9.377 1.00 0.00 N ATOM 100 CA SER A 7 25.626 -10.228 8.935 1.00 0.00 C ATOM 101 C SER A 7 25.132 -8.792 8.714 1.00 0.00 C ATOM 102 O SER A 7 25.867 -7.945 8.202 1.00 0.00 O ATOM 103 CB SER A 7 26.344 -10.810 7.713 1.00 0.00 C ATOM 104 OG SER A 7 27.070 -11.978 8.070 1.00 0.00 O ATOM 0 H SER A 7 24.838 -11.576 10.282 1.00 0.00 H new ATOM 0 HA SER A 7 26.337 -10.115 9.753 1.00 0.00 H new ATOM 0 HB2 SER A 7 25.617 -11.050 6.937 1.00 0.00 H new ATOM 0 HB3 SER A 7 27.023 -10.067 7.295 1.00 0.00 H new ATOM 0 HG SER A 7 26.443 -12.702 8.277 1.00 0.00 H new ATOM 110 N GLU A 8 23.917 -8.481 9.150 1.00 0.00 N ATOM 111 CA GLU A 8 23.196 -7.258 8.880 1.00 0.00 C ATOM 112 C GLU A 8 23.507 -6.211 9.946 1.00 0.00 C ATOM 113 O GLU A 8 22.634 -5.696 10.649 1.00 0.00 O ATOM 114 CB GLU A 8 21.696 -7.527 8.780 1.00 0.00 C ATOM 115 CG GLU A 8 21.074 -8.468 9.823 1.00 0.00 C ATOM 116 CD GLU A 8 19.534 -8.454 9.745 1.00 0.00 C ATOM 117 OE1 GLU A 8 18.958 -7.984 8.729 1.00 0.00 O ATOM 118 OE2 GLU A 8 18.883 -8.890 10.717 1.00 0.00 O ATOM 0 H GLU A 8 23.382 -9.121 9.737 1.00 0.00 H new ATOM 0 HA GLU A 8 23.524 -6.863 7.918 1.00 0.00 H new ATOM 0 HB2 GLU A 8 21.178 -6.570 8.839 1.00 0.00 H new ATOM 0 HB3 GLU A 8 21.493 -7.939 7.792 1.00 0.00 H new ATOM 0 HG2 GLU A 8 21.439 -9.483 9.663 1.00 0.00 H new ATOM 0 HG3 GLU A 8 21.392 -8.168 10.822 1.00 0.00 H new ATOM 125 N ALA A 9 24.786 -5.900 10.065 1.00 0.00 N ATOM 126 CA ALA A 9 25.289 -4.896 10.973 1.00 0.00 C ATOM 127 C ALA A 9 24.971 -3.497 10.431 1.00 0.00 C ATOM 128 O ALA A 9 25.803 -2.814 9.832 1.00 0.00 O ATOM 129 CB ALA A 9 26.786 -5.109 11.237 1.00 0.00 C ATOM 0 H ALA A 9 25.518 -6.353 9.517 1.00 0.00 H new ATOM 0 HA ALA A 9 24.790 -4.989 11.937 1.00 0.00 H new ATOM 0 HB1 ALA A 9 27.147 -4.343 11.923 1.00 0.00 H new ATOM 0 HB2 ALA A 9 26.941 -6.094 11.678 1.00 0.00 H new ATOM 0 HB3 ALA A 9 27.334 -5.042 10.297 1.00 0.00 H new ATOM 135 N VAL A 10 23.727 -3.099 10.669 1.00 0.00 N ATOM 136 CA VAL A 10 23.153 -1.775 10.430 1.00 0.00 C ATOM 137 C VAL A 10 23.327 -1.372 8.956 1.00 0.00 C ATOM 138 O VAL A 10 23.815 -0.288 8.605 1.00 0.00 O ATOM 139 CB VAL A 10 23.679 -0.758 11.475 1.00 0.00 C ATOM 140 CG1 VAL A 10 22.815 0.512 11.507 1.00 0.00 C ATOM 141 CG2 VAL A 10 23.673 -1.326 12.910 1.00 0.00 C ATOM 0 H VAL A 10 23.039 -3.740 11.064 1.00 0.00 H new ATOM 0 HA VAL A 10 22.074 -1.792 10.584 1.00 0.00 H new ATOM 0 HB VAL A 10 24.700 -0.535 11.163 1.00 0.00 H new ATOM 0 HG11 VAL A 10 23.212 1.203 12.250 1.00 0.00 H new ATOM 0 HG12 VAL A 10 22.829 0.987 10.526 1.00 0.00 H new ATOM 0 HG13 VAL A 10 21.790 0.248 11.768 1.00 0.00 H new ATOM 0 HG21 VAL A 10 24.051 -0.573 13.601 1.00 0.00 H new ATOM 0 HG22 VAL A 10 22.655 -1.597 13.190 1.00 0.00 H new ATOM 0 HG23 VAL A 10 24.309 -2.210 12.954 1.00 0.00 H new ATOM 151 N ALA A 11 22.907 -2.270 8.067 1.00 0.00 N ATOM 152 CA ALA A 11 22.843 -2.008 6.640 1.00 0.00 C ATOM 153 C ALA A 11 21.791 -0.924 6.360 1.00 0.00 C ATOM 154 O ALA A 11 20.770 -0.867 7.057 1.00 0.00 O ATOM 155 CB ALA A 11 22.542 -3.312 5.902 1.00 0.00 C ATOM 0 H ALA A 11 22.600 -3.208 8.325 1.00 0.00 H new ATOM 0 HA ALA A 11 23.800 -1.633 6.277 1.00 0.00 H new ATOM 0 HB1 ALA A 11 22.493 -3.120 4.830 1.00 0.00 H new ATOM 0 HB2 ALA A 11 23.331 -4.036 6.106 1.00 0.00 H new ATOM 0 HB3 ALA A 11 21.587 -3.711 6.243 1.00 0.00 H new ATOM 161 N PRO A 12 22.013 -0.047 5.369 1.00 0.00 N ATOM 162 CA PRO A 12 21.121 1.065 5.083 1.00 0.00 C ATOM 163 C PRO A 12 19.838 0.541 4.436 1.00 0.00 C ATOM 164 O PRO A 12 19.853 -0.484 3.752 1.00 0.00 O ATOM 165 CB PRO A 12 21.919 1.980 4.150 1.00 0.00 C ATOM 166 CG PRO A 12 22.790 0.991 3.376 1.00 0.00 C ATOM 167 CD PRO A 12 23.088 -0.102 4.395 1.00 0.00 C ATOM 0 HA PRO A 12 20.806 1.608 5.974 1.00 0.00 H new ATOM 0 HB2 PRO A 12 21.268 2.551 3.488 1.00 0.00 H new ATOM 0 HB3 PRO A 12 22.520 2.700 4.705 1.00 0.00 H new ATOM 0 HG2 PRO A 12 22.268 0.595 2.505 1.00 0.00 H new ATOM 0 HG3 PRO A 12 23.704 1.461 3.014 1.00 0.00 H new ATOM 0 HD2 PRO A 12 23.131 -1.080 3.916 1.00 0.00 H new ATOM 0 HD3 PRO A 12 24.055 0.062 4.871 1.00 0.00 H new ATOM 175 N ASP A 13 18.731 1.250 4.634 1.00 0.00 N ATOM 176 CA ASP A 13 17.438 0.894 4.051 1.00 0.00 C ATOM 177 C ASP A 13 17.284 1.661 2.733 1.00 0.00 C ATOM 178 O ASP A 13 17.778 2.793 2.625 1.00 0.00 O ATOM 179 CB ASP A 13 16.322 1.260 5.052 1.00 0.00 C ATOM 180 CG ASP A 13 15.036 0.447 4.868 1.00 0.00 C ATOM 181 OD1 ASP A 13 15.155 -0.784 4.655 1.00 0.00 O ATOM 182 OD2 ASP A 13 13.927 0.980 5.093 1.00 0.00 O ATOM 0 H ASP A 13 18.704 2.093 5.207 1.00 0.00 H new ATOM 0 HA ASP A 13 17.372 -0.175 3.847 1.00 0.00 H new ATOM 0 HB2 ASP A 13 16.693 1.111 6.066 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.089 2.320 4.950 1.00 0.00 H new ATOM 187 N PRO A 14 16.654 1.092 1.695 1.00 0.00 N ATOM 188 CA PRO A 14 16.172 1.844 0.539 1.00 0.00 C ATOM 189 C PRO A 14 15.037 2.802 0.952 1.00 0.00 C ATOM 190 O PRO A 14 14.689 2.889 2.129 1.00 0.00 O ATOM 191 CB PRO A 14 15.750 0.775 -0.482 1.00 0.00 C ATOM 192 CG PRO A 14 15.462 -0.465 0.367 1.00 0.00 C ATOM 193 CD PRO A 14 16.415 -0.329 1.536 1.00 0.00 C ATOM 0 HA PRO A 14 16.927 2.497 0.101 1.00 0.00 H new ATOM 0 HB2 PRO A 14 14.869 1.086 -1.043 1.00 0.00 H new ATOM 0 HB3 PRO A 14 16.540 0.585 -1.209 1.00 0.00 H new ATOM 0 HG2 PRO A 14 14.424 -0.491 0.698 1.00 0.00 H new ATOM 0 HG3 PRO A 14 15.642 -1.383 -0.192 1.00 0.00 H new ATOM 0 HD2 PRO A 14 15.984 -0.756 2.442 1.00 0.00 H new ATOM 0 HD3 PRO A 14 17.346 -0.862 1.344 1.00 0.00 H new ATOM 201 N PHE A 15 14.455 3.513 -0.023 1.00 0.00 N ATOM 202 CA PHE A 15 13.328 4.434 0.124 1.00 0.00 C ATOM 203 C PHE A 15 13.673 5.658 0.974 1.00 0.00 C ATOM 204 O PHE A 15 14.725 5.727 1.615 1.00 0.00 O ATOM 205 CB PHE A 15 12.109 3.673 0.637 1.00 0.00 C ATOM 206 CG PHE A 15 11.744 2.440 -0.172 1.00 0.00 C ATOM 207 CD1 PHE A 15 11.026 2.562 -1.375 1.00 0.00 C ATOM 208 CD2 PHE A 15 12.125 1.162 0.276 1.00 0.00 C ATOM 209 CE1 PHE A 15 10.675 1.423 -2.118 1.00 0.00 C ATOM 210 CE2 PHE A 15 11.804 0.024 -0.483 1.00 0.00 C ATOM 211 CZ PHE A 15 11.070 0.152 -1.674 1.00 0.00 C ATOM 0 H PHE A 15 14.779 3.455 -0.989 1.00 0.00 H new ATOM 0 HA PHE A 15 13.084 4.841 -0.857 1.00 0.00 H new ATOM 0 HB2 PHE A 15 12.293 3.373 1.669 1.00 0.00 H new ATOM 0 HB3 PHE A 15 11.254 4.349 0.649 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.742 3.541 -1.731 1.00 0.00 H new ATOM 0 HD2 PHE A 15 12.665 1.055 1.205 1.00 0.00 H new ATOM 0 HE1 PHE A 15 10.103 1.525 -3.028 1.00 0.00 H new ATOM 0 HE2 PHE A 15 12.123 -0.953 -0.150 1.00 0.00 H new ATOM 0 HZ PHE A 15 10.810 -0.726 -2.247 1.00 0.00 H new ATOM 221 N ASN A 16 12.801 6.669 0.943 1.00 0.00 N ATOM 222 CA ASN A 16 13.064 7.944 1.597 1.00 0.00 C ATOM 223 C ASN A 16 11.790 8.502 2.225 1.00 0.00 C ATOM 224 O ASN A 16 10.749 8.464 1.575 1.00 0.00 O ATOM 225 CB ASN A 16 13.596 8.931 0.541 1.00 0.00 C ATOM 226 CG ASN A 16 14.779 9.692 1.095 1.00 0.00 C ATOM 227 OD1 ASN A 16 15.862 9.131 1.220 1.00 0.00 O ATOM 228 ND2 ASN A 16 14.608 10.953 1.445 1.00 0.00 N ATOM 0 H ASN A 16 11.900 6.623 0.466 1.00 0.00 H new ATOM 0 HA ASN A 16 13.798 7.800 2.390 1.00 0.00 H new ATOM 0 HB2 ASN A 16 13.890 8.390 -0.359 1.00 0.00 H new ATOM 0 HB3 ASN A 16 12.808 9.627 0.252 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.388 11.486 1.830 1.00 0.00 H new ATOM 0 HD22 ASN A 16 13.696 11.395 1.330 1.00 0.00 H new ATOM 235 N PRO A 17 11.865 9.156 3.397 1.00 0.00 N ATOM 236 CA PRO A 17 10.692 9.732 4.051 1.00 0.00 C ATOM 237 C PRO A 17 10.243 11.019 3.351 1.00 0.00 C ATOM 238 O PRO A 17 9.043 11.281 3.226 1.00 0.00 O ATOM 239 CB PRO A 17 11.129 9.979 5.500 1.00 0.00 C ATOM 240 CG PRO A 17 12.640 10.149 5.409 1.00 0.00 C ATOM 241 CD PRO A 17 13.029 9.219 4.268 1.00 0.00 C ATOM 0 HA PRO A 17 9.826 9.071 4.007 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.652 10.867 5.914 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.860 9.143 6.145 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.917 11.182 5.198 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.133 9.871 6.341 1.00 0.00 H new ATOM 0 HD2 PRO A 17 13.899 9.599 3.732 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.292 8.230 4.642 1.00 0.00 H new ATOM 249 N ALA A 18 11.212 11.801 2.859 1.00 0.00 N ATOM 250 CA ALA A 18 11.032 13.013 2.075 1.00 0.00 C ATOM 251 C ALA A 18 10.553 12.631 0.673 1.00 0.00 C ATOM 252 O ALA A 18 11.312 12.632 -0.298 1.00 0.00 O ATOM 253 CB ALA A 18 12.332 13.824 2.054 1.00 0.00 C ATOM 0 H ALA A 18 12.197 11.585 3.011 1.00 0.00 H new ATOM 0 HA ALA A 18 10.272 13.651 2.526 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.187 14.729 1.465 1.00 0.00 H new ATOM 0 HB2 ALA A 18 12.608 14.095 3.073 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.127 13.225 1.610 1.00 0.00 H new ATOM 259 N ALA A 19 9.292 12.221 0.628 1.00 0.00 N ATOM 260 CA ALA A 19 8.466 11.884 -0.520 1.00 0.00 C ATOM 261 C ALA A 19 7.038 11.627 -0.019 1.00 0.00 C ATOM 262 O ALA A 19 6.079 12.049 -0.669 1.00 0.00 O ATOM 263 CB ALA A 19 9.040 10.660 -1.249 1.00 0.00 C ATOM 0 H ALA A 19 8.766 12.104 1.494 1.00 0.00 H new ATOM 0 HA ALA A 19 8.453 12.704 -1.238 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.411 10.419 -2.106 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.051 10.881 -1.591 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.066 9.810 -0.568 1.00 0.00 H new ATOM 269 N THR A 20 6.861 11.011 1.160 1.00 0.00 N ATOM 270 CA THR A 20 5.539 10.766 1.738 1.00 0.00 C ATOM 271 C THR A 20 4.805 12.077 2.051 1.00 0.00 C ATOM 272 O THR A 20 3.580 12.104 2.062 1.00 0.00 O ATOM 273 CB THR A 20 5.654 9.883 2.989 1.00 0.00 C ATOM 274 OG1 THR A 20 6.386 8.718 2.686 1.00 0.00 O ATOM 275 CG2 THR A 20 4.303 9.421 3.535 1.00 0.00 C ATOM 0 H THR A 20 7.631 10.671 1.735 1.00 0.00 H new ATOM 0 HA THR A 20 4.944 10.234 0.996 1.00 0.00 H new ATOM 0 HB THR A 20 6.144 10.502 3.740 1.00 0.00 H new ATOM 0 HG1 THR A 20 6.689 8.296 3.517 1.00 0.00 H new ATOM 0 HG21 THR A 20 4.460 8.802 4.418 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.703 10.290 3.803 1.00 0.00 H new ATOM 0 HG23 THR A 20 3.782 8.841 2.773 1.00 0.00 H new ATOM 283 N GLN A 21 5.527 13.187 2.230 1.00 0.00 N ATOM 284 CA GLN A 21 4.961 14.521 2.420 1.00 0.00 C ATOM 285 C GLN A 21 4.034 14.959 1.277 1.00 0.00 C ATOM 286 O GLN A 21 3.259 15.897 1.450 1.00 0.00 O ATOM 287 CB GLN A 21 6.107 15.518 2.632 1.00 0.00 C ATOM 288 CG GLN A 21 7.023 15.687 1.428 1.00 0.00 C ATOM 289 CD GLN A 21 8.326 16.352 1.849 1.00 0.00 C ATOM 290 OE1 GLN A 21 8.359 17.254 2.684 1.00 0.00 O ATOM 291 NE2 GLN A 21 9.422 15.908 1.277 1.00 0.00 N ATOM 0 H GLN A 21 6.547 13.180 2.247 1.00 0.00 H new ATOM 0 HA GLN A 21 4.324 14.494 3.304 1.00 0.00 H new ATOM 0 HB2 GLN A 21 5.685 16.489 2.891 1.00 0.00 H new ATOM 0 HB3 GLN A 21 6.703 15.192 3.484 1.00 0.00 H new ATOM 0 HG2 GLN A 21 7.230 14.715 0.980 1.00 0.00 H new ATOM 0 HG3 GLN A 21 6.528 16.290 0.667 1.00 0.00 H new ATOM 0 HE21 GLN A 21 9.370 15.159 0.587 1.00 0.00 H new ATOM 0 HE22 GLN A 21 10.325 16.313 1.523 1.00 0.00 H new ATOM 300 N LEU A 22 4.081 14.289 0.123 1.00 0.00 N ATOM 301 CA LEU A 22 3.322 14.640 -1.072 1.00 0.00 C ATOM 302 C LEU A 22 2.049 13.796 -1.208 1.00 0.00 C ATOM 303 O LEU A 22 1.350 13.916 -2.206 1.00 0.00 O ATOM 304 CB LEU A 22 4.242 14.517 -2.303 1.00 0.00 C ATOM 305 CG LEU A 22 5.535 15.357 -2.188 1.00 0.00 C ATOM 306 CD1 LEU A 22 6.435 15.157 -3.404 1.00 0.00 C ATOM 307 CD2 LEU A 22 5.231 16.844 -1.977 1.00 0.00 C ATOM 0 H LEU A 22 4.666 13.464 -0.006 1.00 0.00 H new ATOM 0 HA LEU A 22 2.982 15.672 -0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.509 13.470 -2.445 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.692 14.829 -3.191 1.00 0.00 H new ATOM 0 HG LEU A 22 6.069 15.001 -1.307 1.00 0.00 H new ATOM 0 HD11 LEU A 22 7.336 15.761 -3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.711 14.105 -3.484 1.00 0.00 H new ATOM 0 HD13 LEU A 22 5.902 15.462 -4.305 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.166 17.399 -1.901 1.00 0.00 H new ATOM 0 HD22 LEU A 22 4.653 17.220 -2.821 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.658 16.971 -1.059 1.00 0.00 H new ATOM 319 N LEU A 23 1.716 12.950 -0.229 1.00 0.00 N ATOM 320 CA LEU A 23 0.518 12.110 -0.190 1.00 0.00 C ATOM 321 C LEU A 23 -0.688 12.995 0.143 1.00 0.00 C ATOM 322 O LEU A 23 -1.176 13.004 1.272 1.00 0.00 O ATOM 323 CB LEU A 23 0.678 10.967 0.845 1.00 0.00 C ATOM 324 CG LEU A 23 1.424 9.691 0.425 1.00 0.00 C ATOM 325 CD1 LEU A 23 0.469 8.676 -0.198 1.00 0.00 C ATOM 326 CD2 LEU A 23 2.594 9.948 -0.525 1.00 0.00 C ATOM 0 H LEU A 23 2.303 12.827 0.596 1.00 0.00 H new ATOM 0 HA LEU A 23 0.365 11.641 -1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.190 11.378 1.715 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.320 10.674 1.171 1.00 0.00 H new ATOM 0 HG LEU A 23 1.845 9.285 1.345 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.024 7.783 -0.486 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -0.300 8.408 0.526 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -0.000 9.112 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.072 9.002 -0.778 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.227 10.423 -1.435 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.319 10.603 -0.041 1.00 0.00 H new ATOM 338 N ASP A 24 -1.143 13.775 -0.832 1.00 0.00 N ATOM 339 CA ASP A 24 -2.422 14.504 -0.761 1.00 0.00 C ATOM 340 C ASP A 24 -3.152 14.585 -2.106 1.00 0.00 C ATOM 341 O ASP A 24 -4.382 14.567 -2.127 1.00 0.00 O ATOM 342 CB ASP A 24 -2.210 15.894 -0.158 1.00 0.00 C ATOM 343 CG ASP A 24 -3.527 16.615 0.143 1.00 0.00 C ATOM 344 OD1 ASP A 24 -3.990 17.392 -0.721 1.00 0.00 O ATOM 345 OD2 ASP A 24 -4.001 16.536 1.302 1.00 0.00 O ATOM 0 H ASP A 24 -0.637 13.926 -1.704 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.075 13.928 -0.105 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.632 15.802 0.762 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.619 16.498 -0.847 1.00 0.00 H new ATOM 350 N ASP A 25 -2.419 14.581 -3.226 1.00 0.00 N ATOM 351 CA ASP A 25 -2.968 14.522 -4.593 1.00 0.00 C ATOM 352 C ASP A 25 -2.663 13.192 -5.296 1.00 0.00 C ATOM 353 O ASP A 25 -3.113 12.946 -6.418 1.00 0.00 O ATOM 354 CB ASP A 25 -2.425 15.691 -5.449 1.00 0.00 C ATOM 355 CG ASP A 25 -0.951 15.577 -5.883 1.00 0.00 C ATOM 356 OD1 ASP A 25 -0.211 14.699 -5.373 1.00 0.00 O ATOM 357 OD2 ASP A 25 -0.461 16.452 -6.630 1.00 0.00 O ATOM 0 H ASP A 25 -1.400 14.620 -3.210 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.050 14.605 -4.494 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -3.042 15.778 -6.344 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -2.548 16.616 -4.886 1.00 0.00 H new ATOM 362 N THR A 26 -1.872 12.328 -4.662 1.00 0.00 N ATOM 363 CA THR A 26 -1.452 11.036 -5.196 1.00 0.00 C ATOM 364 C THR A 26 -2.628 10.046 -5.219 1.00 0.00 C ATOM 365 O THR A 26 -3.688 10.342 -4.681 1.00 0.00 O ATOM 366 CB THR A 26 -0.290 10.523 -4.344 1.00 0.00 C ATOM 367 OG1 THR A 26 -0.710 10.422 -3.002 1.00 0.00 O ATOM 368 CG2 THR A 26 0.956 11.404 -4.368 1.00 0.00 C ATOM 0 H THR A 26 -1.494 12.515 -3.733 1.00 0.00 H new ATOM 0 HA THR A 26 -1.119 11.143 -6.228 1.00 0.00 H new ATOM 0 HB THR A 26 -0.014 9.562 -4.777 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.624 10.765 -2.919 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.726 10.962 -3.736 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.326 11.483 -5.390 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.707 12.397 -3.995 1.00 0.00 H new ATOM 376 N SER A 27 -2.451 8.834 -5.751 1.00 0.00 N ATOM 377 CA SER A 27 -3.540 7.859 -5.794 1.00 0.00 C ATOM 378 C SER A 27 -3.035 6.478 -5.442 1.00 0.00 C ATOM 379 O SER A 27 -3.378 5.978 -4.380 1.00 0.00 O ATOM 380 CB SER A 27 -4.172 7.884 -7.177 1.00 0.00 C ATOM 381 OG SER A 27 -5.573 7.770 -7.206 1.00 0.00 O ATOM 0 H SER A 27 -1.573 8.508 -6.154 1.00 0.00 H new ATOM 0 HA SER A 27 -4.297 8.122 -5.055 1.00 0.00 H new ATOM 0 HB2 SER A 27 -3.891 8.815 -7.669 1.00 0.00 H new ATOM 0 HB3 SER A 27 -3.747 7.071 -7.766 1.00 0.00 H new ATOM 0 HG SER A 27 -5.843 6.944 -6.753 1.00 0.00 H new ATOM 387 N TRP A 28 -2.154 5.934 -6.286 1.00 0.00 N ATOM 388 CA TRP A 28 -1.539 4.624 -6.151 1.00 0.00 C ATOM 389 C TRP A 28 -2.537 3.475 -6.324 1.00 0.00 C ATOM 390 O TRP A 28 -3.752 3.643 -6.267 1.00 0.00 O ATOM 391 CB TRP A 28 -0.774 4.513 -4.819 1.00 0.00 C ATOM 392 CG TRP A 28 -0.030 5.726 -4.332 1.00 0.00 C ATOM 393 CD1 TRP A 28 -0.540 6.746 -3.604 1.00 0.00 C ATOM 394 CD2 TRP A 28 1.372 6.056 -4.502 1.00 0.00 C ATOM 395 NE1 TRP A 28 0.461 7.615 -3.242 1.00 0.00 N ATOM 396 CE2 TRP A 28 1.674 7.219 -3.744 1.00 0.00 C ATOM 397 CE3 TRP A 28 2.424 5.477 -5.221 1.00 0.00 C ATOM 398 CZ2 TRP A 28 2.970 7.734 -3.645 1.00 0.00 C ATOM 399 CZ3 TRP A 28 3.730 5.988 -5.157 1.00 0.00 C ATOM 400 CH2 TRP A 28 4.005 7.111 -4.364 1.00 0.00 C ATOM 0 H TRP A 28 -1.839 6.426 -7.122 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.823 4.526 -6.967 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.487 4.226 -4.047 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.058 3.696 -4.911 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.582 6.861 -3.345 1.00 0.00 H new ATOM 0 HE1 TRP A 28 0.320 8.449 -2.672 1.00 0.00 H new ATOM 0 HE3 TRP A 28 2.226 4.615 -5.841 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 3.173 8.596 -3.027 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.523 5.516 -5.719 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.012 7.497 -4.306 1.00 0.00 H new ATOM 411 N VAL A 29 -2.004 2.284 -6.562 1.00 0.00 N ATOM 412 CA VAL A 29 -2.755 1.047 -6.717 1.00 0.00 C ATOM 413 C VAL A 29 -1.923 -0.018 -6.010 1.00 0.00 C ATOM 414 O VAL A 29 -0.698 -0.006 -6.126 1.00 0.00 O ATOM 415 CB VAL A 29 -2.960 0.761 -8.221 1.00 0.00 C ATOM 416 CG1 VAL A 29 -3.699 -0.563 -8.468 1.00 0.00 C ATOM 417 CG2 VAL A 29 -3.691 1.900 -8.937 1.00 0.00 C ATOM 0 H VAL A 29 -0.997 2.149 -6.656 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.754 1.083 -6.283 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.957 0.679 -8.640 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.818 -0.718 -9.540 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.123 -1.386 -8.044 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.680 -0.526 -7.995 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.810 1.650 -9.991 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.672 2.043 -8.485 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.112 2.819 -8.845 1.00 0.00 H new ATOM 427 N LEU A 30 -2.550 -0.894 -5.228 1.00 0.00 N ATOM 428 CA LEU A 30 -1.862 -1.999 -4.572 1.00 0.00 C ATOM 429 C LEU A 30 -1.796 -3.161 -5.565 1.00 0.00 C ATOM 430 O LEU A 30 -2.819 -3.497 -6.176 1.00 0.00 O ATOM 431 CB LEU A 30 -2.651 -2.405 -3.327 1.00 0.00 C ATOM 432 CG LEU A 30 -2.000 -3.570 -2.571 1.00 0.00 C ATOM 433 CD1 LEU A 30 -0.679 -3.189 -1.918 1.00 0.00 C ATOM 434 CD2 LEU A 30 -2.976 -4.140 -1.538 1.00 0.00 C ATOM 0 H LEU A 30 -3.550 -0.856 -5.032 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.855 -1.714 -4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.738 -1.547 -2.660 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.663 -2.686 -3.618 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.766 -4.339 -3.307 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.267 -4.054 -1.399 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.023 -2.857 -2.683 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.845 -2.382 -1.204 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.503 -4.966 -1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.249 -3.361 -0.826 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.872 -4.499 -2.044 1.00 0.00 H new ATOM 446 N SER A 31 -0.644 -3.829 -5.690 1.00 0.00 N ATOM 447 CA SER A 31 -0.544 -4.988 -6.572 1.00 0.00 C ATOM 448 C SER A 31 0.290 -6.143 -6.003 1.00 0.00 C ATOM 449 O SER A 31 0.151 -7.259 -6.507 1.00 0.00 O ATOM 450 CB SER A 31 -0.046 -4.515 -7.947 1.00 0.00 C ATOM 451 OG SER A 31 -0.552 -5.325 -8.986 1.00 0.00 O ATOM 0 H SER A 31 0.217 -3.589 -5.199 1.00 0.00 H new ATOM 0 HA SER A 31 -1.539 -5.422 -6.672 1.00 0.00 H new ATOM 0 HB2 SER A 31 -0.350 -3.481 -8.109 1.00 0.00 H new ATOM 0 HB3 SER A 31 1.044 -4.534 -7.967 1.00 0.00 H new ATOM 0 HG SER A 31 -0.219 -4.998 -9.848 1.00 0.00 H new ATOM 457 N ALA A 32 1.061 -5.964 -4.920 1.00 0.00 N ATOM 458 CA ALA A 32 1.731 -7.085 -4.260 1.00 0.00 C ATOM 459 C ALA A 32 1.775 -6.904 -2.746 1.00 0.00 C ATOM 460 O ALA A 32 1.814 -5.784 -2.240 1.00 0.00 O ATOM 461 CB ALA A 32 3.139 -7.258 -4.829 1.00 0.00 C ATOM 0 H ALA A 32 1.233 -5.057 -4.487 1.00 0.00 H new ATOM 0 HA ALA A 32 1.155 -7.989 -4.458 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.632 -8.094 -4.333 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.077 -7.456 -5.899 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.714 -6.347 -4.661 1.00 0.00 H new ATOM 467 N TRP A 33 1.798 -8.025 -2.029 1.00 0.00 N ATOM 468 CA TRP A 33 1.764 -8.120 -0.581 1.00 0.00 C ATOM 469 C TRP A 33 2.693 -9.266 -0.192 1.00 0.00 C ATOM 470 O TRP A 33 2.354 -10.438 -0.366 1.00 0.00 O ATOM 471 CB TRP A 33 0.311 -8.358 -0.134 1.00 0.00 C ATOM 472 CG TRP A 33 0.027 -8.379 1.338 1.00 0.00 C ATOM 473 CD1 TRP A 33 0.928 -8.510 2.340 1.00 0.00 C ATOM 474 CD2 TRP A 33 -1.272 -8.261 1.996 1.00 0.00 C ATOM 475 NE1 TRP A 33 0.282 -8.503 3.553 1.00 0.00 N ATOM 476 CE2 TRP A 33 -1.073 -8.313 3.408 1.00 0.00 C ATOM 477 CE3 TRP A 33 -2.600 -8.122 1.540 1.00 0.00 C ATOM 478 CZ2 TRP A 33 -2.127 -8.201 4.324 1.00 0.00 C ATOM 479 CZ3 TRP A 33 -3.671 -8.033 2.450 1.00 0.00 C ATOM 480 CH2 TRP A 33 -3.437 -8.072 3.836 1.00 0.00 C ATOM 0 H TRP A 33 1.844 -8.942 -2.474 1.00 0.00 H new ATOM 0 HA TRP A 33 2.103 -7.208 -0.090 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.309 -7.582 -0.584 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -0.016 -9.310 -0.552 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.995 -8.606 2.206 1.00 0.00 H new ATOM 0 HE1 TRP A 33 0.750 -8.624 4.451 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -2.798 -8.083 0.479 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -1.935 -8.214 5.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -4.681 -7.934 2.080 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -4.265 -8.003 4.525 1.00 0.00 H new ATOM 491 N LYS A 34 3.908 -8.962 0.256 1.00 0.00 N ATOM 492 CA LYS A 34 4.816 -9.938 0.843 1.00 0.00 C ATOM 493 C LYS A 34 4.526 -10.034 2.333 1.00 0.00 C ATOM 494 O LYS A 34 4.308 -8.997 2.961 1.00 0.00 O ATOM 495 CB LYS A 34 6.264 -9.463 0.657 1.00 0.00 C ATOM 496 CG LYS A 34 7.185 -10.655 0.417 1.00 0.00 C ATOM 497 CD LYS A 34 7.281 -10.972 -1.082 1.00 0.00 C ATOM 498 CE LYS A 34 8.546 -10.330 -1.641 1.00 0.00 C ATOM 499 NZ LYS A 34 8.817 -10.719 -3.038 1.00 0.00 N ATOM 0 H LYS A 34 4.293 -8.018 0.220 1.00 0.00 H new ATOM 0 HA LYS A 34 4.680 -10.906 0.362 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.323 -8.774 -0.186 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.590 -8.915 1.541 1.00 0.00 H new ATOM 0 HG2 LYS A 34 8.178 -10.440 0.813 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.809 -11.526 0.955 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.304 -12.050 -1.239 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.403 -10.593 -1.605 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.454 -9.246 -1.582 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.396 -10.612 -1.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.688 -10.254 -3.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.934 -11.751 -3.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.021 -10.427 -3.640 1.00 0.00 H new ATOM 513 N GLN A 35 4.558 -11.229 2.917 1.00 0.00 N ATOM 514 CA GLN A 35 4.578 -11.329 4.365 1.00 0.00 C ATOM 515 C GLN A 35 5.969 -11.061 4.925 1.00 0.00 C ATOM 516 O GLN A 35 6.949 -11.047 4.183 1.00 0.00 O ATOM 517 CB GLN A 35 4.044 -12.658 4.889 1.00 0.00 C ATOM 518 CG GLN A 35 2.573 -12.921 4.557 1.00 0.00 C ATOM 519 CD GLN A 35 1.970 -13.966 5.496 1.00 0.00 C ATOM 520 OE1 GLN A 35 0.854 -13.797 5.987 1.00 0.00 O ATOM 521 NE2 GLN A 35 2.663 -15.062 5.766 1.00 0.00 N ATOM 0 H GLN A 35 4.570 -12.120 2.420 1.00 0.00 H new ATOM 0 HA GLN A 35 3.898 -10.554 4.719 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.648 -13.467 4.477 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.171 -12.686 5.971 1.00 0.00 H new ATOM 0 HG2 GLN A 35 2.009 -11.991 4.634 1.00 0.00 H new ATOM 0 HG3 GLN A 35 2.486 -13.263 3.526 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.587 -15.195 5.355 1.00 0.00 H new ATOM 0 HE22 GLN A 35 2.272 -15.773 6.384 1.00 0.00 H new ATOM 530 N ALA A 36 6.027 -10.931 6.250 1.00 0.00 N ATOM 531 CA ALA A 36 7.197 -10.629 7.054 1.00 0.00 C ATOM 532 C ALA A 36 8.356 -11.612 6.892 1.00 0.00 C ATOM 533 O ALA A 36 9.480 -11.233 7.218 1.00 0.00 O ATOM 534 CB ALA A 36 6.776 -10.574 8.525 1.00 0.00 C ATOM 0 H ALA A 36 5.193 -11.043 6.826 1.00 0.00 H new ATOM 0 HA ALA A 36 7.576 -9.670 6.700 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.644 -10.348 9.144 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.023 -9.798 8.659 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.361 -11.537 8.821 1.00 0.00 H new ATOM 540 N ASP A 37 8.116 -12.842 6.433 1.00 0.00 N ATOM 541 CA ASP A 37 9.185 -13.812 6.146 1.00 0.00 C ATOM 542 C ASP A 37 9.327 -14.084 4.645 1.00 0.00 C ATOM 543 O ASP A 37 10.170 -14.877 4.243 1.00 0.00 O ATOM 544 CB ASP A 37 8.988 -15.105 6.949 1.00 0.00 C ATOM 545 CG ASP A 37 10.263 -15.957 6.978 1.00 0.00 C ATOM 546 OD1 ASP A 37 11.304 -15.450 7.452 1.00 0.00 O ATOM 547 OD2 ASP A 37 10.198 -17.164 6.637 1.00 0.00 O ATOM 0 H ASP A 37 7.178 -13.197 6.249 1.00 0.00 H new ATOM 0 HA ASP A 37 10.126 -13.366 6.469 1.00 0.00 H new ATOM 0 HB2 ASP A 37 8.692 -14.858 7.969 1.00 0.00 H new ATOM 0 HB3 ASP A 37 8.174 -15.684 6.512 1.00 0.00 H new ATOM 552 N GLY A 38 8.532 -13.415 3.801 1.00 0.00 N ATOM 553 CA GLY A 38 8.684 -13.430 2.351 1.00 0.00 C ATOM 554 C GLY A 38 7.488 -14.028 1.612 1.00 0.00 C ATOM 555 O GLY A 38 7.513 -14.103 0.385 1.00 0.00 O ATOM 0 H GLY A 38 7.752 -12.839 4.118 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.842 -12.410 2.001 1.00 0.00 H new ATOM 0 HA3 GLY A 38 9.579 -13.998 2.095 1.00 0.00 H new ATOM 559 N THR A 39 6.441 -14.457 2.313 1.00 0.00 N ATOM 560 CA THR A 39 5.284 -15.129 1.739 1.00 0.00 C ATOM 561 C THR A 39 4.488 -14.153 0.857 1.00 0.00 C ATOM 562 O THR A 39 3.683 -13.379 1.373 1.00 0.00 O ATOM 563 CB THR A 39 4.417 -15.666 2.893 1.00 0.00 C ATOM 564 OG1 THR A 39 5.184 -16.168 3.974 1.00 0.00 O ATOM 565 CG2 THR A 39 3.348 -16.664 2.480 1.00 0.00 C ATOM 0 H THR A 39 6.375 -14.342 3.324 1.00 0.00 H new ATOM 0 HA THR A 39 5.601 -15.958 1.107 1.00 0.00 H new ATOM 0 HB THR A 39 3.882 -14.781 3.238 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.631 -16.767 4.517 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.790 -16.984 3.360 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.667 -16.195 1.770 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.819 -17.529 2.014 1.00 0.00 H new ATOM 573 N ALA A 40 4.704 -14.116 -0.456 1.00 0.00 N ATOM 574 CA ALA A 40 3.847 -13.339 -1.345 1.00 0.00 C ATOM 575 C ALA A 40 2.412 -13.890 -1.351 1.00 0.00 C ATOM 576 O ALA A 40 2.145 -14.967 -1.894 1.00 0.00 O ATOM 577 CB ALA A 40 4.475 -13.275 -2.729 1.00 0.00 C ATOM 0 H ALA A 40 5.461 -14.613 -0.925 1.00 0.00 H new ATOM 0 HA ALA A 40 3.767 -12.316 -0.978 1.00 0.00 H new ATOM 0 HB1 ALA A 40 3.834 -12.694 -3.393 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.454 -12.800 -2.663 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.587 -14.284 -3.125 1.00 0.00 H new ATOM 583 N ARG A 41 1.488 -13.163 -0.716 1.00 0.00 N ATOM 584 CA ARG A 41 0.068 -13.497 -0.590 1.00 0.00 C ATOM 585 C ARG A 41 -0.623 -13.468 -1.953 1.00 0.00 C ATOM 586 O ARG A 41 -0.135 -12.814 -2.879 1.00 0.00 O ATOM 587 CB ARG A 41 -0.580 -12.489 0.383 1.00 0.00 C ATOM 588 CG ARG A 41 -0.374 -12.904 1.851 1.00 0.00 C ATOM 589 CD ARG A 41 -0.535 -11.713 2.818 1.00 0.00 C ATOM 590 NE ARG A 41 -1.630 -11.892 3.787 1.00 0.00 N ATOM 591 CZ ARG A 41 -1.698 -11.473 5.059 1.00 0.00 C ATOM 592 NH1 ARG A 41 -0.700 -10.869 5.697 1.00 0.00 N ATOM 593 NH2 ARG A 41 -2.821 -11.656 5.739 1.00 0.00 N ATOM 0 H ARG A 41 1.722 -12.284 -0.254 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.042 -14.509 -0.199 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -0.152 -11.500 0.221 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.647 -12.413 0.172 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.092 -13.682 2.112 1.00 0.00 H new ATOM 0 HG3 ARG A 41 0.620 -13.335 1.970 1.00 0.00 H new ATOM 0 HD2 ARG A 41 0.399 -11.565 3.360 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.715 -10.807 2.240 1.00 0.00 H new ATOM 0 HE ARG A 41 -2.444 -12.402 3.445 1.00 0.00 H new ATOM 0 HH11 ARG A 41 0.184 -10.700 5.217 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.818 -10.575 6.667 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -3.618 -12.110 5.294 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -2.888 -11.343 6.707 1.00 0.00 H new ATOM 607 N ALA A 42 -1.775 -14.131 -2.068 1.00 0.00 N ATOM 608 CA ALA A 42 -2.635 -14.032 -3.246 1.00 0.00 C ATOM 609 C ALA A 42 -3.459 -12.763 -3.128 1.00 0.00 C ATOM 610 O ALA A 42 -4.094 -12.536 -2.099 1.00 0.00 O ATOM 611 CB ALA A 42 -3.583 -15.225 -3.337 1.00 0.00 C ATOM 0 H ALA A 42 -2.138 -14.753 -1.345 1.00 0.00 H new ATOM 0 HA ALA A 42 -2.011 -14.018 -4.139 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.210 -15.124 -4.223 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.004 -16.146 -3.405 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -4.213 -15.258 -2.448 1.00 0.00 H new ATOM 617 N VAL A 43 -3.464 -11.942 -4.172 1.00 0.00 N ATOM 618 CA VAL A 43 -4.130 -10.649 -4.182 1.00 0.00 C ATOM 619 C VAL A 43 -4.856 -10.467 -5.522 1.00 0.00 C ATOM 620 O VAL A 43 -4.561 -11.209 -6.466 1.00 0.00 O ATOM 621 CB VAL A 43 -3.100 -9.542 -3.909 1.00 0.00 C ATOM 622 CG1 VAL A 43 -2.375 -9.734 -2.562 1.00 0.00 C ATOM 623 CG2 VAL A 43 -2.041 -9.379 -5.009 1.00 0.00 C ATOM 0 H VAL A 43 -2.996 -12.163 -5.051 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.880 -10.592 -3.394 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.702 -8.634 -3.884 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.658 -8.926 -2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.104 -9.723 -1.752 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.850 -10.689 -2.564 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.354 -8.577 -4.737 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.486 -10.310 -5.120 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.530 -9.133 -5.952 1.00 0.00 H new ATOM 633 N PRO A 44 -5.783 -9.505 -5.651 1.00 0.00 N ATOM 634 CA PRO A 44 -6.340 -9.143 -6.942 1.00 0.00 C ATOM 635 C PRO A 44 -5.336 -8.296 -7.743 1.00 0.00 C ATOM 636 O PRO A 44 -5.024 -7.154 -7.367 1.00 0.00 O ATOM 637 CB PRO A 44 -7.640 -8.404 -6.636 1.00 0.00 C ATOM 638 CG PRO A 44 -7.386 -7.778 -5.266 1.00 0.00 C ATOM 639 CD PRO A 44 -6.446 -8.775 -4.580 1.00 0.00 C ATOM 0 HA PRO A 44 -6.544 -10.010 -7.570 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -7.857 -7.646 -7.389 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.492 -9.084 -6.614 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -6.929 -6.792 -5.355 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -8.312 -7.651 -4.706 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.720 -8.258 -3.953 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -7.002 -9.453 -3.932 1.00 0.00 H new ATOM 647 N SER A 45 -4.827 -8.852 -8.845 1.00 0.00 N ATOM 648 CA SER A 45 -4.178 -8.109 -9.905 1.00 0.00 C ATOM 649 C SER A 45 -5.186 -7.167 -10.590 1.00 0.00 C ATOM 650 O SER A 45 -6.380 -7.180 -10.271 1.00 0.00 O ATOM 651 CB SER A 45 -3.550 -9.154 -10.844 1.00 0.00 C ATOM 652 OG SER A 45 -4.352 -9.509 -11.946 1.00 0.00 O ATOM 0 H SER A 45 -4.860 -9.856 -9.020 1.00 0.00 H new ATOM 0 HA SER A 45 -3.390 -7.451 -9.539 1.00 0.00 H new ATOM 0 HB2 SER A 45 -2.600 -8.768 -11.212 1.00 0.00 H new ATOM 0 HB3 SER A 45 -3.327 -10.053 -10.269 1.00 0.00 H new ATOM 0 HG SER A 45 -3.813 -9.484 -12.764 1.00 0.00 H new ATOM 658 N ALA A 46 -4.736 -6.378 -11.569 1.00 0.00 N ATOM 659 CA ALA A 46 -5.656 -5.686 -12.470 1.00 0.00 C ATOM 660 C ALA A 46 -6.472 -6.696 -13.268 1.00 0.00 C ATOM 661 O ALA A 46 -7.686 -6.560 -13.436 1.00 0.00 O ATOM 662 CB ALA A 46 -4.880 -4.736 -13.386 1.00 0.00 C ATOM 0 H ALA A 46 -3.748 -6.204 -11.756 1.00 0.00 H new ATOM 0 HA ALA A 46 -6.353 -5.088 -11.883 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -5.575 -4.226 -14.053 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -4.350 -4.000 -12.782 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -4.162 -5.305 -13.976 1.00 0.00 H new ATOM 668 N ASP A 47 -5.804 -7.737 -13.745 1.00 0.00 N ATOM 669 CA ASP A 47 -6.350 -8.752 -14.631 1.00 0.00 C ATOM 670 C ASP A 47 -7.438 -9.552 -13.934 1.00 0.00 C ATOM 671 O ASP A 47 -8.428 -9.927 -14.556 1.00 0.00 O ATOM 672 CB ASP A 47 -5.257 -9.703 -15.158 1.00 0.00 C ATOM 673 CG ASP A 47 -3.914 -9.002 -15.317 1.00 0.00 C ATOM 674 OD1 ASP A 47 -3.239 -8.843 -14.269 1.00 0.00 O ATOM 675 OD2 ASP A 47 -3.647 -8.471 -16.419 1.00 0.00 O ATOM 0 H ASP A 47 -4.824 -7.903 -13.514 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.783 -8.229 -15.484 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.148 -10.544 -14.473 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -5.567 -10.113 -16.119 1.00 0.00 H new ATOM 680 N GLN A 48 -7.294 -9.726 -12.622 1.00 0.00 N ATOM 681 CA GLN A 48 -8.245 -10.383 -11.729 1.00 0.00 C ATOM 682 C GLN A 48 -9.623 -9.715 -11.707 1.00 0.00 C ATOM 683 O GLN A 48 -10.572 -10.294 -11.169 1.00 0.00 O ATOM 684 CB GLN A 48 -7.688 -10.405 -10.299 1.00 0.00 C ATOM 685 CG GLN A 48 -6.595 -11.460 -10.106 1.00 0.00 C ATOM 686 CD GLN A 48 -7.136 -12.867 -10.287 1.00 0.00 C ATOM 687 OE1 GLN A 48 -8.084 -13.277 -9.616 1.00 0.00 O ATOM 688 NE2 GLN A 48 -6.549 -13.622 -11.189 1.00 0.00 N ATOM 0 H GLN A 48 -6.466 -9.394 -12.127 1.00 0.00 H new ATOM 0 HA GLN A 48 -8.377 -11.393 -12.117 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -7.285 -9.422 -10.055 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.501 -10.598 -9.600 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.790 -11.285 -10.820 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.165 -11.361 -9.109 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -5.766 -13.255 -11.730 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.877 -14.575 -11.348 1.00 0.00 H new ATOM 697 N GLY A 49 -9.749 -8.510 -12.253 1.00 0.00 N ATOM 698 CA GLY A 49 -11.019 -7.890 -12.567 1.00 0.00 C ATOM 699 C GLY A 49 -11.284 -6.690 -11.687 1.00 0.00 C ATOM 700 O GLY A 49 -11.665 -5.637 -12.188 1.00 0.00 O ATOM 0 H GLY A 49 -8.947 -7.928 -12.493 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -11.026 -7.584 -13.613 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.821 -8.618 -12.442 1.00 0.00 H new ATOM 704 N ALA A 50 -11.035 -6.848 -10.393 1.00 0.00 N ATOM 705 CA ALA A 50 -11.310 -5.870 -9.358 1.00 0.00 C ATOM 706 C ALA A 50 -10.049 -5.678 -8.500 1.00 0.00 C ATOM 707 O ALA A 50 -9.962 -6.259 -7.416 1.00 0.00 O ATOM 708 CB ALA A 50 -12.529 -6.346 -8.570 1.00 0.00 C ATOM 0 H ALA A 50 -10.617 -7.702 -10.024 1.00 0.00 H new ATOM 0 HA ALA A 50 -11.551 -4.889 -9.768 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.758 -5.627 -7.784 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -13.384 -6.434 -9.240 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.317 -7.317 -8.123 1.00 0.00 H new ATOM 714 N PRO A 51 -9.050 -4.920 -8.983 1.00 0.00 N ATOM 715 CA PRO A 51 -7.853 -4.548 -8.231 1.00 0.00 C ATOM 716 C PRO A 51 -8.166 -3.566 -7.095 1.00 0.00 C ATOM 717 O PRO A 51 -9.106 -2.769 -7.187 1.00 0.00 O ATOM 718 CB PRO A 51 -6.925 -3.888 -9.258 1.00 0.00 C ATOM 719 CG PRO A 51 -7.890 -3.336 -10.305 1.00 0.00 C ATOM 720 CD PRO A 51 -8.991 -4.387 -10.332 1.00 0.00 C ATOM 0 HA PRO A 51 -7.406 -5.421 -7.756 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -6.326 -3.097 -8.808 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.230 -4.607 -9.692 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -8.273 -2.355 -10.025 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.412 -3.225 -11.278 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -9.945 -3.948 -10.623 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -8.767 -5.172 -11.055 1.00 0.00 H new ATOM 728 N ILE A 52 -7.312 -3.569 -6.064 1.00 0.00 N ATOM 729 CA ILE A 52 -7.339 -2.596 -4.979 1.00 0.00 C ATOM 730 C ILE A 52 -6.666 -1.306 -5.466 1.00 0.00 C ATOM 731 O ILE A 52 -5.435 -1.208 -5.467 1.00 0.00 O ATOM 732 CB ILE A 52 -6.656 -3.154 -3.701 1.00 0.00 C ATOM 733 CG1 ILE A 52 -7.179 -4.549 -3.291 1.00 0.00 C ATOM 734 CG2 ILE A 52 -6.786 -2.119 -2.570 1.00 0.00 C ATOM 735 CD1 ILE A 52 -7.088 -4.922 -1.801 1.00 0.00 C ATOM 0 H ILE A 52 -6.571 -4.263 -5.964 1.00 0.00 H new ATOM 0 HA ILE A 52 -8.372 -2.382 -4.704 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.600 -3.312 -3.918 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -8.223 -4.621 -3.595 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -6.629 -5.297 -3.861 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.309 -2.503 -1.669 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.301 -1.190 -2.870 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.841 -1.930 -2.370 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.488 -5.925 -1.652 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.046 -4.896 -1.482 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -7.665 -4.210 -1.212 1.00 0.00 H new ATOM 747 N THR A 53 -7.450 -0.304 -5.857 1.00 0.00 N ATOM 748 CA THR A 53 -6.934 1.037 -6.102 1.00 0.00 C ATOM 749 C THR A 53 -7.042 1.885 -4.825 1.00 0.00 C ATOM 750 O THR A 53 -7.921 1.656 -3.979 1.00 0.00 O ATOM 751 CB THR A 53 -7.689 1.673 -7.274 1.00 0.00 C ATOM 752 OG1 THR A 53 -9.074 1.787 -7.020 1.00 0.00 O ATOM 753 CG2 THR A 53 -7.531 0.878 -8.572 1.00 0.00 C ATOM 0 H THR A 53 -8.454 -0.399 -6.012 1.00 0.00 H new ATOM 0 HA THR A 53 -5.879 0.983 -6.371 1.00 0.00 H new ATOM 0 HB THR A 53 -7.244 2.662 -7.386 1.00 0.00 H new ATOM 0 HG1 THR A 53 -9.515 2.199 -7.792 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.085 1.371 -9.371 1.00 0.00 H new ATOM 0 HG22 THR A 53 -6.476 0.826 -8.841 1.00 0.00 H new ATOM 0 HG23 THR A 53 -7.919 -0.131 -8.430 1.00 0.00 H new ATOM 761 N LEU A 54 -6.181 2.903 -4.713 1.00 0.00 N ATOM 762 CA LEU A 54 -6.181 3.917 -3.663 1.00 0.00 C ATOM 763 C LEU A 54 -6.334 5.283 -4.360 1.00 0.00 C ATOM 764 O LEU A 54 -6.008 5.421 -5.547 1.00 0.00 O ATOM 765 CB LEU A 54 -4.872 3.737 -2.854 1.00 0.00 C ATOM 766 CG LEU A 54 -4.584 4.768 -1.742 1.00 0.00 C ATOM 767 CD1 LEU A 54 -5.475 4.577 -0.523 1.00 0.00 C ATOM 768 CD2 LEU A 54 -3.143 4.644 -1.231 1.00 0.00 C ATOM 0 H LEU A 54 -5.430 3.045 -5.388 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.001 3.834 -2.949 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.889 2.746 -2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.037 3.753 -3.554 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.770 5.739 -2.201 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.230 5.328 0.228 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.520 4.683 -0.816 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.314 3.582 -0.107 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.970 5.383 -0.449 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.985 3.644 -0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.449 4.817 -2.054 1.00 0.00 H new ATOM 780 N THR A 55 -6.854 6.293 -3.655 1.00 0.00 N ATOM 781 CA THR A 55 -6.980 7.653 -4.177 1.00 0.00 C ATOM 782 C THR A 55 -6.825 8.655 -3.040 1.00 0.00 C ATOM 783 O THR A 55 -7.770 8.852 -2.273 1.00 0.00 O ATOM 784 CB THR A 55 -8.302 7.875 -4.934 1.00 0.00 C ATOM 785 OG1 THR A 55 -8.592 6.827 -5.840 1.00 0.00 O ATOM 786 CG2 THR A 55 -8.206 9.195 -5.712 1.00 0.00 C ATOM 0 H THR A 55 -7.200 6.187 -2.702 1.00 0.00 H new ATOM 0 HA THR A 55 -6.182 7.805 -4.904 1.00 0.00 H new ATOM 0 HB THR A 55 -9.106 7.903 -4.199 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.440 7.013 -6.294 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.136 9.366 -6.254 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.035 10.016 -5.016 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.378 9.141 -6.419 1.00 0.00 H new ATOM 794 N LEU A 56 -5.655 9.267 -2.854 1.00 0.00 N ATOM 795 CA LEU A 56 -5.570 10.331 -1.852 1.00 0.00 C ATOM 796 C LEU A 56 -6.205 11.580 -2.450 1.00 0.00 C ATOM 797 O LEU A 56 -5.842 11.989 -3.551 1.00 0.00 O ATOM 798 CB LEU A 56 -4.137 10.610 -1.385 1.00 0.00 C ATOM 799 CG LEU A 56 -3.448 9.451 -0.643 1.00 0.00 C ATOM 800 CD1 LEU A 56 -4.267 8.888 0.531 1.00 0.00 C ATOM 801 CD2 LEU A 56 -3.016 8.306 -1.559 1.00 0.00 C ATOM 0 H LEU A 56 -4.792 9.059 -3.356 1.00 0.00 H new ATOM 0 HA LEU A 56 -6.103 10.012 -0.957 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.534 10.872 -2.254 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -4.149 11.482 -0.731 1.00 0.00 H new ATOM 0 HG LEU A 56 -2.551 9.916 -0.234 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.715 8.075 1.003 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -4.446 9.677 1.261 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -5.221 8.512 0.162 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.538 7.526 -0.966 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.890 7.894 -2.064 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.311 8.680 -2.302 1.00 0.00 H new ATOM 813 N SER A 57 -7.184 12.155 -1.754 1.00 0.00 N ATOM 814 CA SER A 57 -7.807 13.396 -2.176 1.00 0.00 C ATOM 815 C SER A 57 -8.443 14.086 -0.954 1.00 0.00 C ATOM 816 O SER A 57 -8.130 13.750 0.196 1.00 0.00 O ATOM 817 CB SER A 57 -8.808 13.099 -3.313 1.00 0.00 C ATOM 818 OG SER A 57 -8.700 14.026 -4.385 1.00 0.00 O ATOM 0 H SER A 57 -7.562 11.772 -0.887 1.00 0.00 H new ATOM 0 HA SER A 57 -7.073 14.093 -2.580 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.637 12.090 -3.690 1.00 0.00 H new ATOM 0 HB3 SER A 57 -9.823 13.123 -2.916 1.00 0.00 H new ATOM 0 HG SER A 57 -9.351 13.798 -5.081 1.00 0.00 H new ATOM 824 N THR A 58 -9.319 15.054 -1.221 1.00 0.00 N ATOM 825 CA THR A 58 -9.925 16.014 -0.306 1.00 0.00 C ATOM 826 C THR A 58 -11.419 16.213 -0.636 1.00 0.00 C ATOM 827 O THR A 58 -11.979 17.274 -0.354 1.00 0.00 O ATOM 828 CB THR A 58 -9.109 17.325 -0.401 1.00 0.00 C ATOM 829 OG1 THR A 58 -8.896 17.694 -1.759 1.00 0.00 O ATOM 830 CG2 THR A 58 -7.734 17.183 0.260 1.00 0.00 C ATOM 0 H THR A 58 -9.652 15.197 -2.174 1.00 0.00 H new ATOM 0 HA THR A 58 -9.896 15.652 0.722 1.00 0.00 H new ATOM 0 HB THR A 58 -9.691 18.088 0.116 1.00 0.00 H new ATOM 0 HG1 THR A 58 -8.380 18.526 -1.795 1.00 0.00 H new ATOM 0 HG21 THR A 58 -7.190 18.123 0.173 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.861 16.933 1.313 1.00 0.00 H new ATOM 0 HG23 THR A 58 -7.172 16.392 -0.236 1.00 0.00 H new ATOM 838 N SER A 59 -12.071 15.234 -1.280 1.00 0.00 N ATOM 839 CA SER A 59 -13.394 15.359 -1.896 1.00 0.00 C ATOM 840 C SER A 59 -14.571 15.536 -0.922 1.00 0.00 C ATOM 841 O SER A 59 -15.710 15.624 -1.381 1.00 0.00 O ATOM 842 CB SER A 59 -13.608 14.168 -2.833 1.00 0.00 C ATOM 843 OG SER A 59 -13.587 12.947 -2.130 1.00 0.00 O ATOM 0 H SER A 59 -11.674 14.301 -1.388 1.00 0.00 H new ATOM 0 HA SER A 59 -13.392 16.298 -2.450 1.00 0.00 H new ATOM 0 HB2 SER A 59 -14.563 14.276 -3.348 1.00 0.00 H new ATOM 0 HB3 SER A 59 -12.832 14.162 -3.598 1.00 0.00 H new ATOM 0 HG SER A 59 -13.728 12.207 -2.756 1.00 0.00 H new ATOM 849 N THR A 60 -14.329 15.574 0.389 1.00 0.00 N ATOM 850 CA THR A 60 -15.298 15.910 1.432 1.00 0.00 C ATOM 851 C THR A 60 -14.871 17.178 2.191 1.00 0.00 C ATOM 852 O THR A 60 -15.549 17.589 3.137 1.00 0.00 O ATOM 853 CB THR A 60 -15.517 14.715 2.381 1.00 0.00 C ATOM 854 OG1 THR A 60 -14.334 14.343 3.072 1.00 0.00 O ATOM 855 CG2 THR A 60 -16.039 13.470 1.657 1.00 0.00 C ATOM 0 H THR A 60 -13.407 15.361 0.770 1.00 0.00 H new ATOM 0 HA THR A 60 -16.255 16.127 0.957 1.00 0.00 H new ATOM 0 HB THR A 60 -16.265 15.068 3.090 1.00 0.00 H new ATOM 0 HG1 THR A 60 -14.524 13.583 3.661 1.00 0.00 H new ATOM 0 HG21 THR A 60 -16.174 12.661 2.375 1.00 0.00 H new ATOM 0 HG22 THR A 60 -16.994 13.698 1.183 1.00 0.00 H new ATOM 0 HG23 THR A 60 -15.321 13.164 0.896 1.00 0.00 H new ATOM 863 N GLY A 61 -13.750 17.790 1.798 1.00 0.00 N ATOM 864 CA GLY A 61 -13.120 18.951 2.401 1.00 0.00 C ATOM 865 C GLY A 61 -11.809 18.559 3.077 1.00 0.00 C ATOM 866 O GLY A 61 -10.781 19.207 2.863 1.00 0.00 O ATOM 0 H GLY A 61 -13.226 17.456 0.989 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.931 19.706 1.638 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.793 19.398 3.132 1.00 0.00 H new ATOM 870 N GLN A 62 -11.835 17.498 3.883 1.00 0.00 N ATOM 871 CA GLN A 62 -10.768 17.089 4.786 1.00 0.00 C ATOM 872 C GLN A 62 -9.871 16.076 4.076 1.00 0.00 C ATOM 873 O GLN A 62 -10.227 15.579 3.014 1.00 0.00 O ATOM 874 CB GLN A 62 -11.370 16.469 6.057 1.00 0.00 C ATOM 875 CG GLN A 62 -12.265 17.434 6.855 1.00 0.00 C ATOM 876 CD GLN A 62 -13.622 17.747 6.210 1.00 0.00 C ATOM 877 OE1 GLN A 62 -14.039 18.898 6.137 1.00 0.00 O ATOM 878 NE2 GLN A 62 -14.337 16.756 5.696 1.00 0.00 N ATOM 0 H GLN A 62 -12.640 16.873 3.923 1.00 0.00 H new ATOM 0 HA GLN A 62 -10.174 17.957 5.071 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.954 15.591 5.780 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.561 16.123 6.700 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -12.439 17.010 7.844 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -11.725 18.370 7.000 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -13.995 15.797 5.754 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -15.229 16.953 5.243 1.00 0.00 H new ATOM 887 N ARG A 63 -8.727 15.718 4.662 1.00 0.00 N ATOM 888 CA ARG A 63 -7.882 14.663 4.107 1.00 0.00 C ATOM 889 C ARG A 63 -8.548 13.315 4.370 1.00 0.00 C ATOM 890 O ARG A 63 -8.517 12.815 5.500 1.00 0.00 O ATOM 891 CB ARG A 63 -6.432 14.769 4.606 1.00 0.00 C ATOM 892 CG ARG A 63 -6.189 14.528 6.105 1.00 0.00 C ATOM 893 CD ARG A 63 -4.807 15.002 6.573 1.00 0.00 C ATOM 894 NE ARG A 63 -3.744 14.646 5.615 1.00 0.00 N ATOM 895 CZ ARG A 63 -2.642 15.373 5.409 1.00 0.00 C ATOM 896 NH1 ARG A 63 -2.215 16.233 6.332 1.00 0.00 N ATOM 897 NH2 ARG A 63 -1.961 15.226 4.283 1.00 0.00 N ATOM 0 H ARG A 63 -8.367 16.142 5.517 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.794 14.777 3.027 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.828 14.055 4.046 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.061 15.763 4.358 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.958 15.045 6.680 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.293 13.464 6.318 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.823 16.083 6.711 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.582 14.560 7.544 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.857 13.789 5.074 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.730 16.341 7.206 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -1.373 16.783 6.165 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.278 14.560 3.578 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.119 15.778 4.120 1.00 0.00 H new ATOM 911 N HIS A 64 -9.198 12.748 3.361 1.00 0.00 N ATOM 912 CA HIS A 64 -9.914 11.487 3.458 1.00 0.00 C ATOM 913 C HIS A 64 -9.360 10.547 2.393 1.00 0.00 C ATOM 914 O HIS A 64 -9.030 10.961 1.280 1.00 0.00 O ATOM 915 CB HIS A 64 -11.412 11.756 3.282 1.00 0.00 C ATOM 916 CG HIS A 64 -12.344 10.965 4.153 1.00 0.00 C ATOM 917 ND1 HIS A 64 -13.314 10.094 3.720 1.00 0.00 N ATOM 918 CD2 HIS A 64 -12.559 11.199 5.482 1.00 0.00 C ATOM 919 CE1 HIS A 64 -14.100 9.798 4.762 1.00 0.00 C ATOM 920 NE2 HIS A 64 -13.685 10.452 5.865 1.00 0.00 N ATOM 0 H HIS A 64 -9.241 13.164 2.431 1.00 0.00 H new ATOM 0 HA HIS A 64 -9.779 11.015 4.431 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -11.592 12.815 3.465 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -11.673 11.564 2.241 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.971 11.841 6.121 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.947 9.129 4.724 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -14.105 10.412 6.794 1.00 0.00 H new ATOM 928 N ALA A 65 -9.249 9.277 2.751 1.00 0.00 N ATOM 929 CA ALA A 65 -8.763 8.195 1.928 1.00 0.00 C ATOM 930 C ALA A 65 -9.976 7.351 1.552 1.00 0.00 C ATOM 931 O ALA A 65 -10.474 6.569 2.366 1.00 0.00 O ATOM 932 CB ALA A 65 -7.699 7.394 2.696 1.00 0.00 C ATOM 0 H ALA A 65 -9.514 8.961 3.684 1.00 0.00 H new ATOM 0 HA ALA A 65 -8.278 8.554 1.020 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.336 6.579 2.070 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.868 8.049 2.957 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -8.138 6.985 3.606 1.00 0.00 H new ATOM 938 N SER A 66 -10.482 7.540 0.336 1.00 0.00 N ATOM 939 CA SER A 66 -11.409 6.618 -0.295 1.00 0.00 C ATOM 940 C SER A 66 -10.647 5.905 -1.417 1.00 0.00 C ATOM 941 O SER A 66 -9.716 6.448 -2.015 1.00 0.00 O ATOM 942 CB SER A 66 -12.672 7.373 -0.741 1.00 0.00 C ATOM 943 OG SER A 66 -13.461 6.677 -1.699 1.00 0.00 O ATOM 0 H SER A 66 -10.254 8.349 -0.242 1.00 0.00 H new ATOM 0 HA SER A 66 -11.774 5.851 0.387 1.00 0.00 H new ATOM 0 HB2 SER A 66 -13.285 7.581 0.136 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.377 8.335 -1.160 1.00 0.00 H new ATOM 0 HG SER A 66 -13.757 5.823 -1.321 1.00 0.00 H new ATOM 949 N GLY A 67 -11.016 4.660 -1.679 1.00 0.00 N ATOM 950 CA GLY A 67 -10.450 3.782 -2.692 1.00 0.00 C ATOM 951 C GLY A 67 -11.469 2.674 -2.934 1.00 0.00 C ATOM 952 O GLY A 67 -12.639 2.856 -2.581 1.00 0.00 O ATOM 0 H GLY A 67 -11.766 4.208 -1.157 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -10.251 4.331 -3.612 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -9.500 3.367 -2.356 1.00 0.00 H new ATOM 956 N PHE A 68 -11.077 1.547 -3.535 1.00 0.00 N ATOM 957 CA PHE A 68 -12.036 0.515 -3.962 1.00 0.00 C ATOM 958 C PHE A 68 -12.032 -0.785 -3.135 1.00 0.00 C ATOM 959 O PHE A 68 -12.968 -1.578 -3.176 1.00 0.00 O ATOM 960 CB PHE A 68 -11.886 0.316 -5.462 1.00 0.00 C ATOM 961 CG PHE A 68 -12.894 -0.645 -6.031 1.00 0.00 C ATOM 962 CD1 PHE A 68 -14.207 -0.217 -6.312 1.00 0.00 C ATOM 963 CD2 PHE A 68 -12.523 -1.988 -6.208 1.00 0.00 C ATOM 964 CE1 PHE A 68 -15.115 -1.120 -6.883 1.00 0.00 C ATOM 965 CE2 PHE A 68 -13.460 -2.902 -6.717 1.00 0.00 C ATOM 966 CZ PHE A 68 -14.755 -2.464 -7.054 1.00 0.00 C ATOM 0 H PHE A 68 -10.103 1.323 -3.738 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.041 0.880 -3.749 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.987 1.279 -5.963 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.882 -0.050 -5.676 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -14.510 0.795 -6.090 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.525 -2.315 -5.955 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.093 -0.780 -7.191 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.188 -3.939 -6.850 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.475 -3.167 -7.446 1.00 0.00 H new ATOM 976 N SER A 69 -11.011 -0.917 -2.308 1.00 0.00 N ATOM 977 CA SER A 69 -10.607 -2.054 -1.503 1.00 0.00 C ATOM 978 C SER A 69 -10.504 -3.332 -2.343 1.00 0.00 C ATOM 979 O SER A 69 -10.412 -3.265 -3.569 1.00 0.00 O ATOM 980 CB SER A 69 -11.543 -2.212 -0.313 1.00 0.00 C ATOM 981 OG SER A 69 -11.545 -1.149 0.603 1.00 0.00 O ATOM 0 H SER A 69 -10.370 -0.136 -2.169 1.00 0.00 H new ATOM 0 HA SER A 69 -9.606 -1.868 -1.114 1.00 0.00 H new ATOM 0 HB2 SER A 69 -12.558 -2.347 -0.687 1.00 0.00 H new ATOM 0 HB3 SER A 69 -11.275 -3.125 0.218 1.00 0.00 H new ATOM 0 HG SER A 69 -11.294 -0.321 0.143 1.00 0.00 H new ATOM 987 N GLY A 70 -10.446 -4.490 -1.676 1.00 0.00 N ATOM 988 CA GLY A 70 -10.506 -5.814 -2.277 1.00 0.00 C ATOM 989 C GLY A 70 -11.696 -6.002 -3.187 1.00 0.00 C ATOM 990 O GLY A 70 -11.579 -6.733 -4.171 1.00 0.00 O ATOM 0 H GLY A 70 -10.352 -4.524 -0.661 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -9.592 -5.990 -2.844 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -10.540 -6.563 -1.486 1.00 0.00 H new ATOM 994 N CYS A 71 -12.802 -5.314 -2.898 1.00 0.00 N ATOM 995 CA CYS A 71 -13.878 -5.105 -3.837 1.00 0.00 C ATOM 996 C CYS A 71 -14.964 -4.176 -3.279 1.00 0.00 C ATOM 997 O CYS A 71 -15.990 -3.971 -3.940 1.00 0.00 O ATOM 998 CB CYS A 71 -14.504 -6.489 -4.040 1.00 0.00 C ATOM 999 SG CYS A 71 -15.538 -6.623 -5.416 1.00 0.00 S ATOM 0 H CYS A 71 -12.967 -4.884 -1.988 1.00 0.00 H new ATOM 0 HA CYS A 71 -13.494 -4.647 -4.749 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -13.704 -7.224 -4.132 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -15.074 -6.748 -3.148 1.00 0.00 H new ATOM 1004 N ASN A 72 -14.831 -3.670 -2.051 1.00 0.00 N ATOM 1005 CA ASN A 72 -15.869 -2.854 -1.430 1.00 0.00 C ATOM 1006 C ASN A 72 -15.273 -1.530 -0.976 1.00 0.00 C ATOM 1007 O ASN A 72 -14.651 -1.387 0.076 1.00 0.00 O ATOM 1008 CB ASN A 72 -16.575 -3.546 -0.263 1.00 0.00 C ATOM 1009 CG ASN A 72 -16.875 -5.036 -0.409 1.00 0.00 C ATOM 1010 OD1 ASN A 72 -17.491 -5.405 -1.517 1.00 0.00 O flip ATOM 1011 ND2 ASN A 72 -16.696 -5.869 0.474 1.00 0.00 N flip ATOM 0 H ASN A 72 -14.008 -3.814 -1.466 1.00 0.00 H new ATOM 0 HA ASN A 72 -16.634 -2.685 -2.188 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -15.963 -3.411 0.629 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -17.517 -3.028 -0.084 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -16.222 -5.603 1.337 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -17.021 -6.827 0.345 1.00 0.00 H new ATOM 1018 N ARG A 73 -15.562 -0.525 -1.778 1.00 0.00 N ATOM 1019 CA ARG A 73 -14.990 0.810 -1.682 1.00 0.00 C ATOM 1020 C ARG A 73 -15.196 1.418 -0.306 1.00 0.00 C ATOM 1021 O ARG A 73 -16.288 1.409 0.263 1.00 0.00 O ATOM 1022 CB ARG A 73 -15.420 1.728 -2.837 1.00 0.00 C ATOM 1023 CG ARG A 73 -16.919 1.765 -3.150 1.00 0.00 C ATOM 1024 CD ARG A 73 -17.588 3.114 -2.850 1.00 0.00 C ATOM 1025 NE ARG A 73 -16.914 4.216 -3.558 1.00 0.00 N ATOM 1026 CZ ARG A 73 -17.220 5.517 -3.546 1.00 0.00 C ATOM 1027 NH1 ARG A 73 -18.309 5.993 -2.947 1.00 0.00 N ATOM 1028 NH2 ARG A 73 -16.400 6.337 -4.187 1.00 0.00 N ATOM 0 H ARG A 73 -16.227 -0.616 -2.546 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.912 0.702 -1.800 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -15.093 2.742 -2.608 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.890 1.417 -3.737 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -17.066 1.525 -4.203 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -17.419 0.987 -2.573 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -18.636 3.076 -3.146 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -17.567 3.302 -1.777 1.00 0.00 H new ATOM 0 HE ARG A 73 -16.112 3.953 -4.130 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -18.949 5.357 -2.472 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -18.503 6.994 -2.963 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -15.577 5.967 -4.662 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -16.592 7.339 -4.206 1.00 0.00 H new ATOM 1042 N TYR A 74 -14.089 1.949 0.187 1.00 0.00 N ATOM 1043 CA TYR A 74 -13.815 2.340 1.559 1.00 0.00 C ATOM 1044 C TYR A 74 -13.674 3.838 1.635 1.00 0.00 C ATOM 1045 O TYR A 74 -13.569 4.512 0.608 1.00 0.00 O ATOM 1046 CB TYR A 74 -12.549 1.686 2.148 1.00 0.00 C ATOM 1047 CG TYR A 74 -11.208 2.050 1.514 1.00 0.00 C ATOM 1048 CD1 TYR A 74 -10.934 1.637 0.195 1.00 0.00 C ATOM 1049 CD2 TYR A 74 -10.181 2.666 2.270 1.00 0.00 C ATOM 1050 CE1 TYR A 74 -9.635 1.710 -0.324 1.00 0.00 C ATOM 1051 CE2 TYR A 74 -8.896 2.818 1.722 1.00 0.00 C ATOM 1052 CZ TYR A 74 -8.607 2.284 0.448 1.00 0.00 C ATOM 1053 OH TYR A 74 -7.327 2.264 0.009 1.00 0.00 O ATOM 0 H TYR A 74 -13.288 2.133 -0.417 1.00 0.00 H new ATOM 0 HA TYR A 74 -14.659 1.990 2.154 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.501 1.940 3.207 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.669 0.604 2.085 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.735 1.260 -0.423 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -10.386 3.020 3.270 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -9.423 1.328 -1.312 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.131 3.343 2.275 1.00 0.00 H new ATOM 0 HH TYR A 74 -7.317 2.278 -0.971 1.00 0.00 H new ATOM 1063 N MET A 75 -13.728 4.360 2.851 1.00 0.00 N ATOM 1064 CA MET A 75 -13.597 5.757 3.197 1.00 0.00 C ATOM 1065 C MET A 75 -13.045 5.775 4.610 1.00 0.00 C ATOM 1066 O MET A 75 -13.283 4.853 5.395 1.00 0.00 O ATOM 1067 CB MET A 75 -14.949 6.499 3.217 1.00 0.00 C ATOM 1068 CG MET A 75 -15.940 6.098 2.131 1.00 0.00 C ATOM 1069 SD MET A 75 -17.699 6.104 2.538 1.00 0.00 S ATOM 1070 CE MET A 75 -17.891 4.306 2.713 1.00 0.00 C ATOM 0 H MET A 75 -13.875 3.775 3.673 1.00 0.00 H new ATOM 0 HA MET A 75 -12.966 6.253 2.459 1.00 0.00 H new ATOM 0 HB2 MET A 75 -15.417 6.337 4.188 1.00 0.00 H new ATOM 0 HB3 MET A 75 -14.757 7.568 3.131 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.792 6.766 1.282 1.00 0.00 H new ATOM 0 HG3 MET A 75 -15.679 5.094 1.796 1.00 0.00 H new ATOM 0 HE1 MET A 75 -18.941 4.067 2.881 1.00 0.00 H new ATOM 0 HE2 MET A 75 -17.548 3.813 1.803 1.00 0.00 H new ATOM 0 HE3 MET A 75 -17.299 3.958 3.560 1.00 0.00 H new ATOM 1080 N GLY A 76 -12.406 6.875 4.955 1.00 0.00 N ATOM 1081 CA GLY A 76 -11.913 7.158 6.292 1.00 0.00 C ATOM 1082 C GLY A 76 -10.811 8.204 6.240 1.00 0.00 C ATOM 1083 O GLY A 76 -10.422 8.650 5.162 1.00 0.00 O ATOM 0 H GLY A 76 -12.208 7.623 4.291 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.730 7.512 6.920 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.534 6.243 6.748 1.00 0.00 H new ATOM 1087 N SER A 77 -10.320 8.628 7.396 1.00 0.00 N ATOM 1088 CA SER A 77 -9.359 9.725 7.496 1.00 0.00 C ATOM 1089 C SER A 77 -7.917 9.207 7.355 1.00 0.00 C ATOM 1090 O SER A 77 -7.674 8.001 7.474 1.00 0.00 O ATOM 1091 CB SER A 77 -9.596 10.441 8.830 1.00 0.00 C ATOM 1092 OG SER A 77 -10.984 10.683 9.022 1.00 0.00 O ATOM 0 H SER A 77 -10.576 8.221 8.296 1.00 0.00 H new ATOM 0 HA SER A 77 -9.502 10.435 6.682 1.00 0.00 H new ATOM 0 HB2 SER A 77 -9.209 9.835 9.649 1.00 0.00 H new ATOM 0 HB3 SER A 77 -9.050 11.384 8.846 1.00 0.00 H new ATOM 0 HG SER A 77 -11.121 11.139 9.878 1.00 0.00 H new ATOM 1098 N TYR A 78 -6.952 10.106 7.123 1.00 0.00 N ATOM 1099 CA TYR A 78 -5.518 9.792 7.105 1.00 0.00 C ATOM 1100 C TYR A 78 -4.691 10.964 7.644 1.00 0.00 C ATOM 1101 O TYR A 78 -5.262 11.980 8.049 1.00 0.00 O ATOM 1102 CB TYR A 78 -5.085 9.331 5.701 1.00 0.00 C ATOM 1103 CG TYR A 78 -4.983 10.401 4.628 1.00 0.00 C ATOM 1104 CD1 TYR A 78 -6.109 10.731 3.852 1.00 0.00 C ATOM 1105 CD2 TYR A 78 -3.743 11.009 4.352 1.00 0.00 C ATOM 1106 CE1 TYR A 78 -6.001 11.657 2.798 1.00 0.00 C ATOM 1107 CE2 TYR A 78 -3.634 11.952 3.317 1.00 0.00 C ATOM 1108 CZ TYR A 78 -4.762 12.276 2.532 1.00 0.00 C ATOM 1109 OH TYR A 78 -4.660 13.228 1.571 1.00 0.00 O ATOM 0 H TYR A 78 -7.150 11.090 6.939 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.326 8.957 7.778 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -4.114 8.844 5.788 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -5.791 8.574 5.360 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -7.062 10.271 4.067 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.874 10.749 4.938 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -6.865 11.893 2.194 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -2.686 12.430 3.121 1.00 0.00 H new ATOM 0 HH TYR A 78 -4.204 14.014 1.937 1.00 0.00 H new ATOM 1119 N ALA A 79 -3.365 10.815 7.722 1.00 0.00 N ATOM 1120 CA ALA A 79 -2.405 11.846 8.107 1.00 0.00 C ATOM 1121 C ALA A 79 -1.016 11.472 7.588 1.00 0.00 C ATOM 1122 O ALA A 79 -0.718 10.291 7.409 1.00 0.00 O ATOM 1123 CB ALA A 79 -2.337 11.929 9.635 1.00 0.00 C ATOM 0 H ALA A 79 -2.913 9.926 7.507 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.720 12.801 7.687 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.621 12.698 9.926 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.321 12.181 10.030 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -2.020 10.967 10.038 1.00 0.00 H new ATOM 1129 N LEU A 80 -0.148 12.468 7.403 1.00 0.00 N ATOM 1130 CA LEU A 80 1.249 12.313 7.012 1.00 0.00 C ATOM 1131 C LEU A 80 2.104 12.738 8.181 1.00 0.00 C ATOM 1132 O LEU A 80 1.912 13.839 8.704 1.00 0.00 O ATOM 1133 CB LEU A 80 1.571 13.225 5.821 1.00 0.00 C ATOM 1134 CG LEU A 80 1.245 12.627 4.452 1.00 0.00 C ATOM 1135 CD1 LEU A 80 -0.055 11.824 4.415 1.00 0.00 C ATOM 1136 CD2 LEU A 80 1.228 13.777 3.448 1.00 0.00 C ATOM 0 H LEU A 80 -0.413 13.445 7.528 1.00 0.00 H new ATOM 0 HA LEU A 80 1.440 11.277 6.731 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.019 14.158 5.936 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.631 13.476 5.849 1.00 0.00 H new ATOM 0 HG LEU A 80 2.012 11.895 4.199 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.213 11.434 3.409 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.009 10.995 5.120 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.889 12.470 4.689 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.998 13.390 2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.469 14.503 3.739 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.205 14.260 3.432 1.00 0.00 H new ATOM 1148 N LYS A 81 3.025 11.876 8.594 1.00 0.00 N ATOM 1149 CA LYS A 81 4.065 12.173 9.585 1.00 0.00 C ATOM 1150 C LYS A 81 5.127 11.084 9.542 1.00 0.00 C ATOM 1151 O LYS A 81 4.866 10.039 8.967 1.00 0.00 O ATOM 1152 CB LYS A 81 3.437 12.272 10.980 1.00 0.00 C ATOM 1153 CG LYS A 81 2.918 10.939 11.549 1.00 0.00 C ATOM 1154 CD LYS A 81 1.713 11.110 12.486 1.00 0.00 C ATOM 1155 CE LYS A 81 1.937 12.126 13.616 1.00 0.00 C ATOM 1156 NZ LYS A 81 1.602 13.516 13.224 1.00 0.00 N ATOM 0 H LYS A 81 3.075 10.920 8.241 1.00 0.00 H new ATOM 0 HA LYS A 81 4.536 13.129 9.354 1.00 0.00 H new ATOM 0 HB2 LYS A 81 4.177 12.681 11.668 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.610 12.981 10.942 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.639 10.283 10.724 1.00 0.00 H new ATOM 0 HG3 LYS A 81 3.724 10.444 12.091 1.00 0.00 H new ATOM 0 HD2 LYS A 81 0.850 11.422 11.898 1.00 0.00 H new ATOM 0 HD3 LYS A 81 1.467 10.143 12.925 1.00 0.00 H new ATOM 0 HE2 LYS A 81 1.332 11.842 14.477 1.00 0.00 H new ATOM 0 HE3 LYS A 81 2.979 12.085 13.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 1.263 14.039 14.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 2.449 13.983 12.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 0.858 13.502 12.497 1.00 0.00 H new ATOM 1170 N ASP A 82 6.264 11.275 10.210 1.00 0.00 N ATOM 1171 CA ASP A 82 7.288 10.254 10.471 1.00 0.00 C ATOM 1172 C ASP A 82 7.620 9.391 9.242 1.00 0.00 C ATOM 1173 O ASP A 82 7.665 8.163 9.307 1.00 0.00 O ATOM 1174 CB ASP A 82 6.867 9.428 11.696 1.00 0.00 C ATOM 1175 CG ASP A 82 7.951 8.458 12.175 1.00 0.00 C ATOM 1176 OD1 ASP A 82 9.157 8.774 12.048 1.00 0.00 O ATOM 1177 OD2 ASP A 82 7.575 7.435 12.800 1.00 0.00 O ATOM 0 H ASP A 82 6.511 12.183 10.603 1.00 0.00 H new ATOM 0 HA ASP A 82 8.229 10.757 10.694 1.00 0.00 H new ATOM 0 HB2 ASP A 82 6.609 10.105 12.511 1.00 0.00 H new ATOM 0 HB3 ASP A 82 5.966 8.864 11.453 1.00 0.00 H new ATOM 1182 N GLY A 83 7.788 10.036 8.082 1.00 0.00 N ATOM 1183 CA GLY A 83 8.068 9.378 6.807 1.00 0.00 C ATOM 1184 C GLY A 83 6.955 8.471 6.272 1.00 0.00 C ATOM 1185 O GLY A 83 7.125 7.884 5.197 1.00 0.00 O ATOM 0 H GLY A 83 7.731 11.052 8.005 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.277 10.145 6.061 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.975 8.784 6.917 1.00 0.00 H new ATOM 1189 N LYS A 84 5.828 8.353 6.976 1.00 0.00 N ATOM 1190 CA LYS A 84 4.789 7.356 6.774 1.00 0.00 C ATOM 1191 C LYS A 84 3.414 7.988 6.624 1.00 0.00 C ATOM 1192 O LYS A 84 3.224 9.203 6.737 1.00 0.00 O ATOM 1193 CB LYS A 84 4.876 6.277 7.875 1.00 0.00 C ATOM 1194 CG LYS A 84 4.514 6.702 9.304 1.00 0.00 C ATOM 1195 CD LYS A 84 5.175 5.749 10.307 1.00 0.00 C ATOM 1196 CE LYS A 84 4.724 5.982 11.755 1.00 0.00 C ATOM 1197 NZ LYS A 84 5.690 5.376 12.706 1.00 0.00 N ATOM 0 H LYS A 84 5.609 8.988 7.743 1.00 0.00 H new ATOM 0 HA LYS A 84 4.957 6.849 5.824 1.00 0.00 H new ATOM 0 HB2 LYS A 84 4.222 5.452 7.592 1.00 0.00 H new ATOM 0 HB3 LYS A 84 5.894 5.887 7.886 1.00 0.00 H new ATOM 0 HG2 LYS A 84 4.846 7.724 9.485 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.432 6.690 9.435 1.00 0.00 H new ATOM 0 HD2 LYS A 84 4.948 4.721 10.024 1.00 0.00 H new ATOM 0 HD3 LYS A 84 6.257 5.864 10.248 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.638 7.051 11.947 1.00 0.00 H new ATOM 0 HE3 LYS A 84 3.735 5.550 11.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.207 5.159 13.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 6.074 4.499 12.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 6.467 6.044 12.885 1.00 0.00 H new ATOM 1211 N LEU A 85 2.458 7.136 6.276 1.00 0.00 N ATOM 1212 CA LEU A 85 1.091 7.499 5.952 1.00 0.00 C ATOM 1213 C LEU A 85 0.248 6.792 7.002 1.00 0.00 C ATOM 1214 O LEU A 85 0.133 5.572 6.959 1.00 0.00 O ATOM 1215 CB LEU A 85 0.795 7.024 4.520 1.00 0.00 C ATOM 1216 CG LEU A 85 -0.467 7.590 3.842 1.00 0.00 C ATOM 1217 CD1 LEU A 85 -0.786 6.687 2.648 1.00 0.00 C ATOM 1218 CD2 LEU A 85 -1.705 7.713 4.732 1.00 0.00 C ATOM 0 H LEU A 85 2.625 6.132 6.210 1.00 0.00 H new ATOM 0 HA LEU A 85 0.887 8.570 5.971 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.654 7.271 3.897 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.714 5.937 4.534 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.235 8.617 3.559 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.677 7.057 2.140 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.055 6.690 1.954 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.963 5.670 2.998 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.532 8.122 4.151 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.980 6.729 5.111 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.487 8.376 5.569 1.00 0.00 H new ATOM 1230 N SER A 86 -0.241 7.512 8.001 1.00 0.00 N ATOM 1231 CA SER A 86 -1.075 6.935 9.046 1.00 0.00 C ATOM 1232 C SER A 86 -2.530 7.064 8.589 1.00 0.00 C ATOM 1233 O SER A 86 -2.877 8.004 7.870 1.00 0.00 O ATOM 1234 CB SER A 86 -0.836 7.654 10.380 1.00 0.00 C ATOM 1235 OG SER A 86 0.517 8.024 10.588 1.00 0.00 O ATOM 0 H SER A 86 -0.071 8.512 8.110 1.00 0.00 H new ATOM 0 HA SER A 86 -0.829 5.885 9.208 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.459 8.548 10.419 1.00 0.00 H new ATOM 0 HB3 SER A 86 -1.157 7.006 11.196 1.00 0.00 H new ATOM 0 HG SER A 86 0.603 8.478 11.452 1.00 0.00 H new ATOM 1241 N PHE A 87 -3.392 6.156 9.031 1.00 0.00 N ATOM 1242 CA PHE A 87 -4.810 6.139 8.660 1.00 0.00 C ATOM 1243 C PHE A 87 -5.695 6.322 9.896 1.00 0.00 C ATOM 1244 O PHE A 87 -5.194 6.526 11.002 1.00 0.00 O ATOM 1245 CB PHE A 87 -5.147 4.880 7.849 1.00 0.00 C ATOM 1246 CG PHE A 87 -4.563 4.857 6.448 1.00 0.00 C ATOM 1247 CD1 PHE A 87 -5.209 5.553 5.405 1.00 0.00 C ATOM 1248 CD2 PHE A 87 -3.386 4.131 6.176 1.00 0.00 C ATOM 1249 CE1 PHE A 87 -4.689 5.513 4.098 1.00 0.00 C ATOM 1250 CE2 PHE A 87 -2.864 4.101 4.870 1.00 0.00 C ATOM 1251 CZ PHE A 87 -3.521 4.785 3.832 1.00 0.00 C ATOM 0 H PHE A 87 -3.128 5.401 9.664 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.019 6.986 8.006 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.788 4.006 8.393 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.231 4.788 7.778 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.106 6.119 5.610 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.885 3.598 6.970 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.189 6.043 3.301 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -1.957 3.552 4.664 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.125 4.749 2.828 1.00 0.00 H new ATOM 1261 N GLY A 88 -7.014 6.324 9.713 1.00 0.00 N ATOM 1262 CA GLY A 88 -7.991 6.404 10.784 1.00 0.00 C ATOM 1263 C GLY A 88 -8.670 5.055 10.959 1.00 0.00 C ATOM 1264 O GLY A 88 -8.059 4.099 11.443 1.00 0.00 O ATOM 0 H GLY A 88 -7.439 6.268 8.787 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.503 6.700 11.713 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.733 7.169 10.556 1.00 0.00 H new ATOM 1268 N THR A 89 -9.912 4.963 10.501 1.00 0.00 N ATOM 1269 CA THR A 89 -10.799 3.843 10.759 1.00 0.00 C ATOM 1270 C THR A 89 -11.538 3.626 9.455 1.00 0.00 C ATOM 1271 O THR A 89 -12.693 4.036 9.294 1.00 0.00 O ATOM 1272 CB THR A 89 -11.742 4.147 11.943 1.00 0.00 C ATOM 1273 OG1 THR A 89 -11.037 4.726 13.018 1.00 0.00 O ATOM 1274 CG2 THR A 89 -12.433 2.877 12.450 1.00 0.00 C ATOM 0 H THR A 89 -10.339 5.687 9.924 1.00 0.00 H new ATOM 0 HA THR A 89 -10.265 2.940 11.056 1.00 0.00 H new ATOM 0 HB THR A 89 -12.492 4.846 11.572 1.00 0.00 H new ATOM 0 HG1 THR A 89 -11.657 4.910 13.754 1.00 0.00 H new ATOM 0 HG21 THR A 89 -13.089 3.128 13.283 1.00 0.00 H new ATOM 0 HG22 THR A 89 -13.021 2.437 11.645 1.00 0.00 H new ATOM 0 HG23 THR A 89 -11.681 2.162 12.783 1.00 0.00 H new ATOM 1282 N LEU A 90 -10.832 3.109 8.449 1.00 0.00 N ATOM 1283 CA LEU A 90 -11.400 2.903 7.161 1.00 0.00 C ATOM 1284 C LEU A 90 -12.533 1.893 7.220 1.00 0.00 C ATOM 1285 O LEU A 90 -12.689 1.157 8.194 1.00 0.00 O ATOM 1286 CB LEU A 90 -10.284 2.365 6.289 1.00 0.00 C ATOM 1287 CG LEU A 90 -9.003 3.201 6.328 1.00 0.00 C ATOM 1288 CD1 LEU A 90 -9.146 4.726 6.417 1.00 0.00 C ATOM 1289 CD2 LEU A 90 -7.969 2.588 7.247 1.00 0.00 C ATOM 0 H LEU A 90 -9.854 2.829 8.526 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.814 3.832 6.770 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.051 1.347 6.602 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -10.637 2.308 5.259 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.611 3.134 5.313 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.157 5.184 6.436 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -9.698 5.091 5.551 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -9.685 4.988 7.327 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.072 3.208 7.250 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.372 2.527 8.258 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.717 1.587 6.895 1.00 0.00 H new ATOM 1301 N GLY A 91 -13.286 1.840 6.138 1.00 0.00 N ATOM 1302 CA GLY A 91 -14.333 0.864 5.952 1.00 0.00 C ATOM 1303 C GLY A 91 -15.263 1.385 4.874 1.00 0.00 C ATOM 1304 O GLY A 91 -15.124 2.524 4.417 1.00 0.00 O ATOM 0 H GLY A 91 -13.183 2.485 5.354 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -13.912 -0.098 5.661 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -14.878 0.705 6.883 1.00 0.00 H new ATOM 1308 N GLY A 92 -16.185 0.552 4.427 1.00 0.00 N ATOM 1309 CA GLY A 92 -16.868 0.704 3.163 1.00 0.00 C ATOM 1310 C GLY A 92 -18.212 -0.003 3.225 1.00 0.00 C ATOM 1311 O GLY A 92 -18.802 -0.189 4.295 1.00 0.00 O ATOM 0 H GLY A 92 -16.485 -0.270 4.950 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -17.011 1.761 2.940 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -16.263 0.287 2.358 1.00 0.00 H new ATOM 1315 N THR A 93 -18.723 -0.378 2.061 1.00 0.00 N ATOM 1316 CA THR A 93 -19.825 -1.320 1.955 1.00 0.00 C ATOM 1317 C THR A 93 -19.306 -2.751 2.186 1.00 0.00 C ATOM 1318 O THR A 93 -18.111 -2.972 2.384 1.00 0.00 O ATOM 1319 CB THR A 93 -20.482 -1.130 0.577 1.00 0.00 C ATOM 1320 OG1 THR A 93 -19.527 -1.215 -0.460 1.00 0.00 O ATOM 1321 CG2 THR A 93 -21.132 0.252 0.479 1.00 0.00 C ATOM 0 H THR A 93 -18.383 -0.036 1.162 1.00 0.00 H new ATOM 0 HA THR A 93 -20.583 -1.141 2.718 1.00 0.00 H new ATOM 0 HB THR A 93 -21.226 -1.919 0.470 1.00 0.00 H new ATOM 0 HG1 THR A 93 -19.516 -0.375 -0.964 1.00 0.00 H new ATOM 0 HG21 THR A 93 -21.592 0.369 -0.502 1.00 0.00 H new ATOM 0 HG22 THR A 93 -21.895 0.351 1.251 1.00 0.00 H new ATOM 0 HG23 THR A 93 -20.373 1.022 0.618 1.00 0.00 H new ATOM 1329 N ARG A 94 -20.194 -3.747 2.117 1.00 0.00 N ATOM 1330 CA ARG A 94 -19.823 -5.151 1.959 1.00 0.00 C ATOM 1331 C ARG A 94 -20.722 -5.713 0.879 1.00 0.00 C ATOM 1332 O ARG A 94 -21.832 -6.169 1.156 1.00 0.00 O ATOM 1333 CB ARG A 94 -19.950 -5.940 3.265 1.00 0.00 C ATOM 1334 CG ARG A 94 -18.922 -5.513 4.324 1.00 0.00 C ATOM 1335 CD ARG A 94 -18.582 -6.700 5.222 1.00 0.00 C ATOM 1336 NE ARG A 94 -19.780 -7.303 5.832 1.00 0.00 N ATOM 1337 CZ ARG A 94 -20.251 -7.154 7.072 1.00 0.00 C ATOM 1338 NH1 ARG A 94 -19.611 -6.422 7.969 1.00 0.00 N ATOM 1339 NH2 ARG A 94 -21.403 -7.734 7.374 1.00 0.00 N ATOM 0 H ARG A 94 -21.201 -3.596 2.170 1.00 0.00 H new ATOM 0 HA ARG A 94 -18.773 -5.235 1.680 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -20.954 -5.808 3.667 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -19.828 -7.003 3.055 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -18.019 -5.142 3.839 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -19.322 -4.695 4.923 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -18.056 -7.455 4.638 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -17.902 -6.374 6.009 1.00 0.00 H new ATOM 0 HE ARG A 94 -20.323 -7.917 5.225 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -18.738 -5.957 7.719 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -19.990 -6.323 8.911 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -21.902 -8.275 6.668 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -21.791 -7.640 8.313 1.00 0.00 H new ATOM 1353 N MET A 95 -20.297 -5.570 -0.368 1.00 0.00 N ATOM 1354 CA MET A 95 -20.995 -6.155 -1.501 1.00 0.00 C ATOM 1355 C MET A 95 -20.601 -7.618 -1.587 1.00 0.00 C ATOM 1356 O MET A 95 -19.489 -7.995 -1.200 1.00 0.00 O ATOM 1357 CB MET A 95 -20.630 -5.439 -2.811 1.00 0.00 C ATOM 1358 CG MET A 95 -20.418 -3.928 -2.656 1.00 0.00 C ATOM 1359 SD MET A 95 -20.162 -3.077 -4.231 1.00 0.00 S ATOM 1360 CE MET A 95 -19.416 -1.532 -3.648 1.00 0.00 C ATOM 0 H MET A 95 -19.460 -5.046 -0.621 1.00 0.00 H new ATOM 0 HA MET A 95 -22.070 -6.050 -1.358 1.00 0.00 H new ATOM 0 HB2 MET A 95 -19.721 -5.884 -3.215 1.00 0.00 H new ATOM 0 HB3 MET A 95 -21.421 -5.612 -3.541 1.00 0.00 H new ATOM 0 HG2 MET A 95 -21.284 -3.496 -2.154 1.00 0.00 H new ATOM 0 HG3 MET A 95 -19.556 -3.753 -2.012 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.972 -1.002 -4.490 1.00 0.00 H new ATOM 0 HE2 MET A 95 -20.183 -0.908 -3.190 1.00 0.00 H new ATOM 0 HE3 MET A 95 -18.644 -1.756 -2.912 1.00 0.00 H new ATOM 1370 N ALA A 96 -21.486 -8.415 -2.178 1.00 0.00 N ATOM 1371 CA ALA A 96 -21.106 -9.693 -2.729 1.00 0.00 C ATOM 1372 C ALA A 96 -20.186 -9.416 -3.899 1.00 0.00 C ATOM 1373 O ALA A 96 -20.432 -8.494 -4.685 1.00 0.00 O ATOM 1374 CB ALA A 96 -22.345 -10.418 -3.233 1.00 0.00 C ATOM 0 H ALA A 96 -22.475 -8.188 -2.283 1.00 0.00 H new ATOM 0 HA ALA A 96 -20.616 -10.310 -1.976 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -22.058 -11.383 -3.649 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -23.038 -10.571 -2.406 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -22.828 -9.819 -4.005 1.00 0.00 H new ATOM 1380 N CYS A 97 -19.160 -10.244 -4.013 1.00 0.00 N ATOM 1381 CA CYS A 97 -18.266 -10.234 -5.153 1.00 0.00 C ATOM 1382 C CYS A 97 -17.806 -11.624 -5.573 1.00 0.00 C ATOM 1383 O CYS A 97 -17.416 -11.792 -6.723 1.00 0.00 O ATOM 1384 CB CYS A 97 -17.046 -9.378 -4.823 1.00 0.00 C ATOM 1385 SG CYS A 97 -17.435 -7.666 -4.591 1.00 0.00 S ATOM 0 H CYS A 97 -18.925 -10.946 -3.311 1.00 0.00 H new ATOM 0 HA CYS A 97 -18.825 -9.820 -5.992 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -16.575 -9.762 -3.918 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -16.316 -9.472 -5.627 1.00 0.00 H new ATOM 1390 N MET A 98 -17.902 -12.636 -4.706 1.00 0.00 N ATOM 1391 CA MET A 98 -17.671 -14.043 -5.047 1.00 0.00 C ATOM 1392 C MET A 98 -16.243 -14.336 -5.527 1.00 0.00 C ATOM 1393 O MET A 98 -16.007 -15.307 -6.247 1.00 0.00 O ATOM 1394 CB MET A 98 -18.733 -14.575 -6.028 1.00 0.00 C ATOM 1395 CG MET A 98 -20.170 -14.205 -5.658 1.00 0.00 C ATOM 1396 SD MET A 98 -21.435 -15.044 -6.655 1.00 0.00 S ATOM 1397 CE MET A 98 -21.570 -13.889 -8.050 1.00 0.00 C ATOM 0 H MET A 98 -18.148 -12.497 -3.726 1.00 0.00 H new ATOM 0 HA MET A 98 -17.780 -14.595 -4.113 1.00 0.00 H new ATOM 0 HB2 MET A 98 -18.516 -14.190 -7.025 1.00 0.00 H new ATOM 0 HB3 MET A 98 -18.651 -15.661 -6.081 1.00 0.00 H new ATOM 0 HG2 MET A 98 -20.335 -14.442 -4.607 1.00 0.00 H new ATOM 0 HG3 MET A 98 -20.295 -13.127 -5.765 1.00 0.00 H new ATOM 0 HE1 MET A 98 -22.311 -14.259 -8.759 1.00 0.00 H new ATOM 0 HE2 MET A 98 -21.877 -12.910 -7.683 1.00 0.00 H new ATOM 0 HE3 MET A 98 -20.603 -13.804 -8.547 1.00 0.00 H new ATOM 1407 N THR A 99 -15.282 -13.517 -5.112 1.00 0.00 N ATOM 1408 CA THR A 99 -13.882 -13.574 -5.507 1.00 0.00 C ATOM 1409 C THR A 99 -12.985 -13.696 -4.267 1.00 0.00 C ATOM 1410 O THR A 99 -13.407 -13.319 -3.164 1.00 0.00 O ATOM 1411 CB THR A 99 -13.527 -12.303 -6.301 1.00 0.00 C ATOM 1412 OG1 THR A 99 -13.934 -11.140 -5.599 1.00 0.00 O ATOM 1413 CG2 THR A 99 -14.141 -12.299 -7.701 1.00 0.00 C ATOM 0 H THR A 99 -15.470 -12.757 -4.458 1.00 0.00 H new ATOM 0 HA THR A 99 -13.718 -14.449 -6.135 1.00 0.00 H new ATOM 0 HB THR A 99 -12.443 -12.300 -6.413 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.698 -10.344 -6.120 1.00 0.00 H new ATOM 0 HG21 THR A 99 -13.860 -11.382 -8.219 1.00 0.00 H new ATOM 0 HG22 THR A 99 -13.774 -13.159 -8.262 1.00 0.00 H new ATOM 0 HG23 THR A 99 -15.227 -12.354 -7.622 1.00 0.00 H new ATOM 1421 N PRO A 100 -11.724 -14.134 -4.432 1.00 0.00 N ATOM 1422 CA PRO A 100 -10.738 -14.116 -3.359 1.00 0.00 C ATOM 1423 C PRO A 100 -10.328 -12.682 -3.006 1.00 0.00 C ATOM 1424 O PRO A 100 -10.106 -12.385 -1.830 1.00 0.00 O ATOM 1425 CB PRO A 100 -9.566 -14.955 -3.875 1.00 0.00 C ATOM 1426 CG PRO A 100 -9.651 -14.819 -5.395 1.00 0.00 C ATOM 1427 CD PRO A 100 -11.150 -14.685 -5.653 1.00 0.00 C ATOM 0 HA PRO A 100 -11.131 -14.529 -2.430 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -8.614 -14.586 -3.494 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -9.653 -15.996 -3.562 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -9.102 -13.948 -5.752 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.232 -15.689 -5.901 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -11.342 -14.031 -6.503 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -11.593 -15.653 -5.889 1.00 0.00 H new ATOM 1435 N GLY A 101 -10.306 -11.783 -3.998 1.00 0.00 N ATOM 1436 CA GLY A 101 -10.090 -10.358 -3.799 1.00 0.00 C ATOM 1437 C GLY A 101 -11.167 -9.747 -2.899 1.00 0.00 C ATOM 1438 O GLY A 101 -10.859 -8.894 -2.073 1.00 0.00 O ATOM 0 H GLY A 101 -10.441 -12.038 -4.976 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.108 -10.197 -3.354 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.090 -9.851 -4.764 1.00 0.00 H new ATOM 1442 N GLY A 102 -12.406 -10.245 -2.973 1.00 0.00 N ATOM 1443 CA GLY A 102 -13.475 -9.856 -2.066 1.00 0.00 C ATOM 1444 C GLY A 102 -13.152 -10.187 -0.607 1.00 0.00 C ATOM 1445 O GLY A 102 -13.432 -9.383 0.278 1.00 0.00 O ATOM 0 H GLY A 102 -12.690 -10.933 -3.670 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -13.657 -8.785 -2.161 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.396 -10.363 -2.355 1.00 0.00 H new ATOM 1449 N GLN A 103 -12.601 -11.375 -0.337 1.00 0.00 N ATOM 1450 CA GLN A 103 -12.450 -11.876 1.027 1.00 0.00 C ATOM 1451 C GLN A 103 -11.168 -11.390 1.700 1.00 0.00 C ATOM 1452 O GLN A 103 -11.181 -11.154 2.913 1.00 0.00 O ATOM 1453 CB GLN A 103 -12.514 -13.405 1.030 1.00 0.00 C ATOM 1454 CG GLN A 103 -13.922 -13.864 0.643 1.00 0.00 C ATOM 1455 CD GLN A 103 -14.100 -15.355 0.873 1.00 0.00 C ATOM 1456 OE1 GLN A 103 -13.697 -16.170 0.048 1.00 0.00 O ATOM 1457 NE2 GLN A 103 -14.723 -15.752 1.972 1.00 0.00 N ATOM 0 H GLN A 103 -12.250 -12.010 -1.054 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.277 -11.473 1.612 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -11.784 -13.810 0.330 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -12.255 -13.787 2.017 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.659 -13.313 1.227 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -14.107 -13.631 -0.406 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -15.052 -15.063 2.649 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -14.874 -16.746 2.142 1.00 0.00 H new ATOM 1466 N ILE A 104 -10.076 -11.203 0.949 1.00 0.00 N ATOM 1467 CA ILE A 104 -8.815 -10.698 1.507 1.00 0.00 C ATOM 1468 C ILE A 104 -8.985 -9.298 2.110 1.00 0.00 C ATOM 1469 O ILE A 104 -8.179 -8.866 2.935 1.00 0.00 O ATOM 1470 CB ILE A 104 -7.684 -10.752 0.455 1.00 0.00 C ATOM 1471 CG1 ILE A 104 -6.339 -10.382 1.111 1.00 0.00 C ATOM 1472 CG2 ILE A 104 -7.953 -9.838 -0.751 1.00 0.00 C ATOM 1473 CD1 ILE A 104 -5.122 -10.821 0.303 1.00 0.00 C ATOM 0 H ILE A 104 -10.040 -11.395 -0.052 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.523 -11.354 2.327 1.00 0.00 H new ATOM 0 HB ILE A 104 -7.644 -11.774 0.077 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -6.299 -9.302 1.254 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -6.290 -10.836 2.101 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.127 -9.916 -1.458 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -8.878 -10.143 -1.240 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -8.045 -8.806 -0.412 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.212 -10.527 0.826 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.137 -11.904 0.182 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.146 -10.346 -0.678 1.00 0.00 H new ATOM 1485 N GLU A 105 -10.050 -8.589 1.746 1.00 0.00 N ATOM 1486 CA GLU A 105 -10.334 -7.263 2.242 1.00 0.00 C ATOM 1487 C GLU A 105 -10.424 -7.233 3.775 1.00 0.00 C ATOM 1488 O GLU A 105 -9.937 -6.295 4.409 1.00 0.00 O ATOM 1489 CB GLU A 105 -11.649 -6.811 1.605 1.00 0.00 C ATOM 1490 CG GLU A 105 -11.827 -5.316 1.807 1.00 0.00 C ATOM 1491 CD GLU A 105 -13.082 -4.814 1.104 1.00 0.00 C ATOM 1492 OE1 GLU A 105 -13.045 -4.703 -0.144 1.00 0.00 O ATOM 1493 OE2 GLU A 105 -14.034 -4.457 1.829 1.00 0.00 O ATOM 0 H GLU A 105 -10.747 -8.934 1.086 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.523 -6.585 1.975 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -11.649 -7.047 0.541 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -12.485 -7.350 2.051 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.890 -5.095 2.872 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.955 -4.787 1.423 1.00 0.00 H new ATOM 1500 N GLY A 106 -10.966 -8.291 4.388 1.00 0.00 N ATOM 1501 CA GLY A 106 -11.021 -8.392 5.841 1.00 0.00 C ATOM 1502 C GLY A 106 -9.635 -8.334 6.482 1.00 0.00 C ATOM 1503 O GLY A 106 -9.523 -7.927 7.638 1.00 0.00 O ATOM 0 H GLY A 106 -11.372 -9.087 3.896 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -11.635 -7.582 6.236 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.508 -9.326 6.119 1.00 0.00 H new ATOM 1507 N ALA A 107 -8.580 -8.736 5.767 1.00 0.00 N ATOM 1508 CA ALA A 107 -7.215 -8.596 6.232 1.00 0.00 C ATOM 1509 C ALA A 107 -6.663 -7.217 5.872 1.00 0.00 C ATOM 1510 O ALA A 107 -5.919 -6.651 6.678 1.00 0.00 O ATOM 1511 CB ALA A 107 -6.348 -9.702 5.620 1.00 0.00 C ATOM 0 H ALA A 107 -8.659 -9.168 4.847 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.198 -8.692 7.318 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.321 -9.596 5.971 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -6.735 -10.676 5.920 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.370 -9.622 4.533 1.00 0.00 H new ATOM 1517 N TYR A 108 -6.951 -6.682 4.673 1.00 0.00 N ATOM 1518 CA TYR A 108 -6.072 -5.628 4.160 1.00 0.00 C ATOM 1519 C TYR A 108 -6.425 -4.334 4.923 1.00 0.00 C ATOM 1520 O TYR A 108 -5.542 -3.522 5.191 1.00 0.00 O ATOM 1521 CB TYR A 108 -6.170 -5.407 2.632 1.00 0.00 C ATOM 1522 CG TYR A 108 -6.997 -4.240 2.120 1.00 0.00 C ATOM 1523 CD1 TYR A 108 -8.376 -4.108 2.349 1.00 0.00 C ATOM 1524 CD2 TYR A 108 -6.291 -3.178 1.521 1.00 0.00 C ATOM 1525 CE1 TYR A 108 -9.042 -2.917 2.020 1.00 0.00 C ATOM 1526 CE2 TYR A 108 -6.944 -1.983 1.192 1.00 0.00 C ATOM 1527 CZ TYR A 108 -8.319 -1.847 1.457 1.00 0.00 C ATOM 1528 OH TYR A 108 -8.923 -0.670 1.184 1.00 0.00 O ATOM 0 H TYR A 108 -7.735 -6.943 4.076 1.00 0.00 H new ATOM 0 HA TYR A 108 -5.038 -5.932 4.326 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -5.157 -5.289 2.249 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -6.573 -6.318 2.190 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -8.928 -4.929 2.782 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -5.237 -3.286 1.314 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -10.103 -2.821 2.198 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -6.395 -1.171 0.738 1.00 0.00 H new ATOM 0 HH TYR A 108 -9.885 -0.816 1.064 1.00 0.00 H new ATOM 1538 N LEU A 109 -7.692 -4.169 5.346 1.00 0.00 N ATOM 1539 CA LEU A 109 -8.160 -3.051 6.170 1.00 0.00 C ATOM 1540 C LEU A 109 -7.414 -3.033 7.500 1.00 0.00 C ATOM 1541 O LEU A 109 -7.081 -1.971 8.021 1.00 0.00 O ATOM 1542 CB LEU A 109 -9.662 -3.203 6.484 1.00 0.00 C ATOM 1543 CG LEU A 109 -10.628 -2.907 5.318 1.00 0.00 C ATOM 1544 CD1 LEU A 109 -12.047 -3.327 5.707 1.00 0.00 C ATOM 1545 CD2 LEU A 109 -10.630 -1.421 4.933 1.00 0.00 C ATOM 0 H LEU A 109 -8.434 -4.830 5.115 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.981 -2.131 5.614 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.840 -4.222 6.828 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.909 -2.539 7.312 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.284 -3.477 4.455 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -12.728 -3.117 4.882 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -12.063 -4.394 5.928 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -12.363 -2.769 6.589 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -11.324 -1.260 4.108 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -10.940 -0.823 5.790 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -9.627 -1.123 4.627 1.00 0.00 H new ATOM 1557 N ASN A 110 -7.165 -4.216 8.064 1.00 0.00 N ATOM 1558 CA ASN A 110 -6.439 -4.354 9.317 1.00 0.00 C ATOM 1559 C ASN A 110 -4.962 -4.070 9.106 1.00 0.00 C ATOM 1560 O ASN A 110 -4.318 -3.497 9.970 1.00 0.00 O ATOM 1561 CB ASN A 110 -6.576 -5.777 9.854 1.00 0.00 C ATOM 1562 CG ASN A 110 -6.453 -5.841 11.378 1.00 0.00 C ATOM 1563 OD1 ASN A 110 -7.213 -6.557 12.029 1.00 0.00 O ATOM 1564 ND2 ASN A 110 -5.540 -5.113 12.001 1.00 0.00 N ATOM 0 H ASN A 110 -7.464 -5.104 7.660 1.00 0.00 H new ATOM 0 HA ASN A 110 -6.859 -3.642 10.027 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -7.541 -6.184 9.553 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -5.809 -6.408 9.404 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -5.468 -5.147 13.018 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -4.908 -4.518 11.464 1.00 0.00 H new ATOM 1571 N ALA A 111 -4.410 -4.478 7.968 1.00 0.00 N ATOM 1572 CA ALA A 111 -3.024 -4.182 7.636 1.00 0.00 C ATOM 1573 C ALA A 111 -2.779 -2.663 7.561 1.00 0.00 C ATOM 1574 O ALA A 111 -1.666 -2.214 7.829 1.00 0.00 O ATOM 1575 CB ALA A 111 -2.650 -4.918 6.350 1.00 0.00 C ATOM 0 H ALA A 111 -4.906 -5.017 7.258 1.00 0.00 H new ATOM 0 HA ALA A 111 -2.368 -4.542 8.428 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -1.613 -4.701 6.095 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -2.771 -5.991 6.497 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.300 -4.587 5.540 1.00 0.00 H new ATOM 1581 N LEU A 112 -3.812 -1.852 7.288 1.00 0.00 N ATOM 1582 CA LEU A 112 -3.699 -0.392 7.323 1.00 0.00 C ATOM 1583 C LEU A 112 -3.526 0.172 8.743 1.00 0.00 C ATOM 1584 O LEU A 112 -3.294 1.372 8.865 1.00 0.00 O ATOM 1585 CB LEU A 112 -4.889 0.302 6.622 1.00 0.00 C ATOM 1586 CG LEU A 112 -5.032 0.006 5.118 1.00 0.00 C ATOM 1587 CD1 LEU A 112 -6.294 0.671 4.554 1.00 0.00 C ATOM 1588 CD2 LEU A 112 -3.826 0.482 4.301 1.00 0.00 C ATOM 0 H LEU A 112 -4.742 -2.190 7.039 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.787 -0.167 6.769 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -5.809 0.002 7.123 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -4.790 1.379 6.755 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.098 -1.078 5.030 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.377 0.450 3.490 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.171 0.286 5.074 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.232 1.750 4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.984 0.246 3.249 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -3.710 1.559 4.418 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -2.926 -0.021 4.654 1.00 0.00 H new ATOM 1600 N THR A 113 -3.635 -0.624 9.815 1.00 0.00 N ATOM 1601 CA THR A 113 -3.570 -0.099 11.181 1.00 0.00 C ATOM 1602 C THR A 113 -2.158 -0.185 11.771 1.00 0.00 C ATOM 1603 O THR A 113 -1.889 0.427 12.806 1.00 0.00 O ATOM 1604 CB THR A 113 -4.629 -0.776 12.075 1.00 0.00 C ATOM 1605 OG1 THR A 113 -4.349 -2.123 12.379 1.00 0.00 O ATOM 1606 CG2 THR A 113 -6.012 -0.735 11.416 1.00 0.00 C ATOM 0 H THR A 113 -3.769 -1.634 9.760 1.00 0.00 H new ATOM 0 HA THR A 113 -3.807 0.964 11.141 1.00 0.00 H new ATOM 0 HB THR A 113 -4.609 -0.203 13.002 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.267 -2.636 11.548 1.00 0.00 H new ATOM 0 HG21 THR A 113 -6.740 -1.219 12.067 1.00 0.00 H new ATOM 0 HG22 THR A 113 -6.306 0.302 11.251 1.00 0.00 H new ATOM 0 HG23 THR A 113 -5.975 -1.258 10.461 1.00 0.00 H new ATOM 1614 N HIS A 114 -1.237 -0.909 11.126 1.00 0.00 N ATOM 1615 CA HIS A 114 0.093 -1.203 11.654 1.00 0.00 C ATOM 1616 C HIS A 114 1.173 -0.518 10.816 1.00 0.00 C ATOM 1617 O HIS A 114 2.247 -1.087 10.633 1.00 0.00 O ATOM 1618 CB HIS A 114 0.289 -2.726 11.777 1.00 0.00 C ATOM 1619 CG HIS A 114 -0.593 -3.361 12.815 1.00 0.00 C ATOM 1620 ND1 HIS A 114 -0.289 -3.535 14.146 1.00 0.00 N ATOM 1621 CD2 HIS A 114 -1.827 -3.902 12.593 1.00 0.00 C ATOM 1622 CE1 HIS A 114 -1.323 -4.172 14.719 1.00 0.00 C ATOM 1623 NE2 HIS A 114 -2.275 -4.430 13.808 1.00 0.00 N ATOM 0 H HIS A 114 -1.402 -1.314 10.204 1.00 0.00 H new ATOM 0 HA HIS A 114 0.186 -0.792 12.659 1.00 0.00 H new ATOM 0 HB2 HIS A 114 0.091 -3.189 10.810 1.00 0.00 H new ATOM 0 HB3 HIS A 114 1.331 -2.932 12.022 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -2.359 -3.919 11.653 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -1.381 -4.439 15.764 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -3.156 -4.918 13.971 1.00 0.00 H new ATOM 1631 N ILE A 115 0.908 0.688 10.295 1.00 0.00 N ATOM 1632 CA ILE A 115 1.885 1.488 9.564 1.00 0.00 C ATOM 1633 C ILE A 115 2.906 2.028 10.573 1.00 0.00 C ATOM 1634 O ILE A 115 2.903 3.216 10.920 1.00 0.00 O ATOM 1635 CB ILE A 115 1.247 2.635 8.737 1.00 0.00 C ATOM 1636 CG1 ILE A 115 -0.165 2.384 8.178 1.00 0.00 C ATOM 1637 CG2 ILE A 115 2.258 3.059 7.656 1.00 0.00 C ATOM 1638 CD1 ILE A 115 -0.307 1.237 7.187 1.00 0.00 C ATOM 0 H ILE A 115 -0.005 1.136 10.374 1.00 0.00 H new ATOM 0 HA ILE A 115 2.373 0.849 8.828 1.00 0.00 H new ATOM 0 HB ILE A 115 1.051 3.452 9.431 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.836 2.196 9.016 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.508 3.298 7.694 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.834 3.866 7.058 1.00 0.00 H new ATOM 0 HG22 ILE A 115 3.176 3.403 8.132 1.00 0.00 H new ATOM 0 HG23 ILE A 115 2.480 2.208 7.012 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -1.346 1.160 6.866 1.00 0.00 H new ATOM 0 HD12 ILE A 115 0.328 1.424 6.321 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -0.005 0.305 7.664 1.00 0.00 H new ATOM 1650 N ASP A 116 3.773 1.155 11.068 1.00 0.00 N ATOM 1651 CA ASP A 116 4.915 1.577 11.854 1.00 0.00 C ATOM 1652 C ASP A 116 5.977 2.156 10.931 1.00 0.00 C ATOM 1653 O ASP A 116 6.606 3.153 11.279 1.00 0.00 O ATOM 1654 CB ASP A 116 5.482 0.431 12.688 1.00 0.00 C ATOM 1655 CG ASP A 116 6.122 1.036 13.936 1.00 0.00 C ATOM 1656 OD1 ASP A 116 7.291 1.461 13.901 1.00 0.00 O ATOM 1657 OD2 ASP A 116 5.393 1.220 14.941 1.00 0.00 O ATOM 0 H ASP A 116 3.703 0.146 10.936 1.00 0.00 H new ATOM 0 HA ASP A 116 4.588 2.346 12.554 1.00 0.00 H new ATOM 0 HB2 ASP A 116 4.692 -0.268 12.964 1.00 0.00 H new ATOM 0 HB3 ASP A 116 6.219 -0.131 12.114 1.00 0.00 H new ATOM 1662 N ARG A 117 6.111 1.599 9.722 1.00 0.00 N ATOM 1663 CA ARG A 117 7.159 1.949 8.772 1.00 0.00 C ATOM 1664 C ARG A 117 6.561 2.299 7.413 1.00 0.00 C ATOM 1665 O ARG A 117 5.426 1.927 7.096 1.00 0.00 O ATOM 1666 CB ARG A 117 8.159 0.808 8.681 1.00 0.00 C ATOM 1667 CG ARG A 117 9.012 0.781 9.955 1.00 0.00 C ATOM 1668 CD ARG A 117 10.103 -0.256 9.778 1.00 0.00 C ATOM 1669 NE ARG A 117 11.171 0.208 8.867 1.00 0.00 N ATOM 1670 CZ ARG A 117 12.358 0.716 9.214 1.00 0.00 C ATOM 1671 NH1 ARG A 117 12.750 0.724 10.489 1.00 0.00 N ATOM 1672 NH2 ARG A 117 13.161 1.191 8.269 1.00 0.00 N ATOM 0 H ARG A 117 5.478 0.878 9.375 1.00 0.00 H new ATOM 0 HA ARG A 117 7.687 2.837 9.120 1.00 0.00 H new ATOM 0 HB2 ARG A 117 7.636 -0.141 8.559 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.796 0.936 7.806 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.448 1.763 10.140 1.00 0.00 H new ATOM 0 HG3 ARG A 117 8.395 0.538 10.820 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.535 -0.496 10.749 1.00 0.00 H new ATOM 0 HD3 ARG A 117 9.668 -1.176 9.387 1.00 0.00 H new ATOM 0 HE ARG A 117 10.982 0.133 7.867 1.00 0.00 H new ATOM 0 HH11 ARG A 117 12.142 0.340 11.212 1.00 0.00 H new ATOM 0 HH12 ARG A 117 13.658 1.114 10.741 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.870 1.166 7.292 1.00 0.00 H new ATOM 0 HH22 ARG A 117 14.069 1.581 8.520 1.00 0.00 H new ATOM 1686 N THR A 118 7.308 3.001 6.570 1.00 0.00 N ATOM 1687 CA THR A 118 6.981 3.230 5.165 1.00 0.00 C ATOM 1688 C THR A 118 8.293 3.407 4.398 1.00 0.00 C ATOM 1689 O THR A 118 9.325 3.762 4.980 1.00 0.00 O ATOM 1690 CB THR A 118 6.058 4.458 5.067 1.00 0.00 C ATOM 1691 OG1 THR A 118 4.789 4.124 5.597 1.00 0.00 O ATOM 1692 CG2 THR A 118 5.787 5.010 3.662 1.00 0.00 C ATOM 0 H THR A 118 8.184 3.440 6.852 1.00 0.00 H new ATOM 0 HA THR A 118 6.446 2.389 4.724 1.00 0.00 H new ATOM 0 HB THR A 118 6.600 5.229 5.614 1.00 0.00 H new ATOM 0 HG1 THR A 118 4.849 3.271 6.076 1.00 0.00 H new ATOM 0 HG21 THR A 118 5.124 5.872 3.732 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.728 5.312 3.202 1.00 0.00 H new ATOM 0 HG23 THR A 118 5.316 4.239 3.053 1.00 0.00 H new ATOM 1700 N GLY A 119 8.241 3.177 3.089 1.00 0.00 N ATOM 1701 CA GLY A 119 9.314 3.432 2.162 1.00 0.00 C ATOM 1702 C GLY A 119 8.725 3.854 0.819 1.00 0.00 C ATOM 1703 O GLY A 119 8.172 3.028 0.104 1.00 0.00 O ATOM 0 H GLY A 119 7.411 2.792 2.637 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.967 4.215 2.549 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.926 2.538 2.040 1.00 0.00 H new ATOM 1707 N VAL A 120 8.841 5.124 0.435 1.00 0.00 N ATOM 1708 CA VAL A 120 8.521 5.580 -0.922 1.00 0.00 C ATOM 1709 C VAL A 120 9.784 5.942 -1.693 1.00 0.00 C ATOM 1710 O VAL A 120 10.833 6.254 -1.126 1.00 0.00 O ATOM 1711 CB VAL A 120 7.469 6.691 -0.883 1.00 0.00 C ATOM 1712 CG1 VAL A 120 7.967 7.796 0.038 1.00 0.00 C ATOM 1713 CG2 VAL A 120 7.112 7.234 -2.281 1.00 0.00 C ATOM 0 H VAL A 120 9.160 5.869 1.055 1.00 0.00 H new ATOM 0 HA VAL A 120 8.069 4.760 -1.480 1.00 0.00 H new ATOM 0 HB VAL A 120 6.540 6.273 -0.495 1.00 0.00 H new ATOM 0 HG11 VAL A 120 7.229 8.597 0.078 1.00 0.00 H new ATOM 0 HG12 VAL A 120 8.120 7.394 1.039 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.909 8.190 -0.343 1.00 0.00 H new ATOM 0 HG21 VAL A 120 6.361 8.019 -2.186 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.006 7.642 -2.752 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.716 6.425 -2.895 1.00 0.00 H new ATOM 1723 N GLN A 121 9.671 5.884 -3.015 1.00 0.00 N ATOM 1724 CA GLN A 121 10.703 6.188 -3.969 1.00 0.00 C ATOM 1725 C GLN A 121 10.031 7.011 -5.067 1.00 0.00 C ATOM 1726 O GLN A 121 9.142 6.518 -5.764 1.00 0.00 O ATOM 1727 CB GLN A 121 11.273 4.843 -4.420 1.00 0.00 C ATOM 1728 CG GLN A 121 12.265 4.928 -5.574 1.00 0.00 C ATOM 1729 CD GLN A 121 11.528 4.877 -6.897 1.00 0.00 C ATOM 1730 OE1 GLN A 121 11.514 5.840 -7.643 1.00 0.00 O ATOM 1731 NE2 GLN A 121 10.840 3.793 -7.163 1.00 0.00 N ATOM 0 H GLN A 121 8.799 5.605 -3.465 1.00 0.00 H new ATOM 0 HA GLN A 121 11.540 6.778 -3.595 1.00 0.00 H new ATOM 0 HB2 GLN A 121 11.764 4.368 -3.570 1.00 0.00 H new ATOM 0 HB3 GLN A 121 10.448 4.194 -4.715 1.00 0.00 H new ATOM 0 HG2 GLN A 121 12.839 5.852 -5.504 1.00 0.00 H new ATOM 0 HG3 GLN A 121 12.977 4.105 -5.513 1.00 0.00 H new ATOM 0 HE21 GLN A 121 10.869 3.000 -6.522 1.00 0.00 H new ATOM 0 HE22 GLN A 121 10.276 3.742 -8.011 1.00 0.00 H new ATOM 1740 N MET A 122 10.382 8.292 -5.178 1.00 0.00 N ATOM 1741 CA MET A 122 9.865 9.228 -6.166 1.00 0.00 C ATOM 1742 C MET A 122 10.952 9.533 -7.192 1.00 0.00 C ATOM 1743 O MET A 122 11.476 10.646 -7.280 1.00 0.00 O ATOM 1744 CB MET A 122 9.296 10.465 -5.461 1.00 0.00 C ATOM 1745 CG MET A 122 8.613 11.402 -6.469 1.00 0.00 C ATOM 1746 SD MET A 122 7.706 12.777 -5.740 1.00 0.00 S ATOM 1747 CE MET A 122 6.600 11.824 -4.680 1.00 0.00 C ATOM 0 H MET A 122 11.064 8.721 -4.553 1.00 0.00 H new ATOM 0 HA MET A 122 9.034 8.794 -6.722 1.00 0.00 H new ATOM 0 HB2 MET A 122 8.579 10.158 -4.700 1.00 0.00 H new ATOM 0 HB3 MET A 122 10.097 10.997 -4.948 1.00 0.00 H new ATOM 0 HG2 MET A 122 9.372 11.803 -7.141 1.00 0.00 H new ATOM 0 HG3 MET A 122 7.925 10.816 -7.078 1.00 0.00 H new ATOM 0 HE1 MET A 122 5.659 12.361 -4.559 1.00 0.00 H new ATOM 0 HE2 MET A 122 6.407 10.853 -5.135 1.00 0.00 H new ATOM 0 HE3 MET A 122 7.064 11.681 -3.704 1.00 0.00 H new ATOM 1757 N ARG A 123 11.318 8.525 -7.978 1.00 0.00 N ATOM 1758 CA ARG A 123 12.264 8.629 -9.066 1.00 0.00 C ATOM 1759 C ARG A 123 11.952 7.569 -10.112 1.00 0.00 C ATOM 1760 O ARG A 123 12.609 6.527 -10.160 1.00 0.00 O ATOM 1761 CB ARG A 123 13.668 8.480 -8.497 1.00 0.00 C ATOM 1762 CG ARG A 123 14.681 8.790 -9.607 1.00 0.00 C ATOM 1763 CD ARG A 123 15.694 9.812 -9.117 1.00 0.00 C ATOM 1764 NE ARG A 123 16.476 9.231 -8.016 1.00 0.00 N ATOM 1765 CZ ARG A 123 16.704 9.752 -6.808 1.00 0.00 C ATOM 1766 NH1 ARG A 123 16.514 11.045 -6.567 1.00 0.00 N ATOM 1767 NH2 ARG A 123 17.100 8.927 -5.848 1.00 0.00 N ATOM 0 H ARG A 123 10.946 7.582 -7.864 1.00 0.00 H new ATOM 0 HA ARG A 123 12.194 9.599 -9.558 1.00 0.00 H new ATOM 0 HB2 ARG A 123 13.809 9.158 -7.656 1.00 0.00 H new ATOM 0 HB3 ARG A 123 13.818 7.468 -8.120 1.00 0.00 H new ATOM 0 HG2 ARG A 123 15.192 7.876 -9.910 1.00 0.00 H new ATOM 0 HG3 ARG A 123 14.163 9.172 -10.487 1.00 0.00 H new ATOM 0 HD2 ARG A 123 16.355 10.106 -9.932 1.00 0.00 H new ATOM 0 HD3 ARG A 123 15.184 10.714 -8.780 1.00 0.00 H new ATOM 0 HE ARG A 123 16.895 8.319 -8.197 1.00 0.00 H new ATOM 0 HH11 ARG A 123 16.188 11.660 -7.312 1.00 0.00 H new ATOM 0 HH12 ARG A 123 16.694 11.422 -5.637 1.00 0.00 H new ATOM 0 HH21 ARG A 123 17.220 7.934 -6.046 1.00 0.00 H new ATOM 0 HH22 ARG A 123 17.285 9.286 -4.911 1.00 0.00 H new ATOM 1781 N ALA A 124 10.958 7.892 -10.939 1.00 0.00 N ATOM 1782 CA ALA A 124 10.363 7.068 -11.978 1.00 0.00 C ATOM 1783 C ALA A 124 11.349 6.036 -12.544 1.00 0.00 C ATOM 1784 O ALA A 124 12.394 6.444 -13.063 1.00 0.00 O ATOM 1785 CB ALA A 124 9.824 7.981 -13.065 1.00 0.00 C ATOM 0 H ALA A 124 10.517 8.810 -10.892 1.00 0.00 H new ATOM 0 HA ALA A 124 9.548 6.488 -11.546 1.00 0.00 H new ATOM 0 HB1 ALA A 124 9.373 7.380 -13.855 1.00 0.00 H new ATOM 0 HB2 ALA A 124 9.072 8.647 -12.641 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.640 8.573 -13.481 1.00 0.00 H new ATOM 1791 N PRO A 125 11.060 4.731 -12.448 1.00 0.00 N ATOM 1792 CA PRO A 125 9.755 4.155 -12.149 1.00 0.00 C ATOM 1793 C PRO A 125 9.443 4.202 -10.647 1.00 0.00 C ATOM 1794 O PRO A 125 10.242 3.734 -9.842 1.00 0.00 O ATOM 1795 CB PRO A 125 9.844 2.728 -12.683 1.00 0.00 C ATOM 1796 CG PRO A 125 11.313 2.362 -12.536 1.00 0.00 C ATOM 1797 CD PRO A 125 12.030 3.691 -12.734 1.00 0.00 C ATOM 0 HA PRO A 125 8.938 4.709 -12.610 1.00 0.00 H new ATOM 0 HB2 PRO A 125 9.207 2.050 -12.115 1.00 0.00 H new ATOM 0 HB3 PRO A 125 9.522 2.672 -13.723 1.00 0.00 H new ATOM 0 HG2 PRO A 125 11.524 1.934 -11.556 1.00 0.00 H new ATOM 0 HG3 PRO A 125 11.620 1.625 -13.279 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.890 3.770 -12.069 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.405 3.781 -13.753 1.00 0.00 H new ATOM 1805 N GLN A 126 8.332 4.834 -10.255 1.00 0.00 N ATOM 1806 CA GLN A 126 7.996 5.093 -8.853 1.00 0.00 C ATOM 1807 C GLN A 126 7.340 3.853 -8.277 1.00 0.00 C ATOM 1808 O GLN A 126 6.516 3.235 -8.952 1.00 0.00 O ATOM 1809 CB GLN A 126 7.042 6.291 -8.705 1.00 0.00 C ATOM 1810 CG GLN A 126 7.618 7.599 -9.266 1.00 0.00 C ATOM 1811 CD GLN A 126 6.609 8.744 -9.267 1.00 0.00 C ATOM 1812 OE1 GLN A 126 6.255 9.254 -10.322 1.00 0.00 O ATOM 1813 NE2 GLN A 126 6.131 9.208 -8.127 1.00 0.00 N ATOM 0 H GLN A 126 7.633 5.184 -10.911 1.00 0.00 H new ATOM 0 HA GLN A 126 8.914 5.334 -8.317 1.00 0.00 H new ATOM 0 HB2 GLN A 126 6.106 6.066 -9.215 1.00 0.00 H new ATOM 0 HB3 GLN A 126 6.805 6.430 -7.650 1.00 0.00 H new ATOM 0 HG2 GLN A 126 8.487 7.889 -8.676 1.00 0.00 H new ATOM 0 HG3 GLN A 126 7.966 7.428 -10.285 1.00 0.00 H new ATOM 0 HE21 GLN A 126 6.421 8.788 -7.244 1.00 0.00 H new ATOM 0 HE22 GLN A 126 5.472 9.986 -8.130 1.00 0.00 H new ATOM 1822 N GLN A 127 7.649 3.543 -7.019 1.00 0.00 N ATOM 1823 CA GLN A 127 6.854 2.657 -6.189 1.00 0.00 C ATOM 1824 C GLN A 127 6.846 3.220 -4.768 1.00 0.00 C ATOM 1825 O GLN A 127 7.563 4.173 -4.433 1.00 0.00 O ATOM 1826 CB GLN A 127 7.304 1.175 -6.249 1.00 0.00 C ATOM 1827 CG GLN A 127 6.999 0.561 -7.625 1.00 0.00 C ATOM 1828 CD GLN A 127 6.850 -0.963 -7.667 1.00 0.00 C ATOM 1829 OE1 GLN A 127 7.582 -1.732 -7.042 1.00 0.00 O ATOM 1830 NE2 GLN A 127 5.931 -1.451 -8.485 1.00 0.00 N ATOM 0 H GLN A 127 8.474 3.910 -6.545 1.00 0.00 H new ATOM 0 HA GLN A 127 5.836 2.629 -6.579 1.00 0.00 H new ATOM 0 HB2 GLN A 127 8.373 1.107 -6.046 1.00 0.00 H new ATOM 0 HB3 GLN A 127 6.795 0.605 -5.472 1.00 0.00 H new ATOM 0 HG2 GLN A 127 6.078 1.006 -8.002 1.00 0.00 H new ATOM 0 HG3 GLN A 127 7.796 0.847 -8.312 1.00 0.00 H new ATOM 0 HE21 GLN A 127 5.323 -0.818 -9.004 1.00 0.00 H new ATOM 0 HE22 GLN A 127 5.831 -2.460 -8.596 1.00 0.00 H new ATOM 1839 N MET A 128 5.995 2.633 -3.942 1.00 0.00 N ATOM 1840 CA MET A 128 5.735 2.962 -2.563 1.00 0.00 C ATOM 1841 C MET A 128 5.502 1.633 -1.874 1.00 0.00 C ATOM 1842 O MET A 128 4.914 0.715 -2.454 1.00 0.00 O ATOM 1843 CB MET A 128 4.506 3.865 -2.461 1.00 0.00 C ATOM 1844 CG MET A 128 4.206 4.321 -1.031 1.00 0.00 C ATOM 1845 SD MET A 128 2.764 3.534 -0.274 1.00 0.00 S ATOM 1846 CE MET A 128 1.547 4.175 -1.450 1.00 0.00 C ATOM 0 H MET A 128 5.423 1.848 -4.253 1.00 0.00 H new ATOM 0 HA MET A 128 6.559 3.507 -2.102 1.00 0.00 H new ATOM 0 HB2 MET A 128 4.655 4.742 -3.091 1.00 0.00 H new ATOM 0 HB3 MET A 128 3.640 3.333 -2.855 1.00 0.00 H new ATOM 0 HG2 MET A 128 5.079 4.122 -0.410 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.055 5.400 -1.032 1.00 0.00 H new ATOM 0 HE1 MET A 128 0.577 4.259 -0.960 1.00 0.00 H new ATOM 0 HE2 MET A 128 1.863 5.157 -1.801 1.00 0.00 H new ATOM 0 HE3 MET A 128 1.467 3.495 -2.298 1.00 0.00 H new ATOM 1856 N GLN A 129 5.989 1.533 -0.651 1.00 0.00 N ATOM 1857 CA GLN A 129 5.987 0.333 0.136 1.00 0.00 C ATOM 1858 C GLN A 129 5.535 0.723 1.533 1.00 0.00 C ATOM 1859 O GLN A 129 6.046 1.683 2.115 1.00 0.00 O ATOM 1860 CB GLN A 129 7.389 -0.306 0.085 1.00 0.00 C ATOM 1861 CG GLN A 129 7.274 -1.805 -0.193 1.00 0.00 C ATOM 1862 CD GLN A 129 8.620 -2.443 -0.544 1.00 0.00 C ATOM 1863 OE1 GLN A 129 9.638 -2.249 0.120 1.00 0.00 O ATOM 1864 NE2 GLN A 129 8.653 -3.233 -1.603 1.00 0.00 N ATOM 0 H GLN A 129 6.413 2.324 -0.167 1.00 0.00 H new ATOM 0 HA GLN A 129 5.301 -0.425 -0.242 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.986 0.171 -0.692 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.906 -0.142 1.030 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.858 -2.302 0.683 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.575 -1.966 -1.013 1.00 0.00 H new ATOM 0 HE21 GLN A 129 7.806 -3.390 -2.149 1.00 0.00 H new ATOM 0 HE22 GLN A 129 9.526 -3.686 -1.874 1.00 0.00 H new ATOM 1873 N LEU A 130 4.548 0.009 2.063 1.00 0.00 N ATOM 1874 CA LEU A 130 4.184 0.105 3.470 1.00 0.00 C ATOM 1875 C LEU A 130 4.743 -1.141 4.129 1.00 0.00 C ATOM 1876 O LEU A 130 4.657 -2.228 3.545 1.00 0.00 O ATOM 1877 CB LEU A 130 2.661 0.227 3.656 1.00 0.00 C ATOM 1878 CG LEU A 130 2.062 1.494 3.006 1.00 0.00 C ATOM 1879 CD1 LEU A 130 0.545 1.534 3.174 1.00 0.00 C ATOM 1880 CD2 LEU A 130 2.626 2.787 3.601 1.00 0.00 C ATOM 0 H LEU A 130 3.980 -0.650 1.531 1.00 0.00 H new ATOM 0 HA LEU A 130 4.597 1.004 3.927 1.00 0.00 H new ATOM 0 HB2 LEU A 130 2.179 -0.653 3.230 1.00 0.00 H new ATOM 0 HB3 LEU A 130 2.432 0.232 4.722 1.00 0.00 H new ATOM 0 HG LEU A 130 2.334 1.436 1.952 1.00 0.00 H new ATOM 0 HD11 LEU A 130 0.151 2.437 2.707 1.00 0.00 H new ATOM 0 HD12 LEU A 130 0.103 0.658 2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 130 0.296 1.537 4.235 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.170 3.644 3.106 1.00 0.00 H new ATOM 0 HD22 LEU A 130 2.405 2.823 4.668 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.706 2.815 3.453 1.00 0.00 H new ATOM 1892 N VAL A 131 5.279 -1.001 5.337 1.00 0.00 N ATOM 1893 CA VAL A 131 5.926 -2.071 6.080 1.00 0.00 C ATOM 1894 C VAL A 131 5.252 -2.100 7.450 1.00 0.00 C ATOM 1895 O VAL A 131 5.161 -1.066 8.118 1.00 0.00 O ATOM 1896 CB VAL A 131 7.449 -1.830 6.114 1.00 0.00 C ATOM 1897 CG1 VAL A 131 8.168 -2.771 7.087 1.00 0.00 C ATOM 1898 CG2 VAL A 131 8.063 -2.016 4.717 1.00 0.00 C ATOM 0 H VAL A 131 5.274 -0.113 5.839 1.00 0.00 H new ATOM 0 HA VAL A 131 5.812 -3.053 5.621 1.00 0.00 H new ATOM 0 HB VAL A 131 7.586 -0.804 6.455 1.00 0.00 H new ATOM 0 HG11 VAL A 131 9.237 -2.561 7.073 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.781 -2.618 8.094 1.00 0.00 H new ATOM 0 HG13 VAL A 131 7.998 -3.805 6.786 1.00 0.00 H new ATOM 0 HG21 VAL A 131 9.138 -1.841 4.766 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.876 -3.032 4.370 1.00 0.00 H new ATOM 0 HG23 VAL A 131 7.611 -1.307 4.024 1.00 0.00 H new ATOM 1908 N LEU A 132 4.703 -3.258 7.831 1.00 0.00 N ATOM 1909 CA LEU A 132 4.066 -3.398 9.136 1.00 0.00 C ATOM 1910 C LEU A 132 5.143 -3.509 10.211 1.00 0.00 C ATOM 1911 O LEU A 132 6.289 -3.853 9.910 1.00 0.00 O ATOM 1912 CB LEU A 132 3.109 -4.604 9.205 1.00 0.00 C ATOM 1913 CG LEU A 132 2.002 -4.651 8.133 1.00 0.00 C ATOM 1914 CD1 LEU A 132 0.940 -5.692 8.519 1.00 0.00 C ATOM 1915 CD2 LEU A 132 1.291 -3.320 7.875 1.00 0.00 C ATOM 0 H LEU A 132 4.689 -4.102 7.258 1.00 0.00 H new ATOM 0 HA LEU A 132 3.456 -2.510 9.306 1.00 0.00 H new ATOM 0 HB2 LEU A 132 3.700 -5.516 9.128 1.00 0.00 H new ATOM 0 HB3 LEU A 132 2.637 -4.612 10.187 1.00 0.00 H new ATOM 0 HG LEU A 132 2.521 -4.914 7.211 1.00 0.00 H new ATOM 0 HD11 LEU A 132 0.162 -5.718 7.756 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.405 -6.675 8.597 1.00 0.00 H new ATOM 0 HD13 LEU A 132 0.498 -5.423 9.478 1.00 0.00 H new ATOM 0 HD21 LEU A 132 0.531 -3.457 7.106 1.00 0.00 H new ATOM 0 HD22 LEU A 132 0.819 -2.976 8.795 1.00 0.00 H new ATOM 0 HD23 LEU A 132 2.017 -2.579 7.540 1.00 0.00 H new ATOM 1927 N ASP A 133 4.764 -3.340 11.479 1.00 0.00 N ATOM 1928 CA ASP A 133 5.670 -3.600 12.602 1.00 0.00 C ATOM 1929 C ASP A 133 6.152 -5.054 12.612 1.00 0.00 C ATOM 1930 O ASP A 133 7.308 -5.301 12.958 1.00 0.00 O ATOM 1931 CB ASP A 133 5.022 -3.255 13.947 1.00 0.00 C ATOM 1932 CG ASP A 133 5.856 -3.761 15.133 1.00 0.00 C ATOM 1933 OD1 ASP A 133 6.867 -3.101 15.482 1.00 0.00 O ATOM 1934 OD2 ASP A 133 5.496 -4.828 15.686 1.00 0.00 O ATOM 0 H ASP A 133 3.835 -3.024 11.755 1.00 0.00 H new ATOM 0 HA ASP A 133 6.534 -2.950 12.461 1.00 0.00 H new ATOM 0 HB2 ASP A 133 4.900 -2.175 14.024 1.00 0.00 H new ATOM 0 HB3 ASP A 133 4.025 -3.693 13.992 1.00 0.00 H new ATOM 1939 N ASN A 134 5.322 -6.012 12.175 1.00 0.00 N ATOM 1940 CA ASN A 134 5.773 -7.401 12.104 1.00 0.00 C ATOM 1941 C ASN A 134 6.586 -7.632 10.834 1.00 0.00 C ATOM 1942 O ASN A 134 7.397 -8.554 10.824 1.00 0.00 O ATOM 1943 CB ASN A 134 4.669 -8.473 12.234 1.00 0.00 C ATOM 1944 CG ASN A 134 3.286 -7.979 12.620 1.00 0.00 C ATOM 1945 OD1 ASN A 134 2.911 -8.002 13.788 1.00 0.00 O ATOM 1946 ND2 ASN A 134 2.502 -7.522 11.658 1.00 0.00 N ATOM 0 H ASN A 134 4.360 -5.854 11.874 1.00 0.00 H new ATOM 0 HA ASN A 134 6.394 -7.533 12.990 1.00 0.00 H new ATOM 0 HB2 ASN A 134 4.590 -8.998 11.282 1.00 0.00 H new ATOM 0 HB3 ASN A 134 4.989 -9.204 12.976 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.567 -7.180 11.881 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.832 -7.511 10.693 1.00 0.00 H new ATOM 1953 N GLY A 135 6.428 -6.800 9.797 1.00 0.00 N ATOM 1954 CA GLY A 135 7.306 -6.777 8.634 1.00 0.00 C ATOM 1955 C GLY A 135 6.637 -7.108 7.301 1.00 0.00 C ATOM 1956 O GLY A 135 7.350 -7.258 6.311 1.00 0.00 O ATOM 0 H GLY A 135 5.673 -6.116 9.747 1.00 0.00 H new ATOM 0 HA2 GLY A 135 7.756 -5.787 8.559 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.118 -7.485 8.799 1.00 0.00 H new ATOM 1960 N ASP A 136 5.310 -7.268 7.226 1.00 0.00 N ATOM 1961 CA ASP A 136 4.630 -7.475 5.935 1.00 0.00 C ATOM 1962 C ASP A 136 4.863 -6.248 5.056 1.00 0.00 C ATOM 1963 O ASP A 136 4.683 -5.121 5.522 1.00 0.00 O ATOM 1964 CB ASP A 136 3.116 -7.709 6.082 1.00 0.00 C ATOM 1965 CG ASP A 136 2.728 -9.176 6.249 1.00 0.00 C ATOM 1966 OD1 ASP A 136 3.445 -9.911 6.973 1.00 0.00 O ATOM 1967 OD2 ASP A 136 1.732 -9.602 5.625 1.00 0.00 O ATOM 0 H ASP A 136 4.688 -7.259 8.034 1.00 0.00 H new ATOM 0 HA ASP A 136 5.050 -8.375 5.485 1.00 0.00 H new ATOM 0 HB2 ASP A 136 2.754 -7.148 6.943 1.00 0.00 H new ATOM 0 HB3 ASP A 136 2.610 -7.308 5.204 1.00 0.00 H new ATOM 1972 N THR A 137 5.225 -6.473 3.795 1.00 0.00 N ATOM 1973 CA THR A 137 5.699 -5.487 2.833 1.00 0.00 C ATOM 1974 C THR A 137 4.690 -5.416 1.681 1.00 0.00 C ATOM 1975 O THR A 137 4.636 -6.317 0.839 1.00 0.00 O ATOM 1976 CB THR A 137 7.122 -5.874 2.369 1.00 0.00 C ATOM 1977 OG1 THR A 137 7.997 -5.875 3.476 1.00 0.00 O ATOM 1978 CG2 THR A 137 7.703 -4.849 1.401 1.00 0.00 C ATOM 0 H THR A 137 5.192 -7.410 3.394 1.00 0.00 H new ATOM 0 HA THR A 137 5.770 -4.493 3.275 1.00 0.00 H new ATOM 0 HB THR A 137 7.037 -6.851 1.892 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.898 -6.122 3.180 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.704 -5.159 1.100 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.065 -4.778 0.520 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.757 -3.876 1.890 1.00 0.00 H new ATOM 1986 N LEU A 138 3.850 -4.378 1.640 1.00 0.00 N ATOM 1987 CA LEU A 138 2.891 -4.168 0.555 1.00 0.00 C ATOM 1988 C LEU A 138 3.529 -3.236 -0.466 1.00 0.00 C ATOM 1989 O LEU A 138 3.795 -2.083 -0.131 1.00 0.00 O ATOM 1990 CB LEU A 138 1.553 -3.601 1.070 1.00 0.00 C ATOM 1991 CG LEU A 138 0.584 -4.717 1.514 1.00 0.00 C ATOM 1992 CD1 LEU A 138 0.914 -5.211 2.924 1.00 0.00 C ATOM 1993 CD2 LEU A 138 -0.882 -4.275 1.513 1.00 0.00 C ATOM 0 H LEU A 138 3.817 -3.658 2.362 1.00 0.00 H new ATOM 0 HA LEU A 138 2.654 -5.126 0.091 1.00 0.00 H new ATOM 0 HB2 LEU A 138 1.742 -2.931 1.908 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.086 -3.006 0.285 1.00 0.00 H new ATOM 0 HG LEU A 138 0.716 -5.514 0.782 1.00 0.00 H new ATOM 0 HD11 LEU A 138 0.214 -5.997 3.207 1.00 0.00 H new ATOM 0 HD12 LEU A 138 1.930 -5.606 2.943 1.00 0.00 H new ATOM 0 HD13 LEU A 138 0.834 -4.382 3.628 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.512 -5.104 1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -1.010 -3.436 2.197 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.169 -3.970 0.507 1.00 0.00 H new ATOM 2005 N THR A 139 3.795 -3.730 -1.677 1.00 0.00 N ATOM 2006 CA THR A 139 4.223 -2.922 -2.812 1.00 0.00 C ATOM 2007 C THR A 139 2.976 -2.378 -3.513 1.00 0.00 C ATOM 2008 O THR A 139 2.097 -3.127 -3.960 1.00 0.00 O ATOM 2009 CB THR A 139 5.094 -3.738 -3.786 1.00 0.00 C ATOM 2010 OG1 THR A 139 6.327 -4.117 -3.190 1.00 0.00 O ATOM 2011 CG2 THR A 139 5.422 -2.958 -5.063 1.00 0.00 C ATOM 0 H THR A 139 3.716 -4.723 -1.896 1.00 0.00 H new ATOM 0 HA THR A 139 4.839 -2.095 -2.459 1.00 0.00 H new ATOM 0 HB THR A 139 4.504 -4.620 -4.035 1.00 0.00 H new ATOM 0 HG1 THR A 139 6.856 -4.634 -3.833 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.038 -3.575 -5.718 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.497 -2.695 -5.576 1.00 0.00 H new ATOM 0 HG23 THR A 139 5.965 -2.049 -4.805 1.00 0.00 H new ATOM 2019 N PHE A 140 2.942 -1.056 -3.638 1.00 0.00 N ATOM 2020 CA PHE A 140 2.026 -0.314 -4.481 1.00 0.00 C ATOM 2021 C PHE A 140 2.749 0.060 -5.778 1.00 0.00 C ATOM 2022 O PHE A 140 3.976 0.200 -5.791 1.00 0.00 O ATOM 2023 CB PHE A 140 1.594 0.949 -3.708 1.00 0.00 C ATOM 2024 CG PHE A 140 0.679 0.702 -2.520 1.00 0.00 C ATOM 2025 CD1 PHE A 140 1.205 0.204 -1.310 1.00 0.00 C ATOM 2026 CD2 PHE A 140 -0.698 0.987 -2.612 1.00 0.00 C ATOM 2027 CE1 PHE A 140 0.357 -0.042 -0.219 1.00 0.00 C ATOM 2028 CE2 PHE A 140 -1.543 0.758 -1.511 1.00 0.00 C ATOM 2029 CZ PHE A 140 -1.019 0.229 -0.318 1.00 0.00 C ATOM 0 H PHE A 140 3.584 -0.449 -3.129 1.00 0.00 H new ATOM 0 HA PHE A 140 1.144 -0.903 -4.733 1.00 0.00 H new ATOM 0 HB2 PHE A 140 2.488 1.463 -3.356 1.00 0.00 H new ATOM 0 HB3 PHE A 140 1.090 1.624 -4.400 1.00 0.00 H new ATOM 0 HD1 PHE A 140 2.264 0.011 -1.223 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -1.106 1.382 -3.531 1.00 0.00 H new ATOM 0 HE1 PHE A 140 0.763 -0.441 0.699 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -2.596 0.989 -1.582 1.00 0.00 H new ATOM 0 HZ PHE A 140 -1.672 0.032 0.520 1.00 0.00 H new ATOM 2039 N ASP A 141 1.991 0.439 -6.806 1.00 0.00 N ATOM 2040 CA ASP A 141 2.452 1.146 -8.004 1.00 0.00 C ATOM 2041 C ASP A 141 1.873 2.567 -7.977 1.00 0.00 C ATOM 2042 O ASP A 141 0.777 2.791 -7.453 1.00 0.00 O ATOM 2043 CB ASP A 141 2.028 0.387 -9.276 1.00 0.00 C ATOM 2044 CG ASP A 141 3.173 -0.478 -9.827 1.00 0.00 C ATOM 2045 OD1 ASP A 141 4.221 0.107 -10.199 1.00 0.00 O ATOM 2046 OD2 ASP A 141 3.068 -1.724 -9.887 1.00 0.00 O ATOM 0 H ASP A 141 0.988 0.253 -6.829 1.00 0.00 H new ATOM 0 HA ASP A 141 3.541 1.201 -8.015 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.168 -0.245 -9.054 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.711 1.100 -10.037 1.00 0.00 H new ATOM 2051 N ARG A 142 2.596 3.556 -8.514 1.00 0.00 N ATOM 2052 CA ARG A 142 2.109 4.929 -8.642 1.00 0.00 C ATOM 2053 C ARG A 142 1.226 4.998 -9.879 1.00 0.00 C ATOM 2054 O ARG A 142 1.741 5.012 -10.999 1.00 0.00 O ATOM 2055 CB ARG A 142 3.276 5.934 -8.719 1.00 0.00 C ATOM 2056 CG ARG A 142 2.757 7.380 -8.886 1.00 0.00 C ATOM 2057 CD ARG A 142 2.528 8.157 -7.579 1.00 0.00 C ATOM 2058 NE ARG A 142 2.198 9.582 -7.799 1.00 0.00 N ATOM 2059 CZ ARG A 142 1.007 10.168 -7.996 1.00 0.00 C ATOM 2060 NH1 ARG A 142 -0.104 9.475 -8.214 1.00 0.00 N ATOM 2061 NH2 ARG A 142 0.883 11.486 -7.949 1.00 0.00 N ATOM 0 H ARG A 142 3.541 3.423 -8.874 1.00 0.00 H new ATOM 0 HA ARG A 142 1.530 5.204 -7.760 1.00 0.00 H new ATOM 0 HB2 ARG A 142 3.880 5.864 -7.815 1.00 0.00 H new ATOM 0 HB3 ARG A 142 3.925 5.679 -9.557 1.00 0.00 H new ATOM 0 HG2 ARG A 142 3.469 7.934 -9.498 1.00 0.00 H new ATOM 0 HG3 ARG A 142 1.818 7.349 -9.439 1.00 0.00 H new ATOM 0 HD2 ARG A 142 1.719 7.685 -7.020 1.00 0.00 H new ATOM 0 HD3 ARG A 142 3.424 8.089 -6.962 1.00 0.00 H new ATOM 0 HE ARG A 142 2.997 10.216 -7.801 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -0.073 8.456 -8.237 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -0.989 9.962 -8.359 1.00 0.00 H new ATOM 0 HH21 ARG A 142 1.699 12.069 -7.761 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -0.028 11.918 -8.101 1.00 0.00 H new ATOM 2075 N SER A 143 -0.086 5.150 -9.699 1.00 0.00 N ATOM 2076 CA SER A 143 -0.928 5.572 -10.794 1.00 0.00 C ATOM 2077 C SER A 143 -0.970 7.094 -10.697 1.00 0.00 C ATOM 2078 O SER A 143 -1.495 7.628 -9.718 1.00 0.00 O ATOM 2079 CB SER A 143 -2.283 4.874 -10.710 1.00 0.00 C ATOM 2080 OG SER A 143 -3.096 5.285 -11.788 1.00 0.00 O ATOM 0 H SER A 143 -0.573 4.988 -8.817 1.00 0.00 H new ATOM 0 HA SER A 143 -0.555 5.293 -11.779 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.148 3.793 -10.735 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.768 5.113 -9.764 1.00 0.00 H new ATOM 0 HG SER A 143 -3.965 4.834 -11.733 1.00 0.00 H new ATOM 2086 N THR A 144 -0.302 7.759 -11.639 1.00 0.00 N ATOM 2087 CA THR A 144 -0.402 9.191 -11.974 1.00 0.00 C ATOM 2088 C THR A 144 -0.971 9.379 -13.388 1.00 0.00 C ATOM 2089 O THR A 144 -0.784 10.422 -14.020 1.00 0.00 O ATOM 2090 CB THR A 144 0.965 9.899 -11.879 1.00 0.00 C ATOM 2091 OG1 THR A 144 1.833 9.181 -11.035 1.00 0.00 O ATOM 2092 CG2 THR A 144 0.806 11.338 -11.380 1.00 0.00 C ATOM 0 H THR A 144 0.374 7.282 -12.235 1.00 0.00 H new ATOM 0 HA THR A 144 -1.076 9.641 -11.245 1.00 0.00 H new ATOM 0 HB THR A 144 1.397 9.933 -12.879 1.00 0.00 H new ATOM 0 HG1 THR A 144 2.697 9.641 -10.986 1.00 0.00 H new ATOM 0 HG21 THR A 144 1.785 11.813 -11.323 1.00 0.00 H new ATOM 0 HG22 THR A 144 0.172 11.895 -12.070 1.00 0.00 H new ATOM 0 HG23 THR A 144 0.347 11.332 -10.391 1.00 0.00 H new ATOM 2100 N ARG A 145 -1.589 8.337 -13.938 1.00 0.00 N ATOM 2101 CA ARG A 145 -2.438 8.466 -15.088 1.00 0.00 C ATOM 2102 C ARG A 145 -3.815 8.868 -14.585 1.00 0.00 C ATOM 2103 O ARG A 145 -4.753 8.772 -15.397 1.00 0.00 O ATOM 2104 CB ARG A 145 -2.409 7.123 -15.827 1.00 0.00 C ATOM 2105 CG ARG A 145 -1.041 6.890 -16.496 1.00 0.00 C ATOM 2106 CD ARG A 145 -0.043 6.046 -15.674 1.00 0.00 C ATOM 2107 NE ARG A 145 1.335 6.577 -15.715 1.00 0.00 N ATOM 2108 CZ ARG A 145 2.062 6.848 -16.807 1.00 0.00 C ATOM 2109 NH1 ARG A 145 1.662 6.503 -18.025 1.00 0.00 N ATOM 2110 NH2 ARG A 145 3.213 7.495 -16.707 1.00 0.00 N ATOM 0 H ARG A 145 -1.506 7.383 -13.587 1.00 0.00 H new ATOM 0 HA ARG A 145 -2.116 9.230 -15.796 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.618 6.314 -15.127 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -3.195 7.102 -16.582 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -1.203 6.400 -17.456 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -0.587 7.859 -16.705 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -0.379 6.003 -14.638 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -0.044 5.023 -16.052 1.00 0.00 H new ATOM 0 HE ARG A 145 1.781 6.757 -14.815 1.00 0.00 H new ATOM 0 HH11 ARG A 145 0.775 6.015 -18.151 1.00 0.00 H new ATOM 0 HH12 ARG A 145 2.242 6.726 -18.834 1.00 0.00 H new ATOM 0 HH21 ARG A 145 3.553 7.792 -15.792 1.00 0.00 H new ATOM 0 HH22 ARG A 145 3.759 7.697 -17.545 1.00 0.00 H new TER 2124 ARG A 145