USER MOD reduce.3.24.130724 H: found=0, std=0, add=1102, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1097 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 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 126 ASN : amide:sc= -0.263 K(o=-0.26,f=-2.4!) USER MOD Set 2.1: A 64 SER OG : rot -123:sc= 1.15 USER MOD Set 2.2: A 131 ASN : amide:sc= 0.975 K(o=2.1,f=-0.62) USER MOD Set 3.1: A 32 SER OG : rot -125:sc= 0.516 USER MOD Set 3.2: A 40 TYR OH : rot 150:sc= 1.45 USER MOD Set 3.3: A 42 GLN : amide:sc= 1.05 K(o=3,f=-1.6) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 88:sc= 0 USER MOD Single : A -1 GLY N :NH3+ 141:sc= 0.022 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.568 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 CYS SG : rot 12:sc= -0.455 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= -0.363 K(o=-0.36,f=-0.98) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 53 GLN : amide:sc= 0.0771 K(o=0.077,f=-6.6!) USER MOD Single : A 58 TYR OH : rot 30:sc=-0.00798 USER MOD Single : A 59 CYS SG : rot 180:sc= -0.0157 USER MOD Single : A 69 THR OG1 : rot 90:sc= 0.441 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HE2:sc= -1 K(o=-1,f=-2.6) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot -79:sc= 0.321 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 MET CE :methyl -173:sc= -0.272 (180deg=-0.391) USER MOD Single : A 99 ASN : amide:sc= -0.377 X(o=-0.38,f=-0.02) USER MOD Single : A 102 ASN : amide:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.37) USER MOD Single : A 115 ASN : amide:sc= -0.235 X(o=-0.23,f=0) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 HIS : no HD1:sc= -0.177 K(o=-0.18,f=-0.72) USER MOD Single : A 130 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0702) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= 0 X(o=0,f=-0.048) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 3.323 -1.412 -3.437 1.00 0.00 N ATOM 2 CA GLY A -1 2.730 -0.311 -2.640 1.00 0.00 C ATOM 3 C GLY A -1 2.083 0.745 -3.527 1.00 0.00 C ATOM 4 O GLY A -1 2.569 1.014 -4.626 1.00 0.00 O ATOM 0 H1 GLY A -1 4.223 -1.706 -3.007 1.00 0.00 H new ATOM 0 H2 GLY A -1 2.668 -2.220 -3.455 1.00 0.00 H new ATOM 0 H3 GLY A -1 3.494 -1.084 -4.409 1.00 0.00 H new ATOM 0 HA2 GLY A -1 1.985 -0.718 -1.956 1.00 0.00 H new ATOM 0 HA3 GLY A -1 3.504 0.153 -2.028 1.00 0.00 H new ATOM 8 N GLY A 0 0.996 1.362 -3.054 1.00 0.00 N ATOM 9 CA GLY A 0 0.208 2.371 -3.760 1.00 0.00 C ATOM 10 C GLY A 0 0.021 3.656 -2.947 1.00 0.00 C ATOM 11 O GLY A 0 0.219 3.675 -1.730 1.00 0.00 O ATOM 0 H GLY A 0 0.626 1.161 -2.125 1.00 0.00 H new ATOM 0 HA2 GLY A 0 0.697 2.612 -4.704 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -0.770 1.956 -4.004 1.00 0.00 H new ATOM 15 N ALA A 1 -0.353 4.734 -3.634 1.00 0.00 N ATOM 16 CA ALA A 1 -0.466 6.089 -3.092 1.00 0.00 C ATOM 17 C ALA A 1 -1.329 7.005 -3.989 1.00 0.00 C ATOM 18 O ALA A 1 -1.802 6.595 -5.055 1.00 0.00 O ATOM 19 CB ALA A 1 0.958 6.620 -2.911 1.00 0.00 C ATOM 0 H ALA A 1 -0.596 4.686 -4.624 1.00 0.00 H new ATOM 0 HA ALA A 1 -0.984 6.073 -2.133 1.00 0.00 H new ATOM 0 HB1 ALA A 1 0.920 7.632 -2.507 1.00 0.00 H new ATOM 0 HB2 ALA A 1 1.502 5.974 -2.222 1.00 0.00 H new ATOM 0 HB3 ALA A 1 1.467 6.633 -3.875 1.00 0.00 H new ATOM 25 N LEU A 2 -1.523 8.252 -3.549 1.00 0.00 N ATOM 26 CA LEU A 2 -2.422 9.244 -4.143 1.00 0.00 C ATOM 27 C LEU A 2 -1.621 10.455 -4.655 1.00 0.00 C ATOM 28 O LEU A 2 -0.623 10.840 -4.045 1.00 0.00 O ATOM 29 CB LEU A 2 -3.437 9.713 -3.080 1.00 0.00 C ATOM 30 CG LEU A 2 -4.353 8.676 -2.398 1.00 0.00 C ATOM 31 CD1 LEU A 2 -5.013 7.717 -3.387 1.00 0.00 C ATOM 32 CD2 LEU A 2 -3.670 7.910 -1.268 1.00 0.00 C ATOM 0 H LEU A 2 -1.034 8.613 -2.730 1.00 0.00 H new ATOM 0 HA LEU A 2 -2.947 8.789 -4.983 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -2.877 10.221 -2.295 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.079 10.459 -3.548 1.00 0.00 H new ATOM 0 HG LEU A 2 -5.145 9.271 -1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -5.644 7.013 -2.845 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -5.623 8.283 -4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -4.244 7.170 -3.932 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -4.373 7.198 -0.834 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -2.807 7.373 -1.662 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -3.342 8.610 -0.500 1.00 0.00 H new ATOM 44 N SER A 3 -2.035 11.058 -5.771 1.00 0.00 N ATOM 45 CA SER A 3 -1.354 12.231 -6.347 1.00 0.00 C ATOM 46 C SER A 3 -1.512 13.485 -5.478 1.00 0.00 C ATOM 47 O SER A 3 -2.407 13.562 -4.636 1.00 0.00 O ATOM 48 CB SER A 3 -1.874 12.483 -7.763 1.00 0.00 C ATOM 49 OG SER A 3 -1.051 13.425 -8.431 1.00 0.00 O ATOM 0 H SER A 3 -2.849 10.752 -6.304 1.00 0.00 H new ATOM 0 HA SER A 3 -0.287 12.011 -6.384 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.894 11.547 -8.322 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.899 12.851 -7.721 1.00 0.00 H new ATOM 0 HG SER A 3 -1.394 13.575 -9.336 1.00 0.00 H new ATOM 55 N TYR A 4 -0.678 14.506 -5.712 1.00 0.00 N ATOM 56 CA TYR A 4 -0.787 15.808 -5.038 1.00 0.00 C ATOM 57 C TYR A 4 -2.209 16.390 -5.113 1.00 0.00 C ATOM 58 O TYR A 4 -2.738 16.884 -4.120 1.00 0.00 O ATOM 59 CB TYR A 4 0.215 16.786 -5.662 1.00 0.00 C ATOM 60 CG TYR A 4 0.195 18.168 -5.033 1.00 0.00 C ATOM 61 CD1 TYR A 4 -0.702 19.143 -5.509 1.00 0.00 C ATOM 62 CD2 TYR A 4 1.046 18.466 -3.952 1.00 0.00 C ATOM 63 CE1 TYR A 4 -0.776 20.404 -4.888 1.00 0.00 C ATOM 64 CE2 TYR A 4 0.980 19.728 -3.329 1.00 0.00 C ATOM 65 CZ TYR A 4 0.066 20.699 -3.791 1.00 0.00 C ATOM 66 OH TYR A 4 0.001 21.915 -3.181 1.00 0.00 O ATOM 0 H TYR A 4 0.094 14.453 -6.376 1.00 0.00 H new ATOM 0 HA TYR A 4 -0.560 15.657 -3.983 1.00 0.00 H new ATOM 0 HB2 TYR A 4 1.219 16.370 -5.572 1.00 0.00 H new ATOM 0 HB3 TYR A 4 0.003 16.879 -6.727 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -1.336 18.922 -6.355 1.00 0.00 H new ATOM 0 HD2 TYR A 4 1.750 17.727 -3.600 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -1.474 21.145 -5.249 1.00 0.00 H new ATOM 0 HE2 TYR A 4 1.630 19.953 -2.496 1.00 0.00 H new ATOM 0 HH TYR A 4 0.648 21.947 -2.446 1.00 0.00 H new ATOM 76 N GLU A 5 -2.838 16.291 -6.289 1.00 0.00 N ATOM 77 CA GLU A 5 -4.181 16.823 -6.571 1.00 0.00 C ATOM 78 C GLU A 5 -5.309 16.136 -5.779 1.00 0.00 C ATOM 79 O GLU A 5 -6.431 16.649 -5.738 1.00 0.00 O ATOM 80 CB GLU A 5 -4.493 16.709 -8.070 1.00 0.00 C ATOM 81 CG GLU A 5 -3.379 17.299 -8.942 1.00 0.00 C ATOM 82 CD GLU A 5 -3.861 17.579 -10.379 1.00 0.00 C ATOM 83 OE1 GLU A 5 -4.338 16.644 -11.066 1.00 0.00 O ATOM 84 OE2 GLU A 5 -3.756 18.745 -10.840 1.00 0.00 O ATOM 0 H GLU A 5 -2.418 15.827 -7.094 1.00 0.00 H new ATOM 0 HA GLU A 5 -4.154 17.865 -6.252 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -4.638 15.660 -8.330 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -5.430 17.223 -8.284 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -3.019 18.225 -8.493 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -2.536 16.609 -8.970 1.00 0.00 H new ATOM 91 N THR A 6 -5.039 14.984 -5.159 1.00 0.00 N ATOM 92 CA THR A 6 -6.001 14.282 -4.292 1.00 0.00 C ATOM 93 C THR A 6 -6.204 15.043 -2.982 1.00 0.00 C ATOM 94 O THR A 6 -5.265 15.233 -2.208 1.00 0.00 O ATOM 95 CB THR A 6 -5.549 12.846 -3.986 1.00 0.00 C ATOM 96 OG1 THR A 6 -5.355 12.129 -5.186 1.00 0.00 O ATOM 97 CG2 THR A 6 -6.601 12.082 -3.180 1.00 0.00 C ATOM 0 H THR A 6 -4.142 14.506 -5.242 1.00 0.00 H new ATOM 0 HA THR A 6 -6.945 14.236 -4.834 1.00 0.00 H new ATOM 0 HB THR A 6 -4.625 12.926 -3.414 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.436 12.259 -5.500 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.245 11.071 -2.983 1.00 0.00 H new ATOM 0 HG22 THR A 6 -6.778 12.595 -2.235 1.00 0.00 H new ATOM 0 HG23 THR A 6 -7.531 12.035 -3.747 1.00 0.00 H new ATOM 105 N GLU A 7 -7.443 15.454 -2.703 1.00 0.00 N ATOM 106 CA GLU A 7 -7.772 16.260 -1.523 1.00 0.00 C ATOM 107 C GLU A 7 -8.411 15.410 -0.418 1.00 0.00 C ATOM 108 O GLU A 7 -9.279 14.567 -0.672 1.00 0.00 O ATOM 109 CB GLU A 7 -8.700 17.425 -1.893 1.00 0.00 C ATOM 110 CG GLU A 7 -8.133 18.298 -3.023 1.00 0.00 C ATOM 111 CD GLU A 7 -8.989 19.551 -3.286 1.00 0.00 C ATOM 112 OE1 GLU A 7 -9.136 20.398 -2.372 1.00 0.00 O ATOM 113 OE2 GLU A 7 -9.510 19.711 -4.417 1.00 0.00 O ATOM 0 H GLU A 7 -8.249 15.237 -3.290 1.00 0.00 H new ATOM 0 HA GLU A 7 -6.835 16.665 -1.141 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -9.670 17.030 -2.196 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.869 18.043 -1.012 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -7.118 18.602 -2.768 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -8.069 17.707 -3.937 1.00 0.00 H new ATOM 120 N ILE A 8 -7.995 15.672 0.819 1.00 0.00 N ATOM 121 CA ILE A 8 -8.338 14.915 2.026 1.00 0.00 C ATOM 122 C ILE A 8 -8.970 15.887 3.015 1.00 0.00 C ATOM 123 O ILE A 8 -8.333 16.853 3.433 1.00 0.00 O ATOM 124 CB ILE A 8 -7.073 14.254 2.632 1.00 0.00 C ATOM 125 CG1 ILE A 8 -6.263 13.419 1.614 1.00 0.00 C ATOM 126 CG2 ILE A 8 -7.425 13.403 3.865 1.00 0.00 C ATOM 127 CD1 ILE A 8 -7.006 12.240 0.976 1.00 0.00 C ATOM 0 H ILE A 8 -7.377 16.459 1.019 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.037 14.113 1.788 1.00 0.00 H new ATOM 0 HB ILE A 8 -6.429 15.078 2.939 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.922 14.082 0.819 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.373 13.036 2.113 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.518 12.953 4.267 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -7.884 14.036 4.625 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.123 12.617 3.577 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.343 11.726 0.280 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.324 11.546 1.754 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.880 12.608 0.440 1.00 0.00 H new ATOM 139 N LEU A 9 -10.240 15.663 3.352 1.00 0.00 N ATOM 140 CA LEU A 9 -10.947 16.466 4.354 1.00 0.00 C ATOM 141 C LEU A 9 -10.295 16.323 5.744 1.00 0.00 C ATOM 142 O LEU A 9 -10.177 15.212 6.272 1.00 0.00 O ATOM 143 CB LEU A 9 -12.441 16.073 4.358 1.00 0.00 C ATOM 144 CG LEU A 9 -13.373 17.202 4.853 1.00 0.00 C ATOM 145 CD1 LEU A 9 -14.775 17.025 4.274 1.00 0.00 C ATOM 146 CD2 LEU A 9 -13.524 17.252 6.362 1.00 0.00 C ATOM 0 H LEU A 9 -10.808 14.922 2.940 1.00 0.00 H new ATOM 0 HA LEU A 9 -10.874 17.522 4.094 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -12.736 15.785 3.349 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -12.576 15.197 4.992 1.00 0.00 H new ATOM 0 HG LEU A 9 -12.902 18.126 4.518 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -15.420 17.827 4.631 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -14.726 17.056 3.186 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -15.181 16.064 4.591 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -14.192 18.069 6.634 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -13.940 16.309 6.717 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -12.548 17.413 6.820 1.00 0.00 H new ATOM 158 N THR A 10 -9.913 17.450 6.349 1.00 0.00 N ATOM 159 CA THR A 10 -9.318 17.523 7.694 1.00 0.00 C ATOM 160 C THR A 10 -10.176 18.344 8.661 1.00 0.00 C ATOM 161 O THR A 10 -10.951 19.214 8.261 1.00 0.00 O ATOM 162 CB THR A 10 -7.877 18.076 7.683 1.00 0.00 C ATOM 163 OG1 THR A 10 -7.845 19.459 7.399 1.00 0.00 O ATOM 164 CG2 THR A 10 -6.958 17.381 6.680 1.00 0.00 C ATOM 0 H THR A 10 -10.010 18.365 5.908 1.00 0.00 H new ATOM 0 HA THR A 10 -9.281 16.492 8.047 1.00 0.00 H new ATOM 0 HB THR A 10 -7.511 17.879 8.691 1.00 0.00 H new ATOM 0 HG1 THR A 10 -6.916 19.772 7.402 1.00 0.00 H new ATOM 0 HG21 THR A 10 -5.963 17.824 6.730 1.00 0.00 H new ATOM 0 HG22 THR A 10 -6.895 16.319 6.919 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.359 17.503 5.674 1.00 0.00 H new ATOM 172 N VAL A 11 -10.023 18.074 9.961 1.00 0.00 N ATOM 173 CA VAL A 11 -10.650 18.862 11.044 1.00 0.00 C ATOM 174 C VAL A 11 -9.903 20.189 11.269 1.00 0.00 C ATOM 175 O VAL A 11 -10.518 21.214 11.573 1.00 0.00 O ATOM 176 CB VAL A 11 -10.685 18.058 12.358 1.00 0.00 C ATOM 177 CG1 VAL A 11 -11.390 18.785 13.507 1.00 0.00 C ATOM 178 CG2 VAL A 11 -11.410 16.716 12.188 1.00 0.00 C ATOM 0 H VAL A 11 -9.457 17.297 10.302 1.00 0.00 H new ATOM 0 HA VAL A 11 -11.672 19.084 10.737 1.00 0.00 H new ATOM 0 HB VAL A 11 -9.633 17.917 12.605 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.375 18.158 14.398 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -10.875 19.723 13.715 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -12.423 18.993 13.227 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.412 16.181 13.138 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.437 16.895 11.870 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.896 16.118 11.435 1.00 0.00 H new ATOM 188 N GLU A 12 -8.574 20.170 11.118 1.00 0.00 N ATOM 189 CA GLU A 12 -7.692 21.322 11.348 1.00 0.00 C ATOM 190 C GLU A 12 -7.875 22.469 10.343 1.00 0.00 C ATOM 191 O GLU A 12 -7.729 23.634 10.726 1.00 0.00 O ATOM 192 CB GLU A 12 -6.232 20.837 11.327 1.00 0.00 C ATOM 193 CG GLU A 12 -5.697 20.499 12.724 1.00 0.00 C ATOM 194 CD GLU A 12 -5.663 21.725 13.657 1.00 0.00 C ATOM 195 OE1 GLU A 12 -4.785 22.609 13.488 1.00 0.00 O ATOM 196 OE2 GLU A 12 -6.511 21.815 14.580 1.00 0.00 O ATOM 0 H GLU A 12 -8.069 19.334 10.825 1.00 0.00 H new ATOM 0 HA GLU A 12 -7.962 21.737 12.319 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -6.156 19.955 10.691 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -5.604 21.608 10.879 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -6.320 19.724 13.170 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.692 20.087 12.634 1.00 0.00 H new ATOM 203 N TYR A 13 -8.223 22.163 9.086 1.00 0.00 N ATOM 204 CA TYR A 13 -8.410 23.168 8.030 1.00 0.00 C ATOM 205 C TYR A 13 -9.606 22.876 7.110 1.00 0.00 C ATOM 206 O TYR A 13 -10.431 23.767 6.888 1.00 0.00 O ATOM 207 CB TYR A 13 -7.132 23.278 7.181 1.00 0.00 C ATOM 208 CG TYR A 13 -5.898 23.818 7.880 1.00 0.00 C ATOM 209 CD1 TYR A 13 -5.893 25.145 8.357 1.00 0.00 C ATOM 210 CD2 TYR A 13 -4.736 23.024 7.999 1.00 0.00 C ATOM 211 CE1 TYR A 13 -4.738 25.677 8.959 1.00 0.00 C ATOM 212 CE2 TYR A 13 -3.576 23.557 8.596 1.00 0.00 C ATOM 213 CZ TYR A 13 -3.575 24.886 9.078 1.00 0.00 C ATOM 214 OH TYR A 13 -2.455 25.415 9.643 1.00 0.00 O ATOM 0 H TYR A 13 -8.384 21.206 8.771 1.00 0.00 H new ATOM 0 HA TYR A 13 -8.621 24.110 8.537 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -6.896 22.288 6.790 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -7.346 23.917 6.324 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -6.779 25.755 8.260 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -4.736 22.008 7.632 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -4.741 26.691 9.330 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.687 22.950 8.685 1.00 0.00 H new ATOM 0 HH TYR A 13 -1.743 24.741 9.651 1.00 0.00 H new ATOM 224 N GLY A 14 -9.713 21.656 6.573 1.00 0.00 N ATOM 225 CA GLY A 14 -10.750 21.268 5.610 1.00 0.00 C ATOM 226 C GLY A 14 -10.189 20.480 4.426 1.00 0.00 C ATOM 227 O GLY A 14 -9.286 19.660 4.572 1.00 0.00 O ATOM 0 H GLY A 14 -9.070 20.897 6.799 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -11.504 20.666 6.117 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.251 22.163 5.241 1.00 0.00 H new ATOM 231 N LEU A 15 -10.762 20.713 3.248 1.00 0.00 N ATOM 232 CA LEU A 15 -10.379 20.120 1.961 1.00 0.00 C ATOM 233 C LEU A 15 -8.999 20.608 1.462 1.00 0.00 C ATOM 234 O LEU A 15 -8.899 21.673 0.845 1.00 0.00 O ATOM 235 CB LEU A 15 -11.482 20.483 0.947 1.00 0.00 C ATOM 236 CG LEU A 15 -12.893 20.002 1.330 1.00 0.00 C ATOM 237 CD1 LEU A 15 -13.902 20.550 0.328 1.00 0.00 C ATOM 238 CD2 LEU A 15 -12.956 18.482 1.317 1.00 0.00 C ATOM 0 H LEU A 15 -11.549 21.355 3.156 1.00 0.00 H new ATOM 0 HA LEU A 15 -10.284 19.040 2.078 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -11.503 21.566 0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -11.219 20.059 -0.022 1.00 0.00 H new ATOM 0 HG LEU A 15 -13.127 20.360 2.333 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.902 20.211 0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -13.872 21.640 0.341 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -13.654 20.192 -0.671 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.960 18.157 1.590 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -12.715 18.116 0.319 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -12.238 18.082 2.033 1.00 0.00 H new ATOM 250 N LEU A 16 -7.937 19.833 1.728 1.00 0.00 N ATOM 251 CA LEU A 16 -6.540 20.167 1.381 1.00 0.00 C ATOM 252 C LEU A 16 -5.817 19.011 0.642 1.00 0.00 C ATOM 253 O LEU A 16 -6.115 17.842 0.899 1.00 0.00 O ATOM 254 CB LEU A 16 -5.748 20.541 2.662 1.00 0.00 C ATOM 255 CG LEU A 16 -5.819 21.986 3.201 1.00 0.00 C ATOM 256 CD1 LEU A 16 -5.382 23.039 2.180 1.00 0.00 C ATOM 257 CD2 LEU A 16 -7.179 22.399 3.752 1.00 0.00 C ATOM 0 H LEU A 16 -8.024 18.934 2.202 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.576 21.018 0.701 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.083 19.877 3.459 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -4.699 20.312 2.477 1.00 0.00 H new ATOM 0 HG LEU A 16 -5.110 21.957 4.029 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.457 24.031 2.626 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -4.350 22.852 1.883 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.027 22.985 1.303 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.130 23.429 4.107 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.929 22.321 2.965 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.451 21.743 4.579 1.00 0.00 H new ATOM 269 N PRO A 17 -4.847 19.305 -0.253 1.00 0.00 N ATOM 270 CA PRO A 17 -4.085 18.302 -1.012 1.00 0.00 C ATOM 271 C PRO A 17 -3.173 17.438 -0.125 1.00 0.00 C ATOM 272 O PRO A 17 -2.364 17.960 0.648 1.00 0.00 O ATOM 273 CB PRO A 17 -3.274 19.099 -2.044 1.00 0.00 C ATOM 274 CG PRO A 17 -3.149 20.492 -1.440 1.00 0.00 C ATOM 275 CD PRO A 17 -4.446 20.647 -0.657 1.00 0.00 C ATOM 0 HA PRO A 17 -4.760 17.587 -1.483 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.295 18.650 -2.212 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.780 19.129 -3.009 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -2.275 20.574 -0.793 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -3.049 21.257 -2.209 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -4.300 21.287 0.213 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -5.216 21.114 -1.271 1.00 0.00 H new ATOM 283 N ILE A 18 -3.246 16.109 -0.281 1.00 0.00 N ATOM 284 CA ILE A 18 -2.403 15.145 0.451 1.00 0.00 C ATOM 285 C ILE A 18 -0.906 15.385 0.244 1.00 0.00 C ATOM 286 O ILE A 18 -0.125 15.281 1.189 1.00 0.00 O ATOM 287 CB ILE A 18 -2.782 13.686 0.103 1.00 0.00 C ATOM 288 CG1 ILE A 18 -2.089 12.704 1.075 1.00 0.00 C ATOM 289 CG2 ILE A 18 -2.490 13.314 -1.361 1.00 0.00 C ATOM 290 CD1 ILE A 18 -2.639 11.277 1.005 1.00 0.00 C ATOM 0 H ILE A 18 -3.899 15.665 -0.926 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.603 15.309 1.510 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.862 13.605 0.223 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -1.021 12.683 0.857 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.199 13.077 2.093 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.779 12.278 -1.538 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -3.059 13.967 -2.023 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -1.425 13.433 -1.561 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.104 10.646 1.715 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.700 11.284 1.253 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -2.504 10.884 -0.003 1.00 0.00 H new ATOM 302 N GLY A 19 -0.495 15.769 -0.968 1.00 0.00 N ATOM 303 CA GLY A 19 0.920 15.947 -1.286 1.00 0.00 C ATOM 304 C GLY A 19 1.559 17.106 -0.521 1.00 0.00 C ATOM 305 O GLY A 19 2.722 17.010 -0.135 1.00 0.00 O ATOM 0 H GLY A 19 -1.126 15.962 -1.745 1.00 0.00 H new ATOM 0 HA2 GLY A 19 1.457 15.027 -1.057 1.00 0.00 H new ATOM 0 HA3 GLY A 19 1.028 16.121 -2.357 1.00 0.00 H new ATOM 309 N LYS A 20 0.787 18.160 -0.209 1.00 0.00 N ATOM 310 CA LYS A 20 1.250 19.276 0.623 1.00 0.00 C ATOM 311 C LYS A 20 1.383 18.859 2.089 1.00 0.00 C ATOM 312 O LYS A 20 2.347 19.228 2.752 1.00 0.00 O ATOM 313 CB LYS A 20 0.283 20.460 0.470 1.00 0.00 C ATOM 314 CG LYS A 20 0.896 21.777 0.966 1.00 0.00 C ATOM 315 CD LYS A 20 -0.138 22.910 0.923 1.00 0.00 C ATOM 316 CE LYS A 20 0.527 24.241 1.291 1.00 0.00 C ATOM 317 NZ LYS A 20 -0.463 25.350 1.362 1.00 0.00 N ATOM 0 H LYS A 20 -0.177 18.260 -0.528 1.00 0.00 H new ATOM 0 HA LYS A 20 2.241 19.579 0.286 1.00 0.00 H new ATOM 0 HB2 LYS A 20 0.002 20.564 -0.578 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.631 20.254 1.027 1.00 0.00 H new ATOM 0 HG2 LYS A 20 1.263 21.652 1.985 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.755 22.039 0.348 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.576 22.976 -0.073 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.952 22.697 1.616 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.032 24.142 2.252 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.291 24.482 0.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.024 26.234 1.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.927 25.461 0.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.178 25.131 2.085 1.00 0.00 H new ATOM 331 N ILE A 21 0.452 18.038 2.584 1.00 0.00 N ATOM 332 CA ILE A 21 0.464 17.532 3.963 1.00 0.00 C ATOM 333 C ILE A 21 1.684 16.642 4.175 1.00 0.00 C ATOM 334 O ILE A 21 2.325 16.732 5.214 1.00 0.00 O ATOM 335 CB ILE A 21 -0.854 16.804 4.314 1.00 0.00 C ATOM 336 CG1 ILE A 21 -2.049 17.788 4.246 1.00 0.00 C ATOM 337 CG2 ILE A 21 -0.801 16.132 5.699 1.00 0.00 C ATOM 338 CD1 ILE A 21 -3.412 17.096 4.138 1.00 0.00 C ATOM 0 H ILE A 21 -0.339 17.702 2.035 1.00 0.00 H new ATOM 0 HA ILE A 21 0.536 18.379 4.646 1.00 0.00 H new ATOM 0 HB ILE A 21 -0.990 16.015 3.574 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -2.041 18.418 5.136 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -1.917 18.447 3.388 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -1.750 15.634 5.899 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.004 15.398 5.717 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.620 16.888 6.463 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.200 17.848 4.095 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.441 16.488 3.234 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.566 16.459 5.009 1.00 0.00 H new ATOM 350 N VAL A 22 2.041 15.824 3.182 1.00 0.00 N ATOM 351 CA VAL A 22 3.175 14.895 3.255 1.00 0.00 C ATOM 352 C VAL A 22 4.519 15.572 2.980 1.00 0.00 C ATOM 353 O VAL A 22 5.488 15.281 3.677 1.00 0.00 O ATOM 354 CB VAL A 22 2.921 13.704 2.316 1.00 0.00 C ATOM 355 CG1 VAL A 22 4.109 12.738 2.223 1.00 0.00 C ATOM 356 CG2 VAL A 22 1.709 12.912 2.836 1.00 0.00 C ATOM 0 H VAL A 22 1.545 15.787 2.292 1.00 0.00 H new ATOM 0 HA VAL A 22 3.247 14.528 4.279 1.00 0.00 H new ATOM 0 HB VAL A 22 2.751 14.118 1.322 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.862 11.922 1.544 1.00 0.00 H new ATOM 0 HG12 VAL A 22 4.982 13.271 1.847 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.328 12.334 3.212 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.519 12.064 2.178 1.00 0.00 H new ATOM 0 HG22 VAL A 22 1.916 12.550 3.843 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.832 13.560 2.856 1.00 0.00 H new ATOM 366 N GLU A 23 4.607 16.510 2.033 1.00 0.00 N ATOM 367 CA GLU A 23 5.879 17.196 1.736 1.00 0.00 C ATOM 368 C GLU A 23 6.260 18.256 2.788 1.00 0.00 C ATOM 369 O GLU A 23 7.445 18.553 2.968 1.00 0.00 O ATOM 370 CB GLU A 23 5.869 17.775 0.313 1.00 0.00 C ATOM 371 CG GLU A 23 5.204 19.148 0.185 1.00 0.00 C ATOM 372 CD GLU A 23 5.054 19.637 -1.270 1.00 0.00 C ATOM 373 OE1 GLU A 23 5.794 19.178 -2.179 1.00 0.00 O ATOM 374 OE2 GLU A 23 4.224 20.552 -1.514 1.00 0.00 O ATOM 0 H GLU A 23 3.821 16.814 1.459 1.00 0.00 H new ATOM 0 HA GLU A 23 6.662 16.440 1.789 1.00 0.00 H new ATOM 0 HB2 GLU A 23 6.897 17.850 -0.041 1.00 0.00 H new ATOM 0 HB3 GLU A 23 5.355 17.075 -0.346 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.218 19.108 0.648 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.789 19.878 0.745 1.00 0.00 H new ATOM 381 N LYS A 24 5.265 18.789 3.518 1.00 0.00 N ATOM 382 CA LYS A 24 5.439 19.781 4.600 1.00 0.00 C ATOM 383 C LYS A 24 5.181 19.174 5.989 1.00 0.00 C ATOM 384 O LYS A 24 5.281 19.880 6.995 1.00 0.00 O ATOM 385 CB LYS A 24 4.543 21.016 4.361 1.00 0.00 C ATOM 386 CG LYS A 24 4.622 21.664 2.967 1.00 0.00 C ATOM 387 CD LYS A 24 6.009 22.163 2.537 1.00 0.00 C ATOM 388 CE LYS A 24 6.523 23.285 3.445 1.00 0.00 C ATOM 389 NZ LYS A 24 7.780 23.882 2.914 1.00 0.00 N ATOM 0 H LYS A 24 4.288 18.536 3.369 1.00 0.00 H new ATOM 0 HA LYS A 24 6.481 20.101 4.580 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.508 20.727 4.544 1.00 0.00 H new ATOM 0 HB3 LYS A 24 4.799 21.772 5.103 1.00 0.00 H new ATOM 0 HG2 LYS A 24 4.273 20.940 2.231 1.00 0.00 H new ATOM 0 HG3 LYS A 24 3.930 22.505 2.939 1.00 0.00 H new ATOM 0 HD2 LYS A 24 6.714 21.332 2.553 1.00 0.00 H new ATOM 0 HD3 LYS A 24 5.962 22.522 1.509 1.00 0.00 H new ATOM 0 HE2 LYS A 24 5.761 24.059 3.536 1.00 0.00 H new ATOM 0 HE3 LYS A 24 6.700 22.892 4.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 8.102 24.638 3.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 8.513 23.147 2.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 7.604 24.278 1.969 1.00 0.00 H new ATOM 403 N ARG A 25 4.886 17.865 6.038 1.00 0.00 N ATOM 404 CA ARG A 25 4.625 17.049 7.244 1.00 0.00 C ATOM 405 C ARG A 25 3.650 17.720 8.225 1.00 0.00 C ATOM 406 O ARG A 25 3.964 17.933 9.400 1.00 0.00 O ATOM 407 CB ARG A 25 5.948 16.595 7.891 1.00 0.00 C ATOM 408 CG ARG A 25 6.915 15.910 6.902 1.00 0.00 C ATOM 409 CD ARG A 25 7.982 16.841 6.297 1.00 0.00 C ATOM 410 NE ARG A 25 8.846 17.442 7.333 1.00 0.00 N ATOM 411 CZ ARG A 25 9.558 18.552 7.229 1.00 0.00 C ATOM 412 NH1 ARG A 25 9.633 19.234 6.120 1.00 0.00 N ATOM 413 NH2 ARG A 25 10.219 19.003 8.258 1.00 0.00 N ATOM 0 H ARG A 25 4.818 17.310 5.185 1.00 0.00 H new ATOM 0 HA ARG A 25 4.103 16.146 6.928 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.444 17.460 8.331 1.00 0.00 H new ATOM 0 HB3 ARG A 25 5.727 15.906 8.706 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.417 15.090 7.415 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.333 15.471 6.091 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.597 16.279 5.594 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.492 17.633 5.730 1.00 0.00 H new ATOM 0 HE ARG A 25 8.899 16.948 8.224 1.00 0.00 H new ATOM 0 HH11 ARG A 25 9.131 18.916 5.291 1.00 0.00 H new ATOM 0 HH12 ARG A 25 10.193 20.085 6.082 1.00 0.00 H new ATOM 0 HH21 ARG A 25 10.188 18.500 9.145 1.00 0.00 H new ATOM 0 HH22 ARG A 25 10.768 19.859 8.176 1.00 0.00 H new ATOM 427 N ILE A 26 2.490 18.140 7.711 1.00 0.00 N ATOM 428 CA ILE A 26 1.526 18.982 8.437 1.00 0.00 C ATOM 429 C ILE A 26 0.754 18.137 9.458 1.00 0.00 C ATOM 430 O ILE A 26 0.109 17.148 9.104 1.00 0.00 O ATOM 431 CB ILE A 26 0.566 19.726 7.475 1.00 0.00 C ATOM 432 CG1 ILE A 26 1.349 20.400 6.330 1.00 0.00 C ATOM 433 CG2 ILE A 26 -0.236 20.787 8.254 1.00 0.00 C ATOM 434 CD1 ILE A 26 0.456 21.126 5.312 1.00 0.00 C ATOM 0 H ILE A 26 2.187 17.903 6.766 1.00 0.00 H new ATOM 0 HA ILE A 26 2.085 19.750 8.973 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.119 18.998 7.042 1.00 0.00 H new ATOM 0 HG12 ILE A 26 2.054 21.114 6.756 1.00 0.00 H new ATOM 0 HG13 ILE A 26 1.937 19.644 5.810 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.909 21.307 7.573 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.817 20.301 9.038 1.00 0.00 H new ATOM 0 HG23 ILE A 26 0.451 21.504 8.703 1.00 0.00 H new ATOM 0 HD11 ILE A 26 1.078 21.575 4.537 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.232 20.413 4.857 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.113 21.906 5.818 1.00 0.00 H new ATOM 446 N GLU A 27 0.830 18.533 10.726 1.00 0.00 N ATOM 447 CA GLU A 27 0.133 17.886 11.847 1.00 0.00 C ATOM 448 C GLU A 27 -1.370 18.218 11.847 1.00 0.00 C ATOM 449 O GLU A 27 -1.788 19.262 12.362 1.00 0.00 O ATOM 450 CB GLU A 27 0.792 18.269 13.185 1.00 0.00 C ATOM 451 CG GLU A 27 2.155 17.589 13.359 1.00 0.00 C ATOM 452 CD GLU A 27 2.806 17.982 14.696 1.00 0.00 C ATOM 453 OE1 GLU A 27 3.519 19.015 14.752 1.00 0.00 O ATOM 454 OE2 GLU A 27 2.618 17.259 15.706 1.00 0.00 O ATOM 0 H GLU A 27 1.392 19.334 11.016 1.00 0.00 H new ATOM 0 HA GLU A 27 0.222 16.807 11.720 1.00 0.00 H new ATOM 0 HB2 GLU A 27 0.916 19.351 13.233 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.136 17.986 14.008 1.00 0.00 H new ATOM 0 HG2 GLU A 27 2.033 16.507 13.315 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.812 17.869 12.535 1.00 0.00 H new ATOM 461 N CYS A 28 -2.180 17.317 11.279 1.00 0.00 N ATOM 462 CA CYS A 28 -3.635 17.469 11.121 1.00 0.00 C ATOM 463 C CYS A 28 -4.412 16.191 11.497 1.00 0.00 C ATOM 464 O CYS A 28 -3.837 15.126 11.743 1.00 0.00 O ATOM 465 CB CYS A 28 -3.952 17.922 9.678 1.00 0.00 C ATOM 466 SG CYS A 28 -3.469 19.650 9.400 1.00 0.00 S ATOM 0 H CYS A 28 -1.832 16.434 10.904 1.00 0.00 H new ATOM 0 HA CYS A 28 -3.971 18.235 11.820 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -3.429 17.279 8.971 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -5.019 17.806 9.485 1.00 0.00 H new ATOM 0 HG CYS A 28 -2.732 20.059 10.390 1.00 0.00 H new ATOM 472 N THR A 29 -5.743 16.299 11.508 1.00 0.00 N ATOM 473 CA THR A 29 -6.690 15.237 11.899 1.00 0.00 C ATOM 474 C THR A 29 -7.628 14.951 10.726 1.00 0.00 C ATOM 475 O THR A 29 -8.072 15.890 10.065 1.00 0.00 O ATOM 476 CB THR A 29 -7.521 15.684 13.119 1.00 0.00 C ATOM 477 OG1 THR A 29 -6.725 16.340 14.083 1.00 0.00 O ATOM 478 CG2 THR A 29 -8.231 14.546 13.847 1.00 0.00 C ATOM 0 H THR A 29 -6.215 17.161 11.235 1.00 0.00 H new ATOM 0 HA THR A 29 -6.132 14.338 12.163 1.00 0.00 H new ATOM 0 HB THR A 29 -8.267 16.352 12.688 1.00 0.00 H new ATOM 0 HG1 THR A 29 -7.285 16.610 14.840 1.00 0.00 H new ATOM 0 HG21 THR A 29 -8.792 14.948 14.691 1.00 0.00 H new ATOM 0 HG22 THR A 29 -8.915 14.046 13.161 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.494 13.830 14.209 1.00 0.00 H new ATOM 486 N VAL A 30 -7.960 13.684 10.476 1.00 0.00 N ATOM 487 CA VAL A 30 -8.721 13.208 9.299 1.00 0.00 C ATOM 488 C VAL A 30 -9.949 12.401 9.724 1.00 0.00 C ATOM 489 O VAL A 30 -10.014 11.935 10.863 1.00 0.00 O ATOM 490 CB VAL A 30 -7.835 12.372 8.343 1.00 0.00 C ATOM 491 CG1 VAL A 30 -6.642 13.182 7.830 1.00 0.00 C ATOM 492 CG2 VAL A 30 -7.305 11.070 8.963 1.00 0.00 C ATOM 0 H VAL A 30 -7.701 12.925 11.106 1.00 0.00 H new ATOM 0 HA VAL A 30 -9.057 14.093 8.759 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.498 12.106 7.520 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.043 12.564 7.162 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -7.002 14.057 7.289 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.031 13.503 8.673 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.694 10.541 8.232 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.701 11.304 9.840 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -8.144 10.440 9.258 1.00 0.00 H new ATOM 502 N TYR A 31 -10.901 12.205 8.809 1.00 0.00 N ATOM 503 CA TYR A 31 -12.113 11.409 9.026 1.00 0.00 C ATOM 504 C TYR A 31 -11.932 9.999 8.461 1.00 0.00 C ATOM 505 O TYR A 31 -11.238 9.799 7.462 1.00 0.00 O ATOM 506 CB TYR A 31 -13.341 12.075 8.380 1.00 0.00 C ATOM 507 CG TYR A 31 -13.761 13.389 9.008 1.00 0.00 C ATOM 508 CD1 TYR A 31 -13.095 14.587 8.677 1.00 0.00 C ATOM 509 CD2 TYR A 31 -14.845 13.416 9.909 1.00 0.00 C ATOM 510 CE1 TYR A 31 -13.496 15.804 9.265 1.00 0.00 C ATOM 511 CE2 TYR A 31 -15.260 14.632 10.483 1.00 0.00 C ATOM 512 CZ TYR A 31 -14.586 15.831 10.163 1.00 0.00 C ATOM 513 OH TYR A 31 -15.007 17.003 10.709 1.00 0.00 O ATOM 0 H TYR A 31 -10.850 12.605 7.872 1.00 0.00 H new ATOM 0 HA TYR A 31 -12.282 11.347 10.101 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -13.130 12.245 7.324 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -14.180 11.381 8.430 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -12.277 14.572 7.972 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -15.359 12.500 10.160 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -12.969 16.717 9.029 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -16.094 14.648 11.169 1.00 0.00 H new ATOM 0 HH TYR A 31 -15.768 16.833 11.302 1.00 0.00 H new ATOM 523 N SER A 32 -12.567 9.026 9.108 1.00 0.00 N ATOM 524 CA SER A 32 -12.450 7.593 8.829 1.00 0.00 C ATOM 525 C SER A 32 -13.695 6.861 9.360 1.00 0.00 C ATOM 526 O SER A 32 -14.371 7.361 10.263 1.00 0.00 O ATOM 527 CB SER A 32 -11.164 7.097 9.506 1.00 0.00 C ATOM 528 OG SER A 32 -11.128 5.687 9.621 1.00 0.00 O ATOM 0 H SER A 32 -13.208 9.221 9.877 1.00 0.00 H new ATOM 0 HA SER A 32 -12.394 7.396 7.758 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.301 7.435 8.933 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.083 7.543 10.497 1.00 0.00 H new ATOM 0 HG SER A 32 -10.985 5.439 10.558 1.00 0.00 H new ATOM 534 N VAL A 33 -14.019 5.686 8.807 1.00 0.00 N ATOM 535 CA VAL A 33 -15.117 4.826 9.290 1.00 0.00 C ATOM 536 C VAL A 33 -14.544 3.662 10.100 1.00 0.00 C ATOM 537 O VAL A 33 -13.656 2.945 9.628 1.00 0.00 O ATOM 538 CB VAL A 33 -16.001 4.263 8.155 1.00 0.00 C ATOM 539 CG1 VAL A 33 -17.379 3.921 8.703 1.00 0.00 C ATOM 540 CG2 VAL A 33 -16.197 5.221 6.975 1.00 0.00 C ATOM 0 H VAL A 33 -13.524 5.298 8.004 1.00 0.00 H new ATOM 0 HA VAL A 33 -15.753 5.458 9.910 1.00 0.00 H new ATOM 0 HB VAL A 33 -15.472 3.386 7.782 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -18.001 3.524 7.901 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -17.282 3.174 9.491 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -17.842 4.820 9.110 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -16.829 4.748 6.224 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -16.673 6.137 7.325 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -15.228 5.460 6.536 1.00 0.00 H new ATOM 550 N ASP A 34 -15.050 3.475 11.322 1.00 0.00 N ATOM 551 CA ASP A 34 -14.664 2.394 12.234 1.00 0.00 C ATOM 552 C ASP A 34 -15.136 1.010 11.745 1.00 0.00 C ATOM 553 O ASP A 34 -15.911 0.869 10.793 1.00 0.00 O ATOM 554 CB ASP A 34 -15.246 2.688 13.631 1.00 0.00 C ATOM 555 CG ASP A 34 -14.675 1.821 14.766 1.00 0.00 C ATOM 556 OD1 ASP A 34 -13.437 1.635 14.829 1.00 0.00 O ATOM 557 OD2 ASP A 34 -15.479 1.261 15.548 1.00 0.00 O ATOM 0 H ASP A 34 -15.761 4.090 11.716 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.575 2.359 12.272 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -15.068 3.737 13.870 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -16.326 2.548 13.595 1.00 0.00 H new ATOM 562 N ASN A 35 -14.730 -0.023 12.481 1.00 0.00 N ATOM 563 CA ASN A 35 -15.136 -1.422 12.270 1.00 0.00 C ATOM 564 C ASN A 35 -16.656 -1.650 12.423 1.00 0.00 C ATOM 565 O ASN A 35 -17.212 -2.561 11.805 1.00 0.00 O ATOM 566 CB ASN A 35 -14.350 -2.326 13.237 1.00 0.00 C ATOM 567 CG ASN A 35 -12.873 -2.457 12.887 1.00 0.00 C ATOM 568 OD1 ASN A 35 -12.476 -2.529 11.731 1.00 0.00 O ATOM 569 ND2 ASN A 35 -12.008 -2.522 13.875 1.00 0.00 N ATOM 0 H ASN A 35 -14.089 0.088 13.267 1.00 0.00 H new ATOM 0 HA ASN A 35 -14.901 -1.678 11.237 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -14.441 -1.928 14.248 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -14.803 -3.318 13.243 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -11.014 -2.632 13.676 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -12.331 -2.463 14.841 1.00 0.00 H new ATOM 576 N ASN A 36 -17.337 -0.812 13.215 1.00 0.00 N ATOM 577 CA ASN A 36 -18.795 -0.814 13.397 1.00 0.00 C ATOM 578 C ASN A 36 -19.546 0.055 12.358 1.00 0.00 C ATOM 579 O ASN A 36 -20.774 0.163 12.412 1.00 0.00 O ATOM 580 CB ASN A 36 -19.093 -0.365 14.840 1.00 0.00 C ATOM 581 CG ASN A 36 -18.666 -1.405 15.863 1.00 0.00 C ATOM 582 OD1 ASN A 36 -19.300 -2.442 16.028 1.00 0.00 O ATOM 583 ND2 ASN A 36 -17.589 -1.178 16.583 1.00 0.00 N ATOM 0 H ASN A 36 -16.873 -0.089 13.765 1.00 0.00 H new ATOM 0 HA ASN A 36 -19.167 -1.825 13.229 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -18.577 0.574 15.041 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -20.160 -0.171 14.945 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -17.284 -1.863 17.275 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -17.058 -0.317 16.449 1.00 0.00 H new ATOM 590 N GLY A 37 -18.830 0.689 11.419 1.00 0.00 N ATOM 591 CA GLY A 37 -19.395 1.561 10.382 1.00 0.00 C ATOM 592 C GLY A 37 -19.773 2.973 10.866 1.00 0.00 C ATOM 593 O GLY A 37 -20.558 3.659 10.206 1.00 0.00 O ATOM 0 H GLY A 37 -17.815 0.607 11.359 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -18.674 1.651 9.569 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -20.283 1.083 9.969 1.00 0.00 H new ATOM 597 N ASN A 38 -19.228 3.412 12.007 1.00 0.00 N ATOM 598 CA ASN A 38 -19.397 4.768 12.544 1.00 0.00 C ATOM 599 C ASN A 38 -18.256 5.675 12.058 1.00 0.00 C ATOM 600 O ASN A 38 -17.086 5.295 12.148 1.00 0.00 O ATOM 601 CB ASN A 38 -19.396 4.707 14.084 1.00 0.00 C ATOM 602 CG ASN A 38 -20.595 3.967 14.654 1.00 0.00 C ATOM 603 OD1 ASN A 38 -21.739 4.186 14.272 1.00 0.00 O ATOM 604 ND2 ASN A 38 -20.381 3.071 15.591 1.00 0.00 N ATOM 0 H ASN A 38 -18.643 2.820 12.597 1.00 0.00 H new ATOM 0 HA ASN A 38 -20.344 5.179 12.194 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -18.482 4.219 14.421 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -19.381 5.722 14.482 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -21.165 2.561 15.997 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -19.431 2.886 15.912 1.00 0.00 H new ATOM 611 N ILE A 39 -18.569 6.878 11.571 1.00 0.00 N ATOM 612 CA ILE A 39 -17.561 7.878 11.214 1.00 0.00 C ATOM 613 C ILE A 39 -16.980 8.480 12.503 1.00 0.00 C ATOM 614 O ILE A 39 -17.714 8.911 13.399 1.00 0.00 O ATOM 615 CB ILE A 39 -18.138 8.961 10.275 1.00 0.00 C ATOM 616 CG1 ILE A 39 -18.753 8.318 9.007 1.00 0.00 C ATOM 617 CG2 ILE A 39 -17.016 9.948 9.888 1.00 0.00 C ATOM 618 CD1 ILE A 39 -19.415 9.324 8.058 1.00 0.00 C ATOM 0 H ILE A 39 -19.529 7.186 11.413 1.00 0.00 H new ATOM 0 HA ILE A 39 -16.758 7.397 10.656 1.00 0.00 H new ATOM 0 HB ILE A 39 -18.931 9.498 10.795 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -17.971 7.784 8.467 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -19.494 7.578 9.310 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -17.418 10.714 9.225 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -16.619 10.418 10.788 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -16.218 9.409 9.377 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -19.821 8.797 7.195 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -20.220 9.841 8.580 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -18.674 10.051 7.724 1.00 0.00 H new ATOM 630 N TYR A 40 -15.656 8.529 12.568 1.00 0.00 N ATOM 631 CA TYR A 40 -14.857 9.124 13.642 1.00 0.00 C ATOM 632 C TYR A 40 -13.673 9.924 13.062 1.00 0.00 C ATOM 633 O TYR A 40 -13.459 9.948 11.844 1.00 0.00 O ATOM 634 CB TYR A 40 -14.404 8.020 14.621 1.00 0.00 C ATOM 635 CG TYR A 40 -13.279 7.132 14.111 1.00 0.00 C ATOM 636 CD1 TYR A 40 -13.548 6.079 13.211 1.00 0.00 C ATOM 637 CD2 TYR A 40 -11.952 7.377 14.520 1.00 0.00 C ATOM 638 CE1 TYR A 40 -12.489 5.328 12.670 1.00 0.00 C ATOM 639 CE2 TYR A 40 -10.895 6.616 13.986 1.00 0.00 C ATOM 640 CZ TYR A 40 -11.159 5.613 13.031 1.00 0.00 C ATOM 641 OH TYR A 40 -10.140 4.941 12.431 1.00 0.00 O ATOM 0 H TYR A 40 -15.073 8.132 11.831 1.00 0.00 H new ATOM 0 HA TYR A 40 -15.465 9.834 14.202 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.083 8.489 15.551 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.262 7.392 14.860 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.567 5.850 12.938 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.746 8.151 15.245 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.698 4.529 11.974 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -9.881 6.801 14.308 1.00 0.00 H new ATOM 0 HH TYR A 40 -9.347 5.516 12.393 1.00 0.00 H new ATOM 651 N THR A 41 -12.893 10.580 13.926 1.00 0.00 N ATOM 652 CA THR A 41 -11.723 11.390 13.539 1.00 0.00 C ATOM 653 C THR A 41 -10.454 10.969 14.277 1.00 0.00 C ATOM 654 O THR A 41 -10.501 10.618 15.459 1.00 0.00 O ATOM 655 CB THR A 41 -11.964 12.900 13.736 1.00 0.00 C ATOM 656 OG1 THR A 41 -12.592 13.191 14.972 1.00 0.00 O ATOM 657 CG2 THR A 41 -12.842 13.462 12.623 1.00 0.00 C ATOM 0 H THR A 41 -13.056 10.566 14.933 1.00 0.00 H new ATOM 0 HA THR A 41 -11.578 11.202 12.475 1.00 0.00 H new ATOM 0 HB THR A 41 -10.978 13.364 13.719 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.722 14.159 15.053 1.00 0.00 H new ATOM 0 HG21 THR A 41 -12.997 14.529 12.785 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.353 13.309 11.661 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.805 12.951 12.626 1.00 0.00 H new ATOM 665 N GLN A 42 -9.314 11.023 13.581 1.00 0.00 N ATOM 666 CA GLN A 42 -8.017 10.527 14.062 1.00 0.00 C ATOM 667 C GLN A 42 -6.845 11.418 13.609 1.00 0.00 C ATOM 668 O GLN A 42 -6.862 11.911 12.477 1.00 0.00 O ATOM 669 CB GLN A 42 -7.819 9.076 13.586 1.00 0.00 C ATOM 670 CG GLN A 42 -7.818 8.877 12.054 1.00 0.00 C ATOM 671 CD GLN A 42 -7.778 7.409 11.621 1.00 0.00 C ATOM 672 OE1 GLN A 42 -7.929 6.479 12.402 1.00 0.00 O ATOM 673 NE2 GLN A 42 -7.594 7.139 10.349 1.00 0.00 N ATOM 0 H GLN A 42 -9.265 11.423 12.644 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.025 10.558 15.152 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.874 8.706 13.984 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -8.609 8.459 14.015 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -8.709 9.345 11.636 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -6.957 9.395 11.630 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.466 7.898 9.680 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -7.579 6.170 10.030 1.00 0.00 H new ATOM 682 N PRO A 43 -5.824 11.644 14.460 1.00 0.00 N ATOM 683 CA PRO A 43 -4.639 12.415 14.089 1.00 0.00 C ATOM 684 C PRO A 43 -3.733 11.627 13.129 1.00 0.00 C ATOM 685 O PRO A 43 -3.654 10.393 13.193 1.00 0.00 O ATOM 686 CB PRO A 43 -3.926 12.715 15.411 1.00 0.00 C ATOM 687 CG PRO A 43 -4.300 11.525 16.294 1.00 0.00 C ATOM 688 CD PRO A 43 -5.717 11.181 15.838 1.00 0.00 C ATOM 0 HA PRO A 43 -4.903 13.328 13.556 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -2.847 12.792 15.277 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.262 13.657 15.844 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -3.617 10.688 16.151 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -4.270 11.784 17.352 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -5.897 10.108 15.903 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -6.459 11.668 16.471 1.00 0.00 H new ATOM 696 N VAL A 44 -3.012 12.339 12.263 1.00 0.00 N ATOM 697 CA VAL A 44 -1.937 11.763 11.437 1.00 0.00 C ATOM 698 C VAL A 44 -0.836 11.148 12.321 1.00 0.00 C ATOM 699 O VAL A 44 -0.437 11.742 13.328 1.00 0.00 O ATOM 700 CB VAL A 44 -1.385 12.815 10.456 1.00 0.00 C ATOM 701 CG1 VAL A 44 -0.682 14.003 11.122 1.00 0.00 C ATOM 702 CG2 VAL A 44 -0.421 12.179 9.455 1.00 0.00 C ATOM 0 H VAL A 44 -3.154 13.337 12.110 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.350 10.952 10.838 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.269 13.207 9.953 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.326 14.692 10.356 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.383 14.520 11.777 1.00 0.00 H new ATOM 0 HG13 VAL A 44 0.164 13.643 11.708 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.046 12.944 8.775 1.00 0.00 H new ATOM 0 HG22 VAL A 44 0.415 11.729 9.990 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.943 11.410 8.885 1.00 0.00 H new ATOM 712 N ALA A 45 -0.342 9.958 11.959 1.00 0.00 N ATOM 713 CA ALA A 45 0.709 9.258 12.702 1.00 0.00 C ATOM 714 C ALA A 45 2.101 9.474 12.069 1.00 0.00 C ATOM 715 O ALA A 45 3.055 9.805 12.779 1.00 0.00 O ATOM 716 CB ALA A 45 0.335 7.770 12.799 1.00 0.00 C ATOM 0 H ALA A 45 -0.664 9.451 11.135 1.00 0.00 H new ATOM 0 HA ALA A 45 0.779 9.671 13.708 1.00 0.00 H new ATOM 0 HB1 ALA A 45 1.109 7.236 13.350 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.617 7.667 13.319 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.248 7.351 11.797 1.00 0.00 H new ATOM 722 N GLN A 46 2.208 9.343 10.741 1.00 0.00 N ATOM 723 CA GLN A 46 3.418 9.583 9.936 1.00 0.00 C ATOM 724 C GLN A 46 3.062 10.153 8.545 1.00 0.00 C ATOM 725 O GLN A 46 1.888 10.281 8.191 1.00 0.00 O ATOM 726 CB GLN A 46 4.228 8.277 9.767 1.00 0.00 C ATOM 727 CG GLN A 46 4.794 7.655 11.055 1.00 0.00 C ATOM 728 CD GLN A 46 3.826 6.756 11.831 1.00 0.00 C ATOM 729 OE1 GLN A 46 2.959 6.084 11.283 1.00 0.00 O ATOM 730 NE2 GLN A 46 3.947 6.687 13.142 1.00 0.00 N ATOM 0 H GLN A 46 1.416 9.053 10.168 1.00 0.00 H new ATOM 0 HA GLN A 46 4.024 10.316 10.468 1.00 0.00 H new ATOM 0 HB2 GLN A 46 3.589 7.539 9.282 1.00 0.00 H new ATOM 0 HB3 GLN A 46 5.058 8.475 9.089 1.00 0.00 H new ATOM 0 HG2 GLN A 46 5.678 7.072 10.798 1.00 0.00 H new ATOM 0 HG3 GLN A 46 5.123 8.460 11.713 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.662 7.238 13.618 1.00 0.00 H new ATOM 0 HE22 GLN A 46 3.326 6.083 13.680 1.00 0.00 H new ATOM 739 N TRP A 47 4.073 10.436 7.720 1.00 0.00 N ATOM 740 CA TRP A 47 3.938 10.943 6.348 1.00 0.00 C ATOM 741 C TRP A 47 4.896 10.169 5.425 1.00 0.00 C ATOM 742 O TRP A 47 6.110 10.179 5.654 1.00 0.00 O ATOM 743 CB TRP A 47 4.252 12.451 6.337 1.00 0.00 C ATOM 744 CG TRP A 47 3.417 13.322 7.224 1.00 0.00 C ATOM 745 CD1 TRP A 47 2.316 14.023 6.858 1.00 0.00 C ATOM 746 CD2 TRP A 47 3.619 13.626 8.640 1.00 0.00 C ATOM 747 NE1 TRP A 47 1.833 14.740 7.933 1.00 0.00 N ATOM 748 CE2 TRP A 47 2.595 14.523 9.062 1.00 0.00 C ATOM 749 CE3 TRP A 47 4.576 13.240 9.608 1.00 0.00 C ATOM 750 CZ2 TRP A 47 2.519 15.005 10.373 1.00 0.00 C ATOM 751 CZ3 TRP A 47 4.496 13.705 10.936 1.00 0.00 C ATOM 752 CH2 TRP A 47 3.464 14.584 11.319 1.00 0.00 C ATOM 0 H TRP A 47 5.047 10.314 7.998 1.00 0.00 H new ATOM 0 HA TRP A 47 2.920 10.798 5.985 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.297 12.582 6.618 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.150 12.812 5.313 1.00 0.00 H new ATOM 0 HD1 TRP A 47 1.881 14.021 5.870 1.00 0.00 H new ATOM 0 HE1 TRP A 47 1.018 15.352 7.898 1.00 0.00 H new ATOM 0 HE3 TRP A 47 5.381 12.578 9.325 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 1.738 15.696 10.654 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 5.229 13.386 11.663 1.00 0.00 H new ATOM 0 HH2 TRP A 47 3.401 14.933 12.339 1.00 0.00 H new ATOM 763 N HIS A 48 4.371 9.492 4.395 1.00 0.00 N ATOM 764 CA HIS A 48 5.147 8.634 3.490 1.00 0.00 C ATOM 765 C HIS A 48 5.122 9.189 2.057 1.00 0.00 C ATOM 766 O HIS A 48 4.067 9.305 1.427 1.00 0.00 O ATOM 767 CB HIS A 48 4.632 7.183 3.528 1.00 0.00 C ATOM 768 CG HIS A 48 4.536 6.577 4.910 1.00 0.00 C ATOM 769 ND1 HIS A 48 5.537 5.931 5.596 1.00 0.00 N ATOM 770 CD2 HIS A 48 3.409 6.523 5.692 1.00 0.00 C ATOM 771 CE1 HIS A 48 5.033 5.499 6.771 1.00 0.00 C ATOM 772 NE2 HIS A 48 3.735 5.840 6.872 1.00 0.00 N ATOM 0 H HIS A 48 3.378 9.526 4.163 1.00 0.00 H new ATOM 0 HA HIS A 48 6.182 8.630 3.833 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.646 7.151 3.064 1.00 0.00 H new ATOM 0 HB3 HIS A 48 5.291 6.563 2.920 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.442 6.934 5.442 1.00 0.00 H new ATOM 0 HE1 HIS A 48 5.590 4.958 7.521 1.00 0.00 H new ATOM 0 HE2 HIS A 48 3.111 5.641 7.654 1.00 0.00 H new ATOM 780 N ASP A 49 6.304 9.517 1.533 1.00 0.00 N ATOM 781 CA ASP A 49 6.511 10.081 0.197 1.00 0.00 C ATOM 782 C ASP A 49 7.139 9.025 -0.725 1.00 0.00 C ATOM 783 O ASP A 49 8.260 8.552 -0.506 1.00 0.00 O ATOM 784 CB ASP A 49 7.330 11.382 0.280 1.00 0.00 C ATOM 785 CG ASP A 49 8.790 11.199 0.738 1.00 0.00 C ATOM 786 OD1 ASP A 49 9.030 10.842 1.918 1.00 0.00 O ATOM 787 OD2 ASP A 49 9.714 11.469 -0.069 1.00 0.00 O ATOM 0 H ASP A 49 7.177 9.393 2.046 1.00 0.00 H new ATOM 0 HA ASP A 49 5.551 10.354 -0.242 1.00 0.00 H new ATOM 0 HB2 ASP A 49 7.329 11.859 -0.700 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.831 12.065 0.967 1.00 0.00 H new ATOM 792 N ARG A 50 6.373 8.599 -1.735 1.00 0.00 N ATOM 793 CA ARG A 50 6.748 7.497 -2.640 1.00 0.00 C ATOM 794 C ARG A 50 7.683 7.941 -3.765 1.00 0.00 C ATOM 795 O ARG A 50 8.488 7.152 -4.258 1.00 0.00 O ATOM 796 CB ARG A 50 5.481 6.902 -3.244 1.00 0.00 C ATOM 797 CG ARG A 50 4.461 6.403 -2.202 1.00 0.00 C ATOM 798 CD ARG A 50 4.993 5.336 -1.232 1.00 0.00 C ATOM 799 NE ARG A 50 5.473 4.132 -1.942 1.00 0.00 N ATOM 800 CZ ARG A 50 5.647 2.920 -1.445 1.00 0.00 C ATOM 801 NH1 ARG A 50 5.430 2.632 -0.193 1.00 0.00 N ATOM 802 NH2 ARG A 50 6.051 1.966 -2.232 1.00 0.00 N ATOM 0 H ARG A 50 5.466 9.011 -1.953 1.00 0.00 H new ATOM 0 HA ARG A 50 7.289 6.758 -2.049 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.004 7.654 -3.873 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.757 6.071 -3.894 1.00 0.00 H new ATOM 0 HG2 ARG A 50 4.109 7.256 -1.622 1.00 0.00 H new ATOM 0 HG3 ARG A 50 3.597 5.996 -2.727 1.00 0.00 H new ATOM 0 HD2 ARG A 50 5.807 5.757 -0.641 1.00 0.00 H new ATOM 0 HD3 ARG A 50 4.204 5.055 -0.534 1.00 0.00 H new ATOM 0 HE ARG A 50 5.696 4.250 -2.930 1.00 0.00 H new ATOM 0 HH11 ARG A 50 5.112 3.357 0.449 1.00 0.00 H new ATOM 0 HH12 ARG A 50 5.578 1.681 0.145 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.229 2.159 -3.218 1.00 0.00 H new ATOM 0 HH22 ARG A 50 6.190 1.025 -1.863 1.00 0.00 H new ATOM 816 N GLY A 51 7.553 9.202 -4.174 1.00 0.00 N ATOM 817 CA GLY A 51 8.429 9.879 -5.131 1.00 0.00 C ATOM 818 C GLY A 51 7.935 9.813 -6.577 1.00 0.00 C ATOM 819 O GLY A 51 7.764 10.865 -7.188 1.00 0.00 O ATOM 0 H GLY A 51 6.804 9.805 -3.834 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.530 10.924 -4.839 1.00 0.00 H new ATOM 0 HA3 GLY A 51 9.423 9.435 -5.076 1.00 0.00 H new ATOM 823 N GLU A 52 7.671 8.613 -7.117 1.00 0.00 N ATOM 824 CA GLU A 52 7.284 8.379 -8.527 1.00 0.00 C ATOM 825 C GLU A 52 6.827 6.925 -8.741 1.00 0.00 C ATOM 826 O GLU A 52 7.653 6.010 -8.840 1.00 0.00 O ATOM 827 CB GLU A 52 8.437 8.615 -9.528 1.00 0.00 C ATOM 828 CG GLU A 52 8.850 10.065 -9.805 1.00 0.00 C ATOM 829 CD GLU A 52 9.707 10.201 -11.080 1.00 0.00 C ATOM 830 OE1 GLU A 52 10.588 9.340 -11.336 1.00 0.00 O ATOM 831 OE2 GLU A 52 9.543 11.200 -11.825 1.00 0.00 O ATOM 0 H GLU A 52 7.721 7.751 -6.574 1.00 0.00 H new ATOM 0 HA GLU A 52 6.483 9.094 -8.713 1.00 0.00 H new ATOM 0 HB2 GLU A 52 9.314 8.080 -9.163 1.00 0.00 H new ATOM 0 HB3 GLU A 52 8.157 8.158 -10.477 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.956 10.681 -9.904 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.409 10.449 -8.952 1.00 0.00 H new ATOM 838 N GLN A 53 5.513 6.707 -8.838 1.00 0.00 N ATOM 839 CA GLN A 53 4.911 5.401 -9.160 1.00 0.00 C ATOM 840 C GLN A 53 3.839 5.524 -10.255 1.00 0.00 C ATOM 841 O GLN A 53 3.393 6.620 -10.578 1.00 0.00 O ATOM 842 CB GLN A 53 4.335 4.795 -7.874 1.00 0.00 C ATOM 843 CG GLN A 53 5.426 4.696 -6.794 1.00 0.00 C ATOM 844 CD GLN A 53 4.977 4.091 -5.482 1.00 0.00 C ATOM 845 OE1 GLN A 53 5.716 3.398 -4.794 1.00 0.00 O ATOM 846 NE2 GLN A 53 3.829 4.487 -4.982 1.00 0.00 N ATOM 0 H GLN A 53 4.822 7.443 -8.693 1.00 0.00 H new ATOM 0 HA GLN A 53 5.680 4.740 -9.559 1.00 0.00 H new ATOM 0 HB2 GLN A 53 3.511 5.409 -7.512 1.00 0.00 H new ATOM 0 HB3 GLN A 53 3.928 3.805 -8.081 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.251 4.102 -7.187 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.816 5.695 -6.601 1.00 0.00 H new ATOM 0 HE21 GLN A 53 3.201 5.065 -5.541 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.565 4.217 -4.034 1.00 0.00 H new ATOM 855 N GLU A 54 3.445 4.397 -10.850 1.00 0.00 N ATOM 856 CA GLU A 54 2.488 4.306 -11.963 1.00 0.00 C ATOM 857 C GLU A 54 1.066 4.791 -11.599 1.00 0.00 C ATOM 858 O GLU A 54 0.282 4.057 -10.994 1.00 0.00 O ATOM 859 CB GLU A 54 2.464 2.881 -12.562 1.00 0.00 C ATOM 860 CG GLU A 54 2.361 1.706 -11.571 1.00 0.00 C ATOM 861 CD GLU A 54 3.746 1.190 -11.129 1.00 0.00 C ATOM 862 OE1 GLU A 54 4.363 1.796 -10.218 1.00 0.00 O ATOM 863 OE2 GLU A 54 4.227 0.176 -11.692 1.00 0.00 O ATOM 0 H GLU A 54 3.796 3.484 -10.561 1.00 0.00 H new ATOM 0 HA GLU A 54 2.847 4.996 -12.727 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.622 2.818 -13.251 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.370 2.747 -13.153 1.00 0.00 H new ATOM 0 HG2 GLU A 54 1.796 2.022 -10.694 1.00 0.00 H new ATOM 0 HG3 GLU A 54 1.803 0.892 -12.033 1.00 0.00 H new ATOM 870 N VAL A 55 0.724 6.029 -11.973 1.00 0.00 N ATOM 871 CA VAL A 55 -0.567 6.682 -11.692 1.00 0.00 C ATOM 872 C VAL A 55 -1.536 6.543 -12.868 1.00 0.00 C ATOM 873 O VAL A 55 -1.173 6.705 -14.035 1.00 0.00 O ATOM 874 CB VAL A 55 -0.395 8.180 -11.360 1.00 0.00 C ATOM 875 CG1 VAL A 55 -1.692 8.827 -10.853 1.00 0.00 C ATOM 876 CG2 VAL A 55 0.641 8.382 -10.255 1.00 0.00 C ATOM 0 H VAL A 55 1.360 6.629 -12.499 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.981 6.172 -10.822 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.085 8.645 -12.296 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.512 9.880 -10.635 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.464 8.741 -11.617 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.021 8.320 -9.946 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.742 9.446 -10.041 1.00 0.00 H new ATOM 0 HG22 VAL A 55 0.319 7.860 -9.354 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.602 7.984 -10.580 1.00 0.00 H new ATOM 886 N PHE A 56 -2.803 6.329 -12.532 1.00 0.00 N ATOM 887 CA PHE A 56 -3.923 6.176 -13.450 1.00 0.00 C ATOM 888 C PHE A 56 -5.015 7.206 -13.122 1.00 0.00 C ATOM 889 O PHE A 56 -5.327 7.465 -11.955 1.00 0.00 O ATOM 890 CB PHE A 56 -4.445 4.734 -13.352 1.00 0.00 C ATOM 891 CG PHE A 56 -3.407 3.675 -13.693 1.00 0.00 C ATOM 892 CD1 PHE A 56 -2.482 3.249 -12.722 1.00 0.00 C ATOM 893 CD2 PHE A 56 -3.333 3.142 -14.992 1.00 0.00 C ATOM 894 CE1 PHE A 56 -1.481 2.318 -13.052 1.00 0.00 C ATOM 895 CE2 PHE A 56 -2.356 2.181 -15.312 1.00 0.00 C ATOM 896 CZ PHE A 56 -1.420 1.779 -14.346 1.00 0.00 C ATOM 0 H PHE A 56 -3.091 6.254 -11.556 1.00 0.00 H new ATOM 0 HA PHE A 56 -3.605 6.360 -14.476 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -4.809 4.558 -12.340 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -5.298 4.621 -14.021 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -2.541 3.640 -11.717 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -4.030 3.472 -15.748 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -0.758 2.017 -12.308 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -2.326 1.752 -16.303 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.656 1.058 -14.598 1.00 0.00 H new ATOM 906 N GLU A 57 -5.593 7.815 -14.158 1.00 0.00 N ATOM 907 CA GLU A 57 -6.769 8.678 -14.044 1.00 0.00 C ATOM 908 C GLU A 57 -7.963 7.897 -13.474 1.00 0.00 C ATOM 909 O GLU A 57 -8.276 6.799 -13.943 1.00 0.00 O ATOM 910 CB GLU A 57 -7.103 9.244 -15.431 1.00 0.00 C ATOM 911 CG GLU A 57 -8.223 10.291 -15.393 1.00 0.00 C ATOM 912 CD GLU A 57 -8.387 10.964 -16.768 1.00 0.00 C ATOM 913 OE1 GLU A 57 -8.883 10.310 -17.721 1.00 0.00 O ATOM 914 OE2 GLU A 57 -8.021 12.158 -16.912 1.00 0.00 O ATOM 0 H GLU A 57 -5.252 7.721 -15.115 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.554 9.497 -13.358 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.207 9.693 -15.860 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -7.398 8.427 -16.090 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -9.160 9.818 -15.100 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.997 11.045 -14.638 1.00 0.00 H new ATOM 921 N TYR A 58 -8.655 8.485 -12.498 1.00 0.00 N ATOM 922 CA TYR A 58 -9.841 7.927 -11.860 1.00 0.00 C ATOM 923 C TYR A 58 -10.959 8.980 -11.914 1.00 0.00 C ATOM 924 O TYR A 58 -11.100 9.840 -11.041 1.00 0.00 O ATOM 925 CB TYR A 58 -9.464 7.417 -10.456 1.00 0.00 C ATOM 926 CG TYR A 58 -10.595 7.017 -9.524 1.00 0.00 C ATOM 927 CD1 TYR A 58 -11.861 6.662 -10.029 1.00 0.00 C ATOM 928 CD2 TYR A 58 -10.356 6.949 -8.135 1.00 0.00 C ATOM 929 CE1 TYR A 58 -12.884 6.278 -9.150 1.00 0.00 C ATOM 930 CE2 TYR A 58 -11.389 6.582 -7.249 1.00 0.00 C ATOM 931 CZ TYR A 58 -12.664 6.265 -7.763 1.00 0.00 C ATOM 932 OH TYR A 58 -13.690 5.953 -6.935 1.00 0.00 O ATOM 0 H TYR A 58 -8.393 9.395 -12.119 1.00 0.00 H new ATOM 0 HA TYR A 58 -10.233 7.053 -12.380 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -8.808 6.555 -10.577 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -8.881 8.194 -9.962 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -12.044 6.686 -11.093 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -9.375 7.180 -7.748 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -13.848 5.990 -9.543 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -11.206 6.544 -6.185 1.00 0.00 H new ATOM 0 HH TYR A 58 -14.302 5.338 -7.390 1.00 0.00 H new ATOM 942 N CYS A 59 -11.729 8.939 -13.004 1.00 0.00 N ATOM 943 CA CYS A 59 -12.879 9.808 -13.233 1.00 0.00 C ATOM 944 C CYS A 59 -14.188 9.093 -12.848 1.00 0.00 C ATOM 945 O CYS A 59 -14.303 7.873 -12.993 1.00 0.00 O ATOM 946 CB CYS A 59 -12.859 10.223 -14.712 1.00 0.00 C ATOM 947 SG CYS A 59 -14.060 11.551 -15.013 1.00 0.00 S ATOM 0 H CYS A 59 -11.564 8.284 -13.768 1.00 0.00 H new ATOM 0 HA CYS A 59 -12.824 10.698 -12.606 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.859 10.558 -14.989 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -13.092 9.364 -15.341 1.00 0.00 H new ATOM 0 HG CYS A 59 -14.027 11.890 -16.268 1.00 0.00 H new ATOM 953 N LEU A 60 -15.189 9.853 -12.397 1.00 0.00 N ATOM 954 CA LEU A 60 -16.503 9.357 -11.973 1.00 0.00 C ATOM 955 C LEU A 60 -17.637 9.877 -12.861 1.00 0.00 C ATOM 956 O LEU A 60 -17.496 10.862 -13.585 1.00 0.00 O ATOM 957 CB LEU A 60 -16.743 9.771 -10.506 1.00 0.00 C ATOM 958 CG LEU A 60 -16.942 8.629 -9.498 1.00 0.00 C ATOM 959 CD1 LEU A 60 -15.837 7.590 -9.499 1.00 0.00 C ATOM 960 CD2 LEU A 60 -17.000 9.193 -8.080 1.00 0.00 C ATOM 0 H LEU A 60 -15.105 10.866 -12.314 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.503 8.271 -12.067 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -15.895 10.373 -10.178 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.623 10.414 -10.472 1.00 0.00 H new ATOM 0 HG LEU A 60 -17.869 8.145 -9.805 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -16.059 6.822 -8.758 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.768 7.133 -10.486 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -14.888 8.067 -9.253 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -17.141 8.378 -7.370 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -16.068 9.712 -7.856 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.832 9.892 -8.000 1.00 0.00 H new ATOM 972 N GLU A 61 -18.795 9.221 -12.766 1.00 0.00 N ATOM 973 CA GLU A 61 -19.965 9.503 -13.616 1.00 0.00 C ATOM 974 C GLU A 61 -20.627 10.867 -13.319 1.00 0.00 C ATOM 975 O GLU A 61 -21.308 11.429 -14.180 1.00 0.00 O ATOM 976 CB GLU A 61 -20.988 8.363 -13.490 1.00 0.00 C ATOM 977 CG GLU A 61 -20.418 7.000 -13.906 1.00 0.00 C ATOM 978 CD GLU A 61 -21.515 5.923 -13.952 1.00 0.00 C ATOM 979 OE1 GLU A 61 -21.867 5.358 -12.887 1.00 0.00 O ATOM 980 OE2 GLU A 61 -22.021 5.621 -15.061 1.00 0.00 O ATOM 0 H GLU A 61 -18.954 8.472 -12.093 1.00 0.00 H new ATOM 0 HA GLU A 61 -19.603 9.564 -14.642 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -21.336 8.306 -12.459 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -21.857 8.591 -14.107 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -19.948 7.084 -14.886 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -19.640 6.700 -13.204 1.00 0.00 H new ATOM 987 N ASP A 62 -20.387 11.430 -12.127 1.00 0.00 N ATOM 988 CA ASP A 62 -20.767 12.811 -11.769 1.00 0.00 C ATOM 989 C ASP A 62 -19.766 13.869 -12.282 1.00 0.00 C ATOM 990 O ASP A 62 -20.106 15.055 -12.346 1.00 0.00 O ATOM 991 CB ASP A 62 -20.914 12.942 -10.238 1.00 0.00 C ATOM 992 CG ASP A 62 -22.313 12.587 -9.691 1.00 0.00 C ATOM 993 OD1 ASP A 62 -23.172 12.043 -10.427 1.00 0.00 O ATOM 994 OD2 ASP A 62 -22.569 12.888 -8.501 1.00 0.00 O ATOM 0 H ASP A 62 -19.916 10.934 -11.370 1.00 0.00 H new ATOM 0 HA ASP A 62 -21.721 13.006 -12.260 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -20.177 12.297 -9.760 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.675 13.966 -9.950 1.00 0.00 H new ATOM 999 N GLY A 63 -18.541 13.465 -12.641 1.00 0.00 N ATOM 1000 CA GLY A 63 -17.481 14.342 -13.159 1.00 0.00 C ATOM 1001 C GLY A 63 -16.326 14.582 -12.176 1.00 0.00 C ATOM 1002 O GLY A 63 -15.349 15.246 -12.534 1.00 0.00 O ATOM 0 H GLY A 63 -18.250 12.489 -12.577 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -17.080 13.907 -14.074 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -17.919 15.303 -13.429 1.00 0.00 H new ATOM 1006 N SER A 64 -16.420 14.052 -10.950 1.00 0.00 N ATOM 1007 CA SER A 64 -15.346 14.080 -9.945 1.00 0.00 C ATOM 1008 C SER A 64 -14.070 13.414 -10.484 1.00 0.00 C ATOM 1009 O SER A 64 -14.145 12.403 -11.191 1.00 0.00 O ATOM 1010 CB SER A 64 -15.801 13.379 -8.656 1.00 0.00 C ATOM 1011 OG SER A 64 -17.019 13.935 -8.182 1.00 0.00 O ATOM 0 H SER A 64 -17.263 13.581 -10.620 1.00 0.00 H new ATOM 0 HA SER A 64 -15.121 15.123 -9.721 1.00 0.00 H new ATOM 0 HB2 SER A 64 -15.931 12.313 -8.843 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.030 13.477 -7.892 1.00 0.00 H new ATOM 0 HG SER A 64 -16.896 14.258 -7.265 1.00 0.00 H new ATOM 1017 N LEU A 65 -12.902 13.967 -10.141 1.00 0.00 N ATOM 1018 CA LEU A 65 -11.616 13.589 -10.737 1.00 0.00 C ATOM 1019 C LEU A 65 -10.558 13.318 -9.658 1.00 0.00 C ATOM 1020 O LEU A 65 -10.310 14.147 -8.778 1.00 0.00 O ATOM 1021 CB LEU A 65 -11.178 14.703 -11.711 1.00 0.00 C ATOM 1022 CG LEU A 65 -10.155 14.234 -12.762 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -10.817 13.369 -13.837 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -9.520 15.442 -13.452 1.00 0.00 C ATOM 0 H LEU A 65 -12.822 14.698 -9.434 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.728 12.657 -11.292 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.058 15.095 -12.222 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.748 15.526 -11.140 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.399 13.647 -12.240 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.068 13.054 -14.563 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.264 12.490 -13.373 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.592 13.946 -14.342 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.798 15.100 -14.193 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.295 16.029 -13.945 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.013 16.060 -12.711 1.00 0.00 H new ATOM 1036 N ILE A 66 -9.951 12.135 -9.738 1.00 0.00 N ATOM 1037 CA ILE A 66 -9.036 11.547 -8.753 1.00 0.00 C ATOM 1038 C ILE A 66 -7.835 10.959 -9.522 1.00 0.00 C ATOM 1039 O ILE A 66 -7.957 10.580 -10.691 1.00 0.00 O ATOM 1040 CB ILE A 66 -9.792 10.481 -7.898 1.00 0.00 C ATOM 1041 CG1 ILE A 66 -11.117 11.016 -7.284 1.00 0.00 C ATOM 1042 CG2 ILE A 66 -8.886 9.942 -6.772 1.00 0.00 C ATOM 1043 CD1 ILE A 66 -12.044 9.963 -6.648 1.00 0.00 C ATOM 0 H ILE A 66 -10.092 11.521 -10.541 1.00 0.00 H new ATOM 0 HA ILE A 66 -8.665 12.294 -8.052 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.053 9.676 -8.585 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -10.868 11.757 -6.525 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.672 11.534 -8.066 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -9.432 9.201 -6.189 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.000 9.480 -7.208 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -8.584 10.764 -6.123 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -12.935 10.453 -6.254 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -12.335 9.232 -7.402 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.519 9.458 -5.837 1.00 0.00 H new ATOM 1055 N ARG A 67 -6.661 10.888 -8.884 1.00 0.00 N ATOM 1056 CA ARG A 67 -5.427 10.316 -9.452 1.00 0.00 C ATOM 1057 C ARG A 67 -4.702 9.467 -8.411 1.00 0.00 C ATOM 1058 O ARG A 67 -4.234 9.982 -7.395 1.00 0.00 O ATOM 1059 CB ARG A 67 -4.526 11.447 -9.973 1.00 0.00 C ATOM 1060 CG ARG A 67 -5.057 12.049 -11.280 1.00 0.00 C ATOM 1061 CD ARG A 67 -4.036 13.023 -11.872 1.00 0.00 C ATOM 1062 NE ARG A 67 -4.403 13.413 -13.247 1.00 0.00 N ATOM 1063 CZ ARG A 67 -3.709 14.209 -14.044 1.00 0.00 C ATOM 1064 NH1 ARG A 67 -2.556 14.712 -13.696 1.00 0.00 N ATOM 1065 NH2 ARG A 67 -4.152 14.501 -15.233 1.00 0.00 N ATOM 0 H ARG A 67 -6.536 11.235 -7.933 1.00 0.00 H new ATOM 0 HA ARG A 67 -5.684 9.665 -10.287 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.452 12.229 -9.217 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -3.519 11.063 -10.134 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -5.267 11.254 -11.995 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -5.998 12.567 -11.093 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -3.972 13.912 -11.244 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -3.048 12.562 -11.874 1.00 0.00 H new ATOM 0 HE ARG A 67 -5.274 13.033 -13.618 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -2.160 14.495 -12.781 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -2.051 15.322 -14.339 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -5.040 14.115 -15.555 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -3.612 15.115 -15.842 1.00 0.00 H new ATOM 1079 N ALA A 68 -4.609 8.167 -8.673 1.00 0.00 N ATOM 1080 CA ALA A 68 -4.029 7.176 -7.767 1.00 0.00 C ATOM 1081 C ALA A 68 -3.294 6.074 -8.543 1.00 0.00 C ATOM 1082 O ALA A 68 -3.480 5.901 -9.749 1.00 0.00 O ATOM 1083 CB ALA A 68 -5.160 6.595 -6.911 1.00 0.00 C ATOM 0 H ALA A 68 -4.944 7.760 -9.546 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.287 7.651 -7.126 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.753 5.852 -6.226 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.632 7.395 -6.340 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.901 6.125 -7.558 1.00 0.00 H new ATOM 1089 N THR A 69 -2.445 5.316 -7.853 1.00 0.00 N ATOM 1090 CA THR A 69 -1.759 4.155 -8.431 1.00 0.00 C ATOM 1091 C THR A 69 -2.676 2.941 -8.492 1.00 0.00 C ATOM 1092 O THR A 69 -3.517 2.750 -7.610 1.00 0.00 O ATOM 1093 CB THR A 69 -0.540 3.761 -7.593 1.00 0.00 C ATOM 1094 OG1 THR A 69 -0.937 3.646 -6.250 1.00 0.00 O ATOM 1095 CG2 THR A 69 0.575 4.792 -7.642 1.00 0.00 C ATOM 0 H THR A 69 -2.211 5.487 -6.875 1.00 0.00 H new ATOM 0 HA THR A 69 -1.454 4.449 -9.436 1.00 0.00 H new ATOM 0 HB THR A 69 -0.162 2.825 -8.005 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.227 2.727 -6.072 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.410 4.454 -7.028 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.909 4.918 -8.672 1.00 0.00 H new ATOM 0 HG23 THR A 69 0.207 5.745 -7.261 1.00 0.00 H new ATOM 1103 N LYS A 70 -2.419 2.036 -9.438 1.00 0.00 N ATOM 1104 CA LYS A 70 -3.143 0.750 -9.553 1.00 0.00 C ATOM 1105 C LYS A 70 -3.007 -0.158 -8.318 1.00 0.00 C ATOM 1106 O LYS A 70 -3.893 -0.960 -8.047 1.00 0.00 O ATOM 1107 CB LYS A 70 -2.735 0.071 -10.866 1.00 0.00 C ATOM 1108 CG LYS A 70 -3.310 -1.332 -11.058 1.00 0.00 C ATOM 1109 CD LYS A 70 -2.973 -1.899 -12.444 1.00 0.00 C ATOM 1110 CE LYS A 70 -3.664 -1.227 -13.650 1.00 0.00 C ATOM 1111 NZ LYS A 70 -2.944 -1.549 -14.914 1.00 0.00 N ATOM 0 H LYS A 70 -1.703 2.166 -10.152 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.213 0.958 -9.583 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.053 0.698 -11.699 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.647 0.013 -10.908 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.916 -1.995 -10.288 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.392 -1.302 -10.930 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -1.895 -1.831 -12.587 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.229 -2.958 -12.451 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.698 -1.565 -13.718 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.690 -0.147 -13.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.423 -1.088 -15.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -1.964 -1.205 -14.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.941 -2.579 -15.059 1.00 0.00 H new ATOM 1125 N ASP A 71 -1.942 0.011 -7.536 1.00 0.00 N ATOM 1126 CA ASP A 71 -1.672 -0.761 -6.314 1.00 0.00 C ATOM 1127 C ASP A 71 -2.396 -0.196 -5.078 1.00 0.00 C ATOM 1128 O ASP A 71 -2.403 -0.843 -4.026 1.00 0.00 O ATOM 1129 CB ASP A 71 -0.153 -0.791 -6.055 1.00 0.00 C ATOM 1130 CG ASP A 71 0.636 -1.726 -6.992 1.00 0.00 C ATOM 1131 OD1 ASP A 71 0.049 -2.631 -7.632 1.00 0.00 O ATOM 1132 OD2 ASP A 71 1.883 -1.588 -7.048 1.00 0.00 O ATOM 0 H ASP A 71 -1.222 0.705 -7.736 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.055 -1.769 -6.475 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.240 0.221 -6.156 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.021 -1.099 -5.024 1.00 0.00 H new ATOM 1137 N HIS A 72 -2.996 0.998 -5.174 1.00 0.00 N ATOM 1138 CA HIS A 72 -3.747 1.590 -4.072 1.00 0.00 C ATOM 1139 C HIS A 72 -5.169 0.994 -4.064 1.00 0.00 C ATOM 1140 O HIS A 72 -5.820 0.909 -5.113 1.00 0.00 O ATOM 1141 CB HIS A 72 -3.780 3.117 -4.235 1.00 0.00 C ATOM 1142 CG HIS A 72 -4.319 3.805 -3.002 1.00 0.00 C ATOM 1143 ND1 HIS A 72 -5.609 3.768 -2.536 1.00 0.00 N ATOM 1144 CD2 HIS A 72 -3.571 4.420 -2.027 1.00 0.00 C ATOM 1145 CE1 HIS A 72 -5.623 4.284 -1.294 1.00 0.00 C ATOM 1146 NE2 HIS A 72 -4.403 4.702 -0.941 1.00 0.00 N ATOM 0 H HIS A 72 -2.972 1.574 -6.016 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.269 1.365 -3.118 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -2.774 3.481 -4.443 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.398 3.377 -5.095 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -6.418 3.411 -3.044 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -2.517 4.647 -2.090 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -6.500 4.351 -0.667 1.00 0.00 H new ATOM 1154 N LYS A 73 -5.663 0.591 -2.891 1.00 0.00 N ATOM 1155 CA LYS A 73 -6.987 -0.027 -2.711 1.00 0.00 C ATOM 1156 C LYS A 73 -8.031 1.001 -2.270 1.00 0.00 C ATOM 1157 O LYS A 73 -7.715 2.030 -1.674 1.00 0.00 O ATOM 1158 CB LYS A 73 -6.871 -1.177 -1.695 1.00 0.00 C ATOM 1159 CG LYS A 73 -5.988 -2.328 -2.210 1.00 0.00 C ATOM 1160 CD LYS A 73 -5.409 -3.154 -1.055 1.00 0.00 C ATOM 1161 CE LYS A 73 -4.389 -4.152 -1.613 1.00 0.00 C ATOM 1162 NZ LYS A 73 -3.762 -4.957 -0.530 1.00 0.00 N ATOM 0 H LYS A 73 -5.145 0.686 -2.017 1.00 0.00 H new ATOM 0 HA LYS A 73 -7.326 -0.426 -3.667 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -6.457 -0.794 -0.762 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -7.866 -1.560 -1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -6.575 -2.975 -2.862 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -5.175 -1.922 -2.812 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -4.933 -2.498 -0.326 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -6.207 -3.684 -0.535 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -4.881 -4.817 -2.323 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -3.616 -3.614 -2.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -3.077 -5.622 -0.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -3.272 -4.324 0.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -4.498 -5.489 -0.022 1.00 0.00 H new ATOM 1176 N PHE A 74 -9.302 0.725 -2.534 1.00 0.00 N ATOM 1177 CA PHE A 74 -10.395 1.637 -2.181 1.00 0.00 C ATOM 1178 C PHE A 74 -11.552 0.874 -1.532 1.00 0.00 C ATOM 1179 O PHE A 74 -11.857 -0.256 -1.914 1.00 0.00 O ATOM 1180 CB PHE A 74 -10.826 2.428 -3.422 1.00 0.00 C ATOM 1181 CG PHE A 74 -9.832 3.481 -3.895 1.00 0.00 C ATOM 1182 CD1 PHE A 74 -8.739 3.135 -4.721 1.00 0.00 C ATOM 1183 CD2 PHE A 74 -10.012 4.825 -3.510 1.00 0.00 C ATOM 1184 CE1 PHE A 74 -7.840 4.127 -5.155 1.00 0.00 C ATOM 1185 CE2 PHE A 74 -9.114 5.814 -3.949 1.00 0.00 C ATOM 1186 CZ PHE A 74 -8.028 5.465 -4.769 1.00 0.00 C ATOM 0 H PHE A 74 -9.608 -0.131 -2.996 1.00 0.00 H new ATOM 0 HA PHE A 74 -10.048 2.355 -1.438 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.004 1.727 -4.237 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -11.777 2.917 -3.210 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -8.593 2.107 -5.020 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -10.843 5.096 -2.875 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -7.005 3.860 -5.785 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -9.259 6.843 -3.655 1.00 0.00 H new ATOM 0 HZ PHE A 74 -7.337 6.225 -5.103 1.00 0.00 H new ATOM 1196 N MET A 75 -12.170 1.484 -0.515 1.00 0.00 N ATOM 1197 CA MET A 75 -13.277 0.897 0.242 1.00 0.00 C ATOM 1198 C MET A 75 -14.551 0.905 -0.618 1.00 0.00 C ATOM 1199 O MET A 75 -15.233 1.925 -0.768 1.00 0.00 O ATOM 1200 CB MET A 75 -13.465 1.664 1.559 1.00 0.00 C ATOM 1201 CG MET A 75 -14.604 1.095 2.415 1.00 0.00 C ATOM 1202 SD MET A 75 -15.024 2.098 3.867 1.00 0.00 S ATOM 1203 CE MET A 75 -14.082 1.238 5.151 1.00 0.00 C ATOM 0 H MET A 75 -11.909 2.415 -0.191 1.00 0.00 H new ATOM 0 HA MET A 75 -13.054 -0.140 0.493 1.00 0.00 H new ATOM 0 HB2 MET A 75 -12.536 1.633 2.129 1.00 0.00 H new ATOM 0 HB3 MET A 75 -13.669 2.712 1.339 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.492 0.990 1.792 1.00 0.00 H new ATOM 0 HG3 MET A 75 -14.327 0.095 2.747 1.00 0.00 H new ATOM 0 HE1 MET A 75 -14.235 1.735 6.109 1.00 0.00 H new ATOM 0 HE2 MET A 75 -14.421 0.204 5.220 1.00 0.00 H new ATOM 0 HE3 MET A 75 -13.022 1.256 4.898 1.00 0.00 H new ATOM 1213 N THR A 76 -14.859 -0.250 -1.205 1.00 0.00 N ATOM 1214 CA THR A 76 -16.095 -0.449 -1.984 1.00 0.00 C ATOM 1215 C THR A 76 -17.342 -0.385 -1.098 1.00 0.00 C ATOM 1216 O THR A 76 -17.249 -0.398 0.129 1.00 0.00 O ATOM 1217 CB THR A 76 -16.078 -1.781 -2.744 1.00 0.00 C ATOM 1218 OG1 THR A 76 -15.796 -2.839 -1.863 1.00 0.00 O ATOM 1219 CG2 THR A 76 -15.030 -1.783 -3.848 1.00 0.00 C ATOM 0 H THR A 76 -14.264 -1.077 -1.158 1.00 0.00 H new ATOM 0 HA THR A 76 -16.136 0.367 -2.705 1.00 0.00 H new ATOM 0 HB THR A 76 -17.064 -1.909 -3.190 1.00 0.00 H new ATOM 0 HG1 THR A 76 -14.832 -2.871 -1.688 1.00 0.00 H new ATOM 0 HG21 THR A 76 -15.047 -2.743 -4.364 1.00 0.00 H new ATOM 0 HG22 THR A 76 -15.248 -0.985 -4.558 1.00 0.00 H new ATOM 0 HG23 THR A 76 -14.043 -1.623 -3.413 1.00 0.00 H new ATOM 1227 N VAL A 77 -18.529 -0.361 -1.710 1.00 0.00 N ATOM 1228 CA VAL A 77 -19.829 -0.383 -1.006 1.00 0.00 C ATOM 1229 C VAL A 77 -20.053 -1.568 -0.047 1.00 0.00 C ATOM 1230 O VAL A 77 -20.877 -1.463 0.863 1.00 0.00 O ATOM 1231 CB VAL A 77 -21.008 -0.285 -1.988 1.00 0.00 C ATOM 1232 CG1 VAL A 77 -21.072 1.118 -2.594 1.00 0.00 C ATOM 1233 CG2 VAL A 77 -20.932 -1.328 -3.110 1.00 0.00 C ATOM 0 H VAL A 77 -18.623 -0.325 -2.725 1.00 0.00 H new ATOM 0 HA VAL A 77 -19.787 0.504 -0.374 1.00 0.00 H new ATOM 0 HB VAL A 77 -21.914 -0.488 -1.416 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -21.910 1.177 -3.288 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -21.207 1.852 -1.799 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -20.144 1.327 -3.127 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -21.789 -1.212 -3.773 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -20.012 -1.185 -3.678 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -20.940 -2.329 -2.678 1.00 0.00 H new ATOM 1243 N ASP A 78 -19.311 -2.671 -0.202 1.00 0.00 N ATOM 1244 CA ASP A 78 -19.315 -3.823 0.723 1.00 0.00 C ATOM 1245 C ASP A 78 -18.108 -3.837 1.687 1.00 0.00 C ATOM 1246 O ASP A 78 -18.019 -4.696 2.569 1.00 0.00 O ATOM 1247 CB ASP A 78 -19.387 -5.122 -0.097 1.00 0.00 C ATOM 1248 CG ASP A 78 -20.815 -5.402 -0.580 1.00 0.00 C ATOM 1249 OD1 ASP A 78 -21.650 -5.858 0.241 1.00 0.00 O ATOM 1250 OD2 ASP A 78 -21.113 -5.192 -1.782 1.00 0.00 O ATOM 0 H ASP A 78 -18.675 -2.795 -0.990 1.00 0.00 H new ATOM 0 HA ASP A 78 -20.194 -3.735 1.361 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -18.719 -5.049 -0.955 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -19.037 -5.957 0.510 1.00 0.00 H new ATOM 1255 N GLY A 79 -17.175 -2.889 1.535 1.00 0.00 N ATOM 1256 CA GLY A 79 -15.980 -2.734 2.374 1.00 0.00 C ATOM 1257 C GLY A 79 -14.759 -3.510 1.866 1.00 0.00 C ATOM 1258 O GLY A 79 -13.718 -3.515 2.524 1.00 0.00 O ATOM 0 H GLY A 79 -17.233 -2.185 0.799 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -15.726 -1.676 2.435 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -16.213 -3.065 3.386 1.00 0.00 H new ATOM 1262 N GLN A 80 -14.873 -4.166 0.705 1.00 0.00 N ATOM 1263 CA GLN A 80 -13.792 -4.931 0.077 1.00 0.00 C ATOM 1264 C GLN A 80 -12.646 -3.999 -0.344 1.00 0.00 C ATOM 1265 O GLN A 80 -12.866 -3.056 -1.108 1.00 0.00 O ATOM 1266 CB GLN A 80 -14.311 -5.715 -1.143 1.00 0.00 C ATOM 1267 CG GLN A 80 -15.538 -6.599 -0.870 1.00 0.00 C ATOM 1268 CD GLN A 80 -15.941 -7.385 -2.117 1.00 0.00 C ATOM 1269 OE1 GLN A 80 -15.762 -8.595 -2.211 1.00 0.00 O ATOM 1270 NE2 GLN A 80 -16.487 -6.736 -3.127 1.00 0.00 N ATOM 0 H GLN A 80 -15.738 -4.179 0.165 1.00 0.00 H new ATOM 0 HA GLN A 80 -13.414 -5.644 0.810 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -14.560 -5.006 -1.933 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -13.505 -6.344 -1.522 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.318 -7.290 -0.057 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -16.372 -5.978 -0.543 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -16.642 -5.730 -3.063 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -16.755 -7.240 -3.972 1.00 0.00 H new ATOM 1279 N MET A 81 -11.440 -4.275 0.159 1.00 0.00 N ATOM 1280 CA MET A 81 -10.196 -3.527 -0.079 1.00 0.00 C ATOM 1281 C MET A 81 -9.517 -3.996 -1.380 1.00 0.00 C ATOM 1282 O MET A 81 -8.519 -4.721 -1.347 1.00 0.00 O ATOM 1283 CB MET A 81 -9.253 -3.721 1.126 1.00 0.00 C ATOM 1284 CG MET A 81 -9.830 -3.247 2.465 1.00 0.00 C ATOM 1285 SD MET A 81 -8.980 -3.998 3.881 1.00 0.00 S ATOM 1286 CE MET A 81 -10.416 -4.360 4.924 1.00 0.00 C ATOM 0 H MET A 81 -11.294 -5.071 0.779 1.00 0.00 H new ATOM 0 HA MET A 81 -10.429 -2.468 -0.190 1.00 0.00 H new ATOM 0 HB2 MET A 81 -9.000 -4.778 1.207 1.00 0.00 H new ATOM 0 HB3 MET A 81 -8.324 -3.185 0.935 1.00 0.00 H new ATOM 0 HG2 MET A 81 -9.750 -2.162 2.529 1.00 0.00 H new ATOM 0 HG3 MET A 81 -10.891 -3.492 2.509 1.00 0.00 H new ATOM 0 HE1 MET A 81 -10.084 -4.830 5.850 1.00 0.00 H new ATOM 0 HE2 MET A 81 -10.940 -3.433 5.156 1.00 0.00 H new ATOM 0 HE3 MET A 81 -11.089 -5.035 4.395 1.00 0.00 H new ATOM 1296 N LEU A 82 -10.078 -3.628 -2.536 1.00 0.00 N ATOM 1297 CA LEU A 82 -9.597 -4.080 -3.853 1.00 0.00 C ATOM 1298 C LEU A 82 -8.852 -2.947 -4.587 1.00 0.00 C ATOM 1299 O LEU A 82 -9.206 -1.776 -4.409 1.00 0.00 O ATOM 1300 CB LEU A 82 -10.772 -4.612 -4.700 1.00 0.00 C ATOM 1301 CG LEU A 82 -11.671 -5.660 -4.012 1.00 0.00 C ATOM 1302 CD1 LEU A 82 -12.752 -6.143 -4.980 1.00 0.00 C ATOM 1303 CD2 LEU A 82 -10.893 -6.884 -3.520 1.00 0.00 C ATOM 0 H LEU A 82 -10.884 -3.005 -2.589 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.890 -4.895 -3.700 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.393 -3.767 -4.998 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.369 -5.049 -5.613 1.00 0.00 H new ATOM 0 HG LEU A 82 -12.109 -5.163 -3.147 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -13.381 -6.882 -4.484 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -13.364 -5.297 -5.293 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -12.282 -6.594 -5.854 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.580 -7.585 -3.045 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.406 -7.370 -4.366 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.139 -6.570 -2.798 1.00 0.00 H new ATOM 1315 N PRO A 83 -7.830 -3.263 -5.409 1.00 0.00 N ATOM 1316 CA PRO A 83 -7.133 -2.276 -6.233 1.00 0.00 C ATOM 1317 C PRO A 83 -8.065 -1.698 -7.298 1.00 0.00 C ATOM 1318 O PRO A 83 -8.943 -2.391 -7.811 1.00 0.00 O ATOM 1319 CB PRO A 83 -5.948 -3.020 -6.856 1.00 0.00 C ATOM 1320 CG PRO A 83 -6.427 -4.467 -6.910 1.00 0.00 C ATOM 1321 CD PRO A 83 -7.300 -4.596 -5.666 1.00 0.00 C ATOM 0 HA PRO A 83 -6.793 -1.424 -5.645 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -5.711 -2.638 -7.849 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -5.047 -2.918 -6.252 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -6.992 -4.670 -7.820 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -5.592 -5.168 -6.890 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -8.106 -5.312 -5.827 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -6.719 -4.956 -4.817 1.00 0.00 H new ATOM 1329 N ILE A 84 -7.856 -0.434 -7.665 1.00 0.00 N ATOM 1330 CA ILE A 84 -8.704 0.278 -8.637 1.00 0.00 C ATOM 1331 C ILE A 84 -8.885 -0.444 -9.988 1.00 0.00 C ATOM 1332 O ILE A 84 -9.977 -0.428 -10.560 1.00 0.00 O ATOM 1333 CB ILE A 84 -8.212 1.729 -8.797 1.00 0.00 C ATOM 1334 CG1 ILE A 84 -9.134 2.477 -9.772 1.00 0.00 C ATOM 1335 CG2 ILE A 84 -6.746 1.831 -9.251 1.00 0.00 C ATOM 1336 CD1 ILE A 84 -9.332 3.935 -9.395 1.00 0.00 C ATOM 0 H ILE A 84 -7.092 0.133 -7.298 1.00 0.00 H new ATOM 0 HA ILE A 84 -9.712 0.290 -8.222 1.00 0.00 H new ATOM 0 HB ILE A 84 -8.252 2.193 -7.811 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -8.715 2.420 -10.777 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.103 1.980 -9.802 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.466 2.880 -9.343 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.103 1.347 -8.516 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -6.629 1.338 -10.216 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -9.992 4.412 -10.120 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.778 3.997 -8.402 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -8.368 4.444 -9.392 1.00 0.00 H new ATOM 1348 N ASP A 85 -7.859 -1.148 -10.466 1.00 0.00 N ATOM 1349 CA ASP A 85 -7.958 -1.999 -11.665 1.00 0.00 C ATOM 1350 C ASP A 85 -9.022 -3.109 -11.555 1.00 0.00 C ATOM 1351 O ASP A 85 -9.680 -3.445 -12.542 1.00 0.00 O ATOM 1352 CB ASP A 85 -6.577 -2.590 -11.923 1.00 0.00 C ATOM 1353 CG ASP A 85 -6.551 -3.659 -13.025 1.00 0.00 C ATOM 1354 OD1 ASP A 85 -6.571 -3.293 -14.225 1.00 0.00 O ATOM 1355 OD2 ASP A 85 -6.443 -4.865 -12.691 1.00 0.00 O ATOM 0 H ASP A 85 -6.933 -1.148 -10.037 1.00 0.00 H new ATOM 0 HA ASP A 85 -8.288 -1.381 -12.500 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -5.894 -1.785 -12.195 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -6.202 -3.027 -10.998 1.00 0.00 H new ATOM 1360 N GLU A 86 -9.236 -3.645 -10.351 1.00 0.00 N ATOM 1361 CA GLU A 86 -10.271 -4.647 -10.081 1.00 0.00 C ATOM 1362 C GLU A 86 -11.664 -3.997 -9.993 1.00 0.00 C ATOM 1363 O GLU A 86 -12.656 -4.576 -10.443 1.00 0.00 O ATOM 1364 CB GLU A 86 -9.920 -5.376 -8.772 1.00 0.00 C ATOM 1365 CG GLU A 86 -10.596 -6.738 -8.597 1.00 0.00 C ATOM 1366 CD GLU A 86 -9.948 -7.814 -9.491 1.00 0.00 C ATOM 1367 OE1 GLU A 86 -10.339 -7.954 -10.675 1.00 0.00 O ATOM 1368 OE2 GLU A 86 -9.045 -8.540 -9.008 1.00 0.00 O ATOM 0 H GLU A 86 -8.690 -3.393 -9.527 1.00 0.00 H new ATOM 0 HA GLU A 86 -10.305 -5.364 -10.901 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.840 -5.513 -8.727 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -10.195 -4.738 -7.932 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -10.532 -7.045 -7.553 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -11.655 -6.653 -8.840 1.00 0.00 H new ATOM 1375 N ILE A 87 -11.747 -2.768 -9.463 1.00 0.00 N ATOM 1376 CA ILE A 87 -13.005 -2.023 -9.321 1.00 0.00 C ATOM 1377 C ILE A 87 -13.559 -1.643 -10.700 1.00 0.00 C ATOM 1378 O ILE A 87 -14.764 -1.750 -10.934 1.00 0.00 O ATOM 1379 CB ILE A 87 -12.782 -0.783 -8.423 1.00 0.00 C ATOM 1380 CG1 ILE A 87 -12.246 -1.234 -7.043 1.00 0.00 C ATOM 1381 CG2 ILE A 87 -14.080 0.029 -8.269 1.00 0.00 C ATOM 1382 CD1 ILE A 87 -11.926 -0.090 -6.082 1.00 0.00 C ATOM 0 H ILE A 87 -10.934 -2.259 -9.117 1.00 0.00 H new ATOM 0 HA ILE A 87 -13.750 -2.655 -8.837 1.00 0.00 H new ATOM 0 HB ILE A 87 -12.045 -0.134 -8.896 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -12.984 -1.887 -6.577 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.344 -1.828 -7.194 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -13.894 0.895 -7.633 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -14.418 0.365 -9.249 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -14.849 -0.596 -7.815 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -11.557 -0.498 -5.141 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -11.164 0.553 -6.523 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -12.829 0.492 -5.896 1.00 0.00 H new ATOM 1394 N PHE A 88 -12.685 -1.255 -11.634 1.00 0.00 N ATOM 1395 CA PHE A 88 -13.049 -0.953 -13.019 1.00 0.00 C ATOM 1396 C PHE A 88 -13.589 -2.183 -13.782 1.00 0.00 C ATOM 1397 O PHE A 88 -14.499 -2.043 -14.600 1.00 0.00 O ATOM 1398 CB PHE A 88 -11.828 -0.347 -13.724 1.00 0.00 C ATOM 1399 CG PHE A 88 -12.076 0.108 -15.150 1.00 0.00 C ATOM 1400 CD1 PHE A 88 -12.713 1.340 -15.409 1.00 0.00 C ATOM 1401 CD2 PHE A 88 -11.666 -0.702 -16.226 1.00 0.00 C ATOM 1402 CE1 PHE A 88 -12.919 1.765 -16.733 1.00 0.00 C ATOM 1403 CE2 PHE A 88 -11.875 -0.276 -17.551 1.00 0.00 C ATOM 1404 CZ PHE A 88 -12.500 0.957 -17.804 1.00 0.00 C ATOM 0 H PHE A 88 -11.689 -1.141 -11.444 1.00 0.00 H new ATOM 0 HA PHE A 88 -13.869 -0.235 -13.011 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -11.476 0.505 -13.142 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -11.025 -1.084 -13.727 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -13.043 1.958 -14.588 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.190 -1.652 -16.034 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -13.399 2.713 -16.927 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -11.555 -0.897 -18.374 1.00 0.00 H new ATOM 0 HZ PHE A 88 -12.658 1.284 -18.821 1.00 0.00 H new ATOM 1414 N GLU A 89 -13.081 -3.389 -13.499 1.00 0.00 N ATOM 1415 CA GLU A 89 -13.548 -4.632 -14.137 1.00 0.00 C ATOM 1416 C GLU A 89 -14.921 -5.095 -13.625 1.00 0.00 C ATOM 1417 O GLU A 89 -15.796 -5.413 -14.436 1.00 0.00 O ATOM 1418 CB GLU A 89 -12.519 -5.763 -13.964 1.00 0.00 C ATOM 1419 CG GLU A 89 -11.399 -5.665 -15.009 1.00 0.00 C ATOM 1420 CD GLU A 89 -10.582 -6.971 -15.095 1.00 0.00 C ATOM 1421 OE1 GLU A 89 -11.123 -7.995 -15.583 1.00 0.00 O ATOM 1422 OE2 GLU A 89 -9.385 -6.984 -14.721 1.00 0.00 O ATOM 0 H GLU A 89 -12.333 -3.533 -12.820 1.00 0.00 H new ATOM 0 HA GLU A 89 -13.659 -4.400 -15.196 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -12.090 -5.717 -12.963 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -13.018 -6.728 -14.053 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.830 -5.441 -15.985 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -10.736 -4.837 -14.756 1.00 0.00 H new ATOM 1429 N ARG A 90 -15.140 -5.122 -12.298 1.00 0.00 N ATOM 1430 CA ARG A 90 -16.446 -5.434 -11.702 1.00 0.00 C ATOM 1431 C ARG A 90 -17.459 -4.282 -11.760 1.00 0.00 C ATOM 1432 O ARG A 90 -18.633 -4.511 -11.470 1.00 0.00 O ATOM 1433 CB ARG A 90 -16.261 -5.934 -10.261 1.00 0.00 C ATOM 1434 CG ARG A 90 -15.615 -7.323 -10.191 1.00 0.00 C ATOM 1435 CD ARG A 90 -14.086 -7.324 -10.170 1.00 0.00 C ATOM 1436 NE ARG A 90 -13.552 -8.684 -9.961 1.00 0.00 N ATOM 1437 CZ ARG A 90 -13.362 -9.622 -10.874 1.00 0.00 C ATOM 1438 NH1 ARG A 90 -13.683 -9.458 -12.129 1.00 0.00 N ATOM 1439 NH2 ARG A 90 -12.857 -10.774 -10.535 1.00 0.00 N ATOM 0 H ARG A 90 -14.413 -4.927 -11.610 1.00 0.00 H new ATOM 0 HA ARG A 90 -16.879 -6.224 -12.315 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -15.644 -5.223 -9.711 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -17.231 -5.964 -9.765 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -15.976 -7.830 -9.296 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -15.952 -7.908 -11.047 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -13.707 -6.923 -11.110 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -13.731 -6.666 -9.377 1.00 0.00 H new ATOM 0 HE ARG A 90 -13.301 -8.928 -9.003 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -14.098 -8.579 -12.439 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -13.519 -10.209 -12.800 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -12.607 -10.955 -9.563 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -12.712 -11.495 -11.242 1.00 0.00 H new ATOM 1453 N GLU A 91 -17.042 -3.070 -12.153 1.00 0.00 N ATOM 1454 CA GLU A 91 -17.892 -1.874 -12.234 1.00 0.00 C ATOM 1455 C GLU A 91 -18.532 -1.515 -10.873 1.00 0.00 C ATOM 1456 O GLU A 91 -19.679 -1.063 -10.804 1.00 0.00 O ATOM 1457 CB GLU A 91 -18.916 -1.998 -13.384 1.00 0.00 C ATOM 1458 CG GLU A 91 -18.300 -2.447 -14.721 1.00 0.00 C ATOM 1459 CD GLU A 91 -19.283 -2.354 -15.908 1.00 0.00 C ATOM 1460 OE1 GLU A 91 -20.523 -2.315 -15.706 1.00 0.00 O ATOM 1461 OE2 GLU A 91 -18.817 -2.288 -17.071 1.00 0.00 O ATOM 0 H GLU A 91 -16.077 -2.890 -12.431 1.00 0.00 H new ATOM 0 HA GLU A 91 -17.253 -1.025 -12.479 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -19.689 -2.710 -13.094 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.406 -1.035 -13.526 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -17.425 -1.833 -14.934 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -17.952 -3.476 -14.626 1.00 0.00 H new ATOM 1468 N LEU A 92 -17.801 -1.765 -9.778 1.00 0.00 N ATOM 1469 CA LEU A 92 -18.270 -1.509 -8.412 1.00 0.00 C ATOM 1470 C LEU A 92 -18.160 -0.022 -8.037 1.00 0.00 C ATOM 1471 O LEU A 92 -17.214 0.678 -8.401 1.00 0.00 O ATOM 1472 CB LEU A 92 -17.488 -2.372 -7.405 1.00 0.00 C ATOM 1473 CG LEU A 92 -17.783 -3.879 -7.504 1.00 0.00 C ATOM 1474 CD1 LEU A 92 -16.836 -4.650 -6.584 1.00 0.00 C ATOM 1475 CD2 LEU A 92 -19.221 -4.236 -7.115 1.00 0.00 C ATOM 0 H LEU A 92 -16.859 -2.154 -9.818 1.00 0.00 H new ATOM 0 HA LEU A 92 -19.325 -1.781 -8.373 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.421 -2.211 -7.557 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -17.720 -2.033 -6.395 1.00 0.00 H new ATOM 0 HG LEU A 92 -17.638 -4.154 -8.549 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -17.047 -5.717 -6.656 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -15.805 -4.463 -6.884 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -16.980 -4.320 -5.555 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -19.366 -5.313 -7.206 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -19.406 -3.930 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -19.916 -3.719 -7.777 1.00 0.00 H new ATOM 1487 N ASP A 93 -19.137 0.445 -7.265 1.00 0.00 N ATOM 1488 CA ASP A 93 -19.152 1.779 -6.666 1.00 0.00 C ATOM 1489 C ASP A 93 -18.301 1.834 -5.376 1.00 0.00 C ATOM 1490 O ASP A 93 -18.079 0.811 -4.713 1.00 0.00 O ATOM 1491 CB ASP A 93 -20.604 2.164 -6.343 1.00 0.00 C ATOM 1492 CG ASP A 93 -21.607 1.776 -7.448 1.00 0.00 C ATOM 1493 OD1 ASP A 93 -21.670 2.462 -8.492 1.00 0.00 O ATOM 1494 OD2 ASP A 93 -22.353 0.785 -7.254 1.00 0.00 O ATOM 0 H ASP A 93 -19.962 -0.107 -7.032 1.00 0.00 H new ATOM 0 HA ASP A 93 -18.720 2.482 -7.379 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.900 1.683 -5.411 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -20.657 3.240 -6.177 1.00 0.00 H new ATOM 1499 N LEU A 94 -17.870 3.036 -4.970 1.00 0.00 N ATOM 1500 CA LEU A 94 -17.255 3.258 -3.652 1.00 0.00 C ATOM 1501 C LEU A 94 -18.297 3.630 -2.589 1.00 0.00 C ATOM 1502 O LEU A 94 -19.339 4.224 -2.885 1.00 0.00 O ATOM 1503 CB LEU A 94 -16.155 4.336 -3.721 1.00 0.00 C ATOM 1504 CG LEU A 94 -14.878 3.947 -4.489 1.00 0.00 C ATOM 1505 CD1 LEU A 94 -13.748 4.885 -4.058 1.00 0.00 C ATOM 1506 CD2 LEU A 94 -14.392 2.514 -4.258 1.00 0.00 C ATOM 0 H LEU A 94 -17.937 3.878 -5.541 1.00 0.00 H new ATOM 0 HA LEU A 94 -16.797 2.314 -3.356 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -16.576 5.228 -4.184 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -15.875 4.607 -2.703 1.00 0.00 H new ATOM 0 HG LEU A 94 -15.135 4.027 -5.545 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.835 4.624 -4.592 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -14.022 5.915 -4.289 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -13.582 4.786 -2.985 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -13.488 2.338 -4.842 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -14.174 2.370 -3.200 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -15.167 1.813 -4.568 1.00 0.00 H new ATOM 1518 N MET A 95 -17.996 3.300 -1.330 1.00 0.00 N ATOM 1519 CA MET A 95 -18.765 3.775 -0.177 1.00 0.00 C ATOM 1520 C MET A 95 -18.437 5.252 0.108 1.00 0.00 C ATOM 1521 O MET A 95 -17.298 5.674 -0.093 1.00 0.00 O ATOM 1522 CB MET A 95 -18.464 2.877 1.034 1.00 0.00 C ATOM 1523 CG MET A 95 -19.459 3.095 2.184 1.00 0.00 C ATOM 1524 SD MET A 95 -19.910 1.602 3.116 1.00 0.00 S ATOM 1525 CE MET A 95 -18.279 0.991 3.609 1.00 0.00 C ATOM 0 H MET A 95 -17.212 2.696 -1.082 1.00 0.00 H new ATOM 0 HA MET A 95 -19.833 3.717 -0.389 1.00 0.00 H new ATOM 0 HB2 MET A 95 -18.493 1.832 0.725 1.00 0.00 H new ATOM 0 HB3 MET A 95 -17.453 3.076 1.389 1.00 0.00 H new ATOM 0 HG2 MET A 95 -19.034 3.821 2.877 1.00 0.00 H new ATOM 0 HG3 MET A 95 -20.368 3.537 1.777 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.384 0.014 4.081 1.00 0.00 H new ATOM 0 HE2 MET A 95 -17.642 0.902 2.729 1.00 0.00 H new ATOM 0 HE3 MET A 95 -17.827 1.688 4.314 1.00 0.00 H new ATOM 1535 N ARG A 96 -19.423 6.028 0.587 1.00 0.00 N ATOM 1536 CA ARG A 96 -19.301 7.472 0.879 1.00 0.00 C ATOM 1537 C ARG A 96 -19.883 7.889 2.236 1.00 0.00 C ATOM 1538 O ARG A 96 -20.658 7.153 2.847 1.00 0.00 O ATOM 1539 CB ARG A 96 -19.876 8.326 -0.271 1.00 0.00 C ATOM 1540 CG ARG A 96 -21.359 8.125 -0.613 1.00 0.00 C ATOM 1541 CD ARG A 96 -21.634 6.925 -1.536 1.00 0.00 C ATOM 1542 NE ARG A 96 -22.286 5.810 -0.809 1.00 0.00 N ATOM 1543 CZ ARG A 96 -23.545 5.735 -0.403 1.00 0.00 C ATOM 1544 NH1 ARG A 96 -24.440 6.629 -0.703 1.00 0.00 N ATOM 1545 NH2 ARG A 96 -23.941 4.717 0.310 1.00 0.00 N ATOM 0 H ARG A 96 -20.353 5.662 0.788 1.00 0.00 H new ATOM 0 HA ARG A 96 -18.231 7.667 0.954 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -19.725 9.376 -0.021 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -19.291 8.124 -1.168 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -21.920 7.994 0.313 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -21.737 9.030 -1.089 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -22.270 7.241 -2.363 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -20.696 6.577 -1.969 1.00 0.00 H new ATOM 0 HE ARG A 96 -21.696 5.006 -0.596 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -24.185 7.434 -1.276 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -25.397 6.526 -0.366 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -23.281 3.979 0.555 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -24.910 4.659 0.622 1.00 0.00 H new ATOM 1559 N VAL A 97 -19.539 9.109 2.661 1.00 0.00 N ATOM 1560 CA VAL A 97 -19.967 9.730 3.938 1.00 0.00 C ATOM 1561 C VAL A 97 -21.040 10.805 3.752 1.00 0.00 C ATOM 1562 O VAL A 97 -21.902 10.984 4.613 1.00 0.00 O ATOM 1563 CB VAL A 97 -18.785 10.321 4.738 1.00 0.00 C ATOM 1564 CG1 VAL A 97 -17.705 9.267 5.016 1.00 0.00 C ATOM 1565 CG2 VAL A 97 -18.109 11.545 4.108 1.00 0.00 C ATOM 0 H VAL A 97 -18.934 9.720 2.113 1.00 0.00 H new ATOM 0 HA VAL A 97 -20.401 8.910 4.510 1.00 0.00 H new ATOM 0 HB VAL A 97 -19.254 10.657 5.663 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -16.890 9.721 5.580 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -18.135 8.449 5.594 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -17.321 8.882 4.071 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -17.294 11.880 4.749 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -17.714 11.278 3.128 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -18.838 12.348 3.999 1.00 0.00 H new ATOM 1575 N ASP A 98 -21.029 11.486 2.604 1.00 0.00 N ATOM 1576 CA ASP A 98 -21.965 12.574 2.275 1.00 0.00 C ATOM 1577 C ASP A 98 -23.314 12.067 1.730 1.00 0.00 C ATOM 1578 O ASP A 98 -24.222 12.857 1.467 1.00 0.00 O ATOM 1579 CB ASP A 98 -21.280 13.502 1.260 1.00 0.00 C ATOM 1580 CG ASP A 98 -21.969 14.873 1.143 1.00 0.00 C ATOM 1581 OD1 ASP A 98 -22.117 15.569 2.179 1.00 0.00 O ATOM 1582 OD2 ASP A 98 -22.322 15.290 0.013 1.00 0.00 O ATOM 0 H ASP A 98 -20.358 11.296 1.860 1.00 0.00 H new ATOM 0 HA ASP A 98 -22.204 13.112 3.192 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -20.240 13.647 1.552 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -21.272 13.020 0.282 1.00 0.00 H new ATOM 1587 N ASN A 99 -23.451 10.741 1.570 1.00 0.00 N ATOM 1588 CA ASN A 99 -24.645 10.081 1.004 1.00 0.00 C ATOM 1589 C ASN A 99 -24.965 10.543 -0.421 1.00 0.00 C ATOM 1590 O ASN A 99 -26.120 10.647 -0.852 1.00 0.00 O ATOM 1591 CB ASN A 99 -25.807 10.074 2.016 1.00 0.00 C ATOM 1592 CG ASN A 99 -25.504 9.005 3.042 1.00 0.00 C ATOM 1593 OD1 ASN A 99 -26.061 7.916 3.032 1.00 0.00 O ATOM 1594 ND2 ASN A 99 -24.483 9.231 3.834 1.00 0.00 N ATOM 0 H ASN A 99 -22.720 10.081 1.836 1.00 0.00 H new ATOM 0 HA ASN A 99 -24.425 9.025 0.848 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -25.906 11.048 2.494 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -26.752 9.868 1.514 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -24.144 8.494 4.452 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -24.028 10.144 3.832 1.00 0.00 H new ATOM 1601 N LEU A 100 -23.876 10.784 -1.153 1.00 0.00 N ATOM 1602 CA LEU A 100 -23.912 10.969 -2.612 1.00 0.00 C ATOM 1603 C LEU A 100 -24.435 9.683 -3.291 1.00 0.00 C ATOM 1604 O LEU A 100 -24.320 8.598 -2.708 1.00 0.00 O ATOM 1605 CB LEU A 100 -22.508 11.325 -3.146 1.00 0.00 C ATOM 1606 CG LEU A 100 -22.056 12.776 -2.907 1.00 0.00 C ATOM 1607 CD1 LEU A 100 -20.625 12.931 -3.422 1.00 0.00 C ATOM 1608 CD2 LEU A 100 -22.923 13.806 -3.638 1.00 0.00 C ATOM 0 H LEU A 100 -22.940 10.857 -0.754 1.00 0.00 H new ATOM 0 HA LEU A 100 -24.586 11.793 -2.846 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -21.782 10.656 -2.683 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -22.485 11.128 -4.218 1.00 0.00 H new ATOM 0 HG LEU A 100 -22.140 12.963 -1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -20.289 13.955 -3.260 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -19.969 12.245 -2.886 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -20.595 12.704 -4.488 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -22.551 14.809 -3.428 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -22.881 13.621 -4.711 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -23.954 13.722 -3.296 1.00 0.00 H new ATOM 1620 N PRO A 101 -24.970 9.760 -4.523 1.00 0.00 N ATOM 1621 CA PRO A 101 -25.394 8.580 -5.273 1.00 0.00 C ATOM 1622 C PRO A 101 -24.191 7.664 -5.556 1.00 0.00 C ATOM 1623 O PRO A 101 -23.089 8.141 -5.839 1.00 0.00 O ATOM 1624 CB PRO A 101 -26.041 9.121 -6.555 1.00 0.00 C ATOM 1625 CG PRO A 101 -25.392 10.492 -6.747 1.00 0.00 C ATOM 1626 CD PRO A 101 -25.122 10.966 -5.319 1.00 0.00 C ATOM 0 HA PRO A 101 -26.104 7.964 -4.721 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -25.850 8.466 -7.405 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -27.123 9.203 -6.452 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -24.472 10.422 -7.327 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -26.052 11.177 -7.279 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -24.222 11.580 -5.274 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -25.944 11.578 -4.948 1.00 0.00 H new ATOM 1634 N ASN A 102 -24.390 6.347 -5.467 1.00 0.00 N ATOM 1635 CA ASN A 102 -23.338 5.366 -5.760 1.00 0.00 C ATOM 1636 C ASN A 102 -22.966 5.404 -7.255 1.00 0.00 C ATOM 1637 O ASN A 102 -23.844 5.274 -8.118 1.00 0.00 O ATOM 1638 CB ASN A 102 -23.814 3.966 -5.345 1.00 0.00 C ATOM 1639 CG ASN A 102 -24.050 3.816 -3.854 1.00 0.00 C ATOM 1640 OD1 ASN A 102 -25.173 3.643 -3.400 1.00 0.00 O ATOM 1641 ND2 ASN A 102 -23.021 3.860 -3.033 1.00 0.00 N ATOM 0 H ASN A 102 -25.279 5.930 -5.191 1.00 0.00 H new ATOM 0 HA ASN A 102 -22.443 5.615 -5.190 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -24.738 3.735 -5.875 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -23.073 3.232 -5.662 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -23.164 3.750 -2.029 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -22.081 4.004 -3.401 1.00 0.00 H new ATOM 1648 N ILE A 103 -21.672 5.578 -7.552 1.00 0.00 N ATOM 1649 CA ILE A 103 -21.131 5.720 -8.914 1.00 0.00 C ATOM 1650 C ILE A 103 -19.760 5.038 -9.036 1.00 0.00 C ATOM 1651 O ILE A 103 -18.880 5.215 -8.185 1.00 0.00 O ATOM 1652 CB ILE A 103 -21.074 7.206 -9.359 1.00 0.00 C ATOM 1653 CG1 ILE A 103 -20.493 8.140 -8.269 1.00 0.00 C ATOM 1654 CG2 ILE A 103 -22.473 7.668 -9.810 1.00 0.00 C ATOM 1655 CD1 ILE A 103 -20.459 9.624 -8.647 1.00 0.00 C ATOM 0 H ILE A 103 -20.950 5.626 -6.833 1.00 0.00 H new ATOM 0 HA ILE A 103 -21.815 5.213 -9.594 1.00 0.00 H new ATOM 0 HB ILE A 103 -20.386 7.272 -10.202 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -21.082 8.025 -7.359 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -19.479 7.816 -8.035 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -22.429 8.712 -10.122 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -22.807 7.054 -10.646 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -23.174 7.566 -8.982 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -20.037 10.200 -7.823 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -19.844 9.759 -9.537 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -21.472 9.971 -8.850 1.00 0.00 H new ATOM 1667 N LYS A 104 -19.590 4.250 -10.104 1.00 0.00 N ATOM 1668 CA LYS A 104 -18.340 3.557 -10.457 1.00 0.00 C ATOM 1669 C LYS A 104 -17.412 4.449 -11.293 1.00 0.00 C ATOM 1670 O LYS A 104 -17.760 5.572 -11.662 1.00 0.00 O ATOM 1671 CB LYS A 104 -18.667 2.173 -11.079 1.00 0.00 C ATOM 1672 CG LYS A 104 -19.466 2.129 -12.399 1.00 0.00 C ATOM 1673 CD LYS A 104 -18.606 2.409 -13.641 1.00 0.00 C ATOM 1674 CE LYS A 104 -19.395 2.448 -14.959 1.00 0.00 C ATOM 1675 NZ LYS A 104 -19.588 1.103 -15.565 1.00 0.00 N ATOM 0 H LYS A 104 -20.342 4.070 -10.770 1.00 0.00 H new ATOM 0 HA LYS A 104 -17.760 3.353 -9.557 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -17.724 1.653 -11.245 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -19.221 1.599 -10.337 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -19.931 1.148 -12.501 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -20.272 2.861 -12.352 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -18.096 3.363 -13.508 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -17.835 1.642 -13.715 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -20.370 2.902 -14.779 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -18.872 3.088 -15.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -20.126 1.195 -16.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -18.661 0.677 -15.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -20.112 0.496 -14.903 1.00 0.00 H new ATOM 1689 N ILE A 105 -16.219 3.939 -11.600 1.00 0.00 N ATOM 1690 CA ILE A 105 -15.214 4.605 -12.448 1.00 0.00 C ATOM 1691 C ILE A 105 -15.753 4.770 -13.881 1.00 0.00 C ATOM 1692 O ILE A 105 -15.906 3.792 -14.616 1.00 0.00 O ATOM 1693 CB ILE A 105 -13.914 3.766 -12.453 1.00 0.00 C ATOM 1694 CG1 ILE A 105 -13.331 3.537 -11.042 1.00 0.00 C ATOM 1695 CG2 ILE A 105 -12.839 4.417 -13.343 1.00 0.00 C ATOM 1696 CD1 ILE A 105 -12.572 2.223 -10.919 1.00 0.00 C ATOM 0 H ILE A 105 -15.911 3.028 -11.260 1.00 0.00 H new ATOM 0 HA ILE A 105 -15.000 5.596 -12.047 1.00 0.00 H new ATOM 0 HB ILE A 105 -14.194 2.793 -12.857 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -12.663 4.361 -10.793 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -14.141 3.552 -10.313 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -11.936 3.807 -13.328 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -13.210 4.492 -14.365 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -12.609 5.414 -12.966 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -12.186 2.119 -9.905 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -13.244 1.393 -11.139 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -11.742 2.215 -11.626 1.00 0.00 H new ATOM 1708 N ALA A 106 -16.052 6.006 -14.279 1.00 0.00 N ATOM 1709 CA ALA A 106 -16.592 6.345 -15.599 1.00 0.00 C ATOM 1710 C ALA A 106 -15.604 6.023 -16.734 1.00 0.00 C ATOM 1711 O ALA A 106 -15.989 5.444 -17.752 1.00 0.00 O ATOM 1712 CB ALA A 106 -16.961 7.833 -15.600 1.00 0.00 C ATOM 0 H ALA A 106 -15.923 6.821 -13.679 1.00 0.00 H new ATOM 0 HA ALA A 106 -17.476 5.736 -15.785 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -17.365 8.107 -16.574 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -17.709 8.023 -14.830 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -16.071 8.429 -15.396 1.00 0.00 H new ATOM 1718 N THR A 107 -14.325 6.364 -16.533 1.00 0.00 N ATOM 1719 CA THR A 107 -13.195 6.056 -17.431 1.00 0.00 C ATOM 1720 C THR A 107 -11.881 5.937 -16.650 1.00 0.00 C ATOM 1721 O THR A 107 -11.703 6.567 -15.600 1.00 0.00 O ATOM 1722 CB THR A 107 -13.001 7.126 -18.532 1.00 0.00 C ATOM 1723 OG1 THR A 107 -13.115 8.440 -18.030 1.00 0.00 O ATOM 1724 CG2 THR A 107 -13.990 6.993 -19.689 1.00 0.00 C ATOM 0 H THR A 107 -14.032 6.884 -15.706 1.00 0.00 H new ATOM 0 HA THR A 107 -13.446 5.105 -17.901 1.00 0.00 H new ATOM 0 HB THR A 107 -11.991 6.945 -18.899 1.00 0.00 H new ATOM 0 HG1 THR A 107 -12.984 9.081 -18.759 1.00 0.00 H new ATOM 0 HG21 THR A 107 -13.797 7.774 -20.424 1.00 0.00 H new ATOM 0 HG22 THR A 107 -13.872 6.016 -20.158 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.008 7.093 -19.311 1.00 0.00 H new ATOM 1732 N ARG A 108 -10.940 5.153 -17.195 1.00 0.00 N ATOM 1733 CA ARG A 108 -9.573 4.957 -16.681 1.00 0.00 C ATOM 1734 C ARG A 108 -8.561 4.974 -17.836 1.00 0.00 C ATOM 1735 O ARG A 108 -8.832 4.442 -18.915 1.00 0.00 O ATOM 1736 CB ARG A 108 -9.503 3.626 -15.902 1.00 0.00 C ATOM 1737 CG ARG A 108 -8.187 3.458 -15.109 1.00 0.00 C ATOM 1738 CD ARG A 108 -7.978 2.037 -14.573 1.00 0.00 C ATOM 1739 NE ARG A 108 -7.857 1.051 -15.667 1.00 0.00 N ATOM 1740 CZ ARG A 108 -6.834 0.812 -16.467 1.00 0.00 C ATOM 1741 NH1 ARG A 108 -5.663 1.349 -16.281 1.00 0.00 N ATOM 1742 NH2 ARG A 108 -6.972 0.022 -17.493 1.00 0.00 N ATOM 0 H ARG A 108 -11.116 4.614 -18.043 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.319 5.773 -16.004 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -10.346 3.570 -15.213 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -9.608 2.796 -16.601 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -7.348 3.723 -15.752 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -8.183 4.158 -14.274 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -7.079 2.009 -13.957 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -8.814 1.765 -13.929 1.00 0.00 H new ATOM 0 HE ARG A 108 -8.682 0.472 -15.827 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -5.510 1.980 -15.494 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -4.898 1.139 -16.922 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -7.874 -0.416 -17.682 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -6.178 -0.159 -18.108 1.00 0.00 H new ATOM 1756 N LYS A 109 -7.387 5.551 -17.576 1.00 0.00 N ATOM 1757 CA LYS A 109 -6.204 5.615 -18.451 1.00 0.00 C ATOM 1758 C LYS A 109 -4.928 5.718 -17.617 1.00 0.00 C ATOM 1759 O LYS A 109 -4.933 6.341 -16.555 1.00 0.00 O ATOM 1760 CB LYS A 109 -6.279 6.863 -19.352 1.00 0.00 C ATOM 1761 CG LYS A 109 -7.162 6.672 -20.598 1.00 0.00 C ATOM 1762 CD LYS A 109 -6.854 7.722 -21.678 1.00 0.00 C ATOM 1763 CE LYS A 109 -5.461 7.539 -22.303 1.00 0.00 C ATOM 1764 NZ LYS A 109 -5.420 6.422 -23.289 1.00 0.00 N ATOM 0 H LYS A 109 -7.221 6.021 -16.686 1.00 0.00 H new ATOM 0 HA LYS A 109 -6.186 4.708 -19.055 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -6.664 7.699 -18.769 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -5.272 7.133 -19.669 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -7.005 5.673 -21.006 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -8.212 6.739 -20.314 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -7.610 7.664 -22.461 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -6.924 8.718 -21.241 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -5.163 8.465 -22.795 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -4.734 7.349 -21.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.460 6.340 -23.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -5.678 5.532 -22.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -6.093 6.613 -24.058 1.00 0.00 H new ATOM 1778 N TYR A 110 -3.828 5.160 -18.117 1.00 0.00 N ATOM 1779 CA TYR A 110 -2.494 5.382 -17.550 1.00 0.00 C ATOM 1780 C TYR A 110 -2.019 6.807 -17.863 1.00 0.00 C ATOM 1781 O TYR A 110 -1.983 7.211 -19.031 1.00 0.00 O ATOM 1782 CB TYR A 110 -1.509 4.344 -18.109 1.00 0.00 C ATOM 1783 CG TYR A 110 -0.106 4.423 -17.525 1.00 0.00 C ATOM 1784 CD1 TYR A 110 0.077 4.561 -16.135 1.00 0.00 C ATOM 1785 CD2 TYR A 110 1.021 4.356 -18.368 1.00 0.00 C ATOM 1786 CE1 TYR A 110 1.368 4.654 -15.596 1.00 0.00 C ATOM 1787 CE2 TYR A 110 2.321 4.414 -17.825 1.00 0.00 C ATOM 1788 CZ TYR A 110 2.499 4.564 -16.432 1.00 0.00 C ATOM 1789 OH TYR A 110 3.747 4.626 -15.896 1.00 0.00 O ATOM 0 H TYR A 110 -3.833 4.540 -18.927 1.00 0.00 H new ATOM 0 HA TYR A 110 -2.541 5.267 -16.467 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -1.909 3.347 -17.925 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -1.446 4.468 -19.190 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -0.782 4.595 -15.481 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.888 4.260 -19.436 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.497 4.796 -14.533 1.00 0.00 H new ATOM 0 HE2 TYR A 110 3.181 4.344 -18.475 1.00 0.00 H new ATOM 0 HH TYR A 110 4.414 4.547 -16.610 1.00 0.00 H new ATOM 1799 N LEU A 111 -1.667 7.576 -16.829 1.00 0.00 N ATOM 1800 CA LEU A 111 -1.175 8.950 -16.985 1.00 0.00 C ATOM 1801 C LEU A 111 0.348 8.993 -17.109 1.00 0.00 C ATOM 1802 O LEU A 111 0.888 9.713 -17.952 1.00 0.00 O ATOM 1803 CB LEU A 111 -1.585 9.773 -15.756 1.00 0.00 C ATOM 1804 CG LEU A 111 -3.093 9.989 -15.628 1.00 0.00 C ATOM 1805 CD1 LEU A 111 -3.397 10.492 -14.227 1.00 0.00 C ATOM 1806 CD2 LEU A 111 -3.606 11.002 -16.653 1.00 0.00 C ATOM 0 H LEU A 111 -1.715 7.264 -15.859 1.00 0.00 H new ATOM 0 HA LEU A 111 -1.610 9.360 -17.896 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.222 9.272 -14.858 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -1.092 10.744 -15.800 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.595 9.040 -15.816 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.470 10.650 -14.122 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.066 9.755 -13.496 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.873 11.433 -14.056 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.682 11.130 -16.532 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.107 11.959 -16.500 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.395 10.640 -17.659 1.00 0.00 H new ATOM 1818 N GLY A 112 1.031 8.236 -16.250 1.00 0.00 N ATOM 1819 CA GLY A 112 2.488 8.215 -16.158 1.00 0.00 C ATOM 1820 C GLY A 112 2.996 7.875 -14.757 1.00 0.00 C ATOM 1821 O GLY A 112 2.366 7.126 -14.013 1.00 0.00 O ATOM 0 H GLY A 112 0.577 7.609 -15.586 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.880 7.486 -16.867 1.00 0.00 H new ATOM 0 HA3 GLY A 112 2.879 9.189 -16.453 1.00 0.00 H new ATOM 1825 N LYS A 113 4.123 8.472 -14.368 1.00 0.00 N ATOM 1826 CA LYS A 113 4.920 8.080 -13.183 1.00 0.00 C ATOM 1827 C LYS A 113 5.117 9.216 -12.170 1.00 0.00 C ATOM 1828 O LYS A 113 6.226 9.597 -11.794 1.00 0.00 O ATOM 1829 CB LYS A 113 6.222 7.423 -13.661 1.00 0.00 C ATOM 1830 CG LYS A 113 6.639 6.344 -12.654 1.00 0.00 C ATOM 1831 CD LYS A 113 8.001 5.718 -12.986 1.00 0.00 C ATOM 1832 CE LYS A 113 9.153 6.660 -12.612 1.00 0.00 C ATOM 1833 NZ LYS A 113 10.477 6.109 -13.006 1.00 0.00 N ATOM 0 H LYS A 113 4.525 9.261 -14.874 1.00 0.00 H new ATOM 0 HA LYS A 113 4.360 7.344 -12.606 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.080 6.982 -14.648 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.008 8.172 -13.757 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.678 6.780 -11.656 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.880 5.562 -12.631 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.111 4.775 -12.450 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.048 5.487 -14.050 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.004 7.625 -13.097 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.140 6.838 -11.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 11.226 6.778 -12.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.632 5.201 -12.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.500 5.963 -14.035 1.00 0.00 H new ATOM 1847 N GLN A 114 3.989 9.804 -11.811 1.00 0.00 N ATOM 1848 CA GLN A 114 3.830 11.052 -11.058 1.00 0.00 C ATOM 1849 C GLN A 114 4.189 10.894 -9.578 1.00 0.00 C ATOM 1850 O GLN A 114 4.129 9.799 -9.012 1.00 0.00 O ATOM 1851 CB GLN A 114 2.392 11.587 -11.203 1.00 0.00 C ATOM 1852 CG GLN A 114 1.953 11.370 -12.656 1.00 0.00 C ATOM 1853 CD GLN A 114 0.777 12.164 -13.143 1.00 0.00 C ATOM 1854 OE1 GLN A 114 0.011 12.803 -12.430 1.00 0.00 O ATOM 1855 NE2 GLN A 114 0.636 12.121 -14.442 1.00 0.00 N ATOM 0 H GLN A 114 3.086 9.396 -12.054 1.00 0.00 H new ATOM 0 HA GLN A 114 4.529 11.772 -11.483 1.00 0.00 H new ATOM 0 HB2 GLN A 114 1.721 11.067 -10.520 1.00 0.00 H new ATOM 0 HB3 GLN A 114 2.351 12.645 -10.946 1.00 0.00 H new ATOM 0 HG2 GLN A 114 2.802 11.593 -13.302 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.723 10.312 -12.785 1.00 0.00 H new ATOM 0 HE21 GLN A 114 1.290 11.580 -15.008 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -0.128 12.628 -14.889 1.00 0.00 H new ATOM 1864 N ASN A 115 4.509 12.013 -8.933 1.00 0.00 N ATOM 1865 CA ASN A 115 4.703 12.094 -7.505 1.00 0.00 C ATOM 1866 C ASN A 115 3.422 11.723 -6.743 1.00 0.00 C ATOM 1867 O ASN A 115 2.404 12.413 -6.856 1.00 0.00 O ATOM 1868 CB ASN A 115 5.210 13.509 -7.157 1.00 0.00 C ATOM 1869 CG ASN A 115 6.293 13.442 -6.107 1.00 0.00 C ATOM 1870 OD1 ASN A 115 7.360 14.030 -6.236 1.00 0.00 O ATOM 1871 ND2 ASN A 115 6.091 12.671 -5.064 1.00 0.00 N ATOM 0 H ASN A 115 4.642 12.905 -9.409 1.00 0.00 H new ATOM 0 HA ASN A 115 5.453 11.368 -7.191 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.595 13.994 -8.054 1.00 0.00 H new ATOM 0 HB3 ASN A 115 4.382 14.119 -6.795 1.00 0.00 H new ATOM 0 HD21 ASN A 115 6.822 12.562 -4.361 1.00 0.00 H new ATOM 0 HD22 ASN A 115 5.203 12.181 -4.956 1.00 0.00 H new ATOM 1878 N VAL A 116 3.491 10.656 -5.940 1.00 0.00 N ATOM 1879 CA VAL A 116 2.375 10.204 -5.097 1.00 0.00 C ATOM 1880 C VAL A 116 2.790 10.067 -3.631 1.00 0.00 C ATOM 1881 O VAL A 116 3.970 9.908 -3.307 1.00 0.00 O ATOM 1882 CB VAL A 116 1.717 8.925 -5.653 1.00 0.00 C ATOM 1883 CG1 VAL A 116 1.002 9.180 -6.977 1.00 0.00 C ATOM 1884 CG2 VAL A 116 2.697 7.774 -5.893 1.00 0.00 C ATOM 0 H VAL A 116 4.327 10.077 -5.855 1.00 0.00 H new ATOM 0 HA VAL A 116 1.609 10.979 -5.128 1.00 0.00 H new ATOM 0 HB VAL A 116 1.013 8.637 -4.872 1.00 0.00 H new ATOM 0 HG11 VAL A 116 0.553 8.253 -7.333 1.00 0.00 H new ATOM 0 HG12 VAL A 116 0.223 9.928 -6.831 1.00 0.00 H new ATOM 0 HG13 VAL A 116 1.719 9.542 -7.714 1.00 0.00 H new ATOM 0 HG21 VAL A 116 2.157 6.912 -6.284 1.00 0.00 H new ATOM 0 HG22 VAL A 116 3.454 8.085 -6.613 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.179 7.505 -4.953 1.00 0.00 H new ATOM 1894 N TYR A 117 1.801 10.152 -2.744 1.00 0.00 N ATOM 1895 CA TYR A 117 1.961 10.292 -1.298 1.00 0.00 C ATOM 1896 C TYR A 117 0.869 9.527 -0.532 1.00 0.00 C ATOM 1897 O TYR A 117 -0.210 9.252 -1.066 1.00 0.00 O ATOM 1898 CB TYR A 117 1.856 11.782 -0.946 1.00 0.00 C ATOM 1899 CG TYR A 117 2.669 12.739 -1.796 1.00 0.00 C ATOM 1900 CD1 TYR A 117 2.097 13.294 -2.958 1.00 0.00 C ATOM 1901 CD2 TYR A 117 3.973 13.102 -1.413 1.00 0.00 C ATOM 1902 CE1 TYR A 117 2.816 14.238 -3.718 1.00 0.00 C ATOM 1903 CE2 TYR A 117 4.687 14.061 -2.156 1.00 0.00 C ATOM 1904 CZ TYR A 117 4.103 14.645 -3.301 1.00 0.00 C ATOM 1905 OH TYR A 117 4.785 15.594 -3.998 1.00 0.00 O ATOM 0 H TYR A 117 0.821 10.124 -3.027 1.00 0.00 H new ATOM 0 HA TYR A 117 2.929 9.880 -1.013 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.808 12.074 -1.011 1.00 0.00 H new ATOM 0 HB3 TYR A 117 2.158 11.909 0.094 1.00 0.00 H new ATOM 0 HD1 TYR A 117 1.106 12.995 -3.267 1.00 0.00 H new ATOM 0 HD2 TYR A 117 4.427 12.644 -0.547 1.00 0.00 H new ATOM 0 HE1 TYR A 117 2.384 14.650 -4.618 1.00 0.00 H new ATOM 0 HE2 TYR A 117 5.682 14.350 -1.850 1.00 0.00 H new ATOM 0 HH TYR A 117 5.653 15.753 -3.571 1.00 0.00 H new ATOM 1915 N ASP A 118 1.132 9.214 0.736 1.00 0.00 N ATOM 1916 CA ASP A 118 0.208 8.504 1.622 1.00 0.00 C ATOM 1917 C ASP A 118 0.533 8.830 3.089 1.00 0.00 C ATOM 1918 O ASP A 118 1.684 8.736 3.520 1.00 0.00 O ATOM 1919 CB ASP A 118 0.324 6.994 1.361 1.00 0.00 C ATOM 1920 CG ASP A 118 -0.587 6.187 2.298 1.00 0.00 C ATOM 1921 OD1 ASP A 118 -1.803 6.452 2.335 1.00 0.00 O ATOM 1922 OD2 ASP A 118 -0.065 5.264 2.987 1.00 0.00 O ATOM 0 H ASP A 118 2.015 9.453 1.188 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.815 8.822 1.422 1.00 0.00 H new ATOM 0 HB2 ASP A 118 0.061 6.782 0.325 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.358 6.679 1.498 1.00 0.00 H new ATOM 1927 N ILE A 119 -0.468 9.239 3.870 1.00 0.00 N ATOM 1928 CA ILE A 119 -0.287 9.480 5.308 1.00 0.00 C ATOM 1929 C ILE A 119 -0.354 8.167 6.107 1.00 0.00 C ATOM 1930 O ILE A 119 -1.149 7.271 5.815 1.00 0.00 O ATOM 1931 CB ILE A 119 -1.276 10.536 5.841 1.00 0.00 C ATOM 1932 CG1 ILE A 119 -2.758 10.173 5.597 1.00 0.00 C ATOM 1933 CG2 ILE A 119 -0.895 11.899 5.231 1.00 0.00 C ATOM 1934 CD1 ILE A 119 -3.739 11.081 6.344 1.00 0.00 C ATOM 0 H ILE A 119 -1.415 9.411 3.533 1.00 0.00 H new ATOM 0 HA ILE A 119 0.713 9.891 5.449 1.00 0.00 H new ATOM 0 HB ILE A 119 -1.191 10.579 6.927 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -2.966 10.227 4.528 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.926 9.140 5.902 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.581 12.664 5.593 1.00 0.00 H new ATOM 0 HG22 ILE A 119 0.123 12.157 5.523 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.957 11.841 4.144 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -4.761 10.769 6.127 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.557 11.009 7.416 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.598 12.112 6.021 1.00 0.00 H new ATOM 1946 N GLY A 120 0.481 8.066 7.141 1.00 0.00 N ATOM 1947 CA GLY A 120 0.501 6.935 8.066 1.00 0.00 C ATOM 1948 C GLY A 120 -0.553 7.104 9.158 1.00 0.00 C ATOM 1949 O GLY A 120 -0.698 8.195 9.713 1.00 0.00 O ATOM 0 H GLY A 120 1.174 8.781 7.362 1.00 0.00 H new ATOM 0 HA2 GLY A 120 0.319 6.010 7.519 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.489 6.848 8.519 1.00 0.00 H new ATOM 1953 N VAL A 121 -1.274 6.024 9.464 1.00 0.00 N ATOM 1954 CA VAL A 121 -2.360 5.960 10.460 1.00 0.00 C ATOM 1955 C VAL A 121 -2.476 4.533 11.017 1.00 0.00 C ATOM 1956 O VAL A 121 -3.129 3.663 10.441 1.00 0.00 O ATOM 1957 CB VAL A 121 -3.724 6.442 9.897 1.00 0.00 C ATOM 1958 CG1 VAL A 121 -3.883 7.966 9.989 1.00 0.00 C ATOM 1959 CG2 VAL A 121 -4.002 6.036 8.440 1.00 0.00 C ATOM 0 H VAL A 121 -1.114 5.126 9.007 1.00 0.00 H new ATOM 0 HA VAL A 121 -2.100 6.646 11.266 1.00 0.00 H new ATOM 0 HB VAL A 121 -4.447 5.933 10.535 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.852 8.256 9.583 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.819 8.276 11.032 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -3.091 8.450 9.417 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -4.977 6.417 8.136 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -3.231 6.453 7.793 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -3.996 4.949 8.358 1.00 0.00 H new ATOM 1969 N GLU A 122 -1.809 4.264 12.147 1.00 0.00 N ATOM 1970 CA GLU A 122 -1.833 2.945 12.812 1.00 0.00 C ATOM 1971 C GLU A 122 -3.225 2.555 13.353 1.00 0.00 C ATOM 1972 O GLU A 122 -3.531 1.365 13.474 1.00 0.00 O ATOM 1973 CB GLU A 122 -0.824 2.918 13.972 1.00 0.00 C ATOM 1974 CG GLU A 122 0.633 2.964 13.497 1.00 0.00 C ATOM 1975 CD GLU A 122 1.600 2.869 14.690 1.00 0.00 C ATOM 1976 OE1 GLU A 122 1.889 1.738 15.156 1.00 0.00 O ATOM 1977 OE2 GLU A 122 2.087 3.923 15.170 1.00 0.00 O ATOM 0 H GLU A 122 -1.234 4.954 12.631 1.00 0.00 H new ATOM 0 HA GLU A 122 -1.565 2.217 12.046 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -1.013 3.766 14.631 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -0.980 2.015 14.562 1.00 0.00 H new ATOM 0 HG2 GLU A 122 0.821 2.143 12.805 1.00 0.00 H new ATOM 0 HG3 GLU A 122 0.813 3.890 12.950 1.00 0.00 H new ATOM 1984 N ARG A 123 -4.067 3.549 13.675 1.00 0.00 N ATOM 1985 CA ARG A 123 -5.423 3.367 14.225 1.00 0.00 C ATOM 1986 C ARG A 123 -6.343 2.579 13.282 1.00 0.00 C ATOM 1987 O ARG A 123 -7.026 1.662 13.740 1.00 0.00 O ATOM 1988 CB ARG A 123 -5.991 4.757 14.566 1.00 0.00 C ATOM 1989 CG ARG A 123 -7.417 4.790 15.149 1.00 0.00 C ATOM 1990 CD ARG A 123 -7.548 4.162 16.546 1.00 0.00 C ATOM 1991 NE ARG A 123 -7.616 2.688 16.508 1.00 0.00 N ATOM 1992 CZ ARG A 123 -7.727 1.885 17.552 1.00 0.00 C ATOM 1993 NH1 ARG A 123 -7.780 2.339 18.775 1.00 0.00 N ATOM 1994 NH2 ARG A 123 -7.791 0.596 17.387 1.00 0.00 N ATOM 0 H ARG A 123 -3.818 4.531 13.557 1.00 0.00 H new ATOM 0 HA ARG A 123 -5.366 2.761 15.129 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -5.319 5.235 15.279 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -5.978 5.363 13.660 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -7.753 5.826 15.197 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -8.088 4.269 14.466 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -6.698 4.466 17.157 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -8.444 4.550 17.031 1.00 0.00 H new ATOM 0 HE ARG A 123 -7.573 2.247 15.589 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -7.736 3.343 18.949 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -7.866 1.690 19.557 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -7.756 0.200 16.448 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -7.877 -0.018 18.197 1.00 0.00 H new ATOM 2008 N ASP A 124 -6.332 2.917 11.991 1.00 0.00 N ATOM 2009 CA ASP A 124 -6.963 2.173 10.889 1.00 0.00 C ATOM 2010 C ASP A 124 -6.439 2.697 9.532 1.00 0.00 C ATOM 2011 O ASP A 124 -6.331 3.914 9.341 1.00 0.00 O ATOM 2012 CB ASP A 124 -8.499 2.302 10.953 1.00 0.00 C ATOM 2013 CG ASP A 124 -9.231 1.103 10.312 1.00 0.00 C ATOM 2014 OD1 ASP A 124 -8.646 0.388 9.462 1.00 0.00 O ATOM 2015 OD2 ASP A 124 -10.391 0.831 10.713 1.00 0.00 O ATOM 0 H ASP A 124 -5.859 3.760 11.665 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.704 1.119 10.988 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -8.807 2.395 11.994 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -8.803 3.219 10.448 1.00 0.00 H new ATOM 2020 N HIS A 125 -6.104 1.802 8.597 1.00 0.00 N ATOM 2021 CA HIS A 125 -5.427 2.077 7.310 1.00 0.00 C ATOM 2022 C HIS A 125 -6.217 2.901 6.258 1.00 0.00 C ATOM 2023 O HIS A 125 -5.829 2.931 5.088 1.00 0.00 O ATOM 2024 CB HIS A 125 -4.887 0.753 6.720 1.00 0.00 C ATOM 2025 CG HIS A 125 -5.806 -0.453 6.680 1.00 0.00 C ATOM 2026 ND1 HIS A 125 -7.178 -0.496 6.825 1.00 0.00 N ATOM 2027 CD2 HIS A 125 -5.391 -1.748 6.501 1.00 0.00 C ATOM 2028 CE1 HIS A 125 -7.574 -1.779 6.747 1.00 0.00 C ATOM 2029 NE2 HIS A 125 -6.515 -2.586 6.553 1.00 0.00 N ATOM 0 H HIS A 125 -6.306 0.809 8.717 1.00 0.00 H new ATOM 0 HA HIS A 125 -4.610 2.753 7.561 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -4.561 0.954 5.700 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -4.000 0.474 7.289 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -4.371 -2.068 6.346 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -8.597 -2.114 6.829 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -6.527 -3.602 6.462 1.00 0.00 H new ATOM 2037 N ASN A 126 -7.303 3.575 6.633 1.00 0.00 N ATOM 2038 CA ASN A 126 -8.246 4.248 5.733 1.00 0.00 C ATOM 2039 C ASN A 126 -8.612 5.686 6.163 1.00 0.00 C ATOM 2040 O ASN A 126 -8.389 6.090 7.309 1.00 0.00 O ATOM 2041 CB ASN A 126 -9.497 3.358 5.591 1.00 0.00 C ATOM 2042 CG ASN A 126 -10.328 3.270 6.871 1.00 0.00 C ATOM 2043 OD1 ASN A 126 -9.820 3.073 7.963 1.00 0.00 O ATOM 2044 ND2 ASN A 126 -11.635 3.394 6.787 1.00 0.00 N ATOM 0 H ASN A 126 -7.563 3.673 7.614 1.00 0.00 H new ATOM 0 HA ASN A 126 -7.756 4.375 4.767 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.122 3.748 4.787 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -9.189 2.355 5.297 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -12.209 3.325 7.627 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -12.074 3.559 5.881 1.00 0.00 H new ATOM 2051 N PHE A 127 -9.184 6.460 5.231 1.00 0.00 N ATOM 2052 CA PHE A 127 -9.596 7.864 5.420 1.00 0.00 C ATOM 2053 C PHE A 127 -10.574 8.342 4.329 1.00 0.00 C ATOM 2054 O PHE A 127 -10.695 7.711 3.274 1.00 0.00 O ATOM 2055 CB PHE A 127 -8.359 8.788 5.459 1.00 0.00 C ATOM 2056 CG PHE A 127 -7.348 8.599 4.336 1.00 0.00 C ATOM 2057 CD1 PHE A 127 -7.659 8.973 3.012 1.00 0.00 C ATOM 2058 CD2 PHE A 127 -6.079 8.059 4.623 1.00 0.00 C ATOM 2059 CE1 PHE A 127 -6.716 8.790 1.986 1.00 0.00 C ATOM 2060 CE2 PHE A 127 -5.132 7.889 3.599 1.00 0.00 C ATOM 2061 CZ PHE A 127 -5.451 8.255 2.280 1.00 0.00 C ATOM 0 H PHE A 127 -9.381 6.117 4.291 1.00 0.00 H new ATOM 0 HA PHE A 127 -10.120 7.915 6.374 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -8.702 9.822 5.441 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -7.848 8.638 6.410 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -8.624 9.401 2.786 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -5.833 7.774 5.635 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -6.964 9.061 0.970 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -4.160 7.477 3.825 1.00 0.00 H new ATOM 0 HZ PHE A 127 -4.723 8.125 1.493 1.00 0.00 H new ATOM 2071 N ALA A 128 -11.250 9.472 4.563 1.00 0.00 N ATOM 2072 CA ALA A 128 -12.234 10.058 3.651 1.00 0.00 C ATOM 2073 C ALA A 128 -11.623 11.116 2.704 1.00 0.00 C ATOM 2074 O ALA A 128 -10.788 11.935 3.101 1.00 0.00 O ATOM 2075 CB ALA A 128 -13.366 10.666 4.489 1.00 0.00 C ATOM 0 H ALA A 128 -11.123 10.018 5.415 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.617 9.268 3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -14.111 11.109 3.828 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.833 9.886 5.091 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.960 11.436 5.145 1.00 0.00 H new ATOM 2081 N LEU A 129 -12.086 11.117 1.453 1.00 0.00 N ATOM 2082 CA LEU A 129 -11.734 12.065 0.389 1.00 0.00 C ATOM 2083 C LEU A 129 -12.698 13.270 0.346 1.00 0.00 C ATOM 2084 O LEU A 129 -13.745 13.267 0.995 1.00 0.00 O ATOM 2085 CB LEU A 129 -11.748 11.313 -0.962 1.00 0.00 C ATOM 2086 CG LEU A 129 -10.810 10.091 -1.061 1.00 0.00 C ATOM 2087 CD1 LEU A 129 -10.894 9.491 -2.462 1.00 0.00 C ATOM 2088 CD2 LEU A 129 -9.353 10.448 -0.796 1.00 0.00 C ATOM 0 H LEU A 129 -12.756 10.417 1.135 1.00 0.00 H new ATOM 0 HA LEU A 129 -10.740 12.465 0.590 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -12.767 10.982 -1.161 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -11.481 12.017 -1.751 1.00 0.00 H new ATOM 0 HG LEU A 129 -11.139 9.383 -0.300 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -10.231 8.629 -2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -11.918 9.177 -2.663 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -10.593 10.238 -3.196 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.738 9.552 -0.879 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -9.020 11.185 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.257 10.863 0.207 1.00 0.00 H new ATOM 2100 N LYS A 130 -12.377 14.284 -0.472 1.00 0.00 N ATOM 2101 CA LYS A 130 -13.178 15.513 -0.685 1.00 0.00 C ATOM 2102 C LYS A 130 -14.657 15.279 -1.007 1.00 0.00 C ATOM 2103 O LYS A 130 -15.530 15.875 -0.378 1.00 0.00 O ATOM 2104 CB LYS A 130 -12.485 16.349 -1.780 1.00 0.00 C ATOM 2105 CG LYS A 130 -13.340 17.458 -2.428 1.00 0.00 C ATOM 2106 CD LYS A 130 -12.490 18.265 -3.419 1.00 0.00 C ATOM 2107 CE LYS A 130 -13.296 19.278 -4.249 1.00 0.00 C ATOM 2108 NZ LYS A 130 -13.663 20.500 -3.481 1.00 0.00 N ATOM 0 H LYS A 130 -11.521 14.276 -1.027 1.00 0.00 H new ATOM 0 HA LYS A 130 -13.207 16.050 0.263 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -11.595 16.809 -1.350 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -12.147 15.673 -2.565 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -14.193 17.017 -2.943 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -13.739 18.118 -1.658 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -11.714 18.797 -2.868 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -11.985 17.575 -4.096 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -12.714 19.567 -5.124 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -14.204 18.799 -4.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -14.099 21.194 -4.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -14.338 20.249 -2.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -12.808 20.912 -3.054 1.00 0.00 H new ATOM 2122 N ASN A 131 -14.928 14.418 -1.990 1.00 0.00 N ATOM 2123 CA ASN A 131 -16.297 14.078 -2.409 1.00 0.00 C ATOM 2124 C ASN A 131 -17.047 13.282 -1.324 1.00 0.00 C ATOM 2125 O ASN A 131 -18.274 13.337 -1.238 1.00 0.00 O ATOM 2126 CB ASN A 131 -16.230 13.280 -3.724 1.00 0.00 C ATOM 2127 CG ASN A 131 -15.785 14.123 -4.906 1.00 0.00 C ATOM 2128 OD1 ASN A 131 -16.576 14.781 -5.568 1.00 0.00 O ATOM 2129 ND2 ASN A 131 -14.511 14.127 -5.233 1.00 0.00 N ATOM 0 H ASN A 131 -14.205 13.933 -2.522 1.00 0.00 H new ATOM 0 HA ASN A 131 -16.856 15.001 -2.564 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -15.541 12.444 -3.601 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -17.211 12.856 -3.936 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.191 14.675 -6.032 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -13.843 13.582 -4.688 1.00 0.00 H new ATOM 2136 N GLY A 132 -16.299 12.554 -0.490 1.00 0.00 N ATOM 2137 CA GLY A 132 -16.797 11.776 0.643 1.00 0.00 C ATOM 2138 C GLY A 132 -16.482 10.282 0.561 1.00 0.00 C ATOM 2139 O GLY A 132 -16.839 9.551 1.480 1.00 0.00 O ATOM 0 H GLY A 132 -15.286 12.489 -0.592 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -16.368 12.177 1.562 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -17.877 11.905 0.712 1.00 0.00 H new ATOM 2143 N PHE A 133 -15.857 9.806 -0.523 1.00 0.00 N ATOM 2144 CA PHE A 133 -15.474 8.396 -0.678 1.00 0.00 C ATOM 2145 C PHE A 133 -14.346 8.001 0.284 1.00 0.00 C ATOM 2146 O PHE A 133 -13.646 8.872 0.801 1.00 0.00 O ATOM 2147 CB PHE A 133 -15.072 8.114 -2.130 1.00 0.00 C ATOM 2148 CG PHE A 133 -16.119 8.536 -3.140 1.00 0.00 C ATOM 2149 CD1 PHE A 133 -17.369 7.889 -3.168 1.00 0.00 C ATOM 2150 CD2 PHE A 133 -15.865 9.615 -4.008 1.00 0.00 C ATOM 2151 CE1 PHE A 133 -18.377 8.338 -4.040 1.00 0.00 C ATOM 2152 CE2 PHE A 133 -16.875 10.063 -4.878 1.00 0.00 C ATOM 2153 CZ PHE A 133 -18.133 9.433 -4.886 1.00 0.00 C ATOM 0 H PHE A 133 -15.602 10.389 -1.320 1.00 0.00 H new ATOM 0 HA PHE A 133 -16.341 7.786 -0.425 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -14.139 8.633 -2.348 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -14.878 7.048 -2.244 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -17.554 7.046 -2.519 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -14.898 10.097 -4.006 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -19.336 7.842 -4.059 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -16.684 10.893 -5.542 1.00 0.00 H new ATOM 0 HZ PHE A 133 -18.912 9.791 -5.543 1.00 0.00 H new ATOM 2163 N ILE A 134 -14.123 6.700 0.490 1.00 0.00 N ATOM 2164 CA ILE A 134 -13.082 6.195 1.399 1.00 0.00 C ATOM 2165 C ILE A 134 -12.034 5.385 0.624 1.00 0.00 C ATOM 2166 O ILE A 134 -12.351 4.553 -0.233 1.00 0.00 O ATOM 2167 CB ILE A 134 -13.698 5.412 2.585 1.00 0.00 C ATOM 2168 CG1 ILE A 134 -14.629 6.281 3.463 1.00 0.00 C ATOM 2169 CG2 ILE A 134 -12.609 4.820 3.502 1.00 0.00 C ATOM 2170 CD1 ILE A 134 -16.092 6.299 3.006 1.00 0.00 C ATOM 0 H ILE A 134 -14.659 5.963 0.032 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.562 7.046 1.839 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.283 4.616 2.123 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.586 5.916 4.489 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -14.251 7.303 3.472 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -13.079 4.278 4.322 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -11.982 4.137 2.928 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -11.995 5.626 3.904 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -16.675 6.931 3.676 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -16.151 6.693 1.992 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -16.492 5.285 3.025 1.00 0.00 H new ATOM 2182 N ALA A 135 -10.770 5.620 0.962 1.00 0.00 N ATOM 2183 CA ALA A 135 -9.586 5.005 0.368 1.00 0.00 C ATOM 2184 C ALA A 135 -8.777 4.277 1.462 1.00 0.00 C ATOM 2185 O ALA A 135 -8.864 4.665 2.632 1.00 0.00 O ATOM 2186 CB ALA A 135 -8.800 6.122 -0.333 1.00 0.00 C ATOM 0 H ALA A 135 -10.530 6.282 1.700 1.00 0.00 H new ATOM 0 HA ALA A 135 -9.839 4.245 -0.372 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -7.904 5.704 -0.792 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.423 6.577 -1.103 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -8.514 6.879 0.397 1.00 0.00 H new ATOM 2192 N SER A 136 -8.036 3.217 1.119 1.00 0.00 N ATOM 2193 CA SER A 136 -7.392 2.314 2.094 1.00 0.00 C ATOM 2194 C SER A 136 -6.008 1.824 1.639 1.00 0.00 C ATOM 2195 O SER A 136 -5.827 1.435 0.481 1.00 0.00 O ATOM 2196 CB SER A 136 -8.328 1.126 2.357 1.00 0.00 C ATOM 2197 OG SER A 136 -7.798 0.229 3.318 1.00 0.00 O ATOM 0 H SER A 136 -7.862 2.955 0.149 1.00 0.00 H new ATOM 0 HA SER A 136 -7.222 2.877 3.012 1.00 0.00 H new ATOM 0 HB2 SER A 136 -9.294 1.496 2.702 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.506 0.592 1.423 1.00 0.00 H new ATOM 0 HG SER A 136 -8.426 -0.511 3.456 1.00 0.00 H new ATOM 2203 N ASN A 137 -5.028 1.828 2.550 1.00 0.00 N ATOM 2204 CA ASN A 137 -3.626 1.473 2.276 1.00 0.00 C ATOM 2205 C ASN A 137 -3.373 -0.052 2.284 1.00 0.00 C ATOM 2206 O ASN A 137 -3.080 -0.620 1.205 1.00 0.00 O ATOM 2207 CB ASN A 137 -2.724 2.239 3.267 1.00 0.00 C ATOM 2208 CG ASN A 137 -1.241 1.914 3.130 1.00 0.00 C ATOM 2209 OD1 ASN A 137 -0.706 1.694 2.047 1.00 0.00 O ATOM 2210 ND2 ASN A 137 -0.523 1.857 4.231 1.00 0.00 N ATOM 0 H ASN A 137 -5.190 2.084 3.524 1.00 0.00 H new ATOM 0 HA ASN A 137 -3.377 1.777 1.259 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -2.866 3.310 3.120 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -3.043 2.012 4.284 1.00 0.00 H new ATOM 0 HD21 ASN A 137 0.470 1.631 4.181 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -0.960 2.038 5.135 1.00 0.00 H new TER 2217 ASN A 137