USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 794 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 79 SER OG : rot -56:sc= -3.15! USER MOD Set 1.2: A 99 TYR OH : rot 165:sc= -1.09 USER MOD Set 2.1: A 26 ASN : amide:sc= -0.564 K(o=-0.98,f=-3.6!) USER MOD Set 2.2: A 35 ASN : amide:sc= -0.414 K(o=-0.98,f=-4.7!) USER MOD Set 3.1: A 5 SER OG : rot -58:sc= 0.0353 USER MOD Set 3.2: A 71 TYR OH : rot 70:sc= -1.01 USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.108 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot -102:sc= -0.982 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 149:sc= -0.4 (180deg=-1.45!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 37 CYS SG : rot 61:sc= -2.47 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0.171 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -18! C(o=-18!,f=-33!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -3.65! C(o=-3.6!,f=-3.1!) USER MOD Single : A 57 GLN : amide:sc= -2.18! C(o=-2.2!,f=-8.9!) USER MOD Single : A 61 MET CE :methyl -160:sc= -1.01 (180deg=-2.14) USER MOD Single : A 63 SER OG : rot 72:sc= 0.876 USER MOD Single : A 65 SER OG : rot 180:sc= -0.166 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.112 K(o=-0.11,f=-1.9!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.0103 X(o=-0.01,f=0) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= -0.263 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.673 -1.378 1.164 1.00 0.00 N ATOM 2 CA GLY A 1 -19.667 -2.330 0.725 1.00 0.00 C ATOM 3 C GLY A 1 -18.464 -2.331 1.671 1.00 0.00 C ATOM 4 O GLY A 1 -18.339 -1.453 2.523 1.00 0.00 O ATOM 0 H1 GLY A 1 -21.554 -1.883 1.388 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.334 -0.881 2.012 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.852 -0.688 0.407 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -20.101 -3.329 0.681 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.340 -2.080 -0.284 1.00 0.00 H new ATOM 8 N SER A 2 -17.610 -3.327 1.489 1.00 0.00 N ATOM 9 CA SER A 2 -16.421 -3.454 2.315 1.00 0.00 C ATOM 10 C SER A 2 -16.818 -3.582 3.787 1.00 0.00 C ATOM 11 O SER A 2 -17.337 -2.635 4.377 1.00 0.00 O ATOM 12 CB SER A 2 -15.484 -2.261 2.119 1.00 0.00 C ATOM 13 OG SER A 2 -14.268 -2.412 2.846 1.00 0.00 O ATOM 0 H SER A 2 -17.718 -4.054 0.782 1.00 0.00 H new ATOM 0 HA SER A 2 -15.887 -4.354 2.010 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.260 -2.146 1.058 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.987 -1.349 2.439 1.00 0.00 H new ATOM 0 HG SER A 2 -13.696 -1.631 2.693 1.00 0.00 H new ATOM 19 N SER A 3 -16.559 -4.759 4.337 1.00 0.00 N ATOM 20 CA SER A 3 -16.883 -5.021 5.729 1.00 0.00 C ATOM 21 C SER A 3 -15.603 -5.066 6.565 1.00 0.00 C ATOM 22 O SER A 3 -14.665 -5.790 6.233 1.00 0.00 O ATOM 23 CB SER A 3 -17.659 -6.332 5.876 1.00 0.00 C ATOM 24 OG SER A 3 -18.844 -6.167 6.649 1.00 0.00 O ATOM 0 H SER A 3 -16.129 -5.542 3.844 1.00 0.00 H new ATOM 0 HA SER A 3 -17.517 -4.212 6.091 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.920 -6.711 4.888 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.021 -7.080 6.346 1.00 0.00 H new ATOM 0 HG SER A 3 -19.312 -7.025 6.718 1.00 0.00 H new ATOM 30 N GLY A 4 -15.604 -4.283 7.634 1.00 0.00 N ATOM 31 CA GLY A 4 -14.454 -4.225 8.520 1.00 0.00 C ATOM 32 C GLY A 4 -13.185 -3.858 7.748 1.00 0.00 C ATOM 33 O GLY A 4 -13.245 -3.129 6.758 1.00 0.00 O ATOM 0 H GLY A 4 -16.383 -3.684 7.906 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.632 -3.490 9.305 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.319 -5.189 9.011 1.00 0.00 H new ATOM 37 N SER A 5 -12.066 -4.379 8.229 1.00 0.00 N ATOM 38 CA SER A 5 -10.785 -4.116 7.596 1.00 0.00 C ATOM 39 C SER A 5 -10.466 -2.621 7.663 1.00 0.00 C ATOM 40 O SER A 5 -10.094 -2.016 6.658 1.00 0.00 O ATOM 41 CB SER A 5 -10.779 -4.595 6.144 1.00 0.00 C ATOM 42 OG SER A 5 -10.790 -6.017 6.051 1.00 0.00 O ATOM 0 H SER A 5 -12.020 -4.982 9.050 1.00 0.00 H new ATOM 0 HA SER A 5 -10.017 -4.670 8.136 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.648 -4.191 5.625 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.896 -4.205 5.637 1.00 0.00 H new ATOM 0 HG SER A 5 -10.014 -6.382 6.526 1.00 0.00 H new ATOM 48 N SER A 6 -10.624 -2.067 8.856 1.00 0.00 N ATOM 49 CA SER A 6 -10.357 -0.654 9.067 1.00 0.00 C ATOM 50 C SER A 6 -8.931 -0.319 8.627 1.00 0.00 C ATOM 51 O SER A 6 -7.979 -0.536 9.375 1.00 0.00 O ATOM 52 CB SER A 6 -10.565 -0.267 10.532 1.00 0.00 C ATOM 53 OG SER A 6 -11.726 0.540 10.711 1.00 0.00 O ATOM 0 H SER A 6 -10.934 -2.571 9.687 1.00 0.00 H new ATOM 0 HA SER A 6 -11.060 -0.080 8.464 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.654 -1.170 11.136 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.689 0.273 10.892 1.00 0.00 H new ATOM 0 HG SER A 6 -11.825 0.765 11.660 1.00 0.00 H new ATOM 59 N GLY A 7 -8.827 0.203 7.414 1.00 0.00 N ATOM 60 CA GLY A 7 -7.533 0.570 6.865 1.00 0.00 C ATOM 61 C GLY A 7 -7.305 -0.094 5.505 1.00 0.00 C ATOM 62 O GLY A 7 -7.551 0.514 4.465 1.00 0.00 O ATOM 0 H GLY A 7 -9.618 0.381 6.795 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.473 1.653 6.759 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.744 0.273 7.555 1.00 0.00 H new ATOM 66 N LEU A 8 -6.838 -1.333 5.559 1.00 0.00 N ATOM 67 CA LEU A 8 -6.574 -2.086 4.344 1.00 0.00 C ATOM 68 C LEU A 8 -7.704 -1.840 3.342 1.00 0.00 C ATOM 69 O LEU A 8 -7.486 -1.238 2.292 1.00 0.00 O ATOM 70 CB LEU A 8 -6.351 -3.564 4.669 1.00 0.00 C ATOM 71 CG LEU A 8 -4.984 -3.923 5.254 1.00 0.00 C ATOM 72 CD1 LEU A 8 -4.616 -2.986 6.405 1.00 0.00 C ATOM 73 CD2 LEU A 8 -4.936 -5.394 5.674 1.00 0.00 C ATOM 0 H LEU A 8 -6.636 -1.834 6.424 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.651 -1.744 3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.120 -3.881 5.373 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.497 -4.142 3.757 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.233 -3.786 4.476 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -3.640 -3.264 6.802 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.581 -1.959 6.041 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.365 -3.066 7.193 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.953 -5.623 6.086 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.699 -5.582 6.429 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.121 -6.026 4.806 1.00 0.00 H new ATOM 85 N GLY A 9 -8.886 -2.319 3.701 1.00 0.00 N ATOM 86 CA GLY A 9 -10.049 -2.159 2.846 1.00 0.00 C ATOM 87 C GLY A 9 -9.927 -0.902 1.983 1.00 0.00 C ATOM 88 O GLY A 9 -9.733 -0.993 0.772 1.00 0.00 O ATOM 0 H GLY A 9 -9.063 -2.818 4.573 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.157 -3.035 2.206 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.949 -2.098 3.458 1.00 0.00 H new ATOM 92 N ALA A 10 -10.045 0.242 2.640 1.00 0.00 N ATOM 93 CA ALA A 10 -9.950 1.516 1.948 1.00 0.00 C ATOM 94 C ALA A 10 -8.707 1.515 1.055 1.00 0.00 C ATOM 95 O ALA A 10 -8.793 1.815 -0.135 1.00 0.00 O ATOM 96 CB ALA A 10 -9.932 2.654 2.971 1.00 0.00 C ATOM 0 H ALA A 10 -10.206 0.313 3.645 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.817 1.669 1.306 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.861 3.609 2.451 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -10.849 2.629 3.560 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -9.073 2.536 3.632 1.00 0.00 H new ATOM 102 N LEU A 11 -7.581 1.174 1.664 1.00 0.00 N ATOM 103 CA LEU A 11 -6.322 1.130 0.939 1.00 0.00 C ATOM 104 C LEU A 11 -6.472 0.216 -0.279 1.00 0.00 C ATOM 105 O LEU A 11 -6.193 0.626 -1.405 1.00 0.00 O ATOM 106 CB LEU A 11 -5.180 0.727 1.874 1.00 0.00 C ATOM 107 CG LEU A 11 -4.054 -0.094 1.241 1.00 0.00 C ATOM 108 CD1 LEU A 11 -4.433 -1.573 1.159 1.00 0.00 C ATOM 109 CD2 LEU A 11 -3.662 0.474 -0.124 1.00 0.00 C ATOM 0 H LEU A 11 -7.514 0.926 2.651 1.00 0.00 H new ATOM 0 HA LEU A 11 -6.062 2.120 0.565 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.748 1.633 2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.599 0.155 2.702 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.176 -0.022 1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.616 -2.133 0.705 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.623 -1.956 2.162 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.331 -1.685 0.551 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.860 -0.128 -0.552 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.526 0.453 -0.789 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.320 1.502 -0.006 1.00 0.00 H new ATOM 121 N TYR A 12 -6.912 -1.005 -0.012 1.00 0.00 N ATOM 122 CA TYR A 12 -7.102 -1.980 -1.073 1.00 0.00 C ATOM 123 C TYR A 12 -7.991 -1.417 -2.183 1.00 0.00 C ATOM 124 O TYR A 12 -7.625 -1.455 -3.356 1.00 0.00 O ATOM 125 CB TYR A 12 -7.808 -3.174 -0.426 1.00 0.00 C ATOM 126 CG TYR A 12 -8.215 -4.266 -1.416 1.00 0.00 C ATOM 127 CD1 TYR A 12 -7.263 -4.862 -2.217 1.00 0.00 C ATOM 128 CD2 TYR A 12 -9.536 -4.656 -1.508 1.00 0.00 C ATOM 129 CE1 TYR A 12 -7.647 -5.891 -3.149 1.00 0.00 C ATOM 130 CE2 TYR A 12 -9.920 -5.685 -2.440 1.00 0.00 C ATOM 131 CZ TYR A 12 -8.956 -6.251 -3.215 1.00 0.00 C ATOM 132 OH TYR A 12 -9.319 -7.222 -4.095 1.00 0.00 O ATOM 0 H TYR A 12 -7.142 -1.341 0.923 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.146 -2.251 -1.521 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.150 -3.607 0.327 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -8.698 -2.819 0.094 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -6.229 -4.557 -2.145 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -10.282 -4.190 -0.881 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -6.911 -6.366 -3.781 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -10.950 -6.000 -2.522 1.00 0.00 H new ATOM 0 HH TYR A 12 -9.731 -6.811 -4.884 1.00 0.00 H new ATOM 142 N LEU A 13 -9.143 -0.907 -1.772 1.00 0.00 N ATOM 143 CA LEU A 13 -10.088 -0.336 -2.717 1.00 0.00 C ATOM 144 C LEU A 13 -9.331 0.519 -3.736 1.00 0.00 C ATOM 145 O LEU A 13 -9.669 0.528 -4.918 1.00 0.00 O ATOM 146 CB LEU A 13 -11.193 0.421 -1.979 1.00 0.00 C ATOM 147 CG LEU A 13 -12.334 -0.432 -1.421 1.00 0.00 C ATOM 148 CD1 LEU A 13 -13.291 0.414 -0.579 1.00 0.00 C ATOM 149 CD2 LEU A 13 -13.063 -1.175 -2.544 1.00 0.00 C ATOM 0 H LEU A 13 -9.443 -0.877 -0.798 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.592 -1.125 -3.275 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.740 0.971 -1.154 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -11.617 1.159 -2.660 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.905 -1.186 -0.761 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -14.092 -0.217 -0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.747 0.858 0.255 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -13.717 1.205 -1.196 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -13.869 -1.774 -2.120 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.478 -0.454 -3.248 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -12.361 -1.827 -3.064 1.00 0.00 H new ATOM 161 N SER A 14 -8.321 1.218 -3.239 1.00 0.00 N ATOM 162 CA SER A 14 -7.513 2.074 -4.090 1.00 0.00 C ATOM 163 C SER A 14 -6.689 1.223 -5.059 1.00 0.00 C ATOM 164 O SER A 14 -6.709 1.455 -6.266 1.00 0.00 O ATOM 165 CB SER A 14 -6.594 2.970 -3.258 1.00 0.00 C ATOM 166 OG SER A 14 -6.524 4.294 -3.778 1.00 0.00 O ATOM 0 H SER A 14 -8.044 1.209 -2.257 1.00 0.00 H new ATOM 0 HA SER A 14 -8.183 2.717 -4.661 1.00 0.00 H new ATOM 0 HB2 SER A 14 -6.954 3.003 -2.230 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.594 2.538 -3.231 1.00 0.00 H new ATOM 0 HG SER A 14 -5.929 4.834 -3.218 1.00 0.00 H new ATOM 172 N MET A 15 -5.985 0.254 -4.492 1.00 0.00 N ATOM 173 CA MET A 15 -5.156 -0.634 -5.290 1.00 0.00 C ATOM 174 C MET A 15 -5.921 -1.147 -6.512 1.00 0.00 C ATOM 175 O MET A 15 -5.315 -1.528 -7.513 1.00 0.00 O ATOM 176 CB MET A 15 -4.706 -1.819 -4.434 1.00 0.00 C ATOM 177 CG MET A 15 -3.719 -1.373 -3.354 1.00 0.00 C ATOM 178 SD MET A 15 -3.458 -2.693 -2.182 1.00 0.00 S ATOM 179 CE MET A 15 -1.726 -3.020 -2.464 1.00 0.00 C ATOM 0 H MET A 15 -5.972 0.064 -3.490 1.00 0.00 H new ATOM 0 HA MET A 15 -4.287 -0.075 -5.637 1.00 0.00 H new ATOM 0 HB2 MET A 15 -5.574 -2.286 -3.968 1.00 0.00 H new ATOM 0 HB3 MET A 15 -4.240 -2.574 -5.068 1.00 0.00 H new ATOM 0 HG2 MET A 15 -2.771 -1.089 -3.811 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.103 -0.491 -2.841 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.265 -3.365 -1.538 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.621 -3.788 -3.230 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.233 -2.107 -2.796 1.00 0.00 H new ATOM 189 N LYS A 16 -7.240 -1.140 -6.391 1.00 0.00 N ATOM 190 CA LYS A 16 -8.094 -1.599 -7.473 1.00 0.00 C ATOM 191 C LYS A 16 -7.976 -0.635 -8.655 1.00 0.00 C ATOM 192 O LYS A 16 -7.845 -1.064 -9.800 1.00 0.00 O ATOM 193 CB LYS A 16 -9.528 -1.793 -6.978 1.00 0.00 C ATOM 194 CG LYS A 16 -9.589 -2.847 -5.870 1.00 0.00 C ATOM 195 CD LYS A 16 -10.811 -3.751 -6.040 1.00 0.00 C ATOM 196 CE LYS A 16 -12.017 -3.192 -5.283 1.00 0.00 C ATOM 197 NZ LYS A 16 -13.020 -2.655 -6.229 1.00 0.00 N ATOM 0 H LYS A 16 -7.739 -0.823 -5.559 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.768 -2.577 -7.826 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.919 -0.846 -6.606 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.165 -2.096 -7.809 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.681 -3.450 -5.886 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.628 -2.356 -4.898 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.053 -3.845 -7.099 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.581 -4.752 -5.675 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.467 -3.976 -4.674 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -11.693 -2.405 -4.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -13.832 -2.280 -5.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.592 -1.893 -6.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -13.342 -3.415 -6.862 1.00 0.00 H new ATOM 211 N ASP A 17 -8.026 0.650 -8.336 1.00 0.00 N ATOM 212 CA ASP A 17 -7.926 1.679 -9.357 1.00 0.00 C ATOM 213 C ASP A 17 -6.672 1.435 -10.200 1.00 0.00 C ATOM 214 O ASP A 17 -5.555 1.502 -9.690 1.00 0.00 O ATOM 215 CB ASP A 17 -7.810 3.069 -8.729 1.00 0.00 C ATOM 216 CG ASP A 17 -8.442 4.201 -9.542 1.00 0.00 C ATOM 217 OD1 ASP A 17 -7.823 4.582 -10.559 1.00 0.00 O ATOM 218 OD2 ASP A 17 -9.529 4.659 -9.129 1.00 0.00 O ATOM 0 H ASP A 17 -8.134 1.002 -7.385 1.00 0.00 H new ATOM 0 HA ASP A 17 -8.826 1.634 -9.970 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.275 3.046 -7.744 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.755 3.296 -8.578 1.00 0.00 H new ATOM 223 N PRO A 18 -6.906 1.150 -11.509 1.00 0.00 N ATOM 224 CA PRO A 18 -5.809 0.896 -12.427 1.00 0.00 C ATOM 225 C PRO A 18 -5.096 2.196 -12.802 1.00 0.00 C ATOM 226 O PRO A 18 -4.115 2.179 -13.544 1.00 0.00 O ATOM 227 CB PRO A 18 -6.447 0.203 -13.620 1.00 0.00 C ATOM 228 CG PRO A 18 -7.933 0.510 -13.535 1.00 0.00 C ATOM 229 CD PRO A 18 -8.216 1.062 -12.147 1.00 0.00 C ATOM 0 HA PRO A 18 -5.031 0.271 -11.990 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.025 0.570 -14.556 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -6.268 -0.872 -13.589 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.218 1.233 -14.299 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.520 -0.391 -13.715 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -8.697 2.039 -12.200 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -8.885 0.407 -11.589 1.00 0.00 H new ATOM 237 N GLU A 19 -5.617 3.293 -12.272 1.00 0.00 N ATOM 238 CA GLU A 19 -5.042 4.600 -12.542 1.00 0.00 C ATOM 239 C GLU A 19 -4.544 5.240 -11.244 1.00 0.00 C ATOM 240 O GLU A 19 -3.382 5.630 -11.146 1.00 0.00 O ATOM 241 CB GLU A 19 -6.051 5.508 -13.249 1.00 0.00 C ATOM 242 CG GLU A 19 -5.932 5.380 -14.769 1.00 0.00 C ATOM 243 CD GLU A 19 -6.284 6.700 -15.459 1.00 0.00 C ATOM 244 OE1 GLU A 19 -5.879 7.750 -14.915 1.00 0.00 O ATOM 245 OE2 GLU A 19 -6.950 6.628 -16.514 1.00 0.00 O ATOM 0 H GLU A 19 -6.431 3.304 -11.657 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.190 4.469 -13.210 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.062 5.247 -12.936 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -5.883 6.544 -12.953 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -4.917 5.086 -15.035 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.595 4.591 -15.124 1.00 0.00 H new ATOM 252 N LYS A 20 -5.449 5.327 -10.280 1.00 0.00 N ATOM 253 CA LYS A 20 -5.117 5.912 -8.993 1.00 0.00 C ATOM 254 C LYS A 20 -4.749 4.798 -8.011 1.00 0.00 C ATOM 255 O LYS A 20 -4.708 5.020 -6.801 1.00 0.00 O ATOM 256 CB LYS A 20 -6.253 6.813 -8.504 1.00 0.00 C ATOM 257 CG LYS A 20 -6.232 8.162 -9.225 1.00 0.00 C ATOM 258 CD LYS A 20 -6.838 9.261 -8.350 1.00 0.00 C ATOM 259 CE LYS A 20 -8.322 9.459 -8.667 1.00 0.00 C ATOM 260 NZ LYS A 20 -8.827 10.697 -8.034 1.00 0.00 N ATOM 0 H LYS A 20 -6.412 5.002 -10.365 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.245 6.559 -9.083 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.211 6.321 -8.673 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.161 6.970 -7.429 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.206 8.423 -9.485 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.789 8.088 -10.159 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.719 9.001 -7.298 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.301 10.196 -8.510 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.465 9.511 -9.746 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.893 8.602 -8.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.835 10.816 -8.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.708 10.633 -7.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.293 11.514 -8.394 1.00 0.00 H new ATOM 274 N GLY A 21 -4.492 3.624 -8.567 1.00 0.00 N ATOM 275 CA GLY A 21 -4.129 2.474 -7.755 1.00 0.00 C ATOM 276 C GLY A 21 -3.015 1.663 -8.419 1.00 0.00 C ATOM 277 O GLY A 21 -2.242 2.198 -9.214 1.00 0.00 O ATOM 0 H GLY A 21 -4.528 3.443 -9.570 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -3.803 2.808 -6.770 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.003 1.841 -7.603 1.00 0.00 H new ATOM 281 N ILE A 22 -2.967 0.386 -8.070 1.00 0.00 N ATOM 282 CA ILE A 22 -1.960 -0.503 -8.622 1.00 0.00 C ATOM 283 C ILE A 22 -2.238 -0.720 -10.111 1.00 0.00 C ATOM 284 O ILE A 22 -3.335 -0.435 -10.589 1.00 0.00 O ATOM 285 CB ILE A 22 -1.890 -1.801 -7.814 1.00 0.00 C ATOM 286 CG1 ILE A 22 -0.557 -1.913 -7.071 1.00 0.00 C ATOM 287 CG2 ILE A 22 -2.154 -3.016 -8.705 1.00 0.00 C ATOM 288 CD1 ILE A 22 -0.568 -3.096 -6.101 1.00 0.00 C ATOM 0 H ILE A 22 -3.610 -0.054 -7.411 1.00 0.00 H new ATOM 0 HA ILE A 22 -0.971 -0.052 -8.544 1.00 0.00 H new ATOM 0 HB ILE A 22 -2.677 -1.778 -7.060 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.254 -2.034 -7.789 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.363 -0.991 -6.523 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.098 -3.925 -8.106 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.146 -2.933 -9.148 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -1.406 -3.056 -9.496 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.391 -3.153 -5.586 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.365 -2.960 -5.370 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.738 -4.019 -6.655 1.00 0.00 H new ATOM 300 N LYS A 23 -1.226 -1.223 -10.802 1.00 0.00 N ATOM 301 CA LYS A 23 -1.349 -1.482 -12.227 1.00 0.00 C ATOM 302 C LYS A 23 -1.726 -2.949 -12.444 1.00 0.00 C ATOM 303 O LYS A 23 -2.015 -3.667 -11.489 1.00 0.00 O ATOM 304 CB LYS A 23 -0.074 -1.060 -12.959 1.00 0.00 C ATOM 305 CG LYS A 23 -0.252 0.304 -13.630 1.00 0.00 C ATOM 306 CD LYS A 23 -0.407 0.154 -15.145 1.00 0.00 C ATOM 307 CE LYS A 23 -1.646 0.898 -15.646 1.00 0.00 C ATOM 308 NZ LYS A 23 -1.370 2.348 -15.755 1.00 0.00 N ATOM 0 H LYS A 23 -0.318 -1.458 -10.402 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.150 -0.880 -12.656 1.00 0.00 H new ATOM 0 HB2 LYS A 23 0.757 -1.017 -12.254 1.00 0.00 H new ATOM 0 HB3 LYS A 23 0.183 -1.808 -13.709 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -1.129 0.804 -13.219 1.00 0.00 H new ATOM 0 HG3 LYS A 23 0.608 0.937 -13.410 1.00 0.00 H new ATOM 0 HD2 LYS A 23 0.481 0.541 -15.645 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -0.483 -0.902 -15.403 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -1.946 0.505 -16.617 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -2.479 0.730 -14.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -2.221 2.839 -16.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -1.106 2.722 -14.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -0.589 2.503 -16.424 1.00 0.00 H new ATOM 322 N GLU A 24 -1.710 -3.350 -13.707 1.00 0.00 N ATOM 323 CA GLU A 24 -2.047 -4.718 -14.062 1.00 0.00 C ATOM 324 C GLU A 24 -1.322 -5.127 -15.346 1.00 0.00 C ATOM 325 O GLU A 24 -1.788 -4.833 -16.446 1.00 0.00 O ATOM 326 CB GLU A 24 -3.560 -4.890 -14.208 1.00 0.00 C ATOM 327 CG GLU A 24 -4.281 -4.531 -12.907 1.00 0.00 C ATOM 328 CD GLU A 24 -5.714 -5.067 -12.908 1.00 0.00 C ATOM 329 OE1 GLU A 24 -5.886 -6.227 -12.475 1.00 0.00 O ATOM 330 OE2 GLU A 24 -6.605 -4.305 -13.342 1.00 0.00 O ATOM 0 H GLU A 24 -1.469 -2.751 -14.497 1.00 0.00 H new ATOM 0 HA GLU A 24 -1.716 -5.374 -13.256 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.925 -4.257 -15.017 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -3.788 -5.920 -14.482 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -3.735 -4.944 -12.059 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.294 -3.448 -12.781 1.00 0.00 H new ATOM 337 N LEU A 25 -0.195 -5.798 -15.163 1.00 0.00 N ATOM 338 CA LEU A 25 0.599 -6.250 -16.293 1.00 0.00 C ATOM 339 C LEU A 25 0.320 -7.733 -16.546 1.00 0.00 C ATOM 340 O LEU A 25 -0.252 -8.414 -15.696 1.00 0.00 O ATOM 341 CB LEU A 25 2.079 -5.932 -16.070 1.00 0.00 C ATOM 342 CG LEU A 25 2.438 -4.448 -15.970 1.00 0.00 C ATOM 343 CD1 LEU A 25 2.019 -3.696 -17.234 1.00 0.00 C ATOM 344 CD2 LEU A 25 1.841 -3.824 -14.707 1.00 0.00 C ATOM 0 H LEU A 25 0.188 -6.040 -14.249 1.00 0.00 H new ATOM 0 HA LEU A 25 0.314 -5.713 -17.198 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.402 -6.426 -15.154 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.652 -6.370 -16.888 1.00 0.00 H new ATOM 0 HG LEU A 25 3.522 -4.363 -15.890 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.286 -2.644 -17.137 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.531 -4.122 -18.097 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.941 -3.786 -17.371 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.111 -2.769 -14.660 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.756 -3.920 -14.732 1.00 0.00 H new ATOM 0 HD23 LEU A 25 2.231 -4.338 -13.828 1.00 0.00 H new ATOM 356 N ASN A 26 0.737 -8.190 -17.718 1.00 0.00 N ATOM 357 CA ASN A 26 0.539 -9.580 -18.093 1.00 0.00 C ATOM 358 C ASN A 26 1.843 -10.351 -17.882 1.00 0.00 C ATOM 359 O ASN A 26 2.743 -10.297 -18.719 1.00 0.00 O ATOM 360 CB ASN A 26 0.151 -9.702 -19.568 1.00 0.00 C ATOM 361 CG ASN A 26 -1.370 -9.735 -19.733 1.00 0.00 C ATOM 362 OD1 ASN A 26 -2.126 -9.396 -18.837 1.00 0.00 O ATOM 363 ND2 ASN A 26 -1.775 -10.162 -20.926 1.00 0.00 N ATOM 0 H ASN A 26 1.211 -7.622 -18.420 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.262 -9.986 -17.474 1.00 0.00 H new ATOM 0 HB2 ASN A 26 0.563 -8.862 -20.127 1.00 0.00 H new ATOM 0 HB3 ASN A 26 0.586 -10.609 -19.989 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -2.772 -10.221 -21.135 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -1.089 -10.430 -21.631 1.00 0.00 H new ATOM 370 N LEU A 27 1.904 -11.051 -16.758 1.00 0.00 N ATOM 371 CA LEU A 27 3.083 -11.832 -16.427 1.00 0.00 C ATOM 372 C LEU A 27 2.997 -13.195 -17.117 1.00 0.00 C ATOM 373 O LEU A 27 2.285 -14.085 -16.655 1.00 0.00 O ATOM 374 CB LEU A 27 3.258 -11.922 -14.909 1.00 0.00 C ATOM 375 CG LEU A 27 3.458 -10.593 -14.178 1.00 0.00 C ATOM 376 CD1 LEU A 27 2.949 -10.677 -12.738 1.00 0.00 C ATOM 377 CD2 LEU A 27 4.920 -10.147 -14.243 1.00 0.00 C ATOM 0 H LEU A 27 1.156 -11.093 -16.066 1.00 0.00 H new ATOM 0 HA LEU A 27 3.982 -11.341 -16.800 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.381 -12.416 -14.491 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.115 -12.562 -14.699 1.00 0.00 H new ATOM 0 HG LEU A 27 2.865 -9.832 -14.685 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.103 -9.719 -12.241 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.886 -10.917 -12.741 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.495 -11.455 -12.204 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.035 -9.200 -13.716 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.552 -10.902 -13.775 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.216 -10.021 -15.284 1.00 0.00 H new ATOM 389 N GLU A 28 3.734 -13.316 -18.212 1.00 0.00 N ATOM 390 CA GLU A 28 3.750 -14.555 -18.970 1.00 0.00 C ATOM 391 C GLU A 28 5.092 -15.268 -18.794 1.00 0.00 C ATOM 392 O GLU A 28 6.101 -14.847 -19.357 1.00 0.00 O ATOM 393 CB GLU A 28 3.457 -14.296 -20.450 1.00 0.00 C ATOM 394 CG GLU A 28 3.220 -15.608 -21.200 1.00 0.00 C ATOM 395 CD GLU A 28 2.442 -15.368 -22.495 1.00 0.00 C ATOM 396 OE1 GLU A 28 2.835 -14.435 -23.228 1.00 0.00 O ATOM 397 OE2 GLU A 28 1.471 -16.121 -22.722 1.00 0.00 O ATOM 0 H GLU A 28 4.324 -12.576 -18.592 1.00 0.00 H new ATOM 0 HA GLU A 28 2.963 -15.204 -18.585 1.00 0.00 H new ATOM 0 HB2 GLU A 28 2.580 -13.656 -20.544 1.00 0.00 H new ATOM 0 HB3 GLU A 28 4.292 -13.761 -20.901 1.00 0.00 H new ATOM 0 HG2 GLU A 28 4.177 -16.078 -21.428 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.669 -16.300 -20.564 1.00 0.00 H new ATOM 404 N LYS A 29 5.060 -16.335 -18.010 1.00 0.00 N ATOM 405 CA LYS A 29 6.262 -17.110 -17.752 1.00 0.00 C ATOM 406 C LYS A 29 5.872 -18.553 -17.425 1.00 0.00 C ATOM 407 O LYS A 29 4.782 -18.805 -16.912 1.00 0.00 O ATOM 408 CB LYS A 29 7.109 -16.441 -16.668 1.00 0.00 C ATOM 409 CG LYS A 29 8.431 -17.185 -16.468 1.00 0.00 C ATOM 410 CD LYS A 29 9.455 -16.302 -15.753 1.00 0.00 C ATOM 411 CE LYS A 29 10.873 -16.841 -15.944 1.00 0.00 C ATOM 412 NZ LYS A 29 11.256 -17.710 -14.809 1.00 0.00 N ATOM 0 H LYS A 29 4.221 -16.681 -17.545 1.00 0.00 H new ATOM 0 HA LYS A 29 6.892 -17.143 -18.641 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.308 -15.406 -16.945 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.554 -16.419 -15.730 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.258 -18.091 -15.887 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.827 -17.497 -17.435 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.394 -15.284 -16.138 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.220 -16.255 -14.690 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.932 -17.403 -16.876 1.00 0.00 H new ATOM 0 HE3 LYS A 29 11.575 -16.012 -16.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.222 -18.067 -14.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 11.220 -17.163 -13.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.596 -18.512 -14.747 1.00 0.00 H new ATOM 426 N ASP A 30 6.784 -19.463 -17.734 1.00 0.00 N ATOM 427 CA ASP A 30 6.549 -20.874 -17.479 1.00 0.00 C ATOM 428 C ASP A 30 5.292 -21.321 -18.228 1.00 0.00 C ATOM 429 O ASP A 30 4.496 -22.099 -17.704 1.00 0.00 O ATOM 430 CB ASP A 30 6.329 -21.136 -15.987 1.00 0.00 C ATOM 431 CG ASP A 30 6.863 -22.476 -15.480 1.00 0.00 C ATOM 432 OD1 ASP A 30 7.371 -23.242 -16.327 1.00 0.00 O ATOM 433 OD2 ASP A 30 6.751 -22.705 -14.256 1.00 0.00 O ATOM 0 H ASP A 30 7.687 -19.251 -18.159 1.00 0.00 H new ATOM 0 HA ASP A 30 7.425 -21.428 -17.817 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.803 -20.335 -15.419 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.260 -21.086 -15.778 1.00 0.00 H new ATOM 438 N LYS A 31 5.152 -20.810 -19.442 1.00 0.00 N ATOM 439 CA LYS A 31 4.006 -21.147 -20.269 1.00 0.00 C ATOM 440 C LYS A 31 2.720 -20.860 -19.491 1.00 0.00 C ATOM 441 O LYS A 31 1.923 -21.765 -19.246 1.00 0.00 O ATOM 442 CB LYS A 31 4.112 -22.588 -20.771 1.00 0.00 C ATOM 443 CG LYS A 31 4.887 -22.654 -22.088 1.00 0.00 C ATOM 444 CD LYS A 31 3.963 -22.408 -23.282 1.00 0.00 C ATOM 445 CE LYS A 31 4.402 -21.173 -24.070 1.00 0.00 C ATOM 446 NZ LYS A 31 3.396 -20.830 -25.100 1.00 0.00 N ATOM 0 H LYS A 31 5.814 -20.165 -19.873 1.00 0.00 H new ATOM 0 HA LYS A 31 3.985 -20.524 -21.163 1.00 0.00 H new ATOM 0 HB2 LYS A 31 4.610 -23.203 -20.021 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.114 -23.002 -20.911 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.685 -21.911 -22.082 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.361 -23.630 -22.186 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.967 -23.281 -23.935 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.939 -22.276 -22.933 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.538 -20.331 -23.391 1.00 0.00 H new ATOM 0 HE3 LYS A 31 5.366 -21.360 -24.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.710 -19.989 -25.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.286 -21.628 -25.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.484 -20.631 -24.642 1.00 0.00 H new ATOM 460 N LYS A 32 2.558 -19.597 -19.123 1.00 0.00 N ATOM 461 CA LYS A 32 1.382 -19.180 -18.378 1.00 0.00 C ATOM 462 C LYS A 32 1.403 -17.659 -18.212 1.00 0.00 C ATOM 463 O LYS A 32 2.384 -17.097 -17.728 1.00 0.00 O ATOM 464 CB LYS A 32 1.288 -19.942 -17.055 1.00 0.00 C ATOM 465 CG LYS A 32 0.169 -20.984 -17.100 1.00 0.00 C ATOM 466 CD LYS A 32 0.606 -22.288 -16.431 1.00 0.00 C ATOM 467 CE LYS A 32 -0.605 -23.097 -15.963 1.00 0.00 C ATOM 468 NZ LYS A 32 -0.171 -24.367 -15.339 1.00 0.00 N ATOM 0 H LYS A 32 3.221 -18.849 -19.327 1.00 0.00 H new ATOM 0 HA LYS A 32 0.474 -19.429 -18.927 1.00 0.00 H new ATOM 0 HB2 LYS A 32 2.238 -20.433 -16.846 1.00 0.00 H new ATOM 0 HB3 LYS A 32 1.105 -19.242 -16.240 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -0.717 -20.593 -16.599 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.110 -21.178 -18.136 1.00 0.00 H new ATOM 0 HD2 LYS A 32 1.195 -22.880 -17.131 1.00 0.00 H new ATOM 0 HD3 LYS A 32 1.250 -22.066 -15.580 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -1.185 -22.514 -15.248 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -1.259 -23.306 -16.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.006 -24.904 -15.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 0.363 -24.929 -16.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 0.435 -24.162 -14.519 1.00 0.00 H new ATOM 482 N VAL A 33 0.308 -17.036 -18.622 1.00 0.00 N ATOM 483 CA VAL A 33 0.188 -15.591 -18.524 1.00 0.00 C ATOM 484 C VAL A 33 -0.974 -15.242 -17.592 1.00 0.00 C ATOM 485 O VAL A 33 -2.130 -15.528 -17.901 1.00 0.00 O ATOM 486 CB VAL A 33 0.038 -14.983 -19.920 1.00 0.00 C ATOM 487 CG1 VAL A 33 -0.937 -15.799 -20.772 1.00 0.00 C ATOM 488 CG2 VAL A 33 -0.399 -13.519 -19.836 1.00 0.00 C ATOM 0 H VAL A 33 -0.504 -17.505 -19.023 1.00 0.00 H new ATOM 0 HA VAL A 33 1.092 -15.161 -18.092 1.00 0.00 H new ATOM 0 HB VAL A 33 1.013 -15.014 -20.406 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.025 -15.345 -21.759 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -0.566 -16.819 -20.873 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -1.915 -15.815 -20.291 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -0.498 -13.111 -20.842 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -1.358 -13.454 -19.322 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.348 -12.948 -19.284 1.00 0.00 H new ATOM 498 N PHE A 34 -0.627 -14.629 -16.470 1.00 0.00 N ATOM 499 CA PHE A 34 -1.627 -14.238 -15.491 1.00 0.00 C ATOM 500 C PHE A 34 -2.091 -12.799 -15.726 1.00 0.00 C ATOM 501 O PHE A 34 -1.398 -11.851 -15.359 1.00 0.00 O ATOM 502 CB PHE A 34 -0.966 -14.329 -14.115 1.00 0.00 C ATOM 503 CG PHE A 34 -0.243 -15.654 -13.859 1.00 0.00 C ATOM 504 CD1 PHE A 34 1.034 -15.826 -14.293 1.00 0.00 C ATOM 505 CD2 PHE A 34 -0.878 -16.658 -13.197 1.00 0.00 C ATOM 506 CE1 PHE A 34 1.705 -17.055 -14.055 1.00 0.00 C ATOM 507 CE2 PHE A 34 -0.207 -17.887 -12.959 1.00 0.00 C ATOM 508 CZ PHE A 34 1.070 -18.059 -13.393 1.00 0.00 C ATOM 0 H PHE A 34 0.333 -14.393 -16.217 1.00 0.00 H new ATOM 0 HA PHE A 34 -2.497 -14.890 -15.568 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -0.253 -13.511 -14.011 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -1.727 -14.188 -13.347 1.00 0.00 H new ATOM 0 HD1 PHE A 34 1.538 -15.028 -14.819 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -1.892 -16.521 -12.852 1.00 0.00 H new ATOM 0 HE1 PHE A 34 2.719 -17.192 -14.400 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -0.711 -18.685 -12.433 1.00 0.00 H new ATOM 0 HZ PHE A 34 1.580 -18.993 -13.212 1.00 0.00 H new ATOM 518 N ASN A 35 -3.261 -12.680 -16.336 1.00 0.00 N ATOM 519 CA ASN A 35 -3.826 -11.373 -16.625 1.00 0.00 C ATOM 520 C ASN A 35 -4.430 -10.789 -15.346 1.00 0.00 C ATOM 521 O ASN A 35 -4.927 -11.528 -14.497 1.00 0.00 O ATOM 522 CB ASN A 35 -4.938 -11.471 -17.670 1.00 0.00 C ATOM 523 CG ASN A 35 -4.385 -11.258 -19.081 1.00 0.00 C ATOM 524 OD1 ASN A 35 -4.591 -10.232 -19.707 1.00 0.00 O ATOM 525 ND2 ASN A 35 -3.674 -12.282 -19.544 1.00 0.00 N ATOM 0 H ASN A 35 -3.834 -13.468 -16.638 1.00 0.00 H new ATOM 0 HA ASN A 35 -3.027 -10.738 -17.008 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.416 -12.448 -17.607 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -5.706 -10.726 -17.460 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.263 -12.237 -20.476 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -3.540 -13.112 -18.967 1.00 0.00 H new ATOM 532 N HIS A 36 -4.367 -9.470 -15.248 1.00 0.00 N ATOM 533 CA HIS A 36 -4.901 -8.779 -14.086 1.00 0.00 C ATOM 534 C HIS A 36 -4.273 -9.352 -12.814 1.00 0.00 C ATOM 535 O HIS A 36 -4.972 -9.910 -11.970 1.00 0.00 O ATOM 536 CB HIS A 36 -6.430 -8.841 -14.073 1.00 0.00 C ATOM 537 CG HIS A 36 -7.077 -8.317 -15.333 1.00 0.00 C ATOM 538 ND1 HIS A 36 -7.043 -6.981 -15.692 1.00 0.00 N ATOM 539 CD2 HIS A 36 -7.773 -8.962 -16.312 1.00 0.00 C ATOM 540 CE1 HIS A 36 -7.693 -6.839 -16.838 1.00 0.00 C ATOM 541 NE2 HIS A 36 -8.145 -8.068 -17.220 1.00 0.00 N ATOM 0 H HIS A 36 -3.954 -8.861 -15.954 1.00 0.00 H new ATOM 0 HA HIS A 36 -4.638 -7.722 -14.134 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -6.740 -9.875 -13.921 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.799 -8.269 -13.222 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -7.986 -10.020 -16.343 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -7.839 -5.913 -17.375 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -8.681 -8.267 -18.065 1.00 0.00 H new ATOM 549 N CYS A 37 -2.961 -9.195 -12.718 1.00 0.00 N ATOM 550 CA CYS A 37 -2.231 -9.689 -11.563 1.00 0.00 C ATOM 551 C CYS A 37 -1.187 -8.643 -11.170 1.00 0.00 C ATOM 552 O CYS A 37 -1.039 -7.625 -11.845 1.00 0.00 O ATOM 553 CB CYS A 37 -1.596 -11.054 -11.837 1.00 0.00 C ATOM 554 SG CYS A 37 -2.897 -12.335 -11.967 1.00 0.00 S ATOM 0 H CYS A 37 -2.385 -8.733 -13.421 1.00 0.00 H new ATOM 0 HA CYS A 37 -2.920 -9.842 -10.733 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.018 -11.016 -12.760 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.902 -11.309 -11.036 1.00 0.00 H new ATOM 0 HG CYS A 37 -3.688 -12.051 -12.958 1.00 0.00 H new ATOM 560 N LEU A 38 -0.490 -8.929 -10.080 1.00 0.00 N ATOM 561 CA LEU A 38 0.537 -8.025 -9.590 1.00 0.00 C ATOM 562 C LEU A 38 1.801 -8.824 -9.265 1.00 0.00 C ATOM 563 O LEU A 38 2.030 -9.889 -9.835 1.00 0.00 O ATOM 564 CB LEU A 38 0.009 -7.204 -8.412 1.00 0.00 C ATOM 565 CG LEU A 38 -1.513 -7.134 -8.271 1.00 0.00 C ATOM 566 CD1 LEU A 38 -1.913 -6.609 -6.891 1.00 0.00 C ATOM 567 CD2 LEU A 38 -2.131 -6.306 -9.400 1.00 0.00 C ATOM 0 H LEU A 38 -0.616 -9.774 -9.522 1.00 0.00 H new ATOM 0 HA LEU A 38 0.806 -7.301 -10.359 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.420 -7.619 -7.492 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.393 -6.188 -8.502 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.910 -8.145 -8.358 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.000 -6.569 -6.818 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.521 -7.274 -6.121 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.503 -5.609 -6.749 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.213 -6.272 -9.276 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.730 -5.293 -9.369 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.890 -6.763 -10.360 1.00 0.00 H new ATOM 579 N THR A 39 2.588 -8.278 -8.350 1.00 0.00 N ATOM 580 CA THR A 39 3.823 -8.926 -7.942 1.00 0.00 C ATOM 581 C THR A 39 4.255 -8.430 -6.561 1.00 0.00 C ATOM 582 O THR A 39 4.212 -7.232 -6.286 1.00 0.00 O ATOM 583 CB THR A 39 4.869 -8.678 -9.031 1.00 0.00 C ATOM 584 OG1 THR A 39 4.613 -7.344 -9.461 1.00 0.00 O ATOM 585 CG2 THR A 39 4.625 -9.526 -10.281 1.00 0.00 C ATOM 0 H THR A 39 2.395 -7.394 -7.879 1.00 0.00 H new ATOM 0 HA THR A 39 3.689 -10.003 -7.838 1.00 0.00 H new ATOM 0 HB THR A 39 5.862 -8.892 -8.636 1.00 0.00 H new ATOM 0 HG1 THR A 39 5.248 -7.100 -10.166 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.395 -9.312 -11.022 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.660 -10.583 -10.016 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.646 -9.289 -10.696 1.00 0.00 H new ATOM 593 N GLY A 40 4.663 -9.377 -5.728 1.00 0.00 N ATOM 594 CA GLY A 40 5.102 -9.051 -4.382 1.00 0.00 C ATOM 595 C GLY A 40 5.930 -7.765 -4.372 1.00 0.00 C ATOM 596 O GLY A 40 5.729 -6.900 -3.521 1.00 0.00 O ATOM 0 H GLY A 40 4.699 -10.370 -5.960 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.235 -8.935 -3.731 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.695 -9.873 -3.980 1.00 0.00 H new ATOM 600 N SER A 41 6.844 -7.679 -5.328 1.00 0.00 N ATOM 601 CA SER A 41 7.703 -6.513 -5.439 1.00 0.00 C ATOM 602 C SER A 41 6.899 -5.318 -5.957 1.00 0.00 C ATOM 603 O SER A 41 7.038 -4.206 -5.451 1.00 0.00 O ATOM 604 CB SER A 41 8.893 -6.791 -6.360 1.00 0.00 C ATOM 605 OG SER A 41 9.945 -5.849 -6.172 1.00 0.00 O ATOM 0 H SER A 41 7.008 -8.398 -6.033 1.00 0.00 H new ATOM 0 HA SER A 41 8.092 -6.279 -4.448 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.269 -7.797 -6.173 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.562 -6.763 -7.398 1.00 0.00 H new ATOM 0 HG SER A 41 10.686 -6.062 -6.777 1.00 0.00 H new ATOM 611 N GLY A 42 6.076 -5.589 -6.959 1.00 0.00 N ATOM 612 CA GLY A 42 5.250 -4.551 -7.551 1.00 0.00 C ATOM 613 C GLY A 42 4.268 -3.980 -6.525 1.00 0.00 C ATOM 614 O GLY A 42 4.172 -2.765 -6.362 1.00 0.00 O ATOM 0 H GLY A 42 5.964 -6.513 -7.376 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.884 -3.753 -7.937 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.700 -4.959 -8.399 1.00 0.00 H new ATOM 618 N VAL A 43 3.564 -4.885 -5.861 1.00 0.00 N ATOM 619 CA VAL A 43 2.593 -4.487 -4.856 1.00 0.00 C ATOM 620 C VAL A 43 3.190 -3.376 -3.988 1.00 0.00 C ATOM 621 O VAL A 43 2.533 -2.370 -3.724 1.00 0.00 O ATOM 622 CB VAL A 43 2.150 -5.706 -4.045 1.00 0.00 C ATOM 623 CG1 VAL A 43 1.268 -5.289 -2.866 1.00 0.00 C ATOM 624 CG2 VAL A 43 1.433 -6.724 -4.933 1.00 0.00 C ATOM 0 H VAL A 43 3.647 -5.892 -5.999 1.00 0.00 H new ATOM 0 HA VAL A 43 1.697 -4.085 -5.329 1.00 0.00 H new ATOM 0 HB VAL A 43 3.043 -6.183 -3.643 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.967 -6.174 -2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.827 -4.619 -2.213 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.381 -4.776 -3.239 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.129 -7.581 -4.332 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.552 -6.262 -5.378 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.107 -7.056 -5.723 1.00 0.00 H new ATOM 634 N ILE A 44 4.427 -3.597 -3.570 1.00 0.00 N ATOM 635 CA ILE A 44 5.119 -2.627 -2.738 1.00 0.00 C ATOM 636 C ILE A 44 5.488 -1.407 -3.583 1.00 0.00 C ATOM 637 O ILE A 44 5.361 -0.271 -3.129 1.00 0.00 O ATOM 638 CB ILE A 44 6.316 -3.277 -2.041 1.00 0.00 C ATOM 639 CG1 ILE A 44 5.895 -4.546 -1.297 1.00 0.00 C ATOM 640 CG2 ILE A 44 7.022 -2.280 -1.119 1.00 0.00 C ATOM 641 CD1 ILE A 44 7.089 -5.481 -1.089 1.00 0.00 C ATOM 0 H ILE A 44 4.968 -4.433 -3.791 1.00 0.00 H new ATOM 0 HA ILE A 44 4.466 -2.276 -1.939 1.00 0.00 H new ATOM 0 HB ILE A 44 7.035 -3.575 -2.804 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.464 -4.280 -0.332 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.118 -5.062 -1.861 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.869 -2.768 -0.636 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.377 -1.432 -1.704 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.324 -1.930 -0.359 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.763 -6.375 -0.558 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.502 -5.764 -2.057 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.854 -4.970 -0.504 1.00 0.00 H new ATOM 653 N ASP A 45 5.937 -1.683 -4.799 1.00 0.00 N ATOM 654 CA ASP A 45 6.325 -0.622 -5.712 1.00 0.00 C ATOM 655 C ASP A 45 5.266 0.482 -5.684 1.00 0.00 C ATOM 656 O ASP A 45 5.598 1.663 -5.597 1.00 0.00 O ATOM 657 CB ASP A 45 6.429 -1.141 -7.148 1.00 0.00 C ATOM 658 CG ASP A 45 7.069 -0.170 -8.142 1.00 0.00 C ATOM 659 OD1 ASP A 45 7.463 0.927 -7.690 1.00 0.00 O ATOM 660 OD2 ASP A 45 7.148 -0.546 -9.332 1.00 0.00 O ATOM 0 H ASP A 45 6.041 -2.626 -5.173 1.00 0.00 H new ATOM 0 HA ASP A 45 7.296 -0.243 -5.394 1.00 0.00 H new ATOM 0 HB2 ASP A 45 7.006 -2.065 -7.143 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.429 -1.392 -7.501 1.00 0.00 H new ATOM 665 N TRP A 46 4.013 0.058 -5.760 1.00 0.00 N ATOM 666 CA TRP A 46 2.903 0.996 -5.745 1.00 0.00 C ATOM 667 C TRP A 46 2.968 1.783 -4.435 1.00 0.00 C ATOM 668 O TRP A 46 3.043 3.011 -4.447 1.00 0.00 O ATOM 669 CB TRP A 46 1.570 0.271 -5.941 1.00 0.00 C ATOM 670 CG TRP A 46 0.347 1.188 -5.871 1.00 0.00 C ATOM 671 CD1 TRP A 46 -0.059 2.091 -6.774 1.00 0.00 C ATOM 672 CD2 TRP A 46 -0.618 1.253 -4.801 1.00 0.00 C ATOM 673 NE1 TRP A 46 -1.211 2.732 -6.364 1.00 0.00 N ATOM 674 CE2 TRP A 46 -1.561 2.206 -5.126 1.00 0.00 C ATOM 675 CE3 TRP A 46 -0.691 0.531 -3.596 1.00 0.00 C ATOM 676 CZ2 TRP A 46 -2.646 2.524 -4.301 1.00 0.00 C ATOM 677 CZ3 TRP A 46 -1.781 0.861 -2.782 1.00 0.00 C ATOM 678 CH2 TRP A 46 -2.740 1.818 -3.096 1.00 0.00 C ATOM 0 H TRP A 46 3.742 -0.923 -5.832 1.00 0.00 H new ATOM 0 HA TRP A 46 2.978 1.697 -6.577 1.00 0.00 H new ATOM 0 HB2 TRP A 46 1.580 -0.231 -6.908 1.00 0.00 H new ATOM 0 HB3 TRP A 46 1.474 -0.504 -5.181 1.00 0.00 H new ATOM 0 HD1 TRP A 46 0.451 2.292 -7.705 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -1.713 3.458 -6.875 1.00 0.00 H new ATOM 0 HE3 TRP A 46 0.036 -0.218 -3.321 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -3.372 3.274 -4.579 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.884 0.335 -1.844 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -3.553 2.015 -2.413 1.00 0.00 H new ATOM 689 N LEU A 47 2.937 1.045 -3.335 1.00 0.00 N ATOM 690 CA LEU A 47 2.992 1.659 -2.019 1.00 0.00 C ATOM 691 C LEU A 47 4.084 2.729 -2.006 1.00 0.00 C ATOM 692 O LEU A 47 3.872 3.832 -1.503 1.00 0.00 O ATOM 693 CB LEU A 47 3.163 0.591 -0.937 1.00 0.00 C ATOM 694 CG LEU A 47 2.039 -0.442 -0.829 1.00 0.00 C ATOM 695 CD1 LEU A 47 2.599 -1.829 -0.510 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.985 -0.001 0.188 1.00 0.00 C ATOM 0 H LEU A 47 2.874 0.027 -3.328 1.00 0.00 H new ATOM 0 HA LEU A 47 2.051 2.161 -1.792 1.00 0.00 H new ATOM 0 HB2 LEU A 47 4.098 0.063 -1.121 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.263 1.091 0.026 1.00 0.00 H new ATOM 0 HG LEU A 47 1.543 -0.510 -1.797 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.780 -2.545 -0.439 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.282 -2.137 -1.302 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.135 -1.796 0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 47 0.198 -0.753 0.245 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.450 0.113 1.167 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.555 0.951 -0.123 1.00 0.00 H new ATOM 708 N VAL A 48 5.230 2.367 -2.564 1.00 0.00 N ATOM 709 CA VAL A 48 6.356 3.283 -2.622 1.00 0.00 C ATOM 710 C VAL A 48 6.078 4.361 -3.672 1.00 0.00 C ATOM 711 O VAL A 48 6.531 5.497 -3.536 1.00 0.00 O ATOM 712 CB VAL A 48 7.648 2.508 -2.889 1.00 0.00 C ATOM 713 CG1 VAL A 48 8.768 3.448 -3.342 1.00 0.00 C ATOM 714 CG2 VAL A 48 8.071 1.706 -1.657 1.00 0.00 C ATOM 0 H VAL A 48 5.403 1.452 -2.980 1.00 0.00 H new ATOM 0 HA VAL A 48 6.487 3.788 -1.665 1.00 0.00 H new ATOM 0 HB VAL A 48 7.454 1.803 -3.698 1.00 0.00 H new ATOM 0 HG11 VAL A 48 9.675 2.872 -3.525 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.469 3.955 -4.259 1.00 0.00 H new ATOM 0 HG13 VAL A 48 8.959 4.188 -2.565 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.992 1.165 -1.874 1.00 0.00 H new ATOM 0 HG22 VAL A 48 8.237 2.385 -0.821 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.285 0.996 -1.398 1.00 0.00 H new ATOM 724 N SER A 49 5.335 3.967 -4.696 1.00 0.00 N ATOM 725 CA SER A 49 4.991 4.885 -5.768 1.00 0.00 C ATOM 726 C SER A 49 4.021 5.950 -5.254 1.00 0.00 C ATOM 727 O SER A 49 4.184 7.135 -5.543 1.00 0.00 O ATOM 728 CB SER A 49 4.379 4.139 -6.956 1.00 0.00 C ATOM 729 OG SER A 49 5.017 4.478 -8.184 1.00 0.00 O ATOM 0 H SER A 49 4.962 3.024 -4.806 1.00 0.00 H new ATOM 0 HA SER A 49 5.905 5.370 -6.110 1.00 0.00 H new ATOM 0 HB2 SER A 49 4.459 3.065 -6.790 1.00 0.00 H new ATOM 0 HB3 SER A 49 3.316 4.373 -7.023 1.00 0.00 H new ATOM 0 HG SER A 49 4.600 3.980 -8.918 1.00 0.00 H new ATOM 735 N ASN A 50 3.032 5.491 -4.500 1.00 0.00 N ATOM 736 CA ASN A 50 2.036 6.390 -3.943 1.00 0.00 C ATOM 737 C ASN A 50 2.568 6.989 -2.639 1.00 0.00 C ATOM 738 O ASN A 50 2.108 8.043 -2.203 1.00 0.00 O ATOM 739 CB ASN A 50 0.738 5.645 -3.626 1.00 0.00 C ATOM 740 CG ASN A 50 1.026 4.315 -2.927 1.00 0.00 C ATOM 741 OD1 ASN A 50 1.469 4.263 -1.791 1.00 0.00 O ATOM 742 ND2 ASN A 50 0.751 3.244 -3.667 1.00 0.00 N ATOM 0 H ASN A 50 2.900 4.508 -4.262 1.00 0.00 H new ATOM 0 HA ASN A 50 1.835 7.168 -4.679 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.105 6.264 -2.991 1.00 0.00 H new ATOM 0 HB3 ASN A 50 0.184 5.463 -4.547 1.00 0.00 H new ATOM 0 HD21 ASN A 50 0.909 2.309 -3.290 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.382 3.358 -4.611 1.00 0.00 H new ATOM 749 N LYS A 51 3.531 6.291 -2.054 1.00 0.00 N ATOM 750 CA LYS A 51 4.130 6.741 -0.810 1.00 0.00 C ATOM 751 C LYS A 51 3.249 6.305 0.363 1.00 0.00 C ATOM 752 O LYS A 51 3.125 7.025 1.352 1.00 0.00 O ATOM 753 CB LYS A 51 4.392 8.248 -0.855 1.00 0.00 C ATOM 754 CG LYS A 51 5.034 8.653 -2.183 1.00 0.00 C ATOM 755 CD LYS A 51 6.560 8.684 -2.067 1.00 0.00 C ATOM 756 CE LYS A 51 7.217 8.422 -3.424 1.00 0.00 C ATOM 757 NZ LYS A 51 8.198 9.484 -3.738 1.00 0.00 N ATOM 0 H LYS A 51 3.911 5.417 -2.419 1.00 0.00 H new ATOM 0 HA LYS A 51 5.105 6.275 -0.667 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.455 8.788 -0.720 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.045 8.532 -0.030 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.739 7.951 -2.963 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.668 9.635 -2.483 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.880 9.653 -1.685 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.889 7.934 -1.348 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.714 7.452 -3.413 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.455 8.381 -4.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 8.635 9.291 -4.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 7.715 10.405 -3.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.935 9.504 -3.004 1.00 0.00 H new ATOM 771 N LEU A 52 2.660 5.127 0.213 1.00 0.00 N ATOM 772 CA LEU A 52 1.795 4.586 1.247 1.00 0.00 C ATOM 773 C LEU A 52 2.639 4.203 2.464 1.00 0.00 C ATOM 774 O LEU A 52 2.112 4.045 3.564 1.00 0.00 O ATOM 775 CB LEU A 52 0.955 3.434 0.693 1.00 0.00 C ATOM 776 CG LEU A 52 -0.406 3.816 0.108 1.00 0.00 C ATOM 777 CD1 LEU A 52 -0.979 2.677 -0.737 1.00 0.00 C ATOM 778 CD2 LEU A 52 -1.373 4.254 1.210 1.00 0.00 C ATOM 0 H LEU A 52 2.765 4.533 -0.609 1.00 0.00 H new ATOM 0 HA LEU A 52 1.081 5.339 1.579 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.532 2.930 -0.082 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.794 2.711 1.492 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.265 4.670 -0.555 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.947 2.975 -1.141 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.297 2.454 -1.557 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.103 1.790 -0.116 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.333 4.520 0.767 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.514 3.436 1.917 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.962 5.118 1.732 1.00 0.00 H new ATOM 790 N VAL A 53 3.935 4.065 2.225 1.00 0.00 N ATOM 791 CA VAL A 53 4.857 3.703 3.288 1.00 0.00 C ATOM 792 C VAL A 53 6.059 4.650 3.259 1.00 0.00 C ATOM 793 O VAL A 53 6.063 5.630 2.516 1.00 0.00 O ATOM 794 CB VAL A 53 5.253 2.230 3.159 1.00 0.00 C ATOM 795 CG1 VAL A 53 4.042 1.317 3.361 1.00 0.00 C ATOM 796 CG2 VAL A 53 5.925 1.960 1.811 1.00 0.00 C ATOM 0 H VAL A 53 4.368 4.197 1.311 1.00 0.00 H new ATOM 0 HA VAL A 53 4.379 3.813 4.262 1.00 0.00 H new ATOM 0 HB VAL A 53 5.975 2.007 3.944 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.351 0.276 3.264 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.625 1.481 4.355 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.287 1.543 2.608 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.197 0.906 1.744 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.235 2.209 1.004 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.822 2.572 1.723 1.00 0.00 H new ATOM 806 N ARG A 54 7.048 4.323 4.077 1.00 0.00 N ATOM 807 CA ARG A 54 8.253 5.132 4.155 1.00 0.00 C ATOM 808 C ARG A 54 9.371 4.501 3.323 1.00 0.00 C ATOM 809 O ARG A 54 10.266 5.198 2.849 1.00 0.00 O ATOM 810 CB ARG A 54 8.725 5.280 5.602 1.00 0.00 C ATOM 811 CG ARG A 54 7.867 6.298 6.357 1.00 0.00 C ATOM 812 CD ARG A 54 8.513 7.685 6.332 1.00 0.00 C ATOM 813 NE ARG A 54 7.506 8.718 6.662 1.00 0.00 N ATOM 814 CZ ARG A 54 7.725 10.037 6.572 1.00 0.00 C ATOM 815 NH1 ARG A 54 8.916 10.491 6.160 1.00 0.00 N ATOM 816 NH2 ARG A 54 6.752 10.901 6.892 1.00 0.00 N ATOM 0 H ARG A 54 7.040 3.509 4.692 1.00 0.00 H new ATOM 0 HA ARG A 54 8.015 6.120 3.760 1.00 0.00 H new ATOM 0 HB2 ARG A 54 8.677 4.314 6.105 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.768 5.595 5.618 1.00 0.00 H new ATOM 0 HG2 ARG A 54 6.875 6.347 5.908 1.00 0.00 H new ATOM 0 HG3 ARG A 54 7.734 5.973 7.389 1.00 0.00 H new ATOM 0 HD2 ARG A 54 9.335 7.725 7.047 1.00 0.00 H new ATOM 0 HD3 ARG A 54 8.937 7.880 5.347 1.00 0.00 H new ATOM 0 HE ARG A 54 6.588 8.406 6.978 1.00 0.00 H new ATOM 0 HH11 ARG A 54 9.656 9.833 5.915 1.00 0.00 H new ATOM 0 HH12 ARG A 54 9.083 11.495 6.091 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.845 10.555 7.204 1.00 0.00 H new ATOM 0 HH22 ARG A 54 6.919 11.905 6.824 1.00 0.00 H new ATOM 830 N ASN A 55 9.283 3.188 3.171 1.00 0.00 N ATOM 831 CA ASN A 55 10.276 2.454 2.405 1.00 0.00 C ATOM 832 C ASN A 55 9.699 1.097 1.997 1.00 0.00 C ATOM 833 O ASN A 55 8.817 0.566 2.670 1.00 0.00 O ATOM 834 CB ASN A 55 11.536 2.202 3.235 1.00 0.00 C ATOM 835 CG ASN A 55 11.798 3.361 4.200 1.00 0.00 C ATOM 836 OD1 ASN A 55 12.569 4.266 3.928 1.00 0.00 O ATOM 837 ND2 ASN A 55 11.115 3.282 5.338 1.00 0.00 N ATOM 0 H ASN A 55 8.539 2.613 3.566 1.00 0.00 H new ATOM 0 HA ASN A 55 10.534 3.050 1.530 1.00 0.00 H new ATOM 0 HB2 ASN A 55 11.426 1.274 3.797 1.00 0.00 H new ATOM 0 HB3 ASN A 55 12.392 2.075 2.573 1.00 0.00 H new ATOM 0 HD21 ASN A 55 11.220 4.007 6.047 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.486 2.496 5.502 1.00 0.00 H new ATOM 844 N ARG A 56 10.220 0.575 0.897 1.00 0.00 N ATOM 845 CA ARG A 56 9.768 -0.710 0.391 1.00 0.00 C ATOM 846 C ARG A 56 9.512 -1.676 1.550 1.00 0.00 C ATOM 847 O ARG A 56 8.529 -2.415 1.540 1.00 0.00 O ATOM 848 CB ARG A 56 10.801 -1.323 -0.556 1.00 0.00 C ATOM 849 CG ARG A 56 10.816 -0.591 -1.900 1.00 0.00 C ATOM 850 CD ARG A 56 10.192 -1.452 -3.000 1.00 0.00 C ATOM 851 NE ARG A 56 10.931 -2.728 -3.124 1.00 0.00 N ATOM 852 CZ ARG A 56 10.967 -3.470 -4.239 1.00 0.00 C ATOM 853 NH1 ARG A 56 10.308 -3.067 -5.334 1.00 0.00 N ATOM 854 NH2 ARG A 56 11.663 -4.615 -4.260 1.00 0.00 N ATOM 0 H ARG A 56 10.951 1.019 0.341 1.00 0.00 H new ATOM 0 HA ARG A 56 8.842 -0.543 -0.159 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.790 -1.275 -0.101 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.574 -2.377 -0.715 1.00 0.00 H new ATOM 0 HG2 ARG A 56 10.268 0.347 -1.813 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.842 -0.338 -2.169 1.00 0.00 H new ATOM 0 HD2 ARG A 56 9.145 -1.649 -2.769 1.00 0.00 H new ATOM 0 HD3 ARG A 56 10.213 -0.916 -3.949 1.00 0.00 H new ATOM 0 HE ARG A 56 11.445 -3.064 -2.310 1.00 0.00 H new ATOM 0 HH11 ARG A 56 9.779 -2.195 -5.319 1.00 0.00 H new ATOM 0 HH12 ARG A 56 10.336 -3.632 -6.183 1.00 0.00 H new ATOM 0 HH21 ARG A 56 12.165 -4.922 -3.427 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.690 -5.180 -5.109 1.00 0.00 H new ATOM 868 N GLN A 57 10.414 -1.638 2.520 1.00 0.00 N ATOM 869 CA GLN A 57 10.298 -2.500 3.684 1.00 0.00 C ATOM 870 C GLN A 57 8.878 -2.438 4.251 1.00 0.00 C ATOM 871 O GLN A 57 8.141 -3.421 4.198 1.00 0.00 O ATOM 872 CB GLN A 57 11.331 -2.127 4.748 1.00 0.00 C ATOM 873 CG GLN A 57 11.835 -3.371 5.484 1.00 0.00 C ATOM 874 CD GLN A 57 10.750 -3.944 6.398 1.00 0.00 C ATOM 875 OE1 GLN A 57 9.713 -3.344 6.625 1.00 0.00 O ATOM 876 NE2 GLN A 57 11.047 -5.136 6.908 1.00 0.00 N ATOM 0 H GLN A 57 11.228 -1.024 2.524 1.00 0.00 H new ATOM 0 HA GLN A 57 10.500 -3.525 3.374 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.170 -1.612 4.280 1.00 0.00 H new ATOM 0 HB3 GLN A 57 10.888 -1.432 5.462 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.143 -4.126 4.761 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.716 -3.117 6.074 1.00 0.00 H new ATOM 0 HE21 GLN A 57 11.934 -5.583 6.676 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.388 -5.603 7.531 1.00 0.00 H new ATOM 885 N GLU A 58 8.538 -1.273 4.782 1.00 0.00 N ATOM 886 CA GLU A 58 7.220 -1.069 5.359 1.00 0.00 C ATOM 887 C GLU A 58 6.154 -1.756 4.503 1.00 0.00 C ATOM 888 O GLU A 58 5.329 -2.510 5.018 1.00 0.00 O ATOM 889 CB GLU A 58 6.916 0.421 5.520 1.00 0.00 C ATOM 890 CG GLU A 58 7.281 0.906 6.925 1.00 0.00 C ATOM 891 CD GLU A 58 8.517 0.177 7.453 1.00 0.00 C ATOM 892 OE1 GLU A 58 9.544 0.212 6.741 1.00 0.00 O ATOM 893 OE2 GLU A 58 8.408 -0.400 8.556 1.00 0.00 O ATOM 0 H GLU A 58 9.153 -0.460 4.825 1.00 0.00 H new ATOM 0 HA GLU A 58 7.207 -1.518 6.352 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.474 0.992 4.778 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.858 0.602 5.332 1.00 0.00 H new ATOM 0 HG2 GLU A 58 7.468 1.980 6.906 1.00 0.00 H new ATOM 0 HG3 GLU A 58 6.441 0.741 7.600 1.00 0.00 H new ATOM 900 N GLY A 59 6.206 -1.472 3.209 1.00 0.00 N ATOM 901 CA GLY A 59 5.255 -2.054 2.277 1.00 0.00 C ATOM 902 C GLY A 59 5.238 -3.579 2.391 1.00 0.00 C ATOM 903 O GLY A 59 4.174 -4.196 2.356 1.00 0.00 O ATOM 0 H GLY A 59 6.891 -0.847 2.785 1.00 0.00 H new ATOM 0 HA2 GLY A 59 4.258 -1.660 2.476 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.515 -1.765 1.259 1.00 0.00 H new ATOM 907 N LEU A 60 6.429 -4.144 2.525 1.00 0.00 N ATOM 908 CA LEU A 60 6.564 -5.586 2.644 1.00 0.00 C ATOM 909 C LEU A 60 5.680 -6.084 3.789 1.00 0.00 C ATOM 910 O LEU A 60 4.847 -6.968 3.595 1.00 0.00 O ATOM 911 CB LEU A 60 8.037 -5.975 2.791 1.00 0.00 C ATOM 912 CG LEU A 60 8.352 -7.467 2.659 1.00 0.00 C ATOM 913 CD1 LEU A 60 8.537 -8.111 4.035 1.00 0.00 C ATOM 914 CD2 LEU A 60 7.284 -8.182 1.830 1.00 0.00 C ATOM 0 H LEU A 60 7.309 -3.629 2.554 1.00 0.00 H new ATOM 0 HA LEU A 60 6.216 -6.078 1.735 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.612 -5.434 2.039 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.387 -5.635 3.766 1.00 0.00 H new ATOM 0 HG LEU A 60 9.296 -7.571 2.125 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.760 -9.171 3.914 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.361 -7.624 4.557 1.00 0.00 H new ATOM 0 HD13 LEU A 60 7.622 -7.997 4.616 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.532 -9.240 1.752 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.314 -8.072 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.244 -7.744 0.833 1.00 0.00 H new ATOM 926 N MET A 61 5.892 -5.495 4.957 1.00 0.00 N ATOM 927 CA MET A 61 5.124 -5.868 6.133 1.00 0.00 C ATOM 928 C MET A 61 3.626 -5.665 5.897 1.00 0.00 C ATOM 929 O MET A 61 2.828 -6.568 6.142 1.00 0.00 O ATOM 930 CB MET A 61 5.573 -5.021 7.326 1.00 0.00 C ATOM 931 CG MET A 61 7.088 -5.106 7.520 1.00 0.00 C ATOM 932 SD MET A 61 7.531 -4.501 9.140 1.00 0.00 S ATOM 933 CE MET A 61 6.755 -2.894 9.093 1.00 0.00 C ATOM 0 H MET A 61 6.584 -4.763 5.114 1.00 0.00 H new ATOM 0 HA MET A 61 5.300 -6.924 6.339 1.00 0.00 H new ATOM 0 HB2 MET A 61 5.281 -3.983 7.170 1.00 0.00 H new ATOM 0 HB3 MET A 61 5.067 -5.362 8.229 1.00 0.00 H new ATOM 0 HG2 MET A 61 7.420 -6.138 7.405 1.00 0.00 H new ATOM 0 HG3 MET A 61 7.595 -4.520 6.753 1.00 0.00 H new ATOM 0 HE1 MET A 61 7.209 -2.249 9.845 1.00 0.00 H new ATOM 0 HE2 MET A 61 6.892 -2.453 8.106 1.00 0.00 H new ATOM 0 HE3 MET A 61 5.690 -2.998 9.299 1.00 0.00 H new ATOM 943 N ILE A 62 3.290 -4.474 5.424 1.00 0.00 N ATOM 944 CA ILE A 62 1.902 -4.142 5.152 1.00 0.00 C ATOM 945 C ILE A 62 1.330 -5.142 4.146 1.00 0.00 C ATOM 946 O ILE A 62 0.266 -5.716 4.372 1.00 0.00 O ATOM 947 CB ILE A 62 1.778 -2.683 4.708 1.00 0.00 C ATOM 948 CG1 ILE A 62 2.396 -1.740 5.742 1.00 0.00 C ATOM 949 CG2 ILE A 62 0.322 -2.324 4.402 1.00 0.00 C ATOM 950 CD1 ILE A 62 1.556 -1.703 7.021 1.00 0.00 C ATOM 0 H ILE A 62 3.955 -3.727 5.222 1.00 0.00 H new ATOM 0 HA ILE A 62 1.305 -4.227 6.060 1.00 0.00 H new ATOM 0 HB ILE A 62 2.341 -2.559 3.783 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.409 -2.066 5.977 1.00 0.00 H new ATOM 0 HG13 ILE A 62 2.473 -0.736 5.324 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.262 -1.282 4.089 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.051 -2.965 3.603 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.284 -2.469 5.296 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.017 -1.025 7.740 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.551 -1.353 6.786 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.501 -2.704 7.449 1.00 0.00 H new ATOM 962 N SER A 63 2.062 -5.320 3.056 1.00 0.00 N ATOM 963 CA SER A 63 1.640 -6.241 2.014 1.00 0.00 C ATOM 964 C SER A 63 1.056 -7.509 2.641 1.00 0.00 C ATOM 965 O SER A 63 -0.036 -7.940 2.275 1.00 0.00 O ATOM 966 CB SER A 63 2.805 -6.595 1.088 1.00 0.00 C ATOM 967 OG SER A 63 3.120 -5.530 0.194 1.00 0.00 O ATOM 0 H SER A 63 2.944 -4.842 2.872 1.00 0.00 H new ATOM 0 HA SER A 63 0.871 -5.752 1.416 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.683 -6.837 1.687 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.554 -7.487 0.515 1.00 0.00 H new ATOM 0 HG SER A 63 3.555 -4.805 0.689 1.00 0.00 H new ATOM 973 N ALA A 64 1.811 -8.070 3.574 1.00 0.00 N ATOM 974 CA ALA A 64 1.382 -9.280 4.255 1.00 0.00 C ATOM 975 C ALA A 64 -0.051 -9.096 4.759 1.00 0.00 C ATOM 976 O ALA A 64 -0.929 -9.899 4.450 1.00 0.00 O ATOM 977 CB ALA A 64 2.360 -9.603 5.386 1.00 0.00 C ATOM 0 H ALA A 64 2.717 -7.709 3.874 1.00 0.00 H new ATOM 0 HA ALA A 64 1.384 -10.127 3.569 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.038 -10.511 5.897 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.357 -9.753 4.973 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.382 -8.776 6.095 1.00 0.00 H new ATOM 983 N SER A 65 -0.243 -8.032 5.526 1.00 0.00 N ATOM 984 CA SER A 65 -1.554 -7.732 6.075 1.00 0.00 C ATOM 985 C SER A 65 -2.617 -7.836 4.979 1.00 0.00 C ATOM 986 O SER A 65 -3.678 -8.420 5.192 1.00 0.00 O ATOM 987 CB SER A 65 -1.580 -6.341 6.710 1.00 0.00 C ATOM 988 OG SER A 65 -2.435 -6.289 7.849 1.00 0.00 O ATOM 0 H SER A 65 0.488 -7.367 5.780 1.00 0.00 H new ATOM 0 HA SER A 65 -1.773 -8.461 6.855 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.569 -6.057 7.003 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.915 -5.612 5.972 1.00 0.00 H new ATOM 0 HG SER A 65 -2.422 -5.385 8.226 1.00 0.00 H new ATOM 994 N LEU A 66 -2.294 -7.260 3.830 1.00 0.00 N ATOM 995 CA LEU A 66 -3.208 -7.280 2.701 1.00 0.00 C ATOM 996 C LEU A 66 -3.500 -8.731 2.312 1.00 0.00 C ATOM 997 O LEU A 66 -4.658 -9.141 2.255 1.00 0.00 O ATOM 998 CB LEU A 66 -2.657 -6.434 1.551 1.00 0.00 C ATOM 999 CG LEU A 66 -2.797 -4.919 1.706 1.00 0.00 C ATOM 1000 CD1 LEU A 66 -4.229 -4.468 1.415 1.00 0.00 C ATOM 1001 CD2 LEU A 66 -2.322 -4.463 3.087 1.00 0.00 C ATOM 0 H LEU A 66 -1.412 -6.777 3.657 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.160 -6.825 2.974 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.600 -6.670 1.426 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.161 -6.733 0.632 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.153 -4.439 0.969 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.301 -3.387 1.532 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.496 -4.741 0.394 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.912 -4.955 2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.432 -3.382 3.171 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.921 -4.950 3.857 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.274 -4.732 3.218 1.00 0.00 H new ATOM 1013 N LEU A 67 -2.429 -9.468 2.056 1.00 0.00 N ATOM 1014 CA LEU A 67 -2.556 -10.864 1.674 1.00 0.00 C ATOM 1015 C LEU A 67 -3.328 -11.617 2.759 1.00 0.00 C ATOM 1016 O LEU A 67 -4.351 -12.240 2.480 1.00 0.00 O ATOM 1017 CB LEU A 67 -1.181 -11.463 1.369 1.00 0.00 C ATOM 1018 CG LEU A 67 -1.149 -12.971 1.109 1.00 0.00 C ATOM 1019 CD1 LEU A 67 -1.273 -13.271 -0.386 1.00 0.00 C ATOM 1020 CD2 LEU A 67 0.101 -13.607 1.719 1.00 0.00 C ATOM 0 H LEU A 67 -1.470 -9.125 2.106 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.130 -10.956 0.752 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.771 -10.955 0.496 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.518 -11.244 2.206 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.011 -13.421 1.601 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.248 -14.349 -0.544 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.216 -12.871 -0.760 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.444 -12.806 -0.920 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.098 -14.679 1.519 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.990 -13.158 1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.106 -13.438 2.796 1.00 0.00 H new ATOM 1032 N SER A 68 -2.808 -11.535 3.975 1.00 0.00 N ATOM 1033 CA SER A 68 -3.435 -12.201 5.104 1.00 0.00 C ATOM 1034 C SER A 68 -4.956 -12.060 5.015 1.00 0.00 C ATOM 1035 O SER A 68 -5.670 -13.055 4.903 1.00 0.00 O ATOM 1036 CB SER A 68 -2.926 -11.634 6.431 1.00 0.00 C ATOM 1037 OG SER A 68 -2.626 -12.662 7.370 1.00 0.00 O ATOM 0 H SER A 68 -1.959 -11.017 4.203 1.00 0.00 H new ATOM 0 HA SER A 68 -3.171 -13.258 5.067 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.033 -11.036 6.251 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.678 -10.966 6.852 1.00 0.00 H new ATOM 0 HG SER A 68 -2.303 -12.260 8.203 1.00 0.00 H new ATOM 1043 N GLU A 69 -5.407 -10.815 5.069 1.00 0.00 N ATOM 1044 CA GLU A 69 -6.830 -10.531 4.996 1.00 0.00 C ATOM 1045 C GLU A 69 -7.475 -11.335 3.865 1.00 0.00 C ATOM 1046 O GLU A 69 -8.575 -11.862 4.022 1.00 0.00 O ATOM 1047 CB GLU A 69 -7.081 -9.032 4.815 1.00 0.00 C ATOM 1048 CG GLU A 69 -6.847 -8.275 6.124 1.00 0.00 C ATOM 1049 CD GLU A 69 -7.859 -8.699 7.191 1.00 0.00 C ATOM 1050 OE1 GLU A 69 -9.059 -8.424 6.976 1.00 0.00 O ATOM 1051 OE2 GLU A 69 -7.409 -9.287 8.198 1.00 0.00 O ATOM 0 H GLU A 69 -4.812 -9.992 5.162 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.289 -10.832 5.937 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.421 -8.640 4.041 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.104 -8.869 4.474 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.835 -8.464 6.482 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.927 -7.202 5.947 1.00 0.00 H new ATOM 1058 N GLY A 70 -6.762 -11.405 2.751 1.00 0.00 N ATOM 1059 CA GLY A 70 -7.251 -12.136 1.594 1.00 0.00 C ATOM 1060 C GLY A 70 -7.467 -11.199 0.404 1.00 0.00 C ATOM 1061 O GLY A 70 -8.369 -11.414 -0.404 1.00 0.00 O ATOM 0 H GLY A 70 -5.849 -10.968 2.625 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -6.538 -12.915 1.323 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.188 -12.634 1.844 1.00 0.00 H new ATOM 1065 N TYR A 71 -6.624 -10.179 0.334 1.00 0.00 N ATOM 1066 CA TYR A 71 -6.712 -9.208 -0.744 1.00 0.00 C ATOM 1067 C TYR A 71 -5.835 -9.623 -1.927 1.00 0.00 C ATOM 1068 O TYR A 71 -6.123 -9.271 -3.070 1.00 0.00 O ATOM 1069 CB TYR A 71 -6.183 -7.892 -0.169 1.00 0.00 C ATOM 1070 CG TYR A 71 -7.196 -7.140 0.697 1.00 0.00 C ATOM 1071 CD1 TYR A 71 -8.388 -6.711 0.149 1.00 0.00 C ATOM 1072 CD2 TYR A 71 -6.917 -6.891 2.025 1.00 0.00 C ATOM 1073 CE1 TYR A 71 -9.341 -6.003 0.964 1.00 0.00 C ATOM 1074 CE2 TYR A 71 -7.870 -6.183 2.840 1.00 0.00 C ATOM 1075 CZ TYR A 71 -9.035 -5.774 2.270 1.00 0.00 C ATOM 1076 OH TYR A 71 -9.935 -5.106 3.040 1.00 0.00 O ATOM 0 H TYR A 71 -5.877 -10.004 1.006 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.737 -9.125 -1.104 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -5.294 -8.099 0.427 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -5.873 -7.247 -0.991 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -8.606 -6.906 -0.891 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.984 -7.227 2.453 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -10.277 -5.661 0.548 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -7.664 -5.981 3.881 1.00 0.00 H new ATOM 0 HH TYR A 71 -10.718 -5.674 3.196 1.00 0.00 H new ATOM 1086 N LEU A 72 -4.784 -10.365 -1.613 1.00 0.00 N ATOM 1087 CA LEU A 72 -3.864 -10.831 -2.636 1.00 0.00 C ATOM 1088 C LEU A 72 -3.900 -12.359 -2.691 1.00 0.00 C ATOM 1089 O LEU A 72 -3.612 -13.026 -1.698 1.00 0.00 O ATOM 1090 CB LEU A 72 -2.465 -10.257 -2.401 1.00 0.00 C ATOM 1091 CG LEU A 72 -2.324 -8.743 -2.568 1.00 0.00 C ATOM 1092 CD1 LEU A 72 -2.904 -8.283 -3.907 1.00 0.00 C ATOM 1093 CD2 LEU A 72 -2.952 -8.000 -1.387 1.00 0.00 C ATOM 0 H LEU A 72 -4.549 -10.655 -0.664 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.171 -10.469 -3.617 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.150 -10.522 -1.392 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.774 -10.744 -3.089 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.262 -8.498 -2.575 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.791 -7.203 -4.001 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.373 -8.775 -4.722 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.962 -8.543 -3.954 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.838 -6.926 -1.531 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -4.012 -8.247 -1.324 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -2.454 -8.297 -0.464 1.00 0.00 H new ATOM 1105 N GLN A 73 -4.256 -12.870 -3.860 1.00 0.00 N ATOM 1106 CA GLN A 73 -4.334 -14.307 -4.057 1.00 0.00 C ATOM 1107 C GLN A 73 -3.051 -14.823 -4.712 1.00 0.00 C ATOM 1108 O GLN A 73 -2.571 -14.245 -5.686 1.00 0.00 O ATOM 1109 CB GLN A 73 -5.563 -14.681 -4.889 1.00 0.00 C ATOM 1110 CG GLN A 73 -6.848 -14.505 -4.077 1.00 0.00 C ATOM 1111 CD GLN A 73 -7.133 -15.745 -3.227 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -6.636 -16.830 -3.479 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -7.958 -15.523 -2.207 1.00 0.00 N ATOM 0 H GLN A 73 -4.494 -12.314 -4.681 1.00 0.00 H new ATOM 0 HA GLN A 73 -4.438 -14.783 -3.082 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.605 -14.058 -5.783 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.479 -15.715 -5.224 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -6.758 -13.631 -3.432 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.685 -14.321 -4.750 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -8.339 -14.589 -2.053 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -8.210 -16.286 -1.579 1.00 0.00 H new ATOM 1122 N PRO A 74 -2.519 -15.935 -4.136 1.00 0.00 N ATOM 1123 CA PRO A 74 -1.301 -16.535 -4.654 1.00 0.00 C ATOM 1124 C PRO A 74 -1.574 -17.297 -5.952 1.00 0.00 C ATOM 1125 O PRO A 74 -2.560 -18.026 -6.053 1.00 0.00 O ATOM 1126 CB PRO A 74 -0.798 -17.432 -3.534 1.00 0.00 C ATOM 1127 CG PRO A 74 -1.988 -17.660 -2.616 1.00 0.00 C ATOM 1128 CD PRO A 74 -3.060 -16.646 -2.982 1.00 0.00 C ATOM 0 HA PRO A 74 -0.548 -15.794 -4.922 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -0.423 -18.376 -3.929 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.025 -16.961 -2.997 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.368 -18.675 -2.729 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -1.693 -17.544 -1.573 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -4.002 -17.137 -3.225 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.259 -15.965 -2.155 1.00 0.00 H new ATOM 1136 N ALA A 75 -0.683 -17.101 -6.914 1.00 0.00 N ATOM 1137 CA ALA A 75 -0.816 -17.760 -8.202 1.00 0.00 C ATOM 1138 C ALA A 75 0.510 -18.432 -8.565 1.00 0.00 C ATOM 1139 O ALA A 75 1.534 -17.763 -8.692 1.00 0.00 O ATOM 1140 CB ALA A 75 -1.261 -16.742 -9.253 1.00 0.00 C ATOM 0 H ALA A 75 0.133 -16.495 -6.827 1.00 0.00 H new ATOM 0 HA ALA A 75 -1.579 -18.538 -8.159 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.361 -17.237 -10.219 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -2.221 -16.316 -8.963 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.519 -15.947 -9.327 1.00 0.00 H new ATOM 1146 N GLY A 76 0.447 -19.746 -8.722 1.00 0.00 N ATOM 1147 CA GLY A 76 1.630 -20.516 -9.068 1.00 0.00 C ATOM 1148 C GLY A 76 1.917 -21.585 -8.012 1.00 0.00 C ATOM 1149 O GLY A 76 1.477 -22.727 -8.144 1.00 0.00 O ATOM 0 H GLY A 76 -0.405 -20.297 -8.616 1.00 0.00 H new ATOM 0 HA2 GLY A 76 1.489 -20.989 -10.040 1.00 0.00 H new ATOM 0 HA3 GLY A 76 2.488 -19.850 -9.159 1.00 0.00 H new ATOM 1153 N ASP A 77 2.652 -21.178 -6.988 1.00 0.00 N ATOM 1154 CA ASP A 77 3.002 -22.087 -5.910 1.00 0.00 C ATOM 1155 C ASP A 77 4.042 -21.422 -5.005 1.00 0.00 C ATOM 1156 O ASP A 77 3.948 -21.504 -3.782 1.00 0.00 O ATOM 1157 CB ASP A 77 3.609 -23.381 -6.456 1.00 0.00 C ATOM 1158 CG ASP A 77 4.679 -23.189 -7.533 1.00 0.00 C ATOM 1159 OD1 ASP A 77 4.334 -22.595 -8.576 1.00 0.00 O ATOM 1160 OD2 ASP A 77 5.819 -23.642 -7.287 1.00 0.00 O ATOM 0 H ASP A 77 3.015 -20.231 -6.882 1.00 0.00 H new ATOM 0 HA ASP A 77 2.092 -22.321 -5.357 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.045 -23.938 -5.627 1.00 0.00 H new ATOM 0 HB3 ASP A 77 2.808 -23.996 -6.866 1.00 0.00 H new ATOM 1165 N LEU A 78 5.009 -20.779 -5.643 1.00 0.00 N ATOM 1166 CA LEU A 78 6.065 -20.100 -4.911 1.00 0.00 C ATOM 1167 C LEU A 78 5.462 -19.383 -3.701 1.00 0.00 C ATOM 1168 O LEU A 78 5.588 -19.851 -2.571 1.00 0.00 O ATOM 1169 CB LEU A 78 6.855 -19.178 -5.842 1.00 0.00 C ATOM 1170 CG LEU A 78 8.049 -18.455 -5.215 1.00 0.00 C ATOM 1171 CD1 LEU A 78 8.954 -17.855 -6.293 1.00 0.00 C ATOM 1172 CD2 LEU A 78 7.585 -17.403 -4.205 1.00 0.00 C ATOM 0 H LEU A 78 5.083 -20.714 -6.658 1.00 0.00 H new ATOM 0 HA LEU A 78 6.787 -20.821 -4.527 1.00 0.00 H new ATOM 0 HB2 LEU A 78 7.215 -19.768 -6.685 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.173 -18.429 -6.244 1.00 0.00 H new ATOM 0 HG LEU A 78 8.642 -19.187 -4.667 1.00 0.00 H new ATOM 0 HD11 LEU A 78 9.795 -17.347 -5.821 1.00 0.00 H new ATOM 0 HD12 LEU A 78 9.327 -18.650 -6.939 1.00 0.00 H new ATOM 0 HD13 LEU A 78 8.386 -17.140 -6.888 1.00 0.00 H new ATOM 0 HD21 LEU A 78 8.453 -16.904 -3.774 1.00 0.00 H new ATOM 0 HD22 LEU A 78 6.957 -16.668 -4.708 1.00 0.00 H new ATOM 0 HD23 LEU A 78 7.014 -17.887 -3.412 1.00 0.00 H new ATOM 1184 N SER A 79 4.819 -18.258 -3.980 1.00 0.00 N ATOM 1185 CA SER A 79 4.196 -17.472 -2.929 1.00 0.00 C ATOM 1186 C SER A 79 3.210 -18.338 -2.143 1.00 0.00 C ATOM 1187 O SER A 79 3.188 -18.298 -0.913 1.00 0.00 O ATOM 1188 CB SER A 79 3.484 -16.247 -3.507 1.00 0.00 C ATOM 1189 OG SER A 79 4.399 -15.320 -4.084 1.00 0.00 O ATOM 0 H SER A 79 4.716 -17.873 -4.919 1.00 0.00 H new ATOM 0 HA SER A 79 4.977 -17.120 -2.255 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.768 -16.568 -4.263 1.00 0.00 H new ATOM 0 HB3 SER A 79 2.916 -15.753 -2.719 1.00 0.00 H new ATOM 0 HG SER A 79 5.067 -15.060 -3.415 1.00 0.00 H new ATOM 1195 N LYS A 80 2.419 -19.100 -2.884 1.00 0.00 N ATOM 1196 CA LYS A 80 1.433 -19.974 -2.271 1.00 0.00 C ATOM 1197 C LYS A 80 2.071 -20.703 -1.086 1.00 0.00 C ATOM 1198 O LYS A 80 1.565 -20.637 0.033 1.00 0.00 O ATOM 1199 CB LYS A 80 0.826 -20.912 -3.315 1.00 0.00 C ATOM 1200 CG LYS A 80 -0.684 -21.053 -3.114 1.00 0.00 C ATOM 1201 CD LYS A 80 -1.212 -22.318 -3.792 1.00 0.00 C ATOM 1202 CE LYS A 80 -2.157 -21.970 -4.944 1.00 0.00 C ATOM 1203 NZ LYS A 80 -2.237 -23.093 -5.905 1.00 0.00 N ATOM 0 H LYS A 80 2.441 -19.130 -3.903 1.00 0.00 H new ATOM 0 HA LYS A 80 0.600 -19.392 -1.877 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.029 -20.529 -4.315 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.299 -21.892 -3.247 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.911 -21.086 -2.048 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -1.192 -20.179 -3.522 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.377 -22.909 -4.168 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.735 -22.935 -3.061 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -3.150 -21.746 -4.553 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.805 -21.072 -5.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -2.882 -22.841 -6.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.291 -23.288 -6.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.594 -23.941 -5.419 1.00 0.00 H new ATOM 1217 N ASN A 81 3.172 -21.381 -1.373 1.00 0.00 N ATOM 1218 CA ASN A 81 3.884 -22.121 -0.345 1.00 0.00 C ATOM 1219 C ASN A 81 4.009 -21.254 0.908 1.00 0.00 C ATOM 1220 O ASN A 81 3.966 -21.763 2.027 1.00 0.00 O ATOM 1221 CB ASN A 81 5.295 -22.489 -0.809 1.00 0.00 C ATOM 1222 CG ASN A 81 5.411 -23.990 -1.078 1.00 0.00 C ATOM 1223 OD1 ASN A 81 5.396 -24.812 -0.177 1.00 0.00 O ATOM 1224 ND2 ASN A 81 5.526 -24.301 -2.366 1.00 0.00 N ATOM 0 H ASN A 81 3.589 -21.434 -2.303 1.00 0.00 H new ATOM 0 HA ASN A 81 3.324 -23.032 -0.137 1.00 0.00 H new ATOM 0 HB2 ASN A 81 5.540 -21.934 -1.715 1.00 0.00 H new ATOM 0 HB3 ASN A 81 6.019 -22.195 -0.049 1.00 0.00 H new ATOM 0 HD21 ASN A 81 5.608 -25.277 -2.650 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.532 -23.563 -3.070 1.00 0.00 H new ATOM 1231 N ALA A 82 4.162 -19.958 0.680 1.00 0.00 N ATOM 1232 CA ALA A 82 4.293 -19.014 1.777 1.00 0.00 C ATOM 1233 C ALA A 82 3.062 -19.115 2.680 1.00 0.00 C ATOM 1234 O ALA A 82 3.159 -19.571 3.819 1.00 0.00 O ATOM 1235 CB ALA A 82 4.492 -17.604 1.217 1.00 0.00 C ATOM 0 H ALA A 82 4.198 -19.539 -0.249 1.00 0.00 H new ATOM 0 HA ALA A 82 5.167 -19.249 2.384 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.590 -16.896 2.040 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.395 -17.579 0.607 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.633 -17.331 0.604 1.00 0.00 H new ATOM 1241 N ALA A 83 1.933 -18.681 2.139 1.00 0.00 N ATOM 1242 CA ALA A 83 0.685 -18.717 2.882 1.00 0.00 C ATOM 1243 C ALA A 83 0.578 -20.049 3.627 1.00 0.00 C ATOM 1244 O ALA A 83 -0.035 -20.121 4.691 1.00 0.00 O ATOM 1245 CB ALA A 83 -0.486 -18.488 1.925 1.00 0.00 C ATOM 0 H ALA A 83 1.857 -18.303 1.195 1.00 0.00 H new ATOM 0 HA ALA A 83 0.658 -17.921 3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.422 -18.515 2.483 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.378 -17.516 1.444 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.493 -19.270 1.165 1.00 0.00 H new ATOM 1251 N ASP A 84 1.183 -21.070 3.039 1.00 0.00 N ATOM 1252 CA ASP A 84 1.164 -22.395 3.633 1.00 0.00 C ATOM 1253 C ASP A 84 1.700 -22.316 5.064 1.00 0.00 C ATOM 1254 O ASP A 84 0.982 -22.615 6.017 1.00 0.00 O ATOM 1255 CB ASP A 84 2.051 -23.364 2.849 1.00 0.00 C ATOM 1256 CG ASP A 84 1.543 -24.806 2.794 1.00 0.00 C ATOM 1257 OD1 ASP A 84 0.332 -24.972 2.532 1.00 0.00 O ATOM 1258 OD2 ASP A 84 2.377 -25.711 3.016 1.00 0.00 O ATOM 0 H ASP A 84 1.690 -21.006 2.156 1.00 0.00 H new ATOM 0 HA ASP A 84 0.135 -22.756 3.618 1.00 0.00 H new ATOM 0 HB2 ASP A 84 2.156 -22.993 1.830 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.046 -23.362 3.293 1.00 0.00 H new ATOM 1263 N GLY A 85 2.957 -21.912 5.169 1.00 0.00 N ATOM 1264 CA GLY A 85 3.597 -21.789 6.468 1.00 0.00 C ATOM 1265 C GLY A 85 5.118 -21.700 6.323 1.00 0.00 C ATOM 1266 O GLY A 85 5.845 -22.544 6.845 1.00 0.00 O ATOM 0 H GLY A 85 3.550 -21.666 4.376 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.224 -20.901 6.979 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.337 -22.647 7.088 1.00 0.00 H new ATOM 1270 N ILE A 86 5.554 -20.671 5.611 1.00 0.00 N ATOM 1271 CA ILE A 86 6.974 -20.462 5.391 1.00 0.00 C ATOM 1272 C ILE A 86 7.605 -19.894 6.664 1.00 0.00 C ATOM 1273 O ILE A 86 8.246 -20.622 7.421 1.00 0.00 O ATOM 1274 CB ILE A 86 7.202 -19.593 4.152 1.00 0.00 C ATOM 1275 CG1 ILE A 86 7.206 -20.443 2.880 1.00 0.00 C ATOM 1276 CG2 ILE A 86 8.481 -18.764 4.291 1.00 0.00 C ATOM 1277 CD1 ILE A 86 8.479 -21.287 2.788 1.00 0.00 C ATOM 0 H ILE A 86 4.948 -19.973 5.179 1.00 0.00 H new ATOM 0 HA ILE A 86 7.471 -21.410 5.184 1.00 0.00 H new ATOM 0 HB ILE A 86 6.371 -18.892 4.069 1.00 0.00 H new ATOM 0 HG12 ILE A 86 6.332 -21.094 2.871 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.130 -19.796 2.006 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.619 -18.156 3.397 1.00 0.00 H new ATOM 0 HG22 ILE A 86 8.401 -18.115 5.163 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.335 -19.430 4.412 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.456 -21.882 1.875 1.00 0.00 H new ATOM 0 HD12 ILE A 86 9.350 -20.632 2.773 1.00 0.00 H new ATOM 0 HD13 ILE A 86 8.539 -21.950 3.651 1.00 0.00 H new ATOM 1289 N ALA A 87 7.402 -18.600 6.861 1.00 0.00 N ATOM 1290 CA ALA A 87 7.942 -17.926 8.029 1.00 0.00 C ATOM 1291 C ALA A 87 6.870 -17.015 8.629 1.00 0.00 C ATOM 1292 O ALA A 87 5.687 -17.354 8.622 1.00 0.00 O ATOM 1293 CB ALA A 87 9.206 -17.159 7.637 1.00 0.00 C ATOM 0 H ALA A 87 6.870 -18.000 6.231 1.00 0.00 H new ATOM 0 HA ALA A 87 8.224 -18.650 8.793 1.00 0.00 H new ATOM 0 HB1 ALA A 87 9.611 -16.653 8.513 1.00 0.00 H new ATOM 0 HB2 ALA A 87 9.947 -17.855 7.245 1.00 0.00 H new ATOM 0 HB3 ALA A 87 8.962 -16.421 6.873 1.00 0.00 H new ATOM 1299 N GLU A 88 7.321 -15.877 9.135 1.00 0.00 N ATOM 1300 CA GLU A 88 6.414 -14.915 9.738 1.00 0.00 C ATOM 1301 C GLU A 88 5.971 -13.881 8.701 1.00 0.00 C ATOM 1302 O GLU A 88 5.292 -12.911 9.036 1.00 0.00 O ATOM 1303 CB GLU A 88 7.060 -14.236 10.947 1.00 0.00 C ATOM 1304 CG GLU A 88 6.138 -14.293 12.166 1.00 0.00 C ATOM 1305 CD GLU A 88 6.408 -13.122 13.113 1.00 0.00 C ATOM 1306 OE1 GLU A 88 5.800 -12.054 12.883 1.00 0.00 O ATOM 1307 OE2 GLU A 88 7.216 -13.321 14.046 1.00 0.00 O ATOM 0 H GLU A 88 8.302 -15.599 9.140 1.00 0.00 H new ATOM 0 HA GLU A 88 5.531 -15.449 10.091 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.007 -14.724 11.180 1.00 0.00 H new ATOM 0 HB3 GLU A 88 7.287 -13.197 10.707 1.00 0.00 H new ATOM 0 HG2 GLU A 88 5.098 -14.270 11.841 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.286 -15.235 12.695 1.00 0.00 H new ATOM 1314 N ASN A 89 6.372 -14.123 7.461 1.00 0.00 N ATOM 1315 CA ASN A 89 6.024 -13.225 6.373 1.00 0.00 C ATOM 1316 C ASN A 89 5.553 -14.046 5.171 1.00 0.00 C ATOM 1317 O ASN A 89 6.362 -14.666 4.482 1.00 0.00 O ATOM 1318 CB ASN A 89 7.234 -12.397 5.935 1.00 0.00 C ATOM 1319 CG ASN A 89 7.527 -11.281 6.939 1.00 0.00 C ATOM 1320 OD1 ASN A 89 8.104 -11.496 7.993 1.00 0.00 O ATOM 1321 ND2 ASN A 89 7.100 -10.082 6.556 1.00 0.00 N ATOM 0 H ASN A 89 6.935 -14.928 7.186 1.00 0.00 H new ATOM 0 HA ASN A 89 5.238 -12.557 6.725 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.106 -13.044 5.840 1.00 0.00 H new ATOM 0 HB3 ASN A 89 7.048 -11.966 4.951 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.248 -9.272 7.157 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.624 -9.972 5.661 1.00 0.00 H new ATOM 1328 N PRO A 90 4.211 -14.024 4.950 1.00 0.00 N ATOM 1329 CA PRO A 90 3.622 -14.758 3.844 1.00 0.00 C ATOM 1330 C PRO A 90 3.888 -14.051 2.513 1.00 0.00 C ATOM 1331 O PRO A 90 3.912 -14.689 1.461 1.00 0.00 O ATOM 1332 CB PRO A 90 2.143 -14.856 4.179 1.00 0.00 C ATOM 1333 CG PRO A 90 1.879 -13.779 5.219 1.00 0.00 C ATOM 1334 CD PRO A 90 3.223 -13.301 5.745 1.00 0.00 C ATOM 0 HA PRO A 90 4.055 -15.751 3.720 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.530 -14.700 3.291 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.895 -15.844 4.568 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.325 -12.950 4.778 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.269 -14.174 6.032 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.333 -12.223 5.628 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.333 -13.519 6.807 1.00 0.00 H new ATOM 1342 N PHE A 91 4.082 -12.744 2.603 1.00 0.00 N ATOM 1343 CA PHE A 91 4.345 -11.943 1.419 1.00 0.00 C ATOM 1344 C PHE A 91 5.837 -11.937 1.082 1.00 0.00 C ATOM 1345 O PHE A 91 6.672 -11.674 1.947 1.00 0.00 O ATOM 1346 CB PHE A 91 3.900 -10.514 1.737 1.00 0.00 C ATOM 1347 CG PHE A 91 3.326 -9.760 0.537 1.00 0.00 C ATOM 1348 CD1 PHE A 91 4.151 -9.049 -0.278 1.00 0.00 C ATOM 1349 CD2 PHE A 91 1.990 -9.799 0.284 1.00 0.00 C ATOM 1350 CE1 PHE A 91 3.618 -8.349 -1.393 1.00 0.00 C ATOM 1351 CE2 PHE A 91 1.457 -9.098 -0.830 1.00 0.00 C ATOM 1352 CZ PHE A 91 2.282 -8.388 -1.645 1.00 0.00 C ATOM 0 H PHE A 91 4.062 -12.219 3.477 1.00 0.00 H new ATOM 0 HA PHE A 91 3.808 -12.355 0.564 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.149 -10.545 2.526 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.752 -9.958 2.129 1.00 0.00 H new ATOM 0 HD1 PHE A 91 5.212 -9.017 -0.077 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.334 -10.363 0.931 1.00 0.00 H new ATOM 0 HE1 PHE A 91 4.274 -7.786 -2.041 1.00 0.00 H new ATOM 0 HE2 PHE A 91 0.396 -9.129 -1.030 1.00 0.00 H new ATOM 0 HZ PHE A 91 1.876 -7.855 -2.492 1.00 0.00 H new ATOM 1362 N LEU A 92 6.128 -12.231 -0.177 1.00 0.00 N ATOM 1363 CA LEU A 92 7.506 -12.263 -0.639 1.00 0.00 C ATOM 1364 C LEU A 92 7.782 -11.022 -1.490 1.00 0.00 C ATOM 1365 O LEU A 92 7.218 -10.868 -2.572 1.00 0.00 O ATOM 1366 CB LEU A 92 7.799 -13.580 -1.360 1.00 0.00 C ATOM 1367 CG LEU A 92 7.598 -14.854 -0.536 1.00 0.00 C ATOM 1368 CD1 LEU A 92 6.197 -14.894 0.079 1.00 0.00 C ATOM 1369 CD2 LEU A 92 7.891 -16.100 -1.374 1.00 0.00 C ATOM 0 H LEU A 92 5.433 -12.449 -0.891 1.00 0.00 H new ATOM 0 HA LEU A 92 8.193 -12.230 0.207 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.162 -13.638 -2.243 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.830 -13.557 -1.712 1.00 0.00 H new ATOM 0 HG LEU A 92 8.311 -14.844 0.288 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.080 -15.809 0.659 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.061 -14.031 0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.450 -14.870 -0.715 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.741 -16.992 -0.765 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.218 -16.128 -2.231 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.923 -16.069 -1.724 1.00 0.00 H new ATOM 1381 N ASP A 93 8.651 -10.167 -0.968 1.00 0.00 N ATOM 1382 CA ASP A 93 9.009 -8.945 -1.666 1.00 0.00 C ATOM 1383 C ASP A 93 9.894 -9.288 -2.866 1.00 0.00 C ATOM 1384 O ASP A 93 11.056 -8.889 -2.919 1.00 0.00 O ATOM 1385 CB ASP A 93 9.794 -8.000 -0.754 1.00 0.00 C ATOM 1386 CG ASP A 93 10.458 -6.818 -1.465 1.00 0.00 C ATOM 1387 OD1 ASP A 93 9.761 -6.188 -2.290 1.00 0.00 O ATOM 1388 OD2 ASP A 93 11.647 -6.572 -1.167 1.00 0.00 O ATOM 0 H ASP A 93 9.117 -10.297 -0.070 1.00 0.00 H new ATOM 0 HA ASP A 93 8.088 -8.457 -1.985 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.120 -7.613 0.010 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.564 -8.574 -0.238 1.00 0.00 H new ATOM 1393 N SER A 94 9.311 -10.025 -3.800 1.00 0.00 N ATOM 1394 CA SER A 94 10.032 -10.427 -4.995 1.00 0.00 C ATOM 1395 C SER A 94 9.127 -10.294 -6.222 1.00 0.00 C ATOM 1396 O SER A 94 7.913 -10.463 -6.123 1.00 0.00 O ATOM 1397 CB SER A 94 10.550 -11.861 -4.870 1.00 0.00 C ATOM 1398 OG SER A 94 11.878 -11.995 -5.369 1.00 0.00 O ATOM 0 H SER A 94 8.347 -10.354 -3.753 1.00 0.00 H new ATOM 0 HA SER A 94 10.892 -9.768 -5.113 1.00 0.00 H new ATOM 0 HB2 SER A 94 10.523 -12.166 -3.824 1.00 0.00 H new ATOM 0 HB3 SER A 94 9.888 -12.534 -5.415 1.00 0.00 H new ATOM 0 HG SER A 94 12.173 -12.924 -5.270 1.00 0.00 H new ATOM 1404 N PRO A 95 9.770 -9.985 -7.380 1.00 0.00 N ATOM 1405 CA PRO A 95 9.036 -9.828 -8.624 1.00 0.00 C ATOM 1406 C PRO A 95 8.608 -11.186 -9.184 1.00 0.00 C ATOM 1407 O PRO A 95 7.822 -11.253 -10.127 1.00 0.00 O ATOM 1408 CB PRO A 95 9.982 -9.076 -9.546 1.00 0.00 C ATOM 1409 CG PRO A 95 11.370 -9.249 -8.950 1.00 0.00 C ATOM 1410 CD PRO A 95 11.206 -9.777 -7.534 1.00 0.00 C ATOM 0 HA PRO A 95 8.104 -9.277 -8.496 1.00 0.00 H new ATOM 0 HB2 PRO A 95 9.939 -9.475 -10.559 1.00 0.00 H new ATOM 0 HB3 PRO A 95 9.712 -8.022 -9.607 1.00 0.00 H new ATOM 0 HG2 PRO A 95 11.960 -9.942 -9.550 1.00 0.00 H new ATOM 0 HG3 PRO A 95 11.904 -8.299 -8.944 1.00 0.00 H new ATOM 0 HD2 PRO A 95 11.758 -10.706 -7.391 1.00 0.00 H new ATOM 0 HD3 PRO A 95 11.584 -9.066 -6.800 1.00 0.00 H new ATOM 1418 N ASP A 96 9.145 -12.235 -8.578 1.00 0.00 N ATOM 1419 CA ASP A 96 8.829 -13.588 -9.005 1.00 0.00 C ATOM 1420 C ASP A 96 7.452 -13.979 -8.464 1.00 0.00 C ATOM 1421 O ASP A 96 6.732 -14.752 -9.094 1.00 0.00 O ATOM 1422 CB ASP A 96 9.852 -14.589 -8.463 1.00 0.00 C ATOM 1423 CG ASP A 96 10.940 -15.002 -9.456 1.00 0.00 C ATOM 1424 OD1 ASP A 96 10.642 -14.974 -10.670 1.00 0.00 O ATOM 1425 OD2 ASP A 96 12.046 -15.336 -8.979 1.00 0.00 O ATOM 0 H ASP A 96 9.796 -12.176 -7.795 1.00 0.00 H new ATOM 0 HA ASP A 96 8.844 -13.611 -10.095 1.00 0.00 H new ATOM 0 HB2 ASP A 96 10.329 -14.158 -7.583 1.00 0.00 H new ATOM 0 HB3 ASP A 96 9.323 -15.483 -8.133 1.00 0.00 H new ATOM 1430 N ALA A 97 7.129 -13.428 -7.304 1.00 0.00 N ATOM 1431 CA ALA A 97 5.851 -13.711 -6.672 1.00 0.00 C ATOM 1432 C ALA A 97 4.740 -12.981 -7.429 1.00 0.00 C ATOM 1433 O ALA A 97 4.873 -11.800 -7.748 1.00 0.00 O ATOM 1434 CB ALA A 97 5.912 -13.309 -5.196 1.00 0.00 C ATOM 0 H ALA A 97 7.729 -12.787 -6.785 1.00 0.00 H new ATOM 0 HA ALA A 97 5.631 -14.778 -6.711 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.954 -13.521 -4.721 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.698 -13.876 -4.697 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.128 -12.243 -5.118 1.00 0.00 H new ATOM 1440 N PHE A 98 3.670 -13.714 -7.696 1.00 0.00 N ATOM 1441 CA PHE A 98 2.536 -13.152 -8.410 1.00 0.00 C ATOM 1442 C PHE A 98 1.263 -13.229 -7.566 1.00 0.00 C ATOM 1443 O PHE A 98 0.873 -14.308 -7.121 1.00 0.00 O ATOM 1444 CB PHE A 98 2.346 -13.989 -9.677 1.00 0.00 C ATOM 1445 CG PHE A 98 3.636 -14.231 -10.463 1.00 0.00 C ATOM 1446 CD1 PHE A 98 4.638 -13.312 -10.425 1.00 0.00 C ATOM 1447 CD2 PHE A 98 3.781 -15.365 -11.199 1.00 0.00 C ATOM 1448 CE1 PHE A 98 5.835 -13.537 -11.155 1.00 0.00 C ATOM 1449 CE2 PHE A 98 4.978 -15.590 -11.929 1.00 0.00 C ATOM 1450 CZ PHE A 98 5.980 -14.671 -11.891 1.00 0.00 C ATOM 0 H PHE A 98 3.564 -14.693 -7.431 1.00 0.00 H new ATOM 0 HA PHE A 98 2.724 -12.103 -8.640 1.00 0.00 H new ATOM 0 HB2 PHE A 98 1.914 -14.951 -9.403 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.626 -13.490 -10.325 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.523 -12.412 -9.840 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.985 -16.095 -11.228 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.631 -12.807 -11.126 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.093 -16.490 -12.514 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.891 -14.842 -12.445 1.00 0.00 H new ATOM 1460 N TYR A 99 0.650 -12.071 -7.370 1.00 0.00 N ATOM 1461 CA TYR A 99 -0.572 -11.994 -6.587 1.00 0.00 C ATOM 1462 C TYR A 99 -1.680 -11.286 -7.368 1.00 0.00 C ATOM 1463 O TYR A 99 -1.411 -10.367 -8.140 1.00 0.00 O ATOM 1464 CB TYR A 99 -0.227 -11.164 -5.349 1.00 0.00 C ATOM 1465 CG TYR A 99 0.569 -11.929 -4.289 1.00 0.00 C ATOM 1466 CD1 TYR A 99 0.118 -13.152 -3.837 1.00 0.00 C ATOM 1467 CD2 TYR A 99 1.737 -11.395 -3.785 1.00 0.00 C ATOM 1468 CE1 TYR A 99 0.867 -13.872 -2.839 1.00 0.00 C ATOM 1469 CE2 TYR A 99 2.486 -12.115 -2.788 1.00 0.00 C ATOM 1470 CZ TYR A 99 2.014 -13.318 -2.364 1.00 0.00 C ATOM 1471 OH TYR A 99 2.721 -13.997 -1.422 1.00 0.00 O ATOM 0 H TYR A 99 0.977 -11.178 -7.740 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.930 -12.992 -6.335 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.346 -10.290 -5.658 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -1.151 -10.798 -4.901 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.797 -13.570 -4.231 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.089 -10.437 -4.138 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.525 -14.830 -2.476 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.402 -11.709 -2.386 1.00 0.00 H new ATOM 0 HH TYR A 99 3.620 -13.614 -1.349 1.00 0.00 H new ATOM 1481 N TYR A 100 -2.904 -11.741 -7.141 1.00 0.00 N ATOM 1482 CA TYR A 100 -4.055 -11.162 -7.814 1.00 0.00 C ATOM 1483 C TYR A 100 -5.243 -11.038 -6.858 1.00 0.00 C ATOM 1484 O TYR A 100 -5.410 -11.861 -5.960 1.00 0.00 O ATOM 1485 CB TYR A 100 -4.418 -12.134 -8.938 1.00 0.00 C ATOM 1486 CG TYR A 100 -5.165 -13.382 -8.464 1.00 0.00 C ATOM 1487 CD1 TYR A 100 -4.459 -14.489 -8.038 1.00 0.00 C ATOM 1488 CD2 TYR A 100 -6.545 -13.402 -8.463 1.00 0.00 C ATOM 1489 CE1 TYR A 100 -5.162 -15.664 -7.592 1.00 0.00 C ATOM 1490 CE2 TYR A 100 -7.248 -14.576 -8.017 1.00 0.00 C ATOM 1491 CZ TYR A 100 -6.522 -15.650 -7.603 1.00 0.00 C ATOM 1492 OH TYR A 100 -7.186 -16.759 -7.182 1.00 0.00 O ATOM 0 H TYR A 100 -3.124 -12.504 -6.501 1.00 0.00 H new ATOM 0 HA TYR A 100 -3.822 -10.163 -8.184 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -5.032 -11.612 -9.672 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.505 -12.441 -9.448 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -3.379 -14.474 -8.039 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -7.098 -12.536 -8.797 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -4.621 -16.537 -7.256 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -8.328 -14.604 -8.011 1.00 0.00 H new ATOM 0 HH TYR A 100 -8.152 -16.605 -7.244 1.00 0.00 H new ATOM 1502 N PHE A 101 -6.039 -10.003 -7.086 1.00 0.00 N ATOM 1503 CA PHE A 101 -7.207 -9.761 -6.257 1.00 0.00 C ATOM 1504 C PHE A 101 -8.270 -10.839 -6.479 1.00 0.00 C ATOM 1505 O PHE A 101 -8.539 -11.226 -7.615 1.00 0.00 O ATOM 1506 CB PHE A 101 -7.778 -8.404 -6.674 1.00 0.00 C ATOM 1507 CG PHE A 101 -6.748 -7.273 -6.688 1.00 0.00 C ATOM 1508 CD1 PHE A 101 -5.824 -7.182 -5.694 1.00 0.00 C ATOM 1509 CD2 PHE A 101 -6.755 -6.359 -7.695 1.00 0.00 C ATOM 1510 CE1 PHE A 101 -4.868 -6.132 -5.708 1.00 0.00 C ATOM 1511 CE2 PHE A 101 -5.799 -5.310 -7.709 1.00 0.00 C ATOM 1512 CZ PHE A 101 -4.875 -5.218 -6.715 1.00 0.00 C ATOM 0 H PHE A 101 -5.898 -9.323 -7.833 1.00 0.00 H new ATOM 0 HA PHE A 101 -6.926 -9.778 -5.204 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.215 -8.495 -7.668 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.586 -8.137 -5.993 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -5.817 -7.908 -4.894 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.488 -6.431 -8.484 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -4.135 -6.059 -4.918 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.805 -4.585 -8.509 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.148 -4.420 -6.725 1.00 0.00 H new ATOM 1522 N PRO A 102 -8.862 -11.304 -5.347 1.00 0.00 N ATOM 1523 CA PRO A 102 -9.890 -12.330 -5.407 1.00 0.00 C ATOM 1524 C PRO A 102 -11.216 -11.749 -5.902 1.00 0.00 C ATOM 1525 O PRO A 102 -12.149 -11.569 -5.121 1.00 0.00 O ATOM 1526 CB PRO A 102 -9.975 -12.885 -3.994 1.00 0.00 C ATOM 1527 CG PRO A 102 -9.330 -11.841 -3.097 1.00 0.00 C ATOM 1528 CD PRO A 102 -8.569 -10.869 -3.984 1.00 0.00 C ATOM 0 HA PRO A 102 -9.653 -13.122 -6.118 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -11.011 -13.062 -3.705 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -9.456 -13.840 -3.918 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.088 -11.315 -2.517 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -8.656 -12.315 -2.384 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -8.895 -9.842 -3.817 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -7.499 -10.901 -3.780 1.00 0.00 H new ATOM 1536 N ASP A 103 -11.256 -11.470 -7.196 1.00 0.00 N ATOM 1537 CA ASP A 103 -12.452 -10.913 -7.805 1.00 0.00 C ATOM 1538 C ASP A 103 -12.205 -10.696 -9.299 1.00 0.00 C ATOM 1539 O ASP A 103 -13.099 -10.908 -10.117 1.00 0.00 O ATOM 1540 CB ASP A 103 -12.808 -9.561 -7.183 1.00 0.00 C ATOM 1541 CG ASP A 103 -14.255 -9.112 -7.397 1.00 0.00 C ATOM 1542 OD1 ASP A 103 -14.983 -9.854 -8.090 1.00 0.00 O ATOM 1543 OD2 ASP A 103 -14.599 -8.036 -6.862 1.00 0.00 O ATOM 0 H ASP A 103 -10.479 -11.619 -7.840 1.00 0.00 H new ATOM 0 HA ASP A 103 -13.271 -11.613 -7.640 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -12.613 -9.608 -6.112 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -12.143 -8.802 -7.595 1.00 0.00 H new ATOM 1548 N SER A 104 -10.988 -10.276 -9.610 1.00 0.00 N ATOM 1549 CA SER A 104 -10.612 -10.028 -10.992 1.00 0.00 C ATOM 1550 C SER A 104 -9.706 -11.152 -11.498 1.00 0.00 C ATOM 1551 O SER A 104 -10.116 -11.954 -12.335 1.00 0.00 O ATOM 1552 CB SER A 104 -9.912 -8.675 -11.138 1.00 0.00 C ATOM 1553 OG SER A 104 -10.778 -7.681 -11.677 1.00 0.00 O ATOM 0 H SER A 104 -10.249 -10.101 -8.929 1.00 0.00 H new ATOM 0 HA SER A 104 -11.520 -10.004 -11.594 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.548 -8.349 -10.164 1.00 0.00 H new ATOM 0 HB3 SER A 104 -9.041 -8.785 -11.784 1.00 0.00 H new ATOM 0 HG SER A 104 -10.294 -6.832 -11.753 1.00 0.00 H new ATOM 1559 N GLY A 105 -8.492 -11.174 -10.968 1.00 0.00 N ATOM 1560 CA GLY A 105 -7.525 -12.187 -11.355 1.00 0.00 C ATOM 1561 C GLY A 105 -7.558 -12.428 -12.866 1.00 0.00 C ATOM 1562 O GLY A 105 -8.097 -11.615 -13.615 1.00 0.00 O ATOM 0 H GLY A 105 -8.156 -10.507 -10.274 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.525 -11.874 -11.055 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.738 -13.118 -10.830 1.00 0.00 H new ATOM 1566 N PRO A 106 -6.960 -13.577 -13.278 1.00 0.00 N ATOM 1567 CA PRO A 106 -6.916 -13.935 -14.685 1.00 0.00 C ATOM 1568 C PRO A 106 -8.280 -14.431 -15.168 1.00 0.00 C ATOM 1569 O PRO A 106 -8.956 -15.180 -14.464 1.00 0.00 O ATOM 1570 CB PRO A 106 -5.828 -14.992 -14.789 1.00 0.00 C ATOM 1571 CG PRO A 106 -5.627 -15.522 -13.378 1.00 0.00 C ATOM 1572 CD PRO A 106 -6.312 -14.563 -12.418 1.00 0.00 C ATOM 0 HA PRO A 106 -6.689 -13.085 -15.328 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.124 -15.792 -15.468 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -4.905 -14.565 -15.181 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -6.048 -16.523 -13.283 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -4.565 -15.599 -13.147 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -7.039 -15.081 -11.792 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -5.593 -14.092 -11.748 1.00 0.00 H new ATOM 1580 N SER A 107 -8.644 -13.994 -16.365 1.00 0.00 N ATOM 1581 CA SER A 107 -9.915 -14.385 -16.949 1.00 0.00 C ATOM 1582 C SER A 107 -9.779 -15.745 -17.637 1.00 0.00 C ATOM 1583 O SER A 107 -10.439 -16.708 -17.251 1.00 0.00 O ATOM 1584 CB SER A 107 -10.410 -13.334 -17.945 1.00 0.00 C ATOM 1585 OG SER A 107 -11.809 -13.097 -17.821 1.00 0.00 O ATOM 0 H SER A 107 -8.081 -13.373 -16.946 1.00 0.00 H new ATOM 0 HA SER A 107 -10.650 -14.462 -16.148 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.869 -12.401 -17.786 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.187 -13.663 -18.960 1.00 0.00 H new ATOM 0 HG SER A 107 -12.085 -12.419 -18.473 1.00 0.00 H new ATOM 1591 N SER A 108 -8.919 -15.780 -18.644 1.00 0.00 N ATOM 1592 CA SER A 108 -8.688 -17.005 -19.389 1.00 0.00 C ATOM 1593 C SER A 108 -8.637 -18.198 -18.432 1.00 0.00 C ATOM 1594 O SER A 108 -9.406 -19.147 -18.575 1.00 0.00 O ATOM 1595 CB SER A 108 -7.394 -16.921 -20.201 1.00 0.00 C ATOM 1596 OG SER A 108 -7.532 -16.071 -21.337 1.00 0.00 O ATOM 0 H SER A 108 -8.373 -14.979 -18.961 1.00 0.00 H new ATOM 0 HA SER A 108 -9.514 -17.141 -20.086 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.590 -16.549 -19.565 1.00 0.00 H new ATOM 0 HB3 SER A 108 -7.106 -17.920 -20.528 1.00 0.00 H new ATOM 0 HG SER A 108 -6.685 -16.042 -21.829 1.00 0.00 H new ATOM 1602 N GLY A 109 -7.723 -18.110 -17.476 1.00 0.00 N ATOM 1603 CA GLY A 109 -7.562 -19.169 -16.495 1.00 0.00 C ATOM 1604 C GLY A 109 -6.195 -19.843 -16.636 1.00 0.00 C ATOM 1605 O GLY A 109 -5.300 -19.615 -15.823 1.00 0.00 O ATOM 0 H GLY A 109 -7.087 -17.321 -17.360 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -7.667 -18.759 -15.491 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.352 -19.910 -16.621 1.00 0.00 H new TER 1609 GLY A 109