USER MOD reduce.3.24.130724 H: found=0, std=0, add=1003, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1001 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 53 TYR OH : rot 180:sc= 0.0698 USER MOD Set 1.2: A 58 LYS NZ :NH3+ 171:sc= 0.0486 (180deg=-0.0302) USER MOD Single : A 1 GLY N :NH3+ -105:sc= 0.145 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -41:sc= 0.225 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -143:sc= 1.3 USER MOD Single : A 8 SER OG : rot 180:sc= 0.117 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 1.15 K(o=1.1,f=-0.082) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 83:sc= 0.0572 USER MOD Single : A 15 LYS NZ :NH3+ 173:sc=-0.00799 (180deg=-0.0897) USER MOD Single : A 18 THR OG1 : rot 98:sc= 1.28 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 23 GLN : amide:sc= 0.278 K(o=0.28,f=-5.7!) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00996 USER MOD Single : A 35 GLN : amide:sc= -0.0835 K(o=-0.083,f=-0.7) USER MOD Single : A 38 SER OG : rot -81:sc= 1.25 USER MOD Single : A 40 ASN : amide:sc= 0.145 K(o=0.14,f=-5!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 171:sc= 0.668 (180deg=0.495) USER MOD Single : A 47 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00732) USER MOD Single : A 50 SER OG : rot 38:sc= 0.0168 USER MOD Single : A 51 THR OG1 : rot -1:sc= 0.898 USER MOD Single : A 54 ASN : amide:sc= -0.0578 X(o=-0.058,f=-0.058) USER MOD Single : A 63 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.022) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0.0836 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 THR OG1 : rot -72:sc= 1.33 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -130:sc= 0.123 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= -0.31 X(o=-0.31,f=-0.31) USER MOD Single : A 87 SER OG : rot 180:sc= 0.0223 USER MOD Single : A 97 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 100 LYS NZ :NH3+ -160:sc= 0.724 (180deg=0.511) USER MOD Single : A 101 SER OG : rot 180:sc= -0.0994 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -0.179 K(o=-0.18,f=-0.78) USER MOD Single : A 118 SER OG : rot 138:sc= 1.32 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 THR OG1 : rot -42:sc= 0.6 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot -89:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.986 4.039 -19.456 1.00 0.00 N ATOM 2 CA GLY A 1 -5.380 4.231 -19.859 1.00 0.00 C ATOM 3 C GLY A 1 -6.239 4.531 -18.653 1.00 0.00 C ATOM 4 O GLY A 1 -5.819 4.298 -17.519 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.430 4.878 -19.718 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.938 3.900 -18.426 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.598 3.203 -19.937 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.449 5.050 -20.575 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.747 3.336 -20.361 1.00 0.00 H new ATOM 8 N SER A 2 -7.431 5.079 -18.876 1.00 0.00 N ATOM 9 CA SER A 2 -8.340 5.431 -17.796 1.00 0.00 C ATOM 10 C SER A 2 -8.975 4.157 -17.239 1.00 0.00 C ATOM 11 O SER A 2 -9.550 3.378 -18.007 1.00 0.00 O ATOM 12 CB SER A 2 -9.408 6.389 -18.321 1.00 0.00 C ATOM 13 OG SER A 2 -8.807 7.551 -18.871 1.00 0.00 O ATOM 0 H SER A 2 -7.790 5.290 -19.807 1.00 0.00 H new ATOM 0 HA SER A 2 -7.796 5.929 -16.994 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.011 5.890 -19.080 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.082 6.670 -17.512 1.00 0.00 H new ATOM 0 HG SER A 2 -9.504 8.153 -19.204 1.00 0.00 H new ATOM 19 N SER A 3 -8.842 3.906 -15.939 1.00 0.00 N ATOM 20 CA SER A 3 -9.498 2.783 -15.282 1.00 0.00 C ATOM 21 C SER A 3 -9.720 2.999 -13.784 1.00 0.00 C ATOM 22 O SER A 3 -10.330 2.132 -13.164 1.00 0.00 O ATOM 23 CB SER A 3 -8.699 1.490 -15.525 1.00 0.00 C ATOM 24 OG SER A 3 -9.500 0.342 -15.285 1.00 0.00 O ATOM 0 H SER A 3 -8.275 4.477 -15.312 1.00 0.00 H new ATOM 0 HA SER A 3 -10.489 2.697 -15.728 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.332 1.473 -16.551 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.825 1.471 -14.873 1.00 0.00 H new ATOM 0 HG SER A 3 -10.045 0.485 -14.484 1.00 0.00 H new ATOM 30 N GLY A 4 -9.243 4.078 -13.162 1.00 0.00 N ATOM 31 CA GLY A 4 -9.351 4.202 -11.716 1.00 0.00 C ATOM 32 C GLY A 4 -8.700 5.480 -11.232 1.00 0.00 C ATOM 33 O GLY A 4 -8.173 6.264 -12.023 1.00 0.00 O ATOM 0 H GLY A 4 -8.788 4.862 -13.629 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.401 4.191 -11.424 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.878 3.345 -11.237 1.00 0.00 H new ATOM 37 N SER A 5 -8.759 5.720 -9.931 1.00 0.00 N ATOM 38 CA SER A 5 -8.470 7.019 -9.355 1.00 0.00 C ATOM 39 C SER A 5 -7.157 6.930 -8.580 1.00 0.00 C ATOM 40 O SER A 5 -7.104 7.142 -7.364 1.00 0.00 O ATOM 41 CB SER A 5 -9.698 7.470 -8.560 1.00 0.00 C ATOM 42 OG SER A 5 -10.894 7.272 -9.299 1.00 0.00 O ATOM 0 H SER A 5 -9.011 5.011 -9.242 1.00 0.00 H new ATOM 0 HA SER A 5 -8.303 7.798 -10.099 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.751 6.915 -7.623 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.599 8.524 -8.301 1.00 0.00 H new ATOM 0 HG SER A 5 -11.661 7.567 -8.765 1.00 0.00 H new ATOM 48 N SER A 6 -6.086 6.592 -9.304 1.00 0.00 N ATOM 49 CA SER A 6 -4.726 6.602 -8.798 1.00 0.00 C ATOM 50 C SER A 6 -4.254 8.040 -8.536 1.00 0.00 C ATOM 51 O SER A 6 -5.018 9.014 -8.616 1.00 0.00 O ATOM 52 CB SER A 6 -3.810 5.828 -9.766 1.00 0.00 C ATOM 53 OG SER A 6 -3.905 6.302 -11.097 1.00 0.00 O ATOM 0 H SER A 6 -6.151 6.299 -10.279 1.00 0.00 H new ATOM 0 HA SER A 6 -4.684 6.092 -7.836 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.777 5.910 -9.427 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.071 4.770 -9.741 1.00 0.00 H new ATOM 0 HG SER A 6 -3.844 5.547 -11.718 1.00 0.00 H new ATOM 59 N GLY A 7 -2.974 8.206 -8.232 1.00 0.00 N ATOM 60 CA GLY A 7 -2.291 9.480 -8.243 1.00 0.00 C ATOM 61 C GLY A 7 -0.792 9.221 -8.220 1.00 0.00 C ATOM 62 O GLY A 7 -0.354 8.071 -8.138 1.00 0.00 O ATOM 0 H GLY A 7 -2.369 7.430 -7.963 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.564 10.049 -9.132 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.586 10.076 -7.380 1.00 0.00 H new ATOM 66 N SER A 8 -0.009 10.294 -8.249 1.00 0.00 N ATOM 67 CA SER A 8 1.416 10.261 -7.962 1.00 0.00 C ATOM 68 C SER A 8 1.680 9.668 -6.567 1.00 0.00 C ATOM 69 O SER A 8 0.773 9.540 -5.743 1.00 0.00 O ATOM 70 CB SER A 8 1.987 11.689 -8.057 1.00 0.00 C ATOM 71 OG SER A 8 1.173 12.558 -8.830 1.00 0.00 O ATOM 0 H SER A 8 -0.355 11.226 -8.477 1.00 0.00 H new ATOM 0 HA SER A 8 1.911 9.623 -8.694 1.00 0.00 H new ATOM 0 HB2 SER A 8 2.096 12.099 -7.053 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.984 11.648 -8.495 1.00 0.00 H new ATOM 0 HG SER A 8 1.579 13.449 -8.856 1.00 0.00 H new ATOM 77 N ALA A 9 2.939 9.383 -6.256 1.00 0.00 N ATOM 78 CA ALA A 9 3.346 8.797 -4.988 1.00 0.00 C ATOM 79 C ALA A 9 2.883 9.578 -3.755 1.00 0.00 C ATOM 80 O ALA A 9 2.077 9.089 -2.955 1.00 0.00 O ATOM 81 CB ALA A 9 4.856 8.615 -5.000 1.00 0.00 C ATOM 0 H ALA A 9 3.718 9.556 -6.891 1.00 0.00 H new ATOM 0 HA ALA A 9 2.847 7.832 -4.898 1.00 0.00 H new ATOM 0 HB1 ALA A 9 5.177 8.176 -4.055 1.00 0.00 H new ATOM 0 HB2 ALA A 9 5.136 7.955 -5.821 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.338 9.584 -5.133 1.00 0.00 H new ATOM 87 N LYS A 10 3.375 10.806 -3.579 1.00 0.00 N ATOM 88 CA LYS A 10 2.899 11.668 -2.504 1.00 0.00 C ATOM 89 C LYS A 10 1.425 12.006 -2.694 1.00 0.00 C ATOM 90 O LYS A 10 0.756 12.307 -1.714 1.00 0.00 O ATOM 91 CB LYS A 10 3.704 12.965 -2.400 1.00 0.00 C ATOM 92 CG LYS A 10 5.134 12.747 -1.903 1.00 0.00 C ATOM 93 CD LYS A 10 5.672 13.974 -1.157 1.00 0.00 C ATOM 94 CE LYS A 10 5.049 14.206 0.232 1.00 0.00 C ATOM 95 NZ LYS A 10 5.722 15.308 0.959 1.00 0.00 N ATOM 0 H LYS A 10 4.099 11.221 -4.165 1.00 0.00 H new ATOM 0 HA LYS A 10 3.033 11.110 -1.577 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.735 13.445 -3.378 1.00 0.00 H new ATOM 0 HB3 LYS A 10 3.192 13.650 -1.725 1.00 0.00 H new ATOM 0 HG2 LYS A 10 5.161 11.880 -1.243 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.783 12.523 -2.750 1.00 0.00 H new ATOM 0 HD2 LYS A 10 6.751 13.869 -1.043 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.500 14.859 -1.770 1.00 0.00 H new ATOM 0 HE2 LYS A 10 3.990 14.437 0.121 1.00 0.00 H new ATOM 0 HE3 LYS A 10 5.116 13.289 0.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 5.275 15.434 1.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 6.728 15.076 1.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.636 16.188 0.412 1.00 0.00 H new ATOM 109 N ASN A 11 0.871 11.889 -3.903 1.00 0.00 N ATOM 110 CA ASN A 11 -0.562 12.057 -4.137 1.00 0.00 C ATOM 111 C ASN A 11 -1.403 10.989 -3.414 1.00 0.00 C ATOM 112 O ASN A 11 -2.608 11.196 -3.274 1.00 0.00 O ATOM 113 CB ASN A 11 -0.883 12.082 -5.633 1.00 0.00 C ATOM 114 CG ASN A 11 -2.070 12.957 -6.007 1.00 0.00 C ATOM 115 OD1 ASN A 11 -1.958 13.791 -6.898 1.00 0.00 O ATOM 116 ND2 ASN A 11 -3.221 12.761 -5.398 1.00 0.00 N ATOM 0 H ASN A 11 1.404 11.675 -4.746 1.00 0.00 H new ATOM 0 HA ASN A 11 -0.836 13.023 -3.713 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -0.004 12.432 -6.175 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -1.079 11.063 -5.967 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -4.039 13.308 -5.666 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -3.294 12.062 -4.659 1.00 0.00 H new ATOM 123 N ALA A 12 -0.813 9.943 -2.823 1.00 0.00 N ATOM 124 CA ALA A 12 -1.471 9.161 -1.777 1.00 0.00 C ATOM 125 C ALA A 12 -1.036 9.587 -0.370 1.00 0.00 C ATOM 126 O ALA A 12 -1.885 9.814 0.486 1.00 0.00 O ATOM 127 CB ALA A 12 -1.177 7.673 -2.009 1.00 0.00 C ATOM 0 H ALA A 12 0.126 9.619 -3.056 1.00 0.00 H new ATOM 0 HA ALA A 12 -2.544 9.343 -1.836 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -1.663 7.081 -1.234 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -1.558 7.375 -2.986 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -0.101 7.505 -1.972 1.00 0.00 H new ATOM 133 N TYR A 13 0.270 9.695 -0.104 1.00 0.00 N ATOM 134 CA TYR A 13 0.780 9.954 1.247 1.00 0.00 C ATOM 135 C TYR A 13 0.270 11.268 1.858 1.00 0.00 C ATOM 136 O TYR A 13 -0.108 11.289 3.031 1.00 0.00 O ATOM 137 CB TYR A 13 2.300 9.961 1.222 1.00 0.00 C ATOM 138 CG TYR A 13 2.935 10.212 2.574 1.00 0.00 C ATOM 139 CD1 TYR A 13 3.044 9.167 3.509 1.00 0.00 C ATOM 140 CD2 TYR A 13 3.452 11.482 2.878 1.00 0.00 C ATOM 141 CE1 TYR A 13 3.785 9.353 4.692 1.00 0.00 C ATOM 142 CE2 TYR A 13 4.186 11.676 4.057 1.00 0.00 C ATOM 143 CZ TYR A 13 4.364 10.613 4.968 1.00 0.00 C ATOM 144 OH TYR A 13 5.103 10.819 6.092 1.00 0.00 O ATOM 0 H TYR A 13 0.998 9.606 -0.813 1.00 0.00 H new ATOM 0 HA TYR A 13 0.404 9.151 1.881 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.652 9.003 0.839 1.00 0.00 H new ATOM 0 HB3 TYR A 13 2.639 10.727 0.525 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.559 8.221 3.320 1.00 0.00 H new ATOM 0 HD2 TYR A 13 3.284 12.309 2.204 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.911 8.535 5.386 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.617 12.643 4.269 1.00 0.00 H new ATOM 0 HH TYR A 13 5.420 11.746 6.110 1.00 0.00 H new ATOM 154 N THR A 14 0.242 12.361 1.097 1.00 0.00 N ATOM 155 CA THR A 14 -0.295 13.637 1.552 1.00 0.00 C ATOM 156 C THR A 14 -1.752 13.547 2.059 1.00 0.00 C ATOM 157 O THR A 14 -2.119 14.351 2.918 1.00 0.00 O ATOM 158 CB THR A 14 -0.096 14.683 0.440 1.00 0.00 C ATOM 159 OG1 THR A 14 1.290 14.744 0.135 1.00 0.00 O ATOM 160 CG2 THR A 14 -0.611 16.072 0.812 1.00 0.00 C ATOM 0 H THR A 14 0.595 12.383 0.140 1.00 0.00 H new ATOM 0 HA THR A 14 0.261 13.955 2.434 1.00 0.00 H new ATOM 0 HB THR A 14 -0.682 14.369 -0.424 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.520 14.023 -0.488 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.438 16.758 -0.017 1.00 0.00 H new ATOM 0 HG22 THR A 14 -1.679 16.020 1.023 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.084 16.431 1.696 1.00 0.00 H new ATOM 168 N LYS A 15 -2.556 12.574 1.608 1.00 0.00 N ATOM 169 CA LYS A 15 -3.952 12.351 1.999 1.00 0.00 C ATOM 170 C LYS A 15 -4.108 11.164 2.954 1.00 0.00 C ATOM 171 O LYS A 15 -5.220 10.883 3.406 1.00 0.00 O ATOM 172 CB LYS A 15 -4.845 12.124 0.763 1.00 0.00 C ATOM 173 CG LYS A 15 -4.895 13.263 -0.265 1.00 0.00 C ATOM 174 CD LYS A 15 -5.110 14.648 0.369 1.00 0.00 C ATOM 175 CE LYS A 15 -5.243 15.781 -0.653 1.00 0.00 C ATOM 176 NZ LYS A 15 -6.366 15.590 -1.594 1.00 0.00 N ATOM 0 H LYS A 15 -2.232 11.888 0.926 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.269 13.254 2.520 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.503 11.222 0.256 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -5.861 11.930 1.107 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -3.964 13.272 -0.832 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.699 13.067 -0.974 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -6.009 14.620 0.985 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.274 14.867 1.034 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -5.378 16.724 -0.124 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.314 15.862 -1.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.476 16.442 -2.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -6.171 14.771 -2.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -7.242 15.422 -1.059 1.00 0.00 H new ATOM 190 N LEU A 16 -3.034 10.427 3.254 1.00 0.00 N ATOM 191 CA LEU A 16 -3.051 9.231 4.043 1.00 0.00 C ATOM 192 C LEU A 16 -3.057 9.582 5.536 1.00 0.00 C ATOM 193 O LEU A 16 -3.464 8.763 6.350 1.00 0.00 O ATOM 194 CB LEU A 16 -1.770 8.488 3.629 1.00 0.00 C ATOM 195 CG LEU A 16 -1.532 7.233 4.435 1.00 0.00 C ATOM 196 CD1 LEU A 16 -2.664 6.203 4.375 1.00 0.00 C ATOM 197 CD2 LEU A 16 -0.231 6.589 3.959 1.00 0.00 C ATOM 0 H LEU A 16 -2.098 10.674 2.931 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.938 8.619 3.881 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.832 8.229 2.572 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.916 9.155 3.744 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.479 7.543 5.478 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.401 5.338 4.984 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.583 6.649 4.756 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -2.815 5.888 3.343 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.044 5.680 4.531 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.314 6.341 2.901 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.594 7.286 4.105 1.00 0.00 H new ATOM 209 N GLY A 17 -2.578 10.775 5.904 1.00 0.00 N ATOM 210 CA GLY A 17 -2.396 11.195 7.288 1.00 0.00 C ATOM 211 C GLY A 17 -3.115 12.495 7.616 1.00 0.00 C ATOM 212 O GLY A 17 -2.930 13.037 8.706 1.00 0.00 O ATOM 0 H GLY A 17 -2.301 11.488 5.229 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -2.758 10.409 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -1.331 11.315 7.488 1.00 0.00 H new ATOM 216 N THR A 18 -3.901 13.037 6.688 1.00 0.00 N ATOM 217 CA THR A 18 -4.839 14.121 6.957 1.00 0.00 C ATOM 218 C THR A 18 -6.035 13.604 7.749 1.00 0.00 C ATOM 219 O THR A 18 -6.790 14.390 8.317 1.00 0.00 O ATOM 220 CB THR A 18 -5.323 14.690 5.615 1.00 0.00 C ATOM 221 OG1 THR A 18 -5.636 13.645 4.710 1.00 0.00 O ATOM 222 CG2 THR A 18 -4.215 15.534 4.996 1.00 0.00 C ATOM 0 H THR A 18 -3.903 12.730 5.715 1.00 0.00 H new ATOM 0 HA THR A 18 -4.343 14.895 7.543 1.00 0.00 H new ATOM 0 HB THR A 18 -6.213 15.291 5.800 1.00 0.00 H new ATOM 0 HG1 THR A 18 -6.603 13.486 4.716 1.00 0.00 H new ATOM 0 HG21 THR A 18 -4.556 15.939 4.043 1.00 0.00 H new ATOM 0 HG22 THR A 18 -3.962 16.353 5.669 1.00 0.00 H new ATOM 0 HG23 THR A 18 -3.334 14.914 4.832 1.00 0.00 H new ATOM 230 N ASP A 19 -6.252 12.291 7.755 1.00 0.00 N ATOM 231 CA ASP A 19 -7.536 11.677 8.015 1.00 0.00 C ATOM 232 C ASP A 19 -7.263 10.412 8.775 1.00 0.00 C ATOM 233 O ASP A 19 -6.840 9.437 8.164 1.00 0.00 O ATOM 234 CB ASP A 19 -8.216 11.334 6.686 1.00 0.00 C ATOM 235 CG ASP A 19 -8.779 12.577 6.026 1.00 0.00 C ATOM 236 OD1 ASP A 19 -9.718 13.185 6.592 1.00 0.00 O ATOM 237 OD2 ASP A 19 -8.242 12.946 4.956 1.00 0.00 O ATOM 0 H ASP A 19 -5.513 11.612 7.573 1.00 0.00 H new ATOM 0 HA ASP A 19 -8.187 12.346 8.578 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -7.498 10.857 6.019 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -9.017 10.615 6.858 1.00 0.00 H new ATOM 242 N ASP A 20 -7.518 10.399 10.078 1.00 0.00 N ATOM 243 CA ASP A 20 -7.229 9.271 10.965 1.00 0.00 C ATOM 244 C ASP A 20 -7.991 7.999 10.570 1.00 0.00 C ATOM 245 O ASP A 20 -7.672 6.911 11.058 1.00 0.00 O ATOM 246 CB ASP A 20 -7.567 9.619 12.422 1.00 0.00 C ATOM 247 CG ASP A 20 -6.759 10.782 12.991 1.00 0.00 C ATOM 248 OD1 ASP A 20 -5.535 10.869 12.727 1.00 0.00 O ATOM 249 OD2 ASP A 20 -7.352 11.623 13.706 1.00 0.00 O ATOM 0 H ASP A 20 -7.942 11.190 10.562 1.00 0.00 H new ATOM 0 HA ASP A 20 -6.162 9.074 10.865 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.628 9.861 12.489 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -7.401 8.738 13.042 1.00 0.00 H new ATOM 254 N ASN A 21 -8.988 8.115 9.688 1.00 0.00 N ATOM 255 CA ASN A 21 -9.710 6.998 9.090 1.00 0.00 C ATOM 256 C ASN A 21 -8.913 6.329 7.977 1.00 0.00 C ATOM 257 O ASN A 21 -9.153 5.156 7.701 1.00 0.00 O ATOM 258 CB ASN A 21 -11.031 7.486 8.480 1.00 0.00 C ATOM 259 CG ASN A 21 -12.067 7.791 9.544 1.00 0.00 C ATOM 260 OD1 ASN A 21 -12.268 6.993 10.451 1.00 0.00 O ATOM 261 ND2 ASN A 21 -12.734 8.926 9.460 1.00 0.00 N ATOM 0 H ASN A 21 -9.323 9.022 9.362 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.886 6.279 9.890 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.847 8.381 7.885 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -11.420 6.727 7.802 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -13.438 9.157 10.161 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -12.546 9.572 8.694 1.00 0.00 H new ATOM 268 N ALA A 22 -8.043 7.054 7.273 1.00 0.00 N ATOM 269 CA ALA A 22 -7.367 6.558 6.081 1.00 0.00 C ATOM 270 C ALA A 22 -6.417 5.396 6.436 1.00 0.00 C ATOM 271 O ALA A 22 -6.004 5.267 7.593 1.00 0.00 O ATOM 272 CB ALA A 22 -6.633 7.722 5.413 1.00 0.00 C ATOM 0 H ALA A 22 -7.788 8.010 7.519 1.00 0.00 H new ATOM 0 HA ALA A 22 -8.095 6.157 5.376 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.122 7.365 4.519 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.351 8.494 5.137 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.902 8.137 6.107 1.00 0.00 H new ATOM 278 N GLN A 23 -6.029 4.568 5.464 1.00 0.00 N ATOM 279 CA GLN A 23 -5.136 3.422 5.654 1.00 0.00 C ATOM 280 C GLN A 23 -4.301 3.142 4.403 1.00 0.00 C ATOM 281 O GLN A 23 -4.497 3.771 3.363 1.00 0.00 O ATOM 282 CB GLN A 23 -5.960 2.166 6.008 1.00 0.00 C ATOM 283 CG GLN A 23 -5.952 1.838 7.508 1.00 0.00 C ATOM 284 CD GLN A 23 -4.615 1.258 7.985 1.00 0.00 C ATOM 285 OE1 GLN A 23 -3.562 1.485 7.396 1.00 0.00 O ATOM 286 NE2 GLN A 23 -4.628 0.484 9.058 1.00 0.00 N ATOM 0 H GLN A 23 -6.335 4.678 4.497 1.00 0.00 H new ATOM 0 HA GLN A 23 -4.456 3.666 6.470 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.989 2.311 5.680 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -5.566 1.314 5.455 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.172 2.743 8.074 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -6.749 1.126 7.723 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -5.506 0.299 9.543 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -3.760 0.072 9.400 1.00 0.00 H new ATOM 295 N LEU A 24 -3.407 2.150 4.489 1.00 0.00 N ATOM 296 CA LEU A 24 -2.494 1.731 3.433 1.00 0.00 C ATOM 297 C LEU A 24 -2.529 0.202 3.306 1.00 0.00 C ATOM 298 O LEU A 24 -2.427 -0.481 4.329 1.00 0.00 O ATOM 299 CB LEU A 24 -1.105 2.237 3.840 1.00 0.00 C ATOM 300 CG LEU A 24 -0.077 2.425 2.723 1.00 0.00 C ATOM 301 CD1 LEU A 24 0.279 1.172 1.914 1.00 0.00 C ATOM 302 CD2 LEU A 24 -0.474 3.554 1.769 1.00 0.00 C ATOM 0 H LEU A 24 -3.300 1.595 5.338 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.769 2.137 2.460 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -1.229 3.192 4.350 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.690 1.539 4.567 1.00 0.00 H new ATOM 0 HG LEU A 24 0.830 2.687 3.268 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.016 1.428 1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.693 0.415 2.580 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.618 0.782 1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.282 3.655 0.990 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.436 3.323 1.312 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.551 4.489 2.324 1.00 0.00 H new ATOM 314 N LEU A 25 -2.679 -0.329 2.084 1.00 0.00 N ATOM 315 CA LEU A 25 -2.682 -1.770 1.789 1.00 0.00 C ATOM 316 C LEU A 25 -1.519 -2.074 0.856 1.00 0.00 C ATOM 317 O LEU A 25 -1.580 -1.874 -0.358 1.00 0.00 O ATOM 318 CB LEU A 25 -4.050 -2.256 1.238 1.00 0.00 C ATOM 319 CG LEU A 25 -4.527 -3.656 1.687 1.00 0.00 C ATOM 320 CD1 LEU A 25 -3.795 -4.809 1.000 1.00 0.00 C ATOM 321 CD2 LEU A 25 -4.434 -3.856 3.187 1.00 0.00 C ATOM 0 H LEU A 25 -2.805 0.247 1.251 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.544 -2.332 2.713 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.810 -1.530 1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.999 -2.248 0.149 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.572 -3.680 1.380 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.185 -5.758 1.367 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.948 -4.746 -0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.729 -4.746 1.220 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.782 -4.857 3.443 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.398 -3.740 3.506 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.055 -3.116 3.692 1.00 0.00 H new ATOM 333 N ASP A 26 -0.403 -2.498 1.435 1.00 0.00 N ATOM 334 CA ASP A 26 0.776 -2.923 0.733 1.00 0.00 C ATOM 335 C ASP A 26 0.521 -4.295 0.112 1.00 0.00 C ATOM 336 O ASP A 26 0.673 -5.325 0.774 1.00 0.00 O ATOM 337 CB ASP A 26 2.014 -2.908 1.650 1.00 0.00 C ATOM 338 CG ASP A 26 1.873 -3.127 3.156 1.00 0.00 C ATOM 339 OD1 ASP A 26 1.071 -2.454 3.813 1.00 0.00 O ATOM 340 OD2 ASP A 26 2.734 -3.837 3.736 1.00 0.00 O ATOM 0 H ASP A 26 -0.302 -2.553 2.449 1.00 0.00 H new ATOM 0 HA ASP A 26 0.995 -2.220 -0.071 1.00 0.00 H new ATOM 0 HB2 ASP A 26 2.698 -3.671 1.278 1.00 0.00 H new ATOM 0 HB3 ASP A 26 2.505 -1.945 1.511 1.00 0.00 H new ATOM 345 N ILE A 27 0.162 -4.324 -1.174 1.00 0.00 N ATOM 346 CA ILE A 27 -0.072 -5.564 -1.929 1.00 0.00 C ATOM 347 C ILE A 27 1.219 -6.241 -2.415 1.00 0.00 C ATOM 348 O ILE A 27 1.156 -7.243 -3.125 1.00 0.00 O ATOM 349 CB ILE A 27 -1.077 -5.358 -3.084 1.00 0.00 C ATOM 350 CG1 ILE A 27 -0.600 -4.304 -4.105 1.00 0.00 C ATOM 351 CG2 ILE A 27 -2.466 -5.055 -2.497 1.00 0.00 C ATOM 352 CD1 ILE A 27 -1.386 -4.361 -5.420 1.00 0.00 C ATOM 0 H ILE A 27 0.023 -3.480 -1.729 1.00 0.00 H new ATOM 0 HA ILE A 27 -0.522 -6.256 -1.218 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.147 -6.280 -3.661 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.699 -3.310 -3.669 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.459 -4.457 -4.312 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.180 -4.909 -3.308 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.789 -5.891 -1.876 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.415 -4.151 -1.891 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.010 -3.599 -6.102 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.266 -5.345 -5.873 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.442 -4.180 -5.221 1.00 0.00 H new ATOM 364 N ARG A 28 2.387 -5.717 -2.041 1.00 0.00 N ATOM 365 CA ARG A 28 3.683 -6.218 -2.489 1.00 0.00 C ATOM 366 C ARG A 28 3.953 -7.629 -1.961 1.00 0.00 C ATOM 367 O ARG A 28 3.468 -7.979 -0.880 1.00 0.00 O ATOM 368 CB ARG A 28 4.788 -5.241 -2.043 1.00 0.00 C ATOM 369 CG ARG A 28 4.485 -3.804 -2.501 1.00 0.00 C ATOM 370 CD ARG A 28 5.704 -2.876 -2.622 1.00 0.00 C ATOM 371 NE ARG A 28 6.587 -2.881 -1.452 1.00 0.00 N ATOM 372 CZ ARG A 28 6.377 -2.411 -0.224 1.00 0.00 C ATOM 373 NH1 ARG A 28 5.223 -1.847 0.136 1.00 0.00 N ATOM 374 NH2 ARG A 28 7.352 -2.556 0.655 1.00 0.00 N ATOM 0 H ARG A 28 2.458 -4.920 -1.408 1.00 0.00 H new ATOM 0 HA ARG A 28 3.676 -6.282 -3.577 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.882 -5.266 -0.957 1.00 0.00 H new ATOM 0 HB3 ARG A 28 5.746 -5.561 -2.453 1.00 0.00 H new ATOM 0 HG2 ARG A 28 3.986 -3.848 -3.469 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.780 -3.359 -1.799 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.282 -3.167 -3.499 1.00 0.00 H new ATOM 0 HD3 ARG A 28 5.355 -1.858 -2.794 1.00 0.00 H new ATOM 0 HE ARG A 28 7.501 -3.309 -1.601 1.00 0.00 H new ATOM 0 HH11 ARG A 28 4.463 -1.764 -0.540 1.00 0.00 H new ATOM 0 HH12 ARG A 28 5.100 -1.499 1.087 1.00 0.00 H new ATOM 0 HH21 ARG A 28 8.222 -3.013 0.381 1.00 0.00 H new ATOM 0 HH22 ARG A 28 7.235 -2.211 1.608 1.00 0.00 H new ATOM 388 N ALA A 29 4.789 -8.394 -2.673 1.00 0.00 N ATOM 389 CA ALA A 29 5.345 -9.680 -2.250 1.00 0.00 C ATOM 390 C ALA A 29 5.857 -9.606 -0.816 1.00 0.00 C ATOM 391 O ALA A 29 6.499 -8.623 -0.449 1.00 0.00 O ATOM 392 CB ALA A 29 6.511 -10.050 -3.177 1.00 0.00 C ATOM 0 H ALA A 29 5.109 -8.119 -3.601 1.00 0.00 H new ATOM 0 HA ALA A 29 4.559 -10.434 -2.302 1.00 0.00 H new ATOM 0 HB1 ALA A 29 6.931 -11.007 -2.869 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.150 -10.125 -4.203 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.281 -9.280 -3.119 1.00 0.00 H new ATOM 398 N THR A 30 5.624 -10.646 -0.011 1.00 0.00 N ATOM 399 CA THR A 30 6.022 -10.618 1.395 1.00 0.00 C ATOM 400 C THR A 30 7.546 -10.509 1.549 1.00 0.00 C ATOM 401 O THR A 30 8.046 -9.934 2.517 1.00 0.00 O ATOM 402 CB THR A 30 5.489 -11.857 2.127 1.00 0.00 C ATOM 403 OG1 THR A 30 4.218 -12.238 1.642 1.00 0.00 O ATOM 404 CG2 THR A 30 5.384 -11.594 3.632 1.00 0.00 C ATOM 0 H THR A 30 5.167 -11.508 -0.306 1.00 0.00 H new ATOM 0 HA THR A 30 5.583 -9.729 1.848 1.00 0.00 H new ATOM 0 HB THR A 30 6.196 -12.665 1.942 1.00 0.00 H new ATOM 0 HG1 THR A 30 3.907 -13.031 2.127 1.00 0.00 H new ATOM 0 HG21 THR A 30 5.004 -12.485 4.131 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.369 -11.348 4.028 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.704 -10.761 3.809 1.00 0.00 H new ATOM 412 N ALA A 31 8.285 -11.031 0.572 1.00 0.00 N ATOM 413 CA ALA A 31 9.728 -10.998 0.557 1.00 0.00 C ATOM 414 C ALA A 31 10.270 -9.578 0.437 1.00 0.00 C ATOM 415 O ALA A 31 11.329 -9.298 0.994 1.00 0.00 O ATOM 416 CB ALA A 31 10.221 -11.842 -0.603 1.00 0.00 C ATOM 0 H ALA A 31 7.881 -11.495 -0.242 1.00 0.00 H new ATOM 0 HA ALA A 31 10.091 -11.398 1.504 1.00 0.00 H new ATOM 0 HB1 ALA A 31 11.311 -11.826 -0.627 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.875 -12.868 -0.479 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.832 -11.439 -1.538 1.00 0.00 H new ATOM 422 N ASP A 32 9.557 -8.688 -0.255 1.00 0.00 N ATOM 423 CA ASP A 32 9.947 -7.293 -0.466 1.00 0.00 C ATOM 424 C ASP A 32 10.281 -6.646 0.874 1.00 0.00 C ATOM 425 O ASP A 32 11.350 -6.069 1.043 1.00 0.00 O ATOM 426 CB ASP A 32 8.805 -6.557 -1.170 1.00 0.00 C ATOM 427 CG ASP A 32 9.202 -5.149 -1.586 1.00 0.00 C ATOM 428 OD1 ASP A 32 9.686 -5.006 -2.728 1.00 0.00 O ATOM 429 OD2 ASP A 32 8.923 -4.206 -0.821 1.00 0.00 O ATOM 0 H ASP A 32 8.668 -8.924 -0.696 1.00 0.00 H new ATOM 0 HA ASP A 32 10.835 -7.240 -1.096 1.00 0.00 H new ATOM 0 HB2 ASP A 32 8.499 -7.122 -2.050 1.00 0.00 H new ATOM 0 HB3 ASP A 32 7.942 -6.509 -0.506 1.00 0.00 H new ATOM 434 N PHE A 33 9.445 -6.883 1.886 1.00 0.00 N ATOM 435 CA PHE A 33 9.591 -6.350 3.238 1.00 0.00 C ATOM 436 C PHE A 33 10.882 -6.772 3.945 1.00 0.00 C ATOM 437 O PHE A 33 11.274 -6.173 4.948 1.00 0.00 O ATOM 438 CB PHE A 33 8.370 -6.796 4.044 1.00 0.00 C ATOM 439 CG PHE A 33 7.049 -6.557 3.333 1.00 0.00 C ATOM 440 CD1 PHE A 33 6.814 -5.336 2.674 1.00 0.00 C ATOM 441 CD2 PHE A 33 6.086 -7.580 3.256 1.00 0.00 C ATOM 442 CE1 PHE A 33 5.602 -5.116 2.009 1.00 0.00 C ATOM 443 CE2 PHE A 33 4.860 -7.347 2.610 1.00 0.00 C ATOM 444 CZ PHE A 33 4.610 -6.098 2.019 1.00 0.00 C ATOM 0 H PHE A 33 8.619 -7.472 1.781 1.00 0.00 H new ATOM 0 HA PHE A 33 9.655 -5.264 3.165 1.00 0.00 H new ATOM 0 HB2 PHE A 33 8.464 -7.858 4.271 1.00 0.00 H new ATOM 0 HB3 PHE A 33 8.361 -6.266 4.997 1.00 0.00 H new ATOM 0 HD1 PHE A 33 7.571 -4.566 2.681 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.289 -8.546 3.694 1.00 0.00 H new ATOM 0 HE1 PHE A 33 5.434 -4.185 1.488 1.00 0.00 H new ATOM 0 HE2 PHE A 33 4.113 -8.126 2.568 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.648 -5.897 1.571 1.00 0.00 H new ATOM 454 N ARG A 34 11.540 -7.818 3.450 1.00 0.00 N ATOM 455 CA ARG A 34 12.737 -8.408 4.031 1.00 0.00 C ATOM 456 C ARG A 34 13.999 -7.898 3.356 1.00 0.00 C ATOM 457 O ARG A 34 15.071 -8.009 3.954 1.00 0.00 O ATOM 458 CB ARG A 34 12.680 -9.921 3.830 1.00 0.00 C ATOM 459 CG ARG A 34 11.282 -10.495 4.110 1.00 0.00 C ATOM 460 CD ARG A 34 11.277 -12.009 4.174 1.00 0.00 C ATOM 461 NE ARG A 34 11.918 -12.645 3.012 1.00 0.00 N ATOM 462 CZ ARG A 34 12.191 -13.951 2.940 1.00 0.00 C ATOM 463 NH1 ARG A 34 11.824 -14.766 3.927 1.00 0.00 N ATOM 464 NH2 ARG A 34 12.848 -14.423 1.891 1.00 0.00 N ATOM 0 H ARG A 34 11.239 -8.294 2.600 1.00 0.00 H new ATOM 0 HA ARG A 34 12.768 -8.138 5.087 1.00 0.00 H new ATOM 0 HB2 ARG A 34 12.970 -10.160 2.807 1.00 0.00 H new ATOM 0 HB3 ARG A 34 13.405 -10.400 4.488 1.00 0.00 H new ATOM 0 HG2 ARG A 34 10.910 -10.094 5.053 1.00 0.00 H new ATOM 0 HG3 ARG A 34 10.595 -10.165 3.331 1.00 0.00 H new ATOM 0 HD2 ARG A 34 11.789 -12.329 5.082 1.00 0.00 H new ATOM 0 HD3 ARG A 34 10.247 -12.359 4.248 1.00 0.00 H new ATOM 0 HE ARG A 34 12.168 -12.056 2.217 1.00 0.00 H new ATOM 0 HH11 ARG A 34 11.333 -14.394 4.740 1.00 0.00 H new ATOM 0 HH12 ARG A 34 12.033 -15.763 3.870 1.00 0.00 H new ATOM 0 HH21 ARG A 34 13.141 -13.791 1.146 1.00 0.00 H new ATOM 0 HH22 ARG A 34 13.061 -15.419 1.828 1.00 0.00 H new ATOM 478 N GLN A 35 13.881 -7.375 2.136 1.00 0.00 N ATOM 479 CA GLN A 35 14.988 -7.076 1.245 1.00 0.00 C ATOM 480 C GLN A 35 14.979 -5.633 0.733 1.00 0.00 C ATOM 481 O GLN A 35 16.026 -4.994 0.763 1.00 0.00 O ATOM 482 CB GLN A 35 15.006 -8.157 0.158 1.00 0.00 C ATOM 483 CG GLN A 35 13.839 -8.217 -0.835 1.00 0.00 C ATOM 484 CD GLN A 35 13.632 -9.650 -1.341 1.00 0.00 C ATOM 485 OE1 GLN A 35 13.495 -10.587 -0.561 1.00 0.00 O ATOM 486 NE2 GLN A 35 13.611 -9.882 -2.638 1.00 0.00 N ATOM 0 H GLN A 35 12.975 -7.141 1.731 1.00 0.00 H new ATOM 0 HA GLN A 35 15.935 -7.115 1.783 1.00 0.00 H new ATOM 0 HB2 GLN A 35 15.924 -8.034 -0.417 1.00 0.00 H new ATOM 0 HB3 GLN A 35 15.069 -9.125 0.655 1.00 0.00 H new ATOM 0 HG2 GLN A 35 12.928 -7.860 -0.355 1.00 0.00 H new ATOM 0 HG3 GLN A 35 14.037 -7.554 -1.677 1.00 0.00 H new ATOM 0 HE21 GLN A 35 13.724 -9.111 -3.296 1.00 0.00 H new ATOM 0 HE22 GLN A 35 13.482 -10.833 -2.984 1.00 0.00 H new ATOM 495 N VAL A 36 13.828 -5.089 0.338 1.00 0.00 N ATOM 496 CA VAL A 36 13.624 -3.660 0.093 1.00 0.00 C ATOM 497 C VAL A 36 13.187 -2.985 1.403 1.00 0.00 C ATOM 498 O VAL A 36 13.625 -1.879 1.717 1.00 0.00 O ATOM 499 CB VAL A 36 12.578 -3.462 -1.028 1.00 0.00 C ATOM 500 CG1 VAL A 36 12.434 -1.985 -1.430 1.00 0.00 C ATOM 501 CG2 VAL A 36 12.952 -4.259 -2.288 1.00 0.00 C ATOM 0 H VAL A 36 12.988 -5.645 0.175 1.00 0.00 H new ATOM 0 HA VAL A 36 14.553 -3.198 -0.240 1.00 0.00 H new ATOM 0 HB VAL A 36 11.633 -3.821 -0.621 1.00 0.00 H new ATOM 0 HG11 VAL A 36 11.689 -1.894 -2.220 1.00 0.00 H new ATOM 0 HG12 VAL A 36 12.119 -1.402 -0.565 1.00 0.00 H new ATOM 0 HG13 VAL A 36 13.392 -1.611 -1.790 1.00 0.00 H new ATOM 0 HG21 VAL A 36 12.197 -4.099 -3.057 1.00 0.00 H new ATOM 0 HG22 VAL A 36 13.922 -3.924 -2.656 1.00 0.00 H new ATOM 0 HG23 VAL A 36 13.003 -5.320 -2.045 1.00 0.00 H new ATOM 511 N GLY A 37 12.400 -3.672 2.235 1.00 0.00 N ATOM 512 CA GLY A 37 11.813 -3.119 3.447 1.00 0.00 C ATOM 513 C GLY A 37 10.368 -2.718 3.197 1.00 0.00 C ATOM 514 O GLY A 37 9.789 -3.067 2.169 1.00 0.00 O ATOM 0 H GLY A 37 12.151 -4.648 2.077 1.00 0.00 H new ATOM 0 HA2 GLY A 37 11.860 -3.854 4.250 1.00 0.00 H new ATOM 0 HA3 GLY A 37 12.387 -2.252 3.775 1.00 0.00 H new ATOM 518 N SER A 38 9.772 -2.008 4.150 1.00 0.00 N ATOM 519 CA SER A 38 8.418 -1.496 4.018 1.00 0.00 C ATOM 520 C SER A 38 8.433 0.021 4.206 1.00 0.00 C ATOM 521 O SER A 38 9.294 0.514 4.932 1.00 0.00 O ATOM 522 CB SER A 38 7.486 -2.184 5.030 1.00 0.00 C ATOM 523 OG SER A 38 7.679 -3.585 5.084 1.00 0.00 O ATOM 0 H SER A 38 10.218 -1.773 5.037 1.00 0.00 H new ATOM 0 HA SER A 38 8.035 -1.716 3.022 1.00 0.00 H new ATOM 0 HB2 SER A 38 7.654 -1.760 6.020 1.00 0.00 H new ATOM 0 HB3 SER A 38 6.450 -1.974 4.765 1.00 0.00 H new ATOM 0 HG SER A 38 7.202 -4.010 4.341 1.00 0.00 H new ATOM 529 N PRO A 39 7.469 0.757 3.638 1.00 0.00 N ATOM 530 CA PRO A 39 7.245 2.161 3.928 1.00 0.00 C ATOM 531 C PRO A 39 6.925 2.363 5.405 1.00 0.00 C ATOM 532 O PRO A 39 6.372 1.471 6.056 1.00 0.00 O ATOM 533 CB PRO A 39 6.074 2.579 3.045 1.00 0.00 C ATOM 534 CG PRO A 39 5.326 1.274 2.764 1.00 0.00 C ATOM 535 CD PRO A 39 6.434 0.248 2.772 1.00 0.00 C ATOM 0 HA PRO A 39 8.130 2.764 3.724 1.00 0.00 H new ATOM 0 HB2 PRO A 39 5.434 3.303 3.550 1.00 0.00 H new ATOM 0 HB3 PRO A 39 6.419 3.046 2.123 1.00 0.00 H new ATOM 0 HG2 PRO A 39 4.575 1.065 3.526 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.808 1.303 1.806 1.00 0.00 H new ATOM 0 HD2 PRO A 39 6.068 -0.713 3.132 1.00 0.00 H new ATOM 0 HD3 PRO A 39 6.818 0.086 1.765 1.00 0.00 H new ATOM 543 N ASN A 40 7.256 3.541 5.941 1.00 0.00 N ATOM 544 CA ASN A 40 6.994 3.875 7.338 1.00 0.00 C ATOM 545 C ASN A 40 5.916 4.946 7.420 1.00 0.00 C ATOM 546 O ASN A 40 6.236 6.137 7.390 1.00 0.00 O ATOM 547 CB ASN A 40 8.254 4.339 8.090 1.00 0.00 C ATOM 548 CG ASN A 40 7.869 4.737 9.513 1.00 0.00 C ATOM 549 OD1 ASN A 40 6.862 4.276 10.046 1.00 0.00 O ATOM 550 ND2 ASN A 40 8.592 5.659 10.111 1.00 0.00 N ATOM 0 H ASN A 40 7.713 4.287 5.417 1.00 0.00 H new ATOM 0 HA ASN A 40 6.653 2.962 7.825 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.995 3.540 8.111 1.00 0.00 H new ATOM 0 HB3 ASN A 40 8.710 5.184 7.574 1.00 0.00 H new ATOM 0 HD21 ASN A 40 8.320 6.003 11.032 1.00 0.00 H new ATOM 0 HD22 ASN A 40 9.425 6.030 9.654 1.00 0.00 H new ATOM 557 N ILE A 41 4.652 4.548 7.550 1.00 0.00 N ATOM 558 CA ILE A 41 3.547 5.483 7.777 1.00 0.00 C ATOM 559 C ILE A 41 3.143 5.530 9.253 1.00 0.00 C ATOM 560 O ILE A 41 2.123 6.128 9.572 1.00 0.00 O ATOM 561 CB ILE A 41 2.359 5.184 6.837 1.00 0.00 C ATOM 562 CG1 ILE A 41 1.699 3.807 7.085 1.00 0.00 C ATOM 563 CG2 ILE A 41 2.845 5.351 5.385 1.00 0.00 C ATOM 564 CD1 ILE A 41 0.177 3.873 7.268 1.00 0.00 C ATOM 0 H ILE A 41 4.363 3.571 7.501 1.00 0.00 H new ATOM 0 HA ILE A 41 3.896 6.485 7.526 1.00 0.00 H new ATOM 0 HB ILE A 41 1.561 5.897 7.047 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.926 3.149 6.246 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.143 3.356 7.973 1.00 0.00 H new ATOM 0 HG21 ILE A 41 2.023 5.145 4.700 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.196 6.372 5.234 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.661 4.655 5.192 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.213 2.869 7.437 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.059 4.504 8.125 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -0.279 4.293 6.372 1.00 0.00 H new ATOM 576 N LYS A 42 3.911 4.912 10.158 1.00 0.00 N ATOM 577 CA LYS A 42 3.533 4.766 11.558 1.00 0.00 C ATOM 578 C LYS A 42 3.303 6.108 12.249 1.00 0.00 C ATOM 579 O LYS A 42 2.402 6.201 13.076 1.00 0.00 O ATOM 580 CB LYS A 42 4.595 3.904 12.244 1.00 0.00 C ATOM 581 CG LYS A 42 4.266 3.370 13.641 1.00 0.00 C ATOM 582 CD LYS A 42 2.955 2.588 13.766 1.00 0.00 C ATOM 583 CE LYS A 42 2.935 1.915 15.145 1.00 0.00 C ATOM 584 NZ LYS A 42 1.592 1.474 15.563 1.00 0.00 N ATOM 0 H LYS A 42 4.816 4.499 9.933 1.00 0.00 H new ATOM 0 HA LYS A 42 2.567 4.266 11.630 1.00 0.00 H new ATOM 0 HB2 LYS A 42 4.808 3.052 11.598 1.00 0.00 H new ATOM 0 HB3 LYS A 42 5.512 4.489 12.313 1.00 0.00 H new ATOM 0 HG2 LYS A 42 5.083 2.725 13.964 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.232 4.212 14.332 1.00 0.00 H new ATOM 0 HD2 LYS A 42 2.101 3.256 13.655 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.880 1.841 12.976 1.00 0.00 H new ATOM 0 HE2 LYS A 42 3.604 1.054 15.130 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.328 2.611 15.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.649 1.029 16.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.955 2.295 15.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 1.223 0.787 14.875 1.00 0.00 H new ATOM 598 N GLY A 43 4.014 7.163 11.845 1.00 0.00 N ATOM 599 CA GLY A 43 3.773 8.512 12.338 1.00 0.00 C ATOM 600 C GLY A 43 2.381 9.017 11.984 1.00 0.00 C ATOM 601 O GLY A 43 1.817 9.806 12.735 1.00 0.00 O ATOM 0 H GLY A 43 4.773 7.101 11.166 1.00 0.00 H new ATOM 0 HA2 GLY A 43 3.899 8.529 13.421 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.519 9.188 11.920 1.00 0.00 H new ATOM 605 N LEU A 44 1.801 8.573 10.867 1.00 0.00 N ATOM 606 CA LEU A 44 0.425 8.876 10.476 1.00 0.00 C ATOM 607 C LEU A 44 -0.576 8.034 11.280 1.00 0.00 C ATOM 608 O LEU A 44 -1.769 8.051 10.985 1.00 0.00 O ATOM 609 CB LEU A 44 0.203 8.671 8.964 1.00 0.00 C ATOM 610 CG LEU A 44 1.274 9.270 8.033 1.00 0.00 C ATOM 611 CD1 LEU A 44 0.829 9.073 6.583 1.00 0.00 C ATOM 612 CD2 LEU A 44 1.568 10.752 8.295 1.00 0.00 C ATOM 0 H LEU A 44 2.287 7.979 10.195 1.00 0.00 H new ATOM 0 HA LEU A 44 0.253 9.929 10.701 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.139 7.600 8.769 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.762 9.102 8.698 1.00 0.00 H new ATOM 0 HG LEU A 44 2.207 8.743 8.236 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.579 9.493 5.912 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.715 8.008 6.379 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.124 9.577 6.423 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.332 11.100 7.600 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.657 11.334 8.154 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.924 10.877 9.318 1.00 0.00 H new ATOM 624 N GLY A 45 -0.129 7.284 12.290 1.00 0.00 N ATOM 625 CA GLY A 45 -0.974 6.798 13.367 1.00 0.00 C ATOM 626 C GLY A 45 -0.980 5.285 13.504 1.00 0.00 C ATOM 627 O GLY A 45 -1.515 4.786 14.493 1.00 0.00 O ATOM 0 H GLY A 45 0.846 6.997 12.378 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -0.639 7.238 14.306 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.994 7.143 13.200 1.00 0.00 H new ATOM 631 N LYS A 46 -0.465 4.551 12.514 1.00 0.00 N ATOM 632 CA LYS A 46 -0.503 3.093 12.437 1.00 0.00 C ATOM 633 C LYS A 46 0.380 2.636 11.292 1.00 0.00 C ATOM 634 O LYS A 46 0.761 3.425 10.431 1.00 0.00 O ATOM 635 CB LYS A 46 -1.928 2.519 12.261 1.00 0.00 C ATOM 636 CG LYS A 46 -2.955 3.368 11.513 1.00 0.00 C ATOM 637 CD LYS A 46 -2.549 3.898 10.128 1.00 0.00 C ATOM 638 CE LYS A 46 -3.564 4.922 9.616 1.00 0.00 C ATOM 639 NZ LYS A 46 -3.697 6.095 10.510 1.00 0.00 N ATOM 0 H LYS A 46 0.007 4.975 11.715 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.137 2.712 13.391 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.842 1.564 11.742 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.328 2.308 13.253 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.863 2.776 11.396 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -3.210 4.222 12.141 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.561 4.356 10.185 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.476 3.069 9.424 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.264 5.259 8.624 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -4.536 4.441 9.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -4.277 6.822 10.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -4.153 5.804 11.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.754 6.483 10.716 1.00 0.00 H new ATOM 653 N LYS A 47 0.763 1.367 11.315 1.00 0.00 N ATOM 654 CA LYS A 47 1.559 0.770 10.249 1.00 0.00 C ATOM 655 C LYS A 47 0.608 0.341 9.134 1.00 0.00 C ATOM 656 O LYS A 47 -0.560 0.045 9.409 1.00 0.00 O ATOM 657 CB LYS A 47 2.380 -0.426 10.772 1.00 0.00 C ATOM 658 CG LYS A 47 3.815 -0.469 10.200 1.00 0.00 C ATOM 659 CD LYS A 47 4.901 -0.011 11.190 1.00 0.00 C ATOM 660 CE LYS A 47 5.517 -1.132 12.041 1.00 0.00 C ATOM 661 NZ LYS A 47 4.532 -2.054 12.644 1.00 0.00 N ATOM 0 H LYS A 47 0.532 0.723 12.071 1.00 0.00 H new ATOM 0 HA LYS A 47 2.275 1.498 9.867 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.430 -0.378 11.860 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.865 -1.352 10.517 1.00 0.00 H new ATOM 0 HG2 LYS A 47 4.037 -1.487 9.880 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.859 0.161 9.312 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.698 0.480 10.631 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.472 0.737 11.857 1.00 0.00 H new ATOM 0 HE2 LYS A 47 6.202 -1.708 11.419 1.00 0.00 H new ATOM 0 HE3 LYS A 47 6.110 -0.682 12.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 5.026 -2.747 13.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.860 -1.513 13.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 4.016 -2.551 11.891 1.00 0.00 H new ATOM 675 N ALA A 48 1.123 0.256 7.910 1.00 0.00 N ATOM 676 CA ALA A 48 0.392 -0.267 6.761 1.00 0.00 C ATOM 677 C ALA A 48 0.085 -1.769 6.929 1.00 0.00 C ATOM 678 O ALA A 48 0.632 -2.416 7.834 1.00 0.00 O ATOM 679 CB ALA A 48 1.235 0.002 5.515 1.00 0.00 C ATOM 0 H ALA A 48 2.073 0.553 7.686 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.574 0.230 6.669 1.00 0.00 H new ATOM 0 HB1 ALA A 48 0.716 -0.378 4.635 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.393 1.075 5.408 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.198 -0.499 5.612 1.00 0.00 H new ATOM 685 N VAL A 49 -0.763 -2.344 6.077 1.00 0.00 N ATOM 686 CA VAL A 49 -1.203 -3.741 6.125 1.00 0.00 C ATOM 687 C VAL A 49 -0.677 -4.499 4.898 1.00 0.00 C ATOM 688 O VAL A 49 -1.161 -4.328 3.782 1.00 0.00 O ATOM 689 CB VAL A 49 -2.742 -3.785 6.217 1.00 0.00 C ATOM 690 CG1 VAL A 49 -3.259 -5.234 6.158 1.00 0.00 C ATOM 691 CG2 VAL A 49 -3.321 -3.097 7.463 1.00 0.00 C ATOM 0 H VAL A 49 -1.180 -1.829 5.302 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.797 -4.234 7.008 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.088 -3.220 5.351 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -4.347 -5.235 6.225 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.953 -5.692 5.217 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.844 -5.803 6.990 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.408 -3.174 7.449 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -2.934 -3.582 8.359 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.032 -2.046 7.466 1.00 0.00 H new ATOM 701 N SER A 50 0.293 -5.387 5.111 1.00 0.00 N ATOM 702 CA SER A 50 0.793 -6.274 4.075 1.00 0.00 C ATOM 703 C SER A 50 -0.266 -7.347 3.786 1.00 0.00 C ATOM 704 O SER A 50 -0.597 -8.147 4.670 1.00 0.00 O ATOM 705 CB SER A 50 2.124 -6.896 4.528 1.00 0.00 C ATOM 706 OG SER A 50 2.132 -7.397 5.858 1.00 0.00 O ATOM 0 H SER A 50 0.753 -5.508 6.013 1.00 0.00 H new ATOM 0 HA SER A 50 0.982 -5.721 3.155 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.377 -7.709 3.848 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.909 -6.146 4.434 1.00 0.00 H new ATOM 0 HG SER A 50 1.267 -7.813 6.056 1.00 0.00 H new ATOM 712 N THR A 51 -0.796 -7.436 2.567 1.00 0.00 N ATOM 713 CA THR A 51 -1.403 -8.664 2.051 1.00 0.00 C ATOM 714 C THR A 51 -1.112 -8.733 0.558 1.00 0.00 C ATOM 715 O THR A 51 -1.697 -7.967 -0.204 1.00 0.00 O ATOM 716 CB THR A 51 -2.914 -8.716 2.332 1.00 0.00 C ATOM 717 OG1 THR A 51 -3.141 -8.653 3.727 1.00 0.00 O ATOM 718 CG2 THR A 51 -3.538 -10.016 1.799 1.00 0.00 C ATOM 0 H THR A 51 -0.817 -6.658 1.908 1.00 0.00 H new ATOM 0 HA THR A 51 -0.974 -9.529 2.558 1.00 0.00 H new ATOM 0 HB THR A 51 -3.375 -7.867 1.827 1.00 0.00 H new ATOM 0 HG1 THR A 51 -2.282 -8.604 4.196 1.00 0.00 H new ATOM 0 HG21 THR A 51 -4.607 -10.021 2.014 1.00 0.00 H new ATOM 0 HG22 THR A 51 -3.384 -10.079 0.722 1.00 0.00 H new ATOM 0 HG23 THR A 51 -3.066 -10.871 2.283 1.00 0.00 H new ATOM 726 N VAL A 52 -0.203 -9.615 0.138 1.00 0.00 N ATOM 727 CA VAL A 52 0.118 -9.765 -1.273 1.00 0.00 C ATOM 728 C VAL A 52 -1.128 -10.232 -2.023 1.00 0.00 C ATOM 729 O VAL A 52 -1.798 -11.179 -1.606 1.00 0.00 O ATOM 730 CB VAL A 52 1.375 -10.631 -1.479 1.00 0.00 C ATOM 731 CG1 VAL A 52 1.331 -11.989 -0.779 1.00 0.00 C ATOM 732 CG2 VAL A 52 1.727 -10.812 -2.961 1.00 0.00 C ATOM 0 H VAL A 52 0.320 -10.233 0.758 1.00 0.00 H new ATOM 0 HA VAL A 52 0.395 -8.804 -1.707 1.00 0.00 H new ATOM 0 HB VAL A 52 2.168 -10.059 -0.997 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.256 -12.531 -0.978 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.221 -11.841 0.295 1.00 0.00 H new ATOM 0 HG13 VAL A 52 0.485 -12.565 -1.155 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.620 -11.430 -3.050 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.897 -11.297 -3.475 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.914 -9.838 -3.412 1.00 0.00 H new ATOM 742 N TYR A 53 -1.479 -9.508 -3.086 1.00 0.00 N ATOM 743 CA TYR A 53 -2.631 -9.839 -3.905 1.00 0.00 C ATOM 744 C TYR A 53 -2.289 -10.980 -4.850 1.00 0.00 C ATOM 745 O TYR A 53 -1.138 -11.143 -5.263 1.00 0.00 O ATOM 746 CB TYR A 53 -3.126 -8.577 -4.631 1.00 0.00 C ATOM 747 CG TYR A 53 -4.314 -8.751 -5.569 1.00 0.00 C ATOM 748 CD1 TYR A 53 -5.424 -9.553 -5.226 1.00 0.00 C ATOM 749 CD2 TYR A 53 -4.326 -8.056 -6.789 1.00 0.00 C ATOM 750 CE1 TYR A 53 -6.513 -9.676 -6.107 1.00 0.00 C ATOM 751 CE2 TYR A 53 -5.411 -8.167 -7.677 1.00 0.00 C ATOM 752 CZ TYR A 53 -6.515 -8.973 -7.334 1.00 0.00 C ATOM 753 OH TYR A 53 -7.585 -9.070 -8.168 1.00 0.00 O ATOM 0 H TYR A 53 -0.971 -8.680 -3.397 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.452 -10.191 -3.281 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.392 -7.834 -3.879 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.296 -8.167 -5.206 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -5.437 -10.075 -4.281 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -3.488 -7.426 -7.050 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -7.349 -10.308 -5.846 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -5.398 -7.637 -8.618 1.00 0.00 H new ATOM 0 HH TYR A 53 -7.427 -8.525 -8.967 1.00 0.00 H new ATOM 763 N ASN A 54 -3.312 -11.755 -5.212 1.00 0.00 N ATOM 764 CA ASN A 54 -3.301 -12.667 -6.338 1.00 0.00 C ATOM 765 C ASN A 54 -4.686 -12.554 -6.950 1.00 0.00 C ATOM 766 O ASN A 54 -5.661 -12.966 -6.316 1.00 0.00 O ATOM 767 CB ASN A 54 -3.012 -14.117 -5.920 1.00 0.00 C ATOM 768 CG ASN A 54 -1.750 -14.240 -5.086 1.00 0.00 C ATOM 769 OD1 ASN A 54 -0.648 -14.305 -5.623 1.00 0.00 O ATOM 770 ND2 ASN A 54 -1.866 -14.270 -3.770 1.00 0.00 N ATOM 0 H ASN A 54 -4.198 -11.759 -4.707 1.00 0.00 H new ATOM 0 HA ASN A 54 -2.508 -12.407 -7.039 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -3.858 -14.504 -5.352 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -2.916 -14.737 -6.812 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -1.033 -14.348 -3.186 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -2.788 -14.215 -3.338 1.00 0.00 H new ATOM 777 N GLY A 55 -4.809 -11.984 -8.150 1.00 0.00 N ATOM 778 CA GLY A 55 -6.099 -11.868 -8.827 1.00 0.00 C ATOM 779 C GLY A 55 -6.717 -13.219 -9.166 1.00 0.00 C ATOM 780 O GLY A 55 -7.931 -13.299 -9.375 1.00 0.00 O ATOM 0 H GLY A 55 -4.026 -11.594 -8.674 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -6.787 -11.309 -8.193 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -5.971 -11.293 -9.744 1.00 0.00 H new ATOM 784 N GLU A 56 -5.896 -14.269 -9.148 1.00 0.00 N ATOM 785 CA GLU A 56 -6.303 -15.657 -9.191 1.00 0.00 C ATOM 786 C GLU A 56 -7.290 -16.003 -8.073 1.00 0.00 C ATOM 787 O GLU A 56 -8.193 -16.799 -8.319 1.00 0.00 O ATOM 788 CB GLU A 56 -5.039 -16.524 -9.116 1.00 0.00 C ATOM 789 CG GLU A 56 -5.361 -18.007 -8.907 1.00 0.00 C ATOM 790 CD GLU A 56 -4.180 -18.907 -9.244 1.00 0.00 C ATOM 791 OE1 GLU A 56 -3.019 -18.600 -8.886 1.00 0.00 O ATOM 792 OE2 GLU A 56 -4.399 -19.925 -9.930 1.00 0.00 O ATOM 0 H GLU A 56 -4.883 -14.160 -9.101 1.00 0.00 H new ATOM 0 HA GLU A 56 -6.833 -15.851 -10.123 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.465 -16.405 -10.035 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.409 -16.173 -8.299 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -5.655 -18.170 -7.870 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.214 -18.282 -9.527 1.00 0.00 H new ATOM 799 N ASP A 57 -7.174 -15.431 -6.870 1.00 0.00 N ATOM 800 CA ASP A 57 -7.955 -15.869 -5.709 1.00 0.00 C ATOM 801 C ASP A 57 -8.562 -14.671 -4.992 1.00 0.00 C ATOM 802 O ASP A 57 -8.153 -14.292 -3.891 1.00 0.00 O ATOM 803 CB ASP A 57 -7.100 -16.740 -4.784 1.00 0.00 C ATOM 804 CG ASP A 57 -7.901 -17.401 -3.657 1.00 0.00 C ATOM 805 OD1 ASP A 57 -9.144 -17.542 -3.770 1.00 0.00 O ATOM 806 OD2 ASP A 57 -7.253 -17.892 -2.706 1.00 0.00 O ATOM 0 H ASP A 57 -6.540 -14.656 -6.674 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.785 -16.489 -6.048 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -6.612 -17.515 -5.375 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.311 -16.128 -4.348 1.00 0.00 H new ATOM 811 N LYS A 58 -9.566 -14.082 -5.644 1.00 0.00 N ATOM 812 CA LYS A 58 -10.388 -12.996 -5.120 1.00 0.00 C ATOM 813 C LYS A 58 -10.867 -13.218 -3.673 1.00 0.00 C ATOM 814 O LYS A 58 -10.592 -12.368 -2.820 1.00 0.00 O ATOM 815 CB LYS A 58 -11.555 -12.706 -6.088 1.00 0.00 C ATOM 816 CG LYS A 58 -11.173 -12.001 -7.397 1.00 0.00 C ATOM 817 CD LYS A 58 -10.691 -10.558 -7.216 1.00 0.00 C ATOM 818 CE LYS A 58 -10.599 -9.828 -8.560 1.00 0.00 C ATOM 819 NZ LYS A 58 -9.747 -10.525 -9.545 1.00 0.00 N ATOM 0 H LYS A 58 -9.837 -14.361 -6.587 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.753 -12.112 -5.061 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -12.042 -13.650 -6.334 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.291 -12.093 -5.568 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -10.388 -12.575 -7.890 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.036 -12.003 -8.063 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -11.375 -10.024 -6.556 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -9.715 -10.557 -6.732 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -11.601 -9.714 -8.973 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -10.206 -8.825 -8.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -9.846 -10.068 -10.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.754 -10.478 -9.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -10.041 -11.520 -9.616 1.00 0.00 H new ATOM 833 N PRO A 59 -11.611 -14.287 -3.353 1.00 0.00 N ATOM 834 CA PRO A 59 -12.151 -14.486 -2.016 1.00 0.00 C ATOM 835 C PRO A 59 -11.041 -14.749 -0.998 1.00 0.00 C ATOM 836 O PRO A 59 -11.029 -14.132 0.070 1.00 0.00 O ATOM 837 CB PRO A 59 -13.111 -15.667 -2.136 1.00 0.00 C ATOM 838 CG PRO A 59 -12.598 -16.441 -3.349 1.00 0.00 C ATOM 839 CD PRO A 59 -12.011 -15.360 -4.242 1.00 0.00 C ATOM 0 HA PRO A 59 -12.666 -13.597 -1.652 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -13.100 -16.283 -1.237 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -14.138 -15.333 -2.281 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -11.847 -17.178 -3.066 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -13.402 -16.981 -3.849 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -11.159 -15.739 -4.806 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -12.745 -15.012 -4.969 1.00 0.00 H new ATOM 847 N GLY A 60 -10.084 -15.621 -1.326 1.00 0.00 N ATOM 848 CA GLY A 60 -8.982 -16.016 -0.457 1.00 0.00 C ATOM 849 C GLY A 60 -7.897 -14.958 -0.397 1.00 0.00 C ATOM 850 O GLY A 60 -6.709 -15.273 -0.353 1.00 0.00 O ATOM 0 H GLY A 60 -10.058 -16.084 -2.234 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -9.362 -16.203 0.547 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -8.555 -16.953 -0.816 1.00 0.00 H new ATOM 854 N PHE A 61 -8.290 -13.689 -0.375 1.00 0.00 N ATOM 855 CA PHE A 61 -7.419 -12.540 -0.307 1.00 0.00 C ATOM 856 C PHE A 61 -8.011 -11.536 0.671 1.00 0.00 C ATOM 857 O PHE A 61 -7.345 -11.174 1.648 1.00 0.00 O ATOM 858 CB PHE A 61 -7.210 -11.986 -1.725 1.00 0.00 C ATOM 859 CG PHE A 61 -6.649 -10.585 -1.795 1.00 0.00 C ATOM 860 CD1 PHE A 61 -5.294 -10.341 -1.500 1.00 0.00 C ATOM 861 CD2 PHE A 61 -7.495 -9.514 -2.139 1.00 0.00 C ATOM 862 CE1 PHE A 61 -4.790 -9.028 -1.567 1.00 0.00 C ATOM 863 CE2 PHE A 61 -6.984 -8.211 -2.205 1.00 0.00 C ATOM 864 CZ PHE A 61 -5.626 -7.966 -1.946 1.00 0.00 C ATOM 0 H PHE A 61 -9.276 -13.430 -0.406 1.00 0.00 H new ATOM 0 HA PHE A 61 -6.430 -12.799 0.071 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -6.539 -12.655 -2.264 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -8.166 -12.003 -2.249 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.644 -11.158 -1.223 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -8.538 -9.697 -2.352 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.755 -8.837 -1.326 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -7.639 -7.390 -2.457 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.227 -6.967 -2.038 1.00 0.00 H new ATOM 874 N LEU A 62 -9.268 -11.127 0.471 1.00 0.00 N ATOM 875 CA LEU A 62 -9.965 -10.144 1.312 1.00 0.00 C ATOM 876 C LEU A 62 -10.026 -10.575 2.779 1.00 0.00 C ATOM 877 O LEU A 62 -10.121 -9.727 3.664 1.00 0.00 O ATOM 878 CB LEU A 62 -11.392 -9.932 0.787 1.00 0.00 C ATOM 879 CG LEU A 62 -11.453 -9.318 -0.622 1.00 0.00 C ATOM 880 CD1 LEU A 62 -12.835 -9.599 -1.216 1.00 0.00 C ATOM 881 CD2 LEU A 62 -11.144 -7.816 -0.641 1.00 0.00 C ATOM 0 H LEU A 62 -9.843 -11.476 -0.296 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.398 -9.214 1.261 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.911 -10.890 0.778 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -11.931 -9.284 1.479 1.00 0.00 H new ATOM 0 HG LEU A 62 -10.675 -9.784 -1.227 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.895 -9.170 -2.216 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.994 -10.676 -1.273 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -13.601 -9.152 -0.583 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -11.204 -7.445 -1.664 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -11.868 -7.288 -0.021 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.140 -7.646 -0.252 1.00 0.00 H new ATOM 893 N LYS A 63 -9.888 -11.874 3.066 1.00 0.00 N ATOM 894 CA LYS A 63 -9.888 -12.453 4.398 1.00 0.00 C ATOM 895 C LYS A 63 -8.831 -11.841 5.301 1.00 0.00 C ATOM 896 O LYS A 63 -8.922 -11.996 6.520 1.00 0.00 O ATOM 897 CB LYS A 63 -9.804 -13.994 4.330 1.00 0.00 C ATOM 898 CG LYS A 63 -8.821 -14.612 3.317 1.00 0.00 C ATOM 899 CD LYS A 63 -7.372 -14.170 3.529 1.00 0.00 C ATOM 900 CE LYS A 63 -6.407 -14.988 2.665 1.00 0.00 C ATOM 901 NZ LYS A 63 -5.034 -15.081 3.197 1.00 0.00 N ATOM 0 H LYS A 63 -9.768 -12.576 2.336 1.00 0.00 H new ATOM 0 HA LYS A 63 -10.841 -12.204 4.864 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -9.538 -14.360 5.322 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.800 -14.375 4.106 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.875 -15.698 3.386 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -9.132 -14.340 2.308 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -7.273 -13.112 3.286 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -7.106 -14.282 4.580 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -6.807 -15.995 2.551 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -6.368 -14.546 1.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -4.467 -15.706 2.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -4.604 -14.134 3.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -5.061 -15.469 4.162 1.00 0.00 H new ATOM 915 N LYS A 64 -7.816 -11.166 4.750 1.00 0.00 N ATOM 916 CA LYS A 64 -6.812 -10.545 5.587 1.00 0.00 C ATOM 917 C LYS A 64 -7.259 -9.180 6.079 1.00 0.00 C ATOM 918 O LYS A 64 -6.787 -8.746 7.121 1.00 0.00 O ATOM 919 CB LYS A 64 -5.476 -10.403 4.862 1.00 0.00 C ATOM 920 CG LYS A 64 -4.884 -11.778 4.490 1.00 0.00 C ATOM 921 CD LYS A 64 -3.416 -11.969 4.898 1.00 0.00 C ATOM 922 CE LYS A 64 -3.277 -12.131 6.416 1.00 0.00 C ATOM 923 NZ LYS A 64 -1.920 -12.570 6.794 1.00 0.00 N ATOM 0 H LYS A 64 -7.678 -11.043 3.747 1.00 0.00 H new ATOM 0 HA LYS A 64 -6.679 -11.206 6.443 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -5.613 -9.808 3.959 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.773 -9.863 5.496 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -5.483 -12.557 4.961 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.970 -11.917 3.412 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -3.008 -12.847 4.397 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.830 -11.112 4.566 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -3.503 -11.184 6.906 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.007 -12.857 6.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.863 -12.669 7.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -1.714 -13.486 6.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -1.225 -11.865 6.475 1.00 0.00 H new ATOM 937 N LEU A 65 -8.105 -8.476 5.331 1.00 0.00 N ATOM 938 CA LEU A 65 -8.502 -7.114 5.655 1.00 0.00 C ATOM 939 C LEU A 65 -9.486 -7.133 6.822 1.00 0.00 C ATOM 940 O LEU A 65 -9.362 -6.314 7.727 1.00 0.00 O ATOM 941 CB LEU A 65 -9.094 -6.427 4.415 1.00 0.00 C ATOM 942 CG LEU A 65 -8.004 -5.830 3.503 1.00 0.00 C ATOM 943 CD1 LEU A 65 -7.456 -6.876 2.557 1.00 0.00 C ATOM 944 CD2 LEU A 65 -8.541 -4.663 2.675 1.00 0.00 C ATOM 0 H LEU A 65 -8.535 -8.839 4.480 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.630 -6.536 5.961 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -9.684 -7.148 3.849 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -9.775 -5.636 4.730 1.00 0.00 H new ATOM 0 HG LEU A 65 -7.211 -5.471 4.159 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.689 -6.429 1.925 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.021 -7.694 3.131 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.263 -7.260 1.932 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.745 -4.268 2.044 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.362 -5.009 2.048 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.899 -3.879 3.342 1.00 0.00 H new ATOM 956 N SER A 66 -10.374 -8.126 6.874 1.00 0.00 N ATOM 957 CA SER A 66 -11.511 -8.231 7.790 1.00 0.00 C ATOM 958 C SER A 66 -11.155 -8.204 9.286 1.00 0.00 C ATOM 959 O SER A 66 -12.032 -8.073 10.137 1.00 0.00 O ATOM 960 CB SER A 66 -12.273 -9.509 7.419 1.00 0.00 C ATOM 961 OG SER A 66 -12.268 -9.698 6.007 1.00 0.00 O ATOM 0 H SER A 66 -10.316 -8.925 6.242 1.00 0.00 H new ATOM 0 HA SER A 66 -12.124 -7.339 7.664 1.00 0.00 H new ATOM 0 HB2 SER A 66 -11.815 -10.368 7.909 1.00 0.00 H new ATOM 0 HB3 SER A 66 -13.299 -9.446 7.780 1.00 0.00 H new ATOM 0 HG SER A 66 -12.756 -10.518 5.785 1.00 0.00 H new ATOM 967 N LEU A 67 -9.873 -8.359 9.620 1.00 0.00 N ATOM 968 CA LEU A 67 -9.328 -8.370 10.973 1.00 0.00 C ATOM 969 C LEU A 67 -8.062 -7.509 11.085 1.00 0.00 C ATOM 970 O LEU A 67 -7.289 -7.655 12.036 1.00 0.00 O ATOM 971 CB LEU A 67 -9.112 -9.819 11.448 1.00 0.00 C ATOM 972 CG LEU A 67 -7.907 -10.578 10.857 1.00 0.00 C ATOM 973 CD1 LEU A 67 -7.656 -11.853 11.663 1.00 0.00 C ATOM 974 CD2 LEU A 67 -8.094 -10.921 9.380 1.00 0.00 C ATOM 0 H LEU A 67 -9.149 -8.487 8.913 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.055 -7.912 11.644 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -9.006 -9.807 12.533 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -10.014 -10.387 11.222 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.043 -9.917 10.923 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.804 -12.387 11.243 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.445 -11.592 12.700 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.540 -12.490 11.621 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.216 -11.454 9.016 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -8.976 -11.551 9.262 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.224 -10.003 8.807 1.00 0.00 H new ATOM 986 N LYS A 68 -7.802 -6.653 10.093 1.00 0.00 N ATOM 987 CA LYS A 68 -6.676 -5.722 10.027 1.00 0.00 C ATOM 988 C LYS A 68 -7.141 -4.264 10.056 1.00 0.00 C ATOM 989 O LYS A 68 -6.318 -3.354 10.194 1.00 0.00 O ATOM 990 CB LYS A 68 -5.896 -5.982 8.729 1.00 0.00 C ATOM 991 CG LYS A 68 -4.693 -6.920 8.879 1.00 0.00 C ATOM 992 CD LYS A 68 -4.972 -8.176 9.705 1.00 0.00 C ATOM 993 CE LYS A 68 -3.849 -9.194 9.551 1.00 0.00 C ATOM 994 NZ LYS A 68 -4.111 -10.375 10.395 1.00 0.00 N ATOM 0 H LYS A 68 -8.404 -6.589 9.272 1.00 0.00 H new ATOM 0 HA LYS A 68 -6.043 -5.886 10.899 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.578 -6.404 7.990 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -5.548 -5.028 8.334 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.355 -7.220 7.887 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -3.874 -6.370 9.342 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -5.082 -7.907 10.756 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -5.916 -8.620 9.389 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -3.763 -9.496 8.507 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -2.898 -8.742 9.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -3.338 -11.062 10.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -4.171 -10.083 11.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.009 -10.814 10.108 1.00 0.00 H new ATOM 1008 N PHE A 69 -8.440 -4.037 9.887 1.00 0.00 N ATOM 1009 CA PHE A 69 -9.087 -2.743 9.844 1.00 0.00 C ATOM 1010 C PHE A 69 -10.272 -2.847 10.774 1.00 0.00 C ATOM 1011 O PHE A 69 -11.101 -3.744 10.607 1.00 0.00 O ATOM 1012 CB PHE A 69 -9.595 -2.417 8.434 1.00 0.00 C ATOM 1013 CG PHE A 69 -8.534 -2.305 7.371 1.00 0.00 C ATOM 1014 CD1 PHE A 69 -7.840 -3.448 6.938 1.00 0.00 C ATOM 1015 CD2 PHE A 69 -8.280 -1.064 6.771 1.00 0.00 C ATOM 1016 CE1 PHE A 69 -6.876 -3.355 5.934 1.00 0.00 C ATOM 1017 CE2 PHE A 69 -7.362 -0.985 5.718 1.00 0.00 C ATOM 1018 CZ PHE A 69 -6.657 -2.125 5.308 1.00 0.00 C ATOM 0 H PHE A 69 -9.104 -4.803 9.770 1.00 0.00 H new ATOM 0 HA PHE A 69 -8.387 -1.958 10.130 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -10.304 -3.189 8.135 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.145 -1.477 8.474 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -8.055 -4.407 7.387 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.788 -0.177 7.118 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -6.305 -4.224 5.644 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -7.196 -0.042 5.219 1.00 0.00 H new ATOM 0 HZ PHE A 69 -5.940 -2.052 4.503 1.00 0.00 H new ATOM 1028 N LYS A 70 -10.370 -1.937 11.739 1.00 0.00 N ATOM 1029 CA LYS A 70 -11.505 -1.965 12.650 1.00 0.00 C ATOM 1030 C LYS A 70 -12.779 -1.563 11.956 1.00 0.00 C ATOM 1031 O LYS A 70 -13.821 -2.163 12.213 1.00 0.00 O ATOM 1032 CB LYS A 70 -11.330 -1.179 13.957 1.00 0.00 C ATOM 1033 CG LYS A 70 -10.116 -0.260 14.021 1.00 0.00 C ATOM 1034 CD LYS A 70 -10.258 1.083 13.285 1.00 0.00 C ATOM 1035 CE LYS A 70 -11.190 2.017 14.074 1.00 0.00 C ATOM 1036 NZ LYS A 70 -11.113 3.424 13.634 1.00 0.00 N ATOM 0 H LYS A 70 -9.696 -1.190 11.907 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.567 -3.009 12.958 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -12.225 -0.579 14.121 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.268 -1.890 14.781 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.891 -0.058 15.068 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.259 -0.791 13.608 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -9.279 1.548 13.166 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.656 0.918 12.284 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -12.217 1.667 13.971 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -10.939 1.960 15.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -11.764 4.002 14.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -10.141 3.774 13.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -11.380 3.489 12.631 1.00 0.00 H new ATOM 1050 N ASP A 71 -12.689 -0.523 11.138 1.00 0.00 N ATOM 1051 CA ASP A 71 -13.858 0.186 10.672 1.00 0.00 C ATOM 1052 C ASP A 71 -13.718 0.450 9.182 1.00 0.00 C ATOM 1053 O ASP A 71 -13.409 1.567 8.764 1.00 0.00 O ATOM 1054 CB ASP A 71 -14.054 1.428 11.537 1.00 0.00 C ATOM 1055 CG ASP A 71 -15.500 1.904 11.479 1.00 0.00 C ATOM 1056 OD1 ASP A 71 -16.174 1.721 10.436 1.00 0.00 O ATOM 1057 OD2 ASP A 71 -15.953 2.535 12.456 1.00 0.00 O ATOM 0 H ASP A 71 -11.806 -0.154 10.784 1.00 0.00 H new ATOM 0 HA ASP A 71 -14.771 -0.400 10.780 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.781 1.205 12.568 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.391 2.223 11.196 1.00 0.00 H new ATOM 1062 N PRO A 72 -13.859 -0.597 8.362 1.00 0.00 N ATOM 1063 CA PRO A 72 -13.610 -0.489 6.936 1.00 0.00 C ATOM 1064 C PRO A 72 -14.662 0.360 6.205 1.00 0.00 C ATOM 1065 O PRO A 72 -14.313 0.957 5.184 1.00 0.00 O ATOM 1066 CB PRO A 72 -13.558 -1.932 6.441 1.00 0.00 C ATOM 1067 CG PRO A 72 -14.457 -2.674 7.410 1.00 0.00 C ATOM 1068 CD PRO A 72 -14.214 -1.962 8.740 1.00 0.00 C ATOM 0 HA PRO A 72 -12.680 0.040 6.730 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.917 -2.017 5.415 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -12.541 -2.325 6.456 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -15.503 -2.618 7.110 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.199 -3.731 7.468 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -15.104 -1.981 9.369 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.413 -2.439 9.305 1.00 0.00 H new ATOM 1076 N GLU A 73 -15.898 0.486 6.723 1.00 0.00 N ATOM 1077 CA GLU A 73 -17.022 1.052 5.977 1.00 0.00 C ATOM 1078 C GLU A 73 -16.754 2.486 5.527 1.00 0.00 C ATOM 1079 O GLU A 73 -17.323 2.910 4.522 1.00 0.00 O ATOM 1080 CB GLU A 73 -18.325 1.147 6.793 1.00 0.00 C ATOM 1081 CG GLU A 73 -18.632 0.186 7.927 1.00 0.00 C ATOM 1082 CD GLU A 73 -18.343 -1.272 7.628 1.00 0.00 C ATOM 1083 OE1 GLU A 73 -18.971 -1.866 6.718 1.00 0.00 O ATOM 1084 OE2 GLU A 73 -17.482 -1.816 8.348 1.00 0.00 O ATOM 0 H GLU A 73 -16.139 0.196 7.671 1.00 0.00 H new ATOM 0 HA GLU A 73 -17.132 0.362 5.140 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -18.361 2.152 7.213 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -19.148 1.069 6.083 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -18.054 0.483 8.802 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -19.685 0.285 8.192 1.00 0.00 H new ATOM 1091 N ASN A 74 -15.952 3.221 6.311 1.00 0.00 N ATOM 1092 CA ASN A 74 -15.652 4.641 6.167 1.00 0.00 C ATOM 1093 C ASN A 74 -14.149 4.910 6.038 1.00 0.00 C ATOM 1094 O ASN A 74 -13.777 6.008 5.626 1.00 0.00 O ATOM 1095 CB ASN A 74 -16.231 5.438 7.352 1.00 0.00 C ATOM 1096 CG ASN A 74 -17.261 6.443 6.891 1.00 0.00 C ATOM 1097 OD1 ASN A 74 -16.934 7.579 6.558 1.00 0.00 O ATOM 1098 ND2 ASN A 74 -18.517 6.042 6.898 1.00 0.00 N ATOM 0 H ASN A 74 -15.469 2.809 7.109 1.00 0.00 H new ATOM 0 HA ASN A 74 -16.124 4.973 5.242 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -16.685 4.752 8.067 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -15.425 5.954 7.874 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -19.259 6.684 6.620 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -18.747 5.089 7.182 1.00 0.00 H new ATOM 1105 N THR A 75 -13.275 3.951 6.364 1.00 0.00 N ATOM 1106 CA THR A 75 -11.843 4.066 6.112 1.00 0.00 C ATOM 1107 C THR A 75 -11.636 4.203 4.603 1.00 0.00 C ATOM 1108 O THR A 75 -12.049 3.325 3.846 1.00 0.00 O ATOM 1109 CB THR A 75 -11.107 2.868 6.767 1.00 0.00 C ATOM 1110 OG1 THR A 75 -10.865 3.210 8.117 1.00 0.00 O ATOM 1111 CG2 THR A 75 -9.749 2.459 6.147 1.00 0.00 C ATOM 0 H THR A 75 -13.546 3.075 6.810 1.00 0.00 H new ATOM 0 HA THR A 75 -11.409 4.955 6.569 1.00 0.00 H new ATOM 0 HB THR A 75 -11.763 2.011 6.616 1.00 0.00 H new ATOM 0 HG1 THR A 75 -10.164 3.893 8.161 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.339 1.611 6.696 1.00 0.00 H new ATOM 0 HG22 THR A 75 -9.895 2.180 5.103 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.055 3.298 6.205 1.00 0.00 H new ATOM 1119 N THR A 76 -10.948 5.257 4.160 1.00 0.00 N ATOM 1120 CA THR A 76 -10.411 5.401 2.809 1.00 0.00 C ATOM 1121 C THR A 76 -9.087 4.633 2.746 1.00 0.00 C ATOM 1122 O THR A 76 -8.223 4.838 3.595 1.00 0.00 O ATOM 1123 CB THR A 76 -10.140 6.887 2.528 1.00 0.00 C ATOM 1124 OG1 THR A 76 -11.177 7.726 3.009 1.00 0.00 O ATOM 1125 CG2 THR A 76 -9.856 7.157 1.056 1.00 0.00 C ATOM 0 H THR A 76 -10.743 6.061 4.754 1.00 0.00 H new ATOM 0 HA THR A 76 -11.117 5.016 2.074 1.00 0.00 H new ATOM 0 HB THR A 76 -9.236 7.135 3.085 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.961 8.661 2.810 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.671 8.221 0.910 1.00 0.00 H new ATOM 0 HG22 THR A 76 -8.978 6.590 0.745 1.00 0.00 H new ATOM 0 HG23 THR A 76 -10.715 6.853 0.458 1.00 0.00 H new ATOM 1133 N LEU A 77 -8.896 3.712 1.804 1.00 0.00 N ATOM 1134 CA LEU A 77 -7.640 2.981 1.665 1.00 0.00 C ATOM 1135 C LEU A 77 -6.777 3.597 0.565 1.00 0.00 C ATOM 1136 O LEU A 77 -7.280 4.310 -0.303 1.00 0.00 O ATOM 1137 CB LEU A 77 -7.960 1.505 1.365 1.00 0.00 C ATOM 1138 CG LEU A 77 -7.423 0.494 2.379 1.00 0.00 C ATOM 1139 CD1 LEU A 77 -7.757 -0.944 1.967 1.00 0.00 C ATOM 1140 CD2 LEU A 77 -5.906 0.614 2.518 1.00 0.00 C ATOM 0 H LEU A 77 -9.605 3.453 1.118 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.071 3.043 2.592 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -9.042 1.392 1.304 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.557 1.257 0.383 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.903 0.719 3.331 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.361 -1.637 2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.839 -1.062 1.902 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.309 -1.158 0.996 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.548 -0.115 3.245 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -5.436 0.425 1.553 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.650 1.618 2.856 1.00 0.00 H new ATOM 1152 N TYR A 78 -5.501 3.217 0.512 1.00 0.00 N ATOM 1153 CA TYR A 78 -4.557 3.545 -0.550 1.00 0.00 C ATOM 1154 C TYR A 78 -3.732 2.281 -0.825 1.00 0.00 C ATOM 1155 O TYR A 78 -2.965 1.870 0.047 1.00 0.00 O ATOM 1156 CB TYR A 78 -3.685 4.737 -0.105 1.00 0.00 C ATOM 1157 CG TYR A 78 -4.430 6.062 0.012 1.00 0.00 C ATOM 1158 CD1 TYR A 78 -5.146 6.387 1.183 1.00 0.00 C ATOM 1159 CD2 TYR A 78 -4.434 6.964 -1.068 1.00 0.00 C ATOM 1160 CE1 TYR A 78 -5.918 7.561 1.249 1.00 0.00 C ATOM 1161 CE2 TYR A 78 -5.171 8.160 -0.993 1.00 0.00 C ATOM 1162 CZ TYR A 78 -5.959 8.439 0.145 1.00 0.00 C ATOM 1163 OH TYR A 78 -6.778 9.527 0.167 1.00 0.00 O ATOM 0 H TYR A 78 -5.080 2.645 1.244 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.057 3.848 -1.470 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.237 4.501 0.860 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.867 4.857 -0.816 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -5.101 5.728 2.037 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -3.868 6.737 -1.959 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -6.479 7.790 2.143 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -5.134 8.867 -1.809 1.00 0.00 H new ATOM 0 HH TYR A 78 -7.301 9.559 -0.661 1.00 0.00 H new ATOM 1173 N ILE A 79 -3.884 1.627 -1.984 1.00 0.00 N ATOM 1174 CA ILE A 79 -3.080 0.436 -2.296 1.00 0.00 C ATOM 1175 C ILE A 79 -1.708 0.824 -2.851 1.00 0.00 C ATOM 1176 O ILE A 79 -1.613 1.782 -3.620 1.00 0.00 O ATOM 1177 CB ILE A 79 -3.871 -0.459 -3.263 1.00 0.00 C ATOM 1178 CG1 ILE A 79 -5.105 -0.995 -2.501 1.00 0.00 C ATOM 1179 CG2 ILE A 79 -3.046 -1.631 -3.812 1.00 0.00 C ATOM 1180 CD1 ILE A 79 -6.387 -0.550 -3.189 1.00 0.00 C ATOM 0 H ILE A 79 -4.546 1.896 -2.712 1.00 0.00 H new ATOM 0 HA ILE A 79 -2.887 -0.127 -1.383 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.159 0.138 -4.128 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -5.068 -2.083 -2.456 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -5.092 -0.632 -1.473 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.662 -2.224 -4.488 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.181 -1.246 -4.352 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.708 -2.257 -2.986 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -7.247 -0.935 -2.641 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -6.429 0.539 -3.211 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -6.405 -0.935 -4.209 1.00 0.00 H new ATOM 1192 N LEU A 80 -0.666 0.052 -2.502 1.00 0.00 N ATOM 1193 CA LEU A 80 0.734 0.295 -2.856 1.00 0.00 C ATOM 1194 C LEU A 80 1.381 -0.995 -3.389 1.00 0.00 C ATOM 1195 O LEU A 80 1.655 -1.912 -2.607 1.00 0.00 O ATOM 1196 CB LEU A 80 1.477 0.840 -1.614 1.00 0.00 C ATOM 1197 CG LEU A 80 2.718 1.716 -1.895 1.00 0.00 C ATOM 1198 CD1 LEU A 80 3.552 1.877 -0.617 1.00 0.00 C ATOM 1199 CD2 LEU A 80 3.664 1.181 -2.956 1.00 0.00 C ATOM 0 H LEU A 80 -0.786 -0.792 -1.942 1.00 0.00 H new ATOM 0 HA LEU A 80 0.797 1.038 -3.651 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.772 1.423 -1.021 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.786 -0.006 -1.000 1.00 0.00 H new ATOM 0 HG LEU A 80 2.300 2.654 -2.259 1.00 0.00 H new ATOM 0 HD11 LEU A 80 4.424 2.496 -0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 80 2.947 2.352 0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 80 3.878 0.897 -0.270 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.501 1.869 -3.077 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.038 0.204 -2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.132 1.086 -3.903 1.00 0.00 H new ATOM 1211 N ASP A 81 1.621 -1.077 -4.702 1.00 0.00 N ATOM 1212 CA ASP A 81 2.379 -2.168 -5.337 1.00 0.00 C ATOM 1213 C ASP A 81 3.895 -1.883 -5.369 1.00 0.00 C ATOM 1214 O ASP A 81 4.332 -0.781 -5.070 1.00 0.00 O ATOM 1215 CB ASP A 81 1.865 -2.416 -6.768 1.00 0.00 C ATOM 1216 CG ASP A 81 2.560 -3.645 -7.343 1.00 0.00 C ATOM 1217 OD1 ASP A 81 2.454 -4.703 -6.691 1.00 0.00 O ATOM 1218 OD2 ASP A 81 3.383 -3.526 -8.281 1.00 0.00 O ATOM 0 H ASP A 81 1.290 -0.378 -5.367 1.00 0.00 H new ATOM 0 HA ASP A 81 2.222 -3.061 -4.732 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.785 -2.565 -6.759 1.00 0.00 H new ATOM 0 HB3 ASP A 81 2.062 -1.546 -7.394 1.00 0.00 H new ATOM 1223 N LYS A 82 4.732 -2.854 -5.753 1.00 0.00 N ATOM 1224 CA LYS A 82 6.127 -2.666 -6.170 1.00 0.00 C ATOM 1225 C LYS A 82 6.226 -1.534 -7.179 1.00 0.00 C ATOM 1226 O LYS A 82 7.071 -0.670 -6.981 1.00 0.00 O ATOM 1227 CB LYS A 82 6.643 -3.956 -6.833 1.00 0.00 C ATOM 1228 CG LYS A 82 6.503 -5.265 -6.037 1.00 0.00 C ATOM 1229 CD LYS A 82 7.635 -5.520 -5.034 1.00 0.00 C ATOM 1230 CE LYS A 82 8.268 -6.897 -5.264 1.00 0.00 C ATOM 1231 NZ LYS A 82 9.204 -6.881 -6.403 1.00 0.00 N ATOM 0 H LYS A 82 4.444 -3.832 -5.783 1.00 0.00 H new ATOM 0 HA LYS A 82 6.724 -2.426 -5.290 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.119 -4.080 -7.781 1.00 0.00 H new ATOM 0 HB3 LYS A 82 7.698 -3.815 -7.068 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.555 -5.250 -5.500 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.460 -6.099 -6.737 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.395 -4.745 -5.132 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.247 -5.459 -4.017 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.796 -7.210 -4.363 1.00 0.00 H new ATOM 0 HE3 LYS A 82 7.484 -7.632 -5.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.613 -7.829 -6.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 8.695 -6.606 -7.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.965 -6.197 -6.217 1.00 0.00 H new ATOM 1245 N PHE A 83 5.429 -1.545 -8.249 1.00 0.00 N ATOM 1246 CA PHE A 83 5.664 -0.686 -9.398 1.00 0.00 C ATOM 1247 C PHE A 83 4.386 -0.429 -10.195 1.00 0.00 C ATOM 1248 O PHE A 83 4.207 0.660 -10.740 1.00 0.00 O ATOM 1249 CB PHE A 83 6.704 -1.391 -10.281 1.00 0.00 C ATOM 1250 CG PHE A 83 7.339 -0.508 -11.330 1.00 0.00 C ATOM 1251 CD1 PHE A 83 6.680 -0.268 -12.548 1.00 0.00 C ATOM 1252 CD2 PHE A 83 8.610 0.046 -11.097 1.00 0.00 C ATOM 1253 CE1 PHE A 83 7.308 0.495 -13.547 1.00 0.00 C ATOM 1254 CE2 PHE A 83 9.244 0.793 -12.103 1.00 0.00 C ATOM 1255 CZ PHE A 83 8.603 0.996 -13.336 1.00 0.00 C ATOM 0 H PHE A 83 4.610 -2.147 -8.338 1.00 0.00 H new ATOM 0 HA PHE A 83 6.018 0.288 -9.060 1.00 0.00 H new ATOM 0 HB2 PHE A 83 7.489 -1.797 -9.642 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.227 -2.237 -10.777 1.00 0.00 H new ATOM 0 HD1 PHE A 83 5.692 -0.670 -12.716 1.00 0.00 H new ATOM 0 HD2 PHE A 83 9.098 -0.103 -10.145 1.00 0.00 H new ATOM 0 HE1 PHE A 83 6.795 0.696 -14.476 1.00 0.00 H new ATOM 0 HE2 PHE A 83 10.224 1.211 -11.929 1.00 0.00 H new ATOM 0 HZ PHE A 83 9.106 1.538 -14.123 1.00 0.00 H new ATOM 1265 N ASP A 84 3.538 -1.450 -10.346 1.00 0.00 N ATOM 1266 CA ASP A 84 2.421 -1.454 -11.285 1.00 0.00 C ATOM 1267 C ASP A 84 1.387 -2.422 -10.732 1.00 0.00 C ATOM 1268 O ASP A 84 0.318 -2.007 -10.272 1.00 0.00 O ATOM 1269 CB ASP A 84 2.877 -1.909 -12.692 1.00 0.00 C ATOM 1270 CG ASP A 84 2.831 -0.810 -13.741 1.00 0.00 C ATOM 1271 OD1 ASP A 84 1.829 -0.055 -13.802 1.00 0.00 O ATOM 1272 OD2 ASP A 84 3.757 -0.749 -14.580 1.00 0.00 O ATOM 0 H ASP A 84 3.613 -2.312 -9.807 1.00 0.00 H new ATOM 0 HA ASP A 84 2.010 -0.450 -11.391 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.895 -2.293 -12.627 1.00 0.00 H new ATOM 0 HB3 ASP A 84 2.245 -2.735 -13.018 1.00 0.00 H new ATOM 1277 N GLY A 85 1.756 -3.707 -10.745 1.00 0.00 N ATOM 1278 CA GLY A 85 1.040 -4.846 -10.218 1.00 0.00 C ATOM 1279 C GLY A 85 -0.414 -4.831 -10.620 1.00 0.00 C ATOM 1280 O GLY A 85 -0.768 -5.269 -11.718 1.00 0.00 O ATOM 0 H GLY A 85 2.643 -3.988 -11.164 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.506 -5.765 -10.575 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.116 -4.851 -9.131 1.00 0.00 H new ATOM 1284 N ASN A 86 -1.257 -4.392 -9.689 1.00 0.00 N ATOM 1285 CA ASN A 86 -2.703 -4.376 -9.843 1.00 0.00 C ATOM 1286 C ASN A 86 -3.326 -3.214 -9.081 1.00 0.00 C ATOM 1287 O ASN A 86 -4.503 -3.303 -8.747 1.00 0.00 O ATOM 1288 CB ASN A 86 -3.321 -5.687 -9.331 1.00 0.00 C ATOM 1289 CG ASN A 86 -2.678 -6.954 -9.860 1.00 0.00 C ATOM 1290 OD1 ASN A 86 -1.941 -7.616 -9.132 1.00 0.00 O ATOM 1291 ND2 ASN A 86 -2.926 -7.325 -11.102 1.00 0.00 N ATOM 0 H ASN A 86 -0.944 -4.030 -8.788 1.00 0.00 H new ATOM 0 HA ASN A 86 -2.910 -4.262 -10.907 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.263 -5.696 -8.243 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -4.379 -5.698 -9.594 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.503 -8.175 -11.474 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -3.541 -6.761 -11.690 1.00 0.00 H new ATOM 1298 N SER A 87 -2.563 -2.184 -8.701 1.00 0.00 N ATOM 1299 CA SER A 87 -2.992 -1.235 -7.677 1.00 0.00 C ATOM 1300 C SER A 87 -4.381 -0.649 -7.991 1.00 0.00 C ATOM 1301 O SER A 87 -5.256 -0.640 -7.129 1.00 0.00 O ATOM 1302 CB SER A 87 -1.953 -0.121 -7.499 1.00 0.00 C ATOM 1303 OG SER A 87 -0.632 -0.611 -7.626 1.00 0.00 O ATOM 0 H SER A 87 -1.641 -1.989 -9.091 1.00 0.00 H new ATOM 0 HA SER A 87 -3.074 -1.780 -6.737 1.00 0.00 H new ATOM 0 HB2 SER A 87 -2.125 0.658 -8.241 1.00 0.00 H new ATOM 0 HB3 SER A 87 -2.078 0.339 -6.519 1.00 0.00 H new ATOM 0 HG SER A 87 0.003 0.126 -7.509 1.00 0.00 H new ATOM 1309 N GLU A 88 -4.600 -0.215 -9.237 1.00 0.00 N ATOM 1310 CA GLU A 88 -5.853 0.375 -9.715 1.00 0.00 C ATOM 1311 C GLU A 88 -6.996 -0.642 -9.854 1.00 0.00 C ATOM 1312 O GLU A 88 -8.154 -0.244 -9.968 1.00 0.00 O ATOM 1313 CB GLU A 88 -5.612 1.035 -11.081 1.00 0.00 C ATOM 1314 CG GLU A 88 -4.724 2.279 -10.978 1.00 0.00 C ATOM 1315 CD GLU A 88 -4.432 2.908 -12.344 1.00 0.00 C ATOM 1316 OE1 GLU A 88 -4.197 2.165 -13.330 1.00 0.00 O ATOM 1317 OE2 GLU A 88 -4.375 4.154 -12.432 1.00 0.00 O ATOM 0 H GLU A 88 -3.886 -0.267 -9.963 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.161 1.104 -8.965 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.147 0.314 -11.753 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.570 1.311 -11.523 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.210 3.016 -10.339 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.783 2.011 -10.497 1.00 0.00 H new ATOM 1324 N LEU A 89 -6.696 -1.943 -9.868 1.00 0.00 N ATOM 1325 CA LEU A 89 -7.681 -3.021 -9.832 1.00 0.00 C ATOM 1326 C LEU A 89 -8.166 -3.145 -8.391 1.00 0.00 C ATOM 1327 O LEU A 89 -9.362 -3.133 -8.121 1.00 0.00 O ATOM 1328 CB LEU A 89 -7.034 -4.339 -10.315 1.00 0.00 C ATOM 1329 CG LEU A 89 -7.974 -5.436 -10.844 1.00 0.00 C ATOM 1330 CD1 LEU A 89 -9.030 -5.905 -9.838 1.00 0.00 C ATOM 1331 CD2 LEU A 89 -8.634 -5.023 -12.162 1.00 0.00 C ATOM 0 H LEU A 89 -5.735 -2.282 -9.906 1.00 0.00 H new ATOM 0 HA LEU A 89 -8.522 -2.808 -10.491 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.322 -4.096 -11.104 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.461 -4.757 -9.487 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.327 -6.295 -11.021 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.649 -6.678 -10.294 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.536 -6.309 -8.954 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.657 -5.062 -9.549 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.291 -5.822 -12.506 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.217 -4.115 -12.008 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.865 -4.838 -12.912 1.00 0.00 H new ATOM 1343 N VAL A 90 -7.230 -3.231 -7.445 1.00 0.00 N ATOM 1344 CA VAL A 90 -7.558 -3.326 -6.032 1.00 0.00 C ATOM 1345 C VAL A 90 -8.309 -2.052 -5.587 1.00 0.00 C ATOM 1346 O VAL A 90 -9.191 -2.116 -4.725 1.00 0.00 O ATOM 1347 CB VAL A 90 -6.276 -3.599 -5.212 1.00 0.00 C ATOM 1348 CG1 VAL A 90 -6.640 -4.006 -3.776 1.00 0.00 C ATOM 1349 CG2 VAL A 90 -5.332 -4.639 -5.847 1.00 0.00 C ATOM 0 H VAL A 90 -6.229 -3.236 -7.641 1.00 0.00 H new ATOM 0 HA VAL A 90 -8.228 -4.167 -5.851 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.719 -2.662 -5.203 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.728 -4.195 -3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -7.202 -3.202 -3.301 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.248 -4.910 -3.797 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -4.457 -4.773 -5.210 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.855 -5.590 -5.950 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.015 -4.291 -6.830 1.00 0.00 H new ATOM 1359 N ALA A 91 -8.005 -0.897 -6.196 1.00 0.00 N ATOM 1360 CA ALA A 91 -8.603 0.387 -5.852 1.00 0.00 C ATOM 1361 C ALA A 91 -10.119 0.409 -6.151 1.00 0.00 C ATOM 1362 O ALA A 91 -10.832 1.252 -5.615 1.00 0.00 O ATOM 1363 CB ALA A 91 -7.907 1.507 -6.626 1.00 0.00 C ATOM 0 H ALA A 91 -7.324 -0.835 -6.953 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.471 0.541 -4.781 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -8.358 2.464 -6.365 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.848 1.523 -6.369 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -8.018 1.333 -7.696 1.00 0.00 H new ATOM 1369 N GLU A 92 -10.631 -0.513 -6.976 1.00 0.00 N ATOM 1370 CA GLU A 92 -12.045 -0.638 -7.348 1.00 0.00 C ATOM 1371 C GLU A 92 -12.636 -1.950 -6.822 1.00 0.00 C ATOM 1372 O GLU A 92 -13.593 -2.485 -7.390 1.00 0.00 O ATOM 1373 CB GLU A 92 -12.207 -0.502 -8.872 1.00 0.00 C ATOM 1374 CG GLU A 92 -11.535 -1.635 -9.669 1.00 0.00 C ATOM 1375 CD GLU A 92 -12.057 -1.718 -11.095 1.00 0.00 C ATOM 1376 OE1 GLU A 92 -11.947 -0.712 -11.831 1.00 0.00 O ATOM 1377 OE2 GLU A 92 -12.602 -2.780 -11.493 1.00 0.00 O ATOM 0 H GLU A 92 -10.047 -1.221 -7.421 1.00 0.00 H new ATOM 0 HA GLU A 92 -12.606 0.172 -6.881 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -13.269 -0.479 -9.115 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -11.787 0.452 -9.189 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.457 -1.475 -9.687 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -11.708 -2.585 -9.164 1.00 0.00 H new ATOM 1384 N LEU A 93 -12.058 -2.500 -5.754 1.00 0.00 N ATOM 1385 CA LEU A 93 -12.364 -3.837 -5.272 1.00 0.00 C ATOM 1386 C LEU A 93 -12.811 -3.780 -3.825 1.00 0.00 C ATOM 1387 O LEU A 93 -13.958 -4.109 -3.527 1.00 0.00 O ATOM 1388 CB LEU A 93 -11.116 -4.704 -5.464 1.00 0.00 C ATOM 1389 CG LEU A 93 -11.256 -6.150 -4.980 1.00 0.00 C ATOM 1390 CD1 LEU A 93 -12.117 -6.961 -5.936 1.00 0.00 C ATOM 1391 CD2 LEU A 93 -9.853 -6.745 -4.933 1.00 0.00 C ATOM 0 H LEU A 93 -11.354 -2.018 -5.195 1.00 0.00 H new ATOM 0 HA LEU A 93 -13.188 -4.278 -5.833 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -10.857 -4.714 -6.523 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -10.283 -4.239 -4.937 1.00 0.00 H new ATOM 0 HG LEU A 93 -11.734 -6.172 -4.000 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.201 -7.984 -5.571 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -13.110 -6.515 -5.999 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -11.658 -6.966 -6.925 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.907 -7.779 -4.592 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.411 -6.714 -5.929 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.236 -6.168 -4.245 1.00 0.00 H new ATOM 1403 N VAL A 94 -11.937 -3.354 -2.914 1.00 0.00 N ATOM 1404 CA VAL A 94 -12.273 -3.252 -1.495 1.00 0.00 C ATOM 1405 C VAL A 94 -13.497 -2.360 -1.286 1.00 0.00 C ATOM 1406 O VAL A 94 -14.404 -2.732 -0.538 1.00 0.00 O ATOM 1407 CB VAL A 94 -11.060 -2.776 -0.678 1.00 0.00 C ATOM 1408 CG1 VAL A 94 -10.054 -3.920 -0.539 1.00 0.00 C ATOM 1409 CG2 VAL A 94 -10.359 -1.548 -1.274 1.00 0.00 C ATOM 0 H VAL A 94 -10.982 -3.072 -3.137 1.00 0.00 H new ATOM 0 HA VAL A 94 -12.536 -4.245 -1.130 1.00 0.00 H new ATOM 0 HB VAL A 94 -11.443 -2.474 0.297 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.195 -3.581 0.040 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -10.526 -4.760 -0.030 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.723 -4.235 -1.528 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -9.514 -1.270 -0.644 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -10.002 -1.784 -2.277 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.062 -0.717 -1.325 1.00 0.00 H new ATOM 1419 N ALA A 95 -13.571 -1.241 -2.017 1.00 0.00 N ATOM 1420 CA ALA A 95 -14.678 -0.296 -1.971 1.00 0.00 C ATOM 1421 C ALA A 95 -16.022 -0.923 -2.363 1.00 0.00 C ATOM 1422 O ALA A 95 -17.069 -0.317 -2.149 1.00 0.00 O ATOM 1423 CB ALA A 95 -14.366 0.886 -2.894 1.00 0.00 C ATOM 0 H ALA A 95 -12.839 -0.966 -2.673 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.780 0.036 -0.938 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -15.191 1.598 -2.865 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.451 1.376 -2.561 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.234 0.526 -3.914 1.00 0.00 H new ATOM 1429 N LEU A 96 -16.005 -2.132 -2.933 1.00 0.00 N ATOM 1430 CA LEU A 96 -17.170 -2.884 -3.370 1.00 0.00 C ATOM 1431 C LEU A 96 -17.260 -4.233 -2.646 1.00 0.00 C ATOM 1432 O LEU A 96 -18.021 -5.104 -3.068 1.00 0.00 O ATOM 1433 CB LEU A 96 -17.150 -3.013 -4.903 1.00 0.00 C ATOM 1434 CG LEU A 96 -17.352 -1.631 -5.562 1.00 0.00 C ATOM 1435 CD1 LEU A 96 -16.123 -1.176 -6.338 1.00 0.00 C ATOM 1436 CD2 LEU A 96 -18.559 -1.600 -6.495 1.00 0.00 C ATOM 0 H LEU A 96 -15.133 -2.631 -3.108 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.079 -2.347 -3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -16.201 -3.442 -5.226 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.935 -3.696 -5.227 1.00 0.00 H new ATOM 0 HG LEU A 96 -17.527 -0.944 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -16.314 -0.199 -6.783 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -15.271 -1.106 -5.662 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -15.903 -1.896 -7.126 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -18.656 -0.606 -6.932 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.424 -2.334 -7.289 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -19.461 -1.838 -5.931 1.00 0.00 H new ATOM 1448 N ASN A 97 -16.508 -4.434 -1.560 1.00 0.00 N ATOM 1449 CA ASN A 97 -16.479 -5.679 -0.789 1.00 0.00 C ATOM 1450 C ASN A 97 -16.601 -5.430 0.719 1.00 0.00 C ATOM 1451 O ASN A 97 -16.391 -6.368 1.500 1.00 0.00 O ATOM 1452 CB ASN A 97 -15.224 -6.495 -1.152 1.00 0.00 C ATOM 1453 CG ASN A 97 -15.439 -7.273 -2.440 1.00 0.00 C ATOM 1454 OD1 ASN A 97 -15.918 -8.407 -2.410 1.00 0.00 O ATOM 1455 ND2 ASN A 97 -15.124 -6.686 -3.578 1.00 0.00 N ATOM 0 H ASN A 97 -15.887 -3.717 -1.184 1.00 0.00 H new ATOM 0 HA ASN A 97 -17.354 -6.269 -1.060 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -14.370 -5.827 -1.264 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -14.986 -7.184 -0.341 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.276 -7.172 -4.462 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -14.729 -5.746 -3.575 1.00 0.00 H new ATOM 1462 N GLY A 98 -16.931 -4.204 1.143 1.00 0.00 N ATOM 1463 CA GLY A 98 -17.150 -3.849 2.545 1.00 0.00 C ATOM 1464 C GLY A 98 -16.420 -2.581 2.985 1.00 0.00 C ATOM 1465 O GLY A 98 -16.326 -2.342 4.186 1.00 0.00 O ATOM 0 H GLY A 98 -17.055 -3.417 0.506 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -18.219 -3.718 2.713 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -16.828 -4.679 3.174 1.00 0.00 H new ATOM 1469 N PHE A 99 -15.864 -1.795 2.057 1.00 0.00 N ATOM 1470 CA PHE A 99 -15.150 -0.566 2.373 1.00 0.00 C ATOM 1471 C PHE A 99 -15.734 0.633 1.620 1.00 0.00 C ATOM 1472 O PHE A 99 -16.534 0.458 0.703 1.00 0.00 O ATOM 1473 CB PHE A 99 -13.670 -0.700 2.019 1.00 0.00 C ATOM 1474 CG PHE A 99 -12.805 -1.591 2.886 1.00 0.00 C ATOM 1475 CD1 PHE A 99 -12.860 -2.994 2.826 1.00 0.00 C ATOM 1476 CD2 PHE A 99 -11.843 -0.975 3.699 1.00 0.00 C ATOM 1477 CE1 PHE A 99 -11.990 -3.753 3.631 1.00 0.00 C ATOM 1478 CE2 PHE A 99 -10.930 -1.721 4.446 1.00 0.00 C ATOM 1479 CZ PHE A 99 -11.038 -3.115 4.451 1.00 0.00 C ATOM 0 H PHE A 99 -15.901 -2.001 1.059 1.00 0.00 H new ATOM 0 HA PHE A 99 -15.261 -0.396 3.444 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -13.604 -1.067 0.995 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -13.234 0.299 2.028 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -13.563 -3.485 2.169 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -11.808 0.103 3.748 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -12.052 -4.831 3.620 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -10.152 -1.229 5.011 1.00 0.00 H new ATOM 0 HZ PHE A 99 -10.391 -3.704 5.084 1.00 0.00 H new ATOM 1489 N LYS A 100 -15.298 1.850 1.976 1.00 0.00 N ATOM 1490 CA LYS A 100 -15.828 3.107 1.456 1.00 0.00 C ATOM 1491 C LYS A 100 -15.488 3.404 -0.012 1.00 0.00 C ATOM 1492 O LYS A 100 -16.401 3.411 -0.841 1.00 0.00 O ATOM 1493 CB LYS A 100 -15.436 4.284 2.373 1.00 0.00 C ATOM 1494 CG LYS A 100 -16.270 5.562 2.148 1.00 0.00 C ATOM 1495 CD LYS A 100 -17.732 5.585 2.617 1.00 0.00 C ATOM 1496 CE LYS A 100 -18.693 4.630 1.902 1.00 0.00 C ATOM 1497 NZ LYS A 100 -18.668 4.717 0.423 1.00 0.00 N ATOM 0 H LYS A 100 -14.546 1.985 2.652 1.00 0.00 H new ATOM 0 HA LYS A 100 -16.911 2.984 1.463 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -15.542 3.972 3.412 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -14.383 4.518 2.216 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -15.752 6.385 2.641 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -16.263 5.776 1.079 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -17.752 5.356 3.682 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -18.111 6.600 2.502 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -18.453 3.608 2.196 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -19.707 4.832 2.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -19.546 4.314 0.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -18.588 5.713 0.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -17.853 4.185 0.058 1.00 0.00 H new ATOM 1511 N SER A 101 -14.254 3.834 -0.271 1.00 0.00 N ATOM 1512 CA SER A 101 -13.767 4.506 -1.468 1.00 0.00 C ATOM 1513 C SER A 101 -12.248 4.356 -1.485 1.00 0.00 C ATOM 1514 O SER A 101 -11.594 4.620 -0.469 1.00 0.00 O ATOM 1515 CB SER A 101 -14.061 6.008 -1.413 1.00 0.00 C ATOM 1516 OG SER A 101 -15.439 6.265 -1.193 1.00 0.00 O ATOM 0 H SER A 101 -13.507 3.709 0.413 1.00 0.00 H new ATOM 0 HA SER A 101 -14.251 4.071 -2.342 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.474 6.465 -0.616 1.00 0.00 H new ATOM 0 HB3 SER A 101 -13.748 6.475 -2.347 1.00 0.00 H new ATOM 0 HG SER A 101 -15.590 7.233 -1.162 1.00 0.00 H new ATOM 1522 N ALA A 102 -11.679 3.928 -2.607 1.00 0.00 N ATOM 1523 CA ALA A 102 -10.285 3.506 -2.667 1.00 0.00 C ATOM 1524 C ALA A 102 -9.527 4.156 -3.833 1.00 0.00 C ATOM 1525 O ALA A 102 -10.089 4.744 -4.758 1.00 0.00 O ATOM 1526 CB ALA A 102 -10.224 1.970 -2.623 1.00 0.00 C ATOM 0 H ALA A 102 -12.170 3.864 -3.499 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.748 3.869 -1.791 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.184 1.646 -2.667 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.676 1.614 -1.697 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.769 1.560 -3.473 1.00 0.00 H new ATOM 1532 N TYR A 103 -8.203 4.133 -3.689 1.00 0.00 N ATOM 1533 CA TYR A 103 -7.172 4.864 -4.417 1.00 0.00 C ATOM 1534 C TYR A 103 -5.996 3.918 -4.681 1.00 0.00 C ATOM 1535 O TYR A 103 -5.803 2.937 -3.956 1.00 0.00 O ATOM 1536 CB TYR A 103 -6.619 5.999 -3.534 1.00 0.00 C ATOM 1537 CG TYR A 103 -7.406 7.288 -3.391 1.00 0.00 C ATOM 1538 CD1 TYR A 103 -8.650 7.311 -2.733 1.00 0.00 C ATOM 1539 CD2 TYR A 103 -6.807 8.504 -3.776 1.00 0.00 C ATOM 1540 CE1 TYR A 103 -9.291 8.532 -2.465 1.00 0.00 C ATOM 1541 CE2 TYR A 103 -7.424 9.730 -3.478 1.00 0.00 C ATOM 1542 CZ TYR A 103 -8.669 9.750 -2.819 1.00 0.00 C ATOM 1543 OH TYR A 103 -9.238 10.941 -2.508 1.00 0.00 O ATOM 0 H TYR A 103 -7.782 3.534 -2.979 1.00 0.00 H new ATOM 0 HA TYR A 103 -7.602 5.255 -5.339 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -6.474 5.592 -2.533 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -5.633 6.260 -3.918 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -9.115 6.384 -2.432 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -5.865 8.493 -4.305 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -10.260 8.540 -1.988 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -6.944 10.657 -3.754 1.00 0.00 H new ATOM 0 HH TYR A 103 -8.667 11.670 -2.829 1.00 0.00 H new ATOM 1553 N ALA A 104 -5.139 4.275 -5.636 1.00 0.00 N ATOM 1554 CA ALA A 104 -3.860 3.625 -5.898 1.00 0.00 C ATOM 1555 C ALA A 104 -2.754 4.682 -5.990 1.00 0.00 C ATOM 1556 O ALA A 104 -3.044 5.866 -6.183 1.00 0.00 O ATOM 1557 CB ALA A 104 -3.977 2.832 -7.204 1.00 0.00 C ATOM 0 H ALA A 104 -5.324 5.052 -6.270 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.604 2.942 -5.088 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -3.029 2.339 -7.416 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -4.762 2.082 -7.105 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.224 3.510 -8.021 1.00 0.00 H new ATOM 1563 N ILE A 105 -1.495 4.251 -5.925 1.00 0.00 N ATOM 1564 CA ILE A 105 -0.313 5.069 -6.187 1.00 0.00 C ATOM 1565 C ILE A 105 0.349 4.525 -7.459 1.00 0.00 C ATOM 1566 O ILE A 105 0.509 3.312 -7.624 1.00 0.00 O ATOM 1567 CB ILE A 105 0.630 5.170 -4.949 1.00 0.00 C ATOM 1568 CG1 ILE A 105 2.115 5.235 -5.375 1.00 0.00 C ATOM 1569 CG2 ILE A 105 0.409 4.085 -3.883 1.00 0.00 C ATOM 1570 CD1 ILE A 105 3.103 5.423 -4.225 1.00 0.00 C ATOM 0 H ILE A 105 -1.262 3.289 -5.680 1.00 0.00 H new ATOM 0 HA ILE A 105 -0.591 6.108 -6.363 1.00 0.00 H new ATOM 0 HB ILE A 105 0.357 6.108 -4.465 1.00 0.00 H new ATOM 0 HG12 ILE A 105 2.367 4.317 -5.906 1.00 0.00 H new ATOM 0 HG13 ILE A 105 2.240 6.056 -6.081 1.00 0.00 H new ATOM 0 HG21 ILE A 105 1.109 4.235 -3.061 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -0.612 4.147 -3.507 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.574 3.102 -4.325 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.118 5.457 -4.620 1.00 0.00 H new ATOM 0 HD12 ILE A 105 2.884 6.356 -3.706 1.00 0.00 H new ATOM 0 HD13 ILE A 105 3.012 4.590 -3.528 1.00 0.00 H new ATOM 1582 N LYS A 106 0.727 5.433 -8.357 1.00 0.00 N ATOM 1583 CA LYS A 106 1.481 5.150 -9.570 1.00 0.00 C ATOM 1584 C LYS A 106 2.949 4.901 -9.236 1.00 0.00 C ATOM 1585 O LYS A 106 3.446 5.421 -8.241 1.00 0.00 O ATOM 1586 CB LYS A 106 1.358 6.373 -10.481 1.00 0.00 C ATOM 1587 CG LYS A 106 1.804 6.081 -11.925 1.00 0.00 C ATOM 1588 CD LYS A 106 0.975 6.825 -12.981 1.00 0.00 C ATOM 1589 CE LYS A 106 -0.282 6.015 -13.330 1.00 0.00 C ATOM 1590 NZ LYS A 106 -1.139 6.703 -14.317 1.00 0.00 N ATOM 0 H LYS A 106 0.506 6.423 -8.253 1.00 0.00 H new ATOM 0 HA LYS A 106 1.090 4.258 -10.060 1.00 0.00 H new ATOM 0 HB2 LYS A 106 0.323 6.715 -10.486 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.961 7.186 -10.076 1.00 0.00 H new ATOM 0 HG2 LYS A 106 2.853 6.357 -12.036 1.00 0.00 H new ATOM 0 HG3 LYS A 106 1.735 5.009 -12.109 1.00 0.00 H new ATOM 0 HD2 LYS A 106 0.691 7.808 -12.606 1.00 0.00 H new ATOM 0 HD3 LYS A 106 1.574 6.987 -13.877 1.00 0.00 H new ATOM 0 HE2 LYS A 106 0.013 5.043 -13.724 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -0.855 5.830 -12.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -1.974 6.117 -14.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -1.444 7.620 -13.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -0.603 6.857 -15.195 1.00 0.00 H new ATOM 1604 N ASP A 107 3.652 4.170 -10.104 1.00 0.00 N ATOM 1605 CA ASP A 107 5.073 3.813 -9.976 1.00 0.00 C ATOM 1606 C ASP A 107 5.360 2.987 -8.707 1.00 0.00 C ATOM 1607 O ASP A 107 6.523 2.714 -8.395 1.00 0.00 O ATOM 1608 CB ASP A 107 5.993 5.049 -10.071 1.00 0.00 C ATOM 1609 CG ASP A 107 5.818 5.885 -11.330 1.00 0.00 C ATOM 1610 OD1 ASP A 107 6.182 5.412 -12.430 1.00 0.00 O ATOM 1611 OD2 ASP A 107 5.356 7.040 -11.250 1.00 0.00 O ATOM 0 H ASP A 107 3.231 3.793 -10.953 1.00 0.00 H new ATOM 0 HA ASP A 107 5.305 3.173 -10.827 1.00 0.00 H new ATOM 0 HB2 ASP A 107 5.814 5.684 -9.203 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.030 4.717 -10.015 1.00 0.00 H new ATOM 1616 N GLY A 108 4.308 2.561 -7.995 1.00 0.00 N ATOM 1617 CA GLY A 108 4.336 1.798 -6.763 1.00 0.00 C ATOM 1618 C GLY A 108 5.361 2.332 -5.775 1.00 0.00 C ATOM 1619 O GLY A 108 5.380 3.521 -5.465 1.00 0.00 O ATOM 0 H GLY A 108 3.354 2.760 -8.295 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.348 1.818 -6.304 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.562 0.756 -6.989 1.00 0.00 H new ATOM 1623 N ALA A 109 6.175 1.442 -5.220 1.00 0.00 N ATOM 1624 CA ALA A 109 7.236 1.749 -4.296 1.00 0.00 C ATOM 1625 C ALA A 109 8.516 2.040 -5.060 1.00 0.00 C ATOM 1626 O ALA A 109 9.144 3.060 -4.797 1.00 0.00 O ATOM 1627 CB ALA A 109 7.447 0.573 -3.335 1.00 0.00 C ATOM 0 H ALA A 109 6.102 0.444 -5.417 1.00 0.00 H new ATOM 0 HA ALA A 109 6.963 2.631 -3.717 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.251 0.812 -2.639 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.528 0.388 -2.779 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.712 -0.318 -3.904 1.00 0.00 H new ATOM 1633 N GLU A 110 8.934 1.103 -5.911 1.00 0.00 N ATOM 1634 CA GLU A 110 10.297 1.001 -6.402 1.00 0.00 C ATOM 1635 C GLU A 110 10.569 1.852 -7.647 1.00 0.00 C ATOM 1636 O GLU A 110 11.708 1.883 -8.120 1.00 0.00 O ATOM 1637 CB GLU A 110 10.692 -0.469 -6.638 1.00 0.00 C ATOM 1638 CG GLU A 110 11.173 -1.151 -5.348 1.00 0.00 C ATOM 1639 CD GLU A 110 12.026 -2.374 -5.687 1.00 0.00 C ATOM 1640 OE1 GLU A 110 11.450 -3.443 -5.984 1.00 0.00 O ATOM 1641 OE2 GLU A 110 13.278 -2.272 -5.741 1.00 0.00 O ATOM 0 H GLU A 110 8.317 0.381 -6.283 1.00 0.00 H new ATOM 0 HA GLU A 110 10.929 1.413 -5.616 1.00 0.00 H new ATOM 0 HB2 GLU A 110 9.837 -1.014 -7.039 1.00 0.00 H new ATOM 0 HB3 GLU A 110 11.481 -0.516 -7.389 1.00 0.00 H new ATOM 0 HG2 GLU A 110 11.753 -0.448 -4.750 1.00 0.00 H new ATOM 0 HG3 GLU A 110 10.316 -1.451 -4.745 1.00 0.00 H new ATOM 1648 N GLY A 111 9.566 2.529 -8.210 1.00 0.00 N ATOM 1649 CA GLY A 111 9.793 3.397 -9.354 1.00 0.00 C ATOM 1650 C GLY A 111 10.689 4.590 -8.984 1.00 0.00 C ATOM 1651 O GLY A 111 10.690 5.020 -7.831 1.00 0.00 O ATOM 0 H GLY A 111 8.598 2.490 -7.891 1.00 0.00 H new ATOM 0 HA2 GLY A 111 10.258 2.827 -10.159 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.838 3.761 -9.732 1.00 0.00 H new ATOM 1655 N PRO A 112 11.347 5.244 -9.961 1.00 0.00 N ATOM 1656 CA PRO A 112 12.125 6.479 -9.770 1.00 0.00 C ATOM 1657 C PRO A 112 11.273 7.658 -9.301 1.00 0.00 C ATOM 1658 O PRO A 112 11.798 8.717 -8.950 1.00 0.00 O ATOM 1659 CB PRO A 112 12.744 6.777 -11.140 1.00 0.00 C ATOM 1660 CG PRO A 112 11.796 6.092 -12.118 1.00 0.00 C ATOM 1661 CD PRO A 112 11.399 4.837 -11.352 1.00 0.00 C ATOM 0 HA PRO A 112 12.870 6.340 -8.987 1.00 0.00 H new ATOM 0 HB2 PRO A 112 12.807 7.849 -11.327 1.00 0.00 H new ATOM 0 HB3 PRO A 112 13.756 6.380 -11.218 1.00 0.00 H new ATOM 0 HG2 PRO A 112 10.934 6.715 -12.354 1.00 0.00 H new ATOM 0 HG3 PRO A 112 12.286 5.855 -13.062 1.00 0.00 H new ATOM 0 HD2 PRO A 112 10.434 4.459 -11.688 1.00 0.00 H new ATOM 0 HD3 PRO A 112 12.125 4.038 -11.502 1.00 0.00 H new ATOM 1669 N ARG A 113 9.957 7.488 -9.330 1.00 0.00 N ATOM 1670 CA ARG A 113 8.933 8.434 -8.928 1.00 0.00 C ATOM 1671 C ARG A 113 7.832 7.721 -8.139 1.00 0.00 C ATOM 1672 O ARG A 113 6.730 8.261 -8.035 1.00 0.00 O ATOM 1673 CB ARG A 113 8.390 9.108 -10.194 1.00 0.00 C ATOM 1674 CG ARG A 113 9.433 9.983 -10.908 1.00 0.00 C ATOM 1675 CD ARG A 113 8.882 10.620 -12.185 1.00 0.00 C ATOM 1676 NE ARG A 113 7.767 11.540 -11.916 1.00 0.00 N ATOM 1677 CZ ARG A 113 6.467 11.252 -11.979 1.00 0.00 C ATOM 1678 NH1 ARG A 113 6.053 10.032 -12.284 1.00 0.00 N ATOM 1679 NH2 ARG A 113 5.572 12.192 -11.727 1.00 0.00 N ATOM 0 H ARG A 113 9.550 6.614 -9.662 1.00 0.00 H new ATOM 0 HA ARG A 113 9.346 9.197 -8.268 1.00 0.00 H new ATOM 0 HB2 ARG A 113 8.036 8.341 -10.883 1.00 0.00 H new ATOM 0 HB3 ARG A 113 7.529 9.722 -9.930 1.00 0.00 H new ATOM 0 HG2 ARG A 113 9.771 10.767 -10.230 1.00 0.00 H new ATOM 0 HG3 ARG A 113 10.305 9.377 -11.154 1.00 0.00 H new ATOM 0 HD2 ARG A 113 9.681 11.160 -12.692 1.00 0.00 H new ATOM 0 HD3 ARG A 113 8.547 9.836 -12.864 1.00 0.00 H new ATOM 0 HE ARG A 113 8.013 12.495 -11.655 1.00 0.00 H new ATOM 0 HH11 ARG A 113 6.733 9.296 -12.475 1.00 0.00 H new ATOM 0 HH12 ARG A 113 5.054 9.828 -12.328 1.00 0.00 H new ATOM 0 HH21 ARG A 113 5.877 13.135 -11.485 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.577 11.974 -11.775 1.00 0.00 H new ATOM 1693 N GLY A 114 8.079 6.501 -7.655 1.00 0.00 N ATOM 1694 CA GLY A 114 7.165 5.792 -6.779 1.00 0.00 C ATOM 1695 C GLY A 114 7.254 6.394 -5.387 1.00 0.00 C ATOM 1696 O GLY A 114 7.617 7.559 -5.210 1.00 0.00 O ATOM 0 H GLY A 114 8.930 5.979 -7.867 1.00 0.00 H new ATOM 0 HA2 GLY A 114 6.146 5.866 -7.158 1.00 0.00 H new ATOM 0 HA3 GLY A 114 7.417 4.732 -6.749 1.00 0.00 H new ATOM 1700 N TRP A 115 6.886 5.604 -4.387 1.00 0.00 N ATOM 1701 CA TRP A 115 7.010 5.963 -2.988 1.00 0.00 C ATOM 1702 C TRP A 115 8.454 6.354 -2.677 1.00 0.00 C ATOM 1703 O TRP A 115 8.696 7.378 -2.033 1.00 0.00 O ATOM 1704 CB TRP A 115 6.578 4.773 -2.127 1.00 0.00 C ATOM 1705 CG TRP A 115 6.274 5.114 -0.708 1.00 0.00 C ATOM 1706 CD1 TRP A 115 7.193 5.324 0.259 1.00 0.00 C ATOM 1707 CD2 TRP A 115 4.975 5.360 -0.100 1.00 0.00 C ATOM 1708 NE1 TRP A 115 6.543 5.614 1.446 1.00 0.00 N ATOM 1709 CE2 TRP A 115 5.176 5.714 1.263 1.00 0.00 C ATOM 1710 CE3 TRP A 115 3.647 5.350 -0.575 1.00 0.00 C ATOM 1711 CZ2 TRP A 115 4.099 6.070 2.092 1.00 0.00 C ATOM 1712 CZ3 TRP A 115 2.564 5.705 0.245 1.00 0.00 C ATOM 1713 CH2 TRP A 115 2.791 6.075 1.577 1.00 0.00 C ATOM 0 H TRP A 115 6.485 4.677 -4.533 1.00 0.00 H new ATOM 0 HA TRP A 115 6.369 6.817 -2.767 1.00 0.00 H new ATOM 0 HB2 TRP A 115 5.695 4.318 -2.575 1.00 0.00 H new ATOM 0 HB3 TRP A 115 7.368 4.022 -2.146 1.00 0.00 H new ATOM 0 HD1 TRP A 115 8.264 5.274 0.127 1.00 0.00 H new ATOM 0 HE1 TRP A 115 7.013 5.738 2.343 1.00 0.00 H new ATOM 0 HE3 TRP A 115 3.458 5.061 -1.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 4.276 6.339 3.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 1.559 5.693 -0.150 1.00 0.00 H new ATOM 0 HH2 TRP A 115 1.963 6.364 2.207 1.00 0.00 H new ATOM 1724 N LEU A 116 9.404 5.506 -3.080 1.00 0.00 N ATOM 1725 CA LEU A 116 10.798 5.759 -2.976 1.00 0.00 C ATOM 1726 C LEU A 116 11.126 6.812 -4.027 1.00 0.00 C ATOM 1727 O LEU A 116 10.361 7.174 -4.920 1.00 0.00 O ATOM 1728 CB LEU A 116 11.593 4.457 -3.212 1.00 0.00 C ATOM 1729 CG LEU A 116 11.390 3.384 -2.121 1.00 0.00 C ATOM 1730 CD1 LEU A 116 11.926 2.030 -2.594 1.00 0.00 C ATOM 1731 CD2 LEU A 116 12.091 3.774 -0.814 1.00 0.00 C ATOM 0 H LEU A 116 9.191 4.601 -3.498 1.00 0.00 H new ATOM 0 HA LEU A 116 11.070 6.117 -1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.304 4.038 -4.176 1.00 0.00 H new ATOM 0 HB3 LEU A 116 12.654 4.699 -3.275 1.00 0.00 H new ATOM 0 HG LEU A 116 10.319 3.310 -1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.775 1.286 -1.812 1.00 0.00 H new ATOM 0 HD12 LEU A 116 11.395 1.723 -3.495 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.991 2.116 -2.812 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.928 2.997 -0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.160 3.886 -0.994 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.684 4.717 -0.450 1.00 0.00 H new ATOM 1743 N ASN A 117 12.297 7.357 -3.816 1.00 0.00 N ATOM 1744 CA ASN A 117 12.890 8.520 -4.491 1.00 0.00 C ATOM 1745 C ASN A 117 11.925 9.733 -4.568 1.00 0.00 C ATOM 1746 O ASN A 117 12.122 10.657 -5.361 1.00 0.00 O ATOM 1747 CB ASN A 117 13.445 8.056 -5.852 1.00 0.00 C ATOM 1748 CG ASN A 117 14.304 9.073 -6.605 1.00 0.00 C ATOM 1749 OD1 ASN A 117 14.721 10.118 -6.105 1.00 0.00 O ATOM 1750 ND2 ASN A 117 14.651 8.755 -7.835 1.00 0.00 N ATOM 0 H ASN A 117 12.927 6.977 -3.109 1.00 0.00 H new ATOM 0 HA ASN A 117 13.720 8.908 -3.900 1.00 0.00 H new ATOM 0 HB2 ASN A 117 14.038 7.156 -5.693 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.606 7.776 -6.489 1.00 0.00 H new ATOM 0 HD21 ASN A 117 15.262 9.373 -8.368 1.00 0.00 H new ATOM 0 HD22 ASN A 117 14.308 7.890 -8.254 1.00 0.00 H new ATOM 1757 N SER A 118 10.890 9.793 -3.720 1.00 0.00 N ATOM 1758 CA SER A 118 9.920 10.889 -3.645 1.00 0.00 C ATOM 1759 C SER A 118 9.879 11.516 -2.246 1.00 0.00 C ATOM 1760 O SER A 118 8.907 12.197 -1.915 1.00 0.00 O ATOM 1761 CB SER A 118 8.537 10.410 -4.111 1.00 0.00 C ATOM 1762 OG SER A 118 8.567 10.023 -5.474 1.00 0.00 O ATOM 0 H SER A 118 10.700 9.053 -3.044 1.00 0.00 H new ATOM 0 HA SER A 118 10.242 11.680 -4.322 1.00 0.00 H new ATOM 0 HB2 SER A 118 8.214 9.569 -3.497 1.00 0.00 H new ATOM 0 HB3 SER A 118 7.806 11.206 -3.971 1.00 0.00 H new ATOM 0 HG SER A 118 8.053 9.197 -5.591 1.00 0.00 H new ATOM 1768 N SER A 119 10.919 11.318 -1.427 1.00 0.00 N ATOM 1769 CA SER A 119 11.091 11.879 -0.083 1.00 0.00 C ATOM 1770 C SER A 119 10.265 11.152 0.979 1.00 0.00 C ATOM 1771 O SER A 119 10.232 11.612 2.119 1.00 0.00 O ATOM 1772 CB SER A 119 10.788 13.391 -0.059 1.00 0.00 C ATOM 1773 OG SER A 119 11.619 14.090 0.849 1.00 0.00 O ATOM 0 H SER A 119 11.706 10.729 -1.700 1.00 0.00 H new ATOM 0 HA SER A 119 12.140 11.729 0.171 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.920 13.802 -1.060 1.00 0.00 H new ATOM 0 HB3 SER A 119 9.744 13.546 0.214 1.00 0.00 H new ATOM 0 HG SER A 119 11.394 15.044 0.831 1.00 0.00 H new ATOM 1779 N LEU A 120 9.540 10.084 0.641 1.00 0.00 N ATOM 1780 CA LEU A 120 8.643 9.458 1.604 1.00 0.00 C ATOM 1781 C LEU A 120 9.408 8.547 2.562 1.00 0.00 C ATOM 1782 O LEU A 120 10.398 7.935 2.157 1.00 0.00 O ATOM 1783 CB LEU A 120 7.508 8.708 0.904 1.00 0.00 C ATOM 1784 CG LEU A 120 6.544 9.648 0.171 1.00 0.00 C ATOM 1785 CD1 LEU A 120 5.426 8.848 -0.496 1.00 0.00 C ATOM 1786 CD2 LEU A 120 5.945 10.670 1.142 1.00 0.00 C ATOM 0 H LEU A 120 9.557 9.643 -0.278 1.00 0.00 H new ATOM 0 HA LEU A 120 8.190 10.252 2.198 1.00 0.00 H new ATOM 0 HB2 LEU A 120 7.931 8.000 0.192 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.953 8.127 1.640 1.00 0.00 H new ATOM 0 HG LEU A 120 7.105 10.181 -0.596 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.750 9.529 -1.012 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.857 8.150 -1.214 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.873 8.293 0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.264 11.328 0.603 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.400 10.148 1.928 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.745 11.262 1.587 1.00 0.00 H new ATOM 1798 N PRO A 121 8.948 8.445 3.821 1.00 0.00 N ATOM 1799 CA PRO A 121 9.631 7.663 4.839 1.00 0.00 C ATOM 1800 C PRO A 121 9.604 6.160 4.530 1.00 0.00 C ATOM 1801 O PRO A 121 8.584 5.635 4.058 1.00 0.00 O ATOM 1802 CB PRO A 121 8.906 7.966 6.152 1.00 0.00 C ATOM 1803 CG PRO A 121 7.735 8.899 5.850 1.00 0.00 C ATOM 1804 CD PRO A 121 7.780 9.143 4.348 1.00 0.00 C ATOM 0 HA PRO A 121 10.687 7.930 4.887 1.00 0.00 H new ATOM 0 HB2 PRO A 121 8.548 7.044 6.610 1.00 0.00 H new ATOM 0 HB3 PRO A 121 9.588 8.431 6.864 1.00 0.00 H new ATOM 0 HG2 PRO A 121 6.788 8.447 6.145 1.00 0.00 H new ATOM 0 HG3 PRO A 121 7.827 9.835 6.402 1.00 0.00 H new ATOM 0 HD2 PRO A 121 6.869 8.777 3.874 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.844 10.210 4.135 1.00 0.00 H new ATOM 1812 N TRP A 122 10.662 5.441 4.905 1.00 0.00 N ATOM 1813 CA TRP A 122 10.784 3.994 4.752 1.00 0.00 C ATOM 1814 C TRP A 122 11.281 3.401 6.075 1.00 0.00 C ATOM 1815 O TRP A 122 11.997 4.072 6.817 1.00 0.00 O ATOM 1816 CB TRP A 122 11.716 3.692 3.567 1.00 0.00 C ATOM 1817 CG TRP A 122 11.488 2.379 2.882 1.00 0.00 C ATOM 1818 CD1 TRP A 122 12.319 1.317 2.914 1.00 0.00 C ATOM 1819 CD2 TRP A 122 10.424 2.011 1.951 1.00 0.00 C ATOM 1820 NE1 TRP A 122 11.822 0.305 2.120 1.00 0.00 N ATOM 1821 CE2 TRP A 122 10.630 0.664 1.527 1.00 0.00 C ATOM 1822 CE3 TRP A 122 9.330 2.700 1.386 1.00 0.00 C ATOM 1823 CZ2 TRP A 122 9.743 0.012 0.655 1.00 0.00 C ATOM 1824 CZ3 TRP A 122 8.457 2.065 0.482 1.00 0.00 C ATOM 1825 CH2 TRP A 122 8.651 0.719 0.133 1.00 0.00 C ATOM 0 H TRP A 122 11.483 5.865 5.337 1.00 0.00 H new ATOM 0 HA TRP A 122 9.823 3.531 4.528 1.00 0.00 H new ATOM 0 HB2 TRP A 122 11.608 4.489 2.831 1.00 0.00 H new ATOM 0 HB3 TRP A 122 12.746 3.722 3.921 1.00 0.00 H new ATOM 0 HD1 TRP A 122 13.238 1.267 3.478 1.00 0.00 H new ATOM 0 HE1 TRP A 122 12.279 -0.597 1.988 1.00 0.00 H new ATOM 0 HE3 TRP A 122 9.159 3.733 1.652 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 9.901 -1.023 0.389 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 7.633 2.617 0.054 1.00 0.00 H new ATOM 0 HH2 TRP A 122 7.960 0.229 -0.537 1.00 0.00 H new ATOM 1836 N ILE A 123 10.862 2.180 6.414 1.00 0.00 N ATOM 1837 CA ILE A 123 11.310 1.435 7.592 1.00 0.00 C ATOM 1838 C ILE A 123 12.662 0.779 7.286 1.00 0.00 C ATOM 1839 O ILE A 123 13.489 0.686 8.193 1.00 0.00 O ATOM 1840 CB ILE A 123 10.269 0.365 8.043 1.00 0.00 C ATOM 1841 CG1 ILE A 123 8.883 0.952 8.366 1.00 0.00 C ATOM 1842 CG2 ILE A 123 10.790 -0.394 9.269 1.00 0.00 C ATOM 1843 CD1 ILE A 123 7.802 -0.084 8.699 1.00 0.00 C ATOM 0 H ILE A 123 10.179 1.666 5.858 1.00 0.00 H new ATOM 0 HA ILE A 123 11.416 2.136 8.420 1.00 0.00 H new ATOM 0 HB ILE A 123 10.143 -0.309 7.195 1.00 0.00 H new ATOM 0 HG12 ILE A 123 8.982 1.635 9.209 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.548 1.543 7.514 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.055 -1.139 9.575 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.727 -0.891 9.018 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.959 0.307 10.086 1.00 0.00 H new ATOM 0 HD11 ILE A 123 6.863 0.426 8.912 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.667 -0.754 7.850 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.108 -0.661 9.572 1.00 0.00 H new ATOM 1855 N GLU A 124 12.860 0.304 6.049 1.00 0.00 N ATOM 1856 CA GLU A 124 13.926 -0.617 5.626 1.00 0.00 C ATOM 1857 C GLU A 124 13.814 -1.998 6.306 1.00 0.00 C ATOM 1858 O GLU A 124 13.126 -2.160 7.321 1.00 0.00 O ATOM 1859 CB GLU A 124 15.320 0.035 5.776 1.00 0.00 C ATOM 1860 CG GLU A 124 15.701 0.813 4.511 1.00 0.00 C ATOM 1861 CD GLU A 124 17.195 1.109 4.468 1.00 0.00 C ATOM 1862 OE1 GLU A 124 17.672 1.928 5.283 1.00 0.00 O ATOM 1863 OE2 GLU A 124 17.901 0.506 3.624 1.00 0.00 O ATOM 0 H GLU A 124 12.249 0.565 5.275 1.00 0.00 H new ATOM 0 HA GLU A 124 13.792 -0.814 4.562 1.00 0.00 H new ATOM 0 HB2 GLU A 124 15.321 0.707 6.635 1.00 0.00 H new ATOM 0 HB3 GLU A 124 16.066 -0.735 5.973 1.00 0.00 H new ATOM 0 HG2 GLU A 124 15.417 0.238 3.629 1.00 0.00 H new ATOM 0 HG3 GLU A 124 15.142 1.748 4.475 1.00 0.00 H new ATOM 1870 N PRO A 125 14.463 -3.042 5.759 1.00 0.00 N ATOM 1871 CA PRO A 125 14.653 -4.299 6.460 1.00 0.00 C ATOM 1872 C PRO A 125 15.753 -4.153 7.524 1.00 0.00 C ATOM 1873 O PRO A 125 16.322 -3.086 7.738 1.00 0.00 O ATOM 1874 CB PRO A 125 15.055 -5.275 5.362 1.00 0.00 C ATOM 1875 CG PRO A 125 15.965 -4.416 4.495 1.00 0.00 C ATOM 1876 CD PRO A 125 15.287 -3.045 4.556 1.00 0.00 C ATOM 0 HA PRO A 125 13.765 -4.634 6.996 1.00 0.00 H new ATOM 0 HB2 PRO A 125 15.574 -6.147 5.760 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.192 -5.644 4.808 1.00 0.00 H new ATOM 0 HG2 PRO A 125 16.983 -4.383 4.884 1.00 0.00 H new ATOM 0 HG3 PRO A 125 16.026 -4.793 3.474 1.00 0.00 H new ATOM 0 HD2 PRO A 125 16.029 -2.247 4.592 1.00 0.00 H new ATOM 0 HD3 PRO A 125 14.678 -2.874 3.668 1.00 0.00 H new ATOM 1884 N LYS A 126 16.063 -5.253 8.208 1.00 0.00 N ATOM 1885 CA LYS A 126 16.991 -5.307 9.347 1.00 0.00 C ATOM 1886 C LYS A 126 18.341 -5.910 8.952 1.00 0.00 C ATOM 1887 O LYS A 126 19.055 -6.496 9.773 1.00 0.00 O ATOM 1888 CB LYS A 126 16.304 -6.111 10.461 1.00 0.00 C ATOM 1889 CG LYS A 126 15.345 -5.328 11.376 1.00 0.00 C ATOM 1890 CD LYS A 126 14.262 -4.511 10.671 1.00 0.00 C ATOM 1891 CE LYS A 126 13.394 -3.805 11.715 1.00 0.00 C ATOM 1892 NZ LYS A 126 12.686 -2.663 11.108 1.00 0.00 N ATOM 0 H LYS A 126 15.664 -6.164 7.981 1.00 0.00 H new ATOM 0 HA LYS A 126 17.216 -4.300 9.699 1.00 0.00 H new ATOM 0 HB2 LYS A 126 15.747 -6.927 10.000 1.00 0.00 H new ATOM 0 HB3 LYS A 126 17.077 -6.563 11.083 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.859 -6.035 12.049 1.00 0.00 H new ATOM 0 HG3 LYS A 126 15.936 -4.653 11.995 1.00 0.00 H new ATOM 0 HD2 LYS A 126 14.719 -3.778 10.007 1.00 0.00 H new ATOM 0 HD3 LYS A 126 13.646 -5.162 10.051 1.00 0.00 H new ATOM 0 HE2 LYS A 126 12.673 -4.508 12.133 1.00 0.00 H new ATOM 0 HE3 LYS A 126 14.016 -3.458 12.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 12.101 -2.194 11.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 13.379 -1.986 10.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 12.078 -3.002 10.336 1.00 0.00 H new ATOM 1906 N LYS A 127 18.638 -5.891 7.662 1.00 0.00 N ATOM 1907 CA LYS A 127 19.806 -6.531 7.061 1.00 0.00 C ATOM 1908 C LYS A 127 20.832 -5.487 6.656 1.00 0.00 C ATOM 1909 O LYS A 127 20.470 -4.350 6.350 1.00 0.00 O ATOM 1910 CB LYS A 127 19.385 -7.343 5.823 1.00 0.00 C ATOM 1911 CG LYS A 127 18.383 -8.474 6.079 1.00 0.00 C ATOM 1912 CD LYS A 127 18.999 -9.624 6.878 1.00 0.00 C ATOM 1913 CE LYS A 127 19.967 -10.466 6.041 1.00 0.00 C ATOM 1914 NZ LYS A 127 20.697 -11.430 6.883 1.00 0.00 N ATOM 0 H LYS A 127 18.053 -5.413 6.977 1.00 0.00 H new ATOM 0 HA LYS A 127 20.250 -7.199 7.799 1.00 0.00 H new ATOM 0 HB2 LYS A 127 18.954 -6.659 5.092 1.00 0.00 H new ATOM 0 HB3 LYS A 127 20.280 -7.771 5.370 1.00 0.00 H new ATOM 0 HG2 LYS A 127 17.523 -8.079 6.619 1.00 0.00 H new ATOM 0 HG3 LYS A 127 18.015 -8.853 5.126 1.00 0.00 H new ATOM 0 HD2 LYS A 127 19.527 -9.220 7.742 1.00 0.00 H new ATOM 0 HD3 LYS A 127 18.204 -10.263 7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 127 19.414 -11.000 5.268 1.00 0.00 H new ATOM 0 HE3 LYS A 127 20.676 -9.813 5.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 21.345 -11.987 6.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 21.242 -10.917 7.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 20.020 -12.067 7.348 1.00 0.00 H new ATOM 1928 N THR A 128 22.079 -5.916 6.544 1.00 0.00 N ATOM 1929 CA THR A 128 23.191 -5.197 5.938 1.00 0.00 C ATOM 1930 C THR A 128 23.764 -6.025 4.772 1.00 0.00 C ATOM 1931 O THR A 128 24.900 -5.807 4.352 1.00 0.00 O ATOM 1932 CB THR A 128 24.216 -4.850 7.034 1.00 0.00 C ATOM 1933 OG1 THR A 128 25.247 -4.064 6.490 1.00 0.00 O ATOM 1934 CG2 THR A 128 24.856 -6.077 7.688 1.00 0.00 C ATOM 0 H THR A 128 22.360 -6.832 6.895 1.00 0.00 H new ATOM 0 HA THR A 128 22.870 -4.251 5.503 1.00 0.00 H new ATOM 0 HB THR A 128 23.659 -4.314 7.803 1.00 0.00 H new ATOM 0 HG1 THR A 128 25.503 -4.421 5.614 1.00 0.00 H new ATOM 0 HG21 THR A 128 25.566 -5.755 8.449 1.00 0.00 H new ATOM 0 HG22 THR A 128 24.081 -6.689 8.150 1.00 0.00 H new ATOM 0 HG23 THR A 128 25.377 -6.663 6.931 1.00 0.00 H new ATOM 1942 N SER A 129 23.009 -7.007 4.281 1.00 0.00 N ATOM 1943 CA SER A 129 23.380 -7.927 3.220 1.00 0.00 C ATOM 1944 C SER A 129 22.240 -7.879 2.207 1.00 0.00 C ATOM 1945 O SER A 129 21.075 -7.803 2.614 1.00 0.00 O ATOM 1946 CB SER A 129 23.561 -9.336 3.807 1.00 0.00 C ATOM 1947 OG SER A 129 24.198 -9.323 5.081 1.00 0.00 O ATOM 0 H SER A 129 22.070 -7.187 4.637 1.00 0.00 H new ATOM 0 HA SER A 129 24.322 -7.659 2.742 1.00 0.00 H new ATOM 0 HB2 SER A 129 22.586 -9.815 3.898 1.00 0.00 H new ATOM 0 HB3 SER A 129 24.150 -9.940 3.117 1.00 0.00 H new ATOM 0 HG SER A 129 24.288 -10.241 5.411 1.00 0.00 H new ATOM 1953 N GLY A 130 22.549 -7.885 0.913 1.00 0.00 N ATOM 1954 CA GLY A 130 21.592 -7.584 -0.135 1.00 0.00 C ATOM 1955 C GLY A 130 21.807 -8.421 -1.389 1.00 0.00 C ATOM 1956 O GLY A 130 22.149 -7.845 -2.420 1.00 0.00 O ATOM 0 H GLY A 130 23.483 -8.102 0.564 1.00 0.00 H new ATOM 0 HA2 GLY A 130 20.583 -7.754 0.241 1.00 0.00 H new ATOM 0 HA3 GLY A 130 21.663 -6.527 -0.393 1.00 0.00 H new ATOM 1960 N PRO A 131 21.546 -9.742 -1.361 1.00 0.00 N ATOM 1961 CA PRO A 131 21.618 -10.621 -2.534 1.00 0.00 C ATOM 1962 C PRO A 131 20.464 -10.386 -3.531 1.00 0.00 C ATOM 1963 O PRO A 131 20.215 -11.214 -4.409 1.00 0.00 O ATOM 1964 CB PRO A 131 21.594 -12.038 -1.948 1.00 0.00 C ATOM 1965 CG PRO A 131 20.728 -11.885 -0.700 1.00 0.00 C ATOM 1966 CD PRO A 131 21.130 -10.503 -0.189 1.00 0.00 C ATOM 0 HA PRO A 131 22.514 -10.430 -3.124 1.00 0.00 H new ATOM 0 HB2 PRO A 131 21.168 -12.756 -2.648 1.00 0.00 H new ATOM 0 HB3 PRO A 131 22.596 -12.389 -1.702 1.00 0.00 H new ATOM 0 HG2 PRO A 131 19.665 -11.938 -0.934 1.00 0.00 H new ATOM 0 HG3 PRO A 131 20.932 -12.665 0.034 1.00 0.00 H new ATOM 0 HD2 PRO A 131 20.295 -10.016 0.315 1.00 0.00 H new ATOM 0 HD3 PRO A 131 21.941 -10.576 0.536 1.00 0.00 H new ATOM 1974 N SER A 132 19.690 -9.319 -3.346 1.00 0.00 N ATOM 1975 CA SER A 132 18.598 -8.865 -4.190 1.00 0.00 C ATOM 1976 C SER A 132 18.528 -7.345 -4.024 1.00 0.00 C ATOM 1977 O SER A 132 17.510 -6.809 -3.585 1.00 0.00 O ATOM 1978 CB SER A 132 17.297 -9.586 -3.793 1.00 0.00 C ATOM 1979 OG SER A 132 17.207 -9.787 -2.382 1.00 0.00 O ATOM 0 H SER A 132 19.823 -8.707 -2.541 1.00 0.00 H new ATOM 0 HA SER A 132 18.753 -9.101 -5.243 1.00 0.00 H new ATOM 0 HB2 SER A 132 16.441 -9.002 -4.132 1.00 0.00 H new ATOM 0 HB3 SER A 132 17.247 -10.549 -4.301 1.00 0.00 H new ATOM 0 HG SER A 132 16.367 -10.246 -2.170 1.00 0.00 H new ATOM 1985 N SER A 133 19.659 -6.660 -4.184 1.00 0.00 N ATOM 1986 CA SER A 133 19.753 -5.218 -3.969 1.00 0.00 C ATOM 1987 C SER A 133 19.207 -4.433 -5.173 1.00 0.00 C ATOM 1988 O SER A 133 18.912 -3.244 -5.051 1.00 0.00 O ATOM 1989 CB SER A 133 21.198 -4.835 -3.604 1.00 0.00 C ATOM 1990 OG SER A 133 22.162 -5.733 -4.134 1.00 0.00 O ATOM 0 H SER A 133 20.539 -7.091 -4.467 1.00 0.00 H new ATOM 0 HA SER A 133 19.121 -4.941 -3.125 1.00 0.00 H new ATOM 0 HB2 SER A 133 21.405 -3.830 -3.972 1.00 0.00 H new ATOM 0 HB3 SER A 133 21.297 -4.804 -2.519 1.00 0.00 H new ATOM 0 HG SER A 133 22.322 -6.457 -3.493 1.00 0.00 H new ATOM 1996 N GLY A 134 19.042 -5.081 -6.327 1.00 0.00 N ATOM 1997 CA GLY A 134 18.520 -4.506 -7.554 1.00 0.00 C ATOM 1998 C GLY A 134 18.421 -5.619 -8.570 1.00 0.00 C ATOM 1999 O GLY A 134 19.326 -6.478 -8.570 1.00 0.00 O ATOM 0 H GLY A 134 19.282 -6.067 -6.430 1.00 0.00 H new ATOM 0 HA2 GLY A 134 17.542 -4.056 -7.381 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.176 -3.714 -7.916 1.00 0.00 H new TER 2003 GLY A 134