USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 794 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 GLN : amide:sc= -0.0567 X(o=-0.057,f=-0.42) USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -152:sc= 0.00152 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 130:sc= -0.541 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= -1.19 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 148:sc= -1.36 (180deg=-2.92!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -1.93 K(o=-1.9,f=-1.4!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.703 K(o=-0.7,f=-2.1) USER MOD Single : A 36 HIS : no HE2:sc= -0.104 K(o=-0.1,f=-5.7!) USER MOD Single : A 37 CYS SG : rot -170:sc= -1.29 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -170:sc= -0.767 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0.00147 X(o=0.0015,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -8.01! C(o=-8!,f=-9.9!) USER MOD Single : A 57 GLN : amide:sc= -0.0231 X(o=-0.023,f=-0.27) USER MOD Single : A 61 MET CE :methyl -143:sc= -0.13 (180deg=-0.525) USER MOD Single : A 63 SER OG : rot 70:sc= 0.315 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= -0.333 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.143 K(o=-0.14,f=-1.1!) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= -0.719 USER MOD Single : A 99 TYR OH : rot -30:sc= -0.515 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.185 -3.571 -2.976 1.00 0.00 N ATOM 2 CA GLY A 1 -18.660 -2.620 -2.011 1.00 0.00 C ATOM 3 C GLY A 1 -17.375 -3.146 -1.368 1.00 0.00 C ATOM 4 O GLY A 1 -16.492 -3.651 -2.059 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.721 -3.063 -3.708 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.398 -4.087 -3.419 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.813 -4.245 -2.493 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.461 -1.668 -2.504 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.406 -2.430 -1.239 1.00 0.00 H new ATOM 8 N SER A 2 -17.311 -3.009 -0.051 1.00 0.00 N ATOM 9 CA SER A 2 -16.149 -3.464 0.693 1.00 0.00 C ATOM 10 C SER A 2 -16.374 -3.257 2.192 1.00 0.00 C ATOM 11 O SER A 2 -16.796 -2.183 2.618 1.00 0.00 O ATOM 12 CB SER A 2 -14.884 -2.732 0.240 1.00 0.00 C ATOM 13 OG SER A 2 -13.711 -3.267 0.847 1.00 0.00 O ATOM 0 H SER A 2 -18.045 -2.589 0.519 1.00 0.00 H new ATOM 0 HA SER A 2 -16.011 -4.527 0.496 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.794 -2.800 -0.844 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.969 -1.674 0.487 1.00 0.00 H new ATOM 0 HG SER A 2 -12.925 -2.774 0.531 1.00 0.00 H new ATOM 19 N SER A 3 -16.082 -4.303 2.951 1.00 0.00 N ATOM 20 CA SER A 3 -16.247 -4.249 4.394 1.00 0.00 C ATOM 21 C SER A 3 -15.064 -4.933 5.082 1.00 0.00 C ATOM 22 O SER A 3 -14.543 -5.930 4.584 1.00 0.00 O ATOM 23 CB SER A 3 -17.561 -4.906 4.823 1.00 0.00 C ATOM 24 OG SER A 3 -18.335 -4.052 5.661 1.00 0.00 O ATOM 0 H SER A 3 -15.732 -5.192 2.594 1.00 0.00 H new ATOM 0 HA SER A 3 -16.279 -3.202 4.695 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.141 -5.169 3.938 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.347 -5.835 5.351 1.00 0.00 H new ATOM 0 HG SER A 3 -19.166 -4.506 5.912 1.00 0.00 H new ATOM 30 N GLY A 4 -14.673 -4.369 6.215 1.00 0.00 N ATOM 31 CA GLY A 4 -13.560 -4.911 6.976 1.00 0.00 C ATOM 32 C GLY A 4 -12.504 -3.837 7.245 1.00 0.00 C ATOM 33 O GLY A 4 -12.829 -2.656 7.356 1.00 0.00 O ATOM 0 H GLY A 4 -15.107 -3.542 6.625 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.923 -5.314 7.922 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.110 -5.739 6.429 1.00 0.00 H new ATOM 37 N SER A 5 -11.262 -4.286 7.342 1.00 0.00 N ATOM 38 CA SER A 5 -10.156 -3.378 7.596 1.00 0.00 C ATOM 39 C SER A 5 -10.353 -2.080 6.809 1.00 0.00 C ATOM 40 O SER A 5 -10.457 -2.103 5.584 1.00 0.00 O ATOM 41 CB SER A 5 -8.818 -4.023 7.228 1.00 0.00 C ATOM 42 OG SER A 5 -7.957 -4.148 8.357 1.00 0.00 O ATOM 0 H SER A 5 -10.996 -5.266 7.249 1.00 0.00 H new ATOM 0 HA SER A 5 -10.138 -3.151 8.662 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.997 -5.008 6.798 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.326 -3.425 6.461 1.00 0.00 H new ATOM 0 HG SER A 5 -7.617 -5.066 8.409 1.00 0.00 H new ATOM 48 N SER A 6 -10.399 -0.980 7.546 1.00 0.00 N ATOM 49 CA SER A 6 -10.582 0.324 6.933 1.00 0.00 C ATOM 50 C SER A 6 -9.307 0.740 6.197 1.00 0.00 C ATOM 51 O SER A 6 -9.311 0.890 4.976 1.00 0.00 O ATOM 52 CB SER A 6 -10.958 1.376 7.979 1.00 0.00 C ATOM 53 OG SER A 6 -12.330 1.752 7.888 1.00 0.00 O ATOM 0 H SER A 6 -10.313 -0.965 8.562 1.00 0.00 H new ATOM 0 HA SER A 6 -11.401 0.253 6.217 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.754 0.985 8.976 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.331 2.258 7.848 1.00 0.00 H new ATOM 0 HG SER A 6 -12.531 2.423 8.573 1.00 0.00 H new ATOM 59 N GLY A 7 -8.245 0.914 6.971 1.00 0.00 N ATOM 60 CA GLY A 7 -6.965 1.310 6.407 1.00 0.00 C ATOM 61 C GLY A 7 -6.660 0.520 5.132 1.00 0.00 C ATOM 62 O GLY A 7 -6.551 1.098 4.052 1.00 0.00 O ATOM 0 H GLY A 7 -8.245 0.788 7.983 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.976 2.377 6.184 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.174 1.145 7.139 1.00 0.00 H new ATOM 66 N LEU A 8 -6.531 -0.787 5.301 1.00 0.00 N ATOM 67 CA LEU A 8 -6.241 -1.662 4.177 1.00 0.00 C ATOM 68 C LEU A 8 -7.384 -1.580 3.164 1.00 0.00 C ATOM 69 O LEU A 8 -7.160 -1.275 1.994 1.00 0.00 O ATOM 70 CB LEU A 8 -5.952 -3.083 4.665 1.00 0.00 C ATOM 71 CG LEU A 8 -4.854 -3.219 5.722 1.00 0.00 C ATOM 72 CD1 LEU A 8 -5.067 -4.471 6.576 1.00 0.00 C ATOM 73 CD2 LEU A 8 -3.467 -3.193 5.078 1.00 0.00 C ATOM 0 H LEU A 8 -6.622 -1.262 6.199 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.336 -1.336 3.664 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.873 -3.501 5.071 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.678 -3.693 3.804 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.914 -2.360 6.390 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.273 -4.544 7.319 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.031 -4.408 7.080 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.049 -5.354 5.938 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.705 -3.291 5.851 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.378 -4.020 4.373 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.329 -2.249 4.550 1.00 0.00 H new ATOM 85 N GLY A 9 -8.585 -1.857 3.651 1.00 0.00 N ATOM 86 CA GLY A 9 -9.764 -1.818 2.803 1.00 0.00 C ATOM 87 C GLY A 9 -9.667 -0.683 1.781 1.00 0.00 C ATOM 88 O GLY A 9 -9.452 -0.928 0.595 1.00 0.00 O ATOM 0 H GLY A 9 -8.767 -2.109 4.622 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -9.875 -2.770 2.285 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.654 -1.684 3.418 1.00 0.00 H new ATOM 92 N ALA A 10 -9.831 0.533 2.279 1.00 0.00 N ATOM 93 CA ALA A 10 -9.765 1.707 1.424 1.00 0.00 C ATOM 94 C ALA A 10 -8.595 1.558 0.450 1.00 0.00 C ATOM 95 O ALA A 10 -8.741 1.813 -0.744 1.00 0.00 O ATOM 96 CB ALA A 10 -9.647 2.963 2.290 1.00 0.00 C ATOM 0 H ALA A 10 -10.009 0.732 3.263 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.676 1.803 0.833 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.597 3.843 1.649 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -10.517 3.038 2.943 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.743 2.904 2.896 1.00 0.00 H new ATOM 102 N LEU A 11 -7.461 1.145 0.997 1.00 0.00 N ATOM 103 CA LEU A 11 -6.266 0.959 0.191 1.00 0.00 C ATOM 104 C LEU A 11 -6.552 -0.066 -0.908 1.00 0.00 C ATOM 105 O LEU A 11 -6.382 0.223 -2.092 1.00 0.00 O ATOM 106 CB LEU A 11 -5.074 0.594 1.077 1.00 0.00 C ATOM 107 CG LEU A 11 -4.240 -0.604 0.619 1.00 0.00 C ATOM 108 CD1 LEU A 11 -3.575 -0.326 -0.731 1.00 0.00 C ATOM 109 CD2 LEU A 11 -3.221 -1.003 1.688 1.00 0.00 C ATOM 0 H LEU A 11 -7.344 0.934 1.988 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.992 1.890 -0.305 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.419 1.462 1.146 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.443 0.392 2.083 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.910 -1.453 0.479 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.988 -1.194 -1.033 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.341 -0.127 -1.480 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.921 0.541 -0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.641 -1.857 1.337 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.551 -0.165 1.883 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.743 -1.272 2.606 1.00 0.00 H new ATOM 121 N TYR A 12 -6.982 -1.243 -0.478 1.00 0.00 N ATOM 122 CA TYR A 12 -7.293 -2.313 -1.410 1.00 0.00 C ATOM 123 C TYR A 12 -8.233 -1.823 -2.514 1.00 0.00 C ATOM 124 O TYR A 12 -8.006 -2.092 -3.692 1.00 0.00 O ATOM 125 CB TYR A 12 -8.006 -3.392 -0.592 1.00 0.00 C ATOM 126 CG TYR A 12 -8.573 -4.538 -1.433 1.00 0.00 C ATOM 127 CD1 TYR A 12 -7.768 -5.187 -2.346 1.00 0.00 C ATOM 128 CD2 TYR A 12 -9.889 -4.921 -1.278 1.00 0.00 C ATOM 129 CE1 TYR A 12 -8.302 -6.266 -3.138 1.00 0.00 C ATOM 130 CE2 TYR A 12 -10.423 -5.999 -2.069 1.00 0.00 C ATOM 131 CZ TYR A 12 -9.603 -6.618 -2.960 1.00 0.00 C ATOM 132 OH TYR A 12 -10.107 -7.637 -3.707 1.00 0.00 O ATOM 0 H TYR A 12 -7.122 -1.479 0.504 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.385 -2.682 -1.887 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.307 -3.802 0.137 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -8.818 -2.930 -0.031 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -6.738 -4.887 -2.467 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -10.519 -4.412 -0.563 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -7.683 -6.783 -3.856 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -11.451 -6.309 -1.957 1.00 0.00 H new ATOM 0 HH TYR A 12 -11.048 -7.780 -3.473 1.00 0.00 H new ATOM 142 N LEU A 13 -9.269 -1.112 -2.092 1.00 0.00 N ATOM 143 CA LEU A 13 -10.244 -0.581 -3.029 1.00 0.00 C ATOM 144 C LEU A 13 -9.516 0.169 -4.146 1.00 0.00 C ATOM 145 O LEU A 13 -9.905 0.088 -5.310 1.00 0.00 O ATOM 146 CB LEU A 13 -11.286 0.266 -2.296 1.00 0.00 C ATOM 147 CG LEU A 13 -12.405 -0.506 -1.594 1.00 0.00 C ATOM 148 CD1 LEU A 13 -13.260 0.429 -0.736 1.00 0.00 C ATOM 149 CD2 LEU A 13 -13.247 -1.290 -2.603 1.00 0.00 C ATOM 0 H LEU A 13 -9.454 -0.892 -1.113 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.801 -1.391 -3.500 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.772 0.876 -1.554 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -11.739 0.950 -3.013 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.950 -1.233 -0.922 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -14.048 -0.144 -0.248 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.634 0.903 0.020 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -13.708 1.196 -1.369 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -14.035 -1.830 -2.078 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.694 -0.600 -3.318 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -12.612 -2.000 -3.133 1.00 0.00 H new ATOM 161 N SER A 14 -8.471 0.883 -3.752 1.00 0.00 N ATOM 162 CA SER A 14 -7.685 1.648 -4.705 1.00 0.00 C ATOM 163 C SER A 14 -6.913 0.701 -5.626 1.00 0.00 C ATOM 164 O SER A 14 -6.929 0.864 -6.845 1.00 0.00 O ATOM 165 CB SER A 14 -6.721 2.596 -3.990 1.00 0.00 C ATOM 166 OG SER A 14 -7.097 3.961 -4.149 1.00 0.00 O ATOM 0 H SER A 14 -8.151 0.948 -2.786 1.00 0.00 H new ATOM 0 HA SER A 14 -8.367 2.252 -5.304 1.00 0.00 H new ATOM 0 HB2 SER A 14 -6.691 2.350 -2.929 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.714 2.450 -4.380 1.00 0.00 H new ATOM 0 HG SER A 14 -6.457 4.534 -3.676 1.00 0.00 H new ATOM 172 N MET A 15 -6.255 -0.269 -5.007 1.00 0.00 N ATOM 173 CA MET A 15 -5.479 -1.242 -5.756 1.00 0.00 C ATOM 174 C MET A 15 -6.268 -1.767 -6.957 1.00 0.00 C ATOM 175 O MET A 15 -5.683 -2.159 -7.966 1.00 0.00 O ATOM 176 CB MET A 15 -5.105 -2.410 -4.841 1.00 0.00 C ATOM 177 CG MET A 15 -4.017 -2.000 -3.845 1.00 0.00 C ATOM 178 SD MET A 15 -3.638 -3.365 -2.759 1.00 0.00 S ATOM 179 CE MET A 15 -1.854 -3.335 -2.836 1.00 0.00 C ATOM 0 H MET A 15 -6.244 -0.401 -3.996 1.00 0.00 H new ATOM 0 HA MET A 15 -4.577 -0.753 -6.124 1.00 0.00 H new ATOM 0 HB2 MET A 15 -5.988 -2.750 -4.301 1.00 0.00 H new ATOM 0 HB3 MET A 15 -4.755 -3.250 -5.442 1.00 0.00 H new ATOM 0 HG2 MET A 15 -3.120 -1.691 -4.381 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.351 -1.142 -3.261 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.443 -3.667 -1.883 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.513 -4.000 -3.629 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.516 -2.320 -3.043 1.00 0.00 H new ATOM 189 N LYS A 16 -7.585 -1.759 -6.808 1.00 0.00 N ATOM 190 CA LYS A 16 -8.460 -2.229 -7.868 1.00 0.00 C ATOM 191 C LYS A 16 -8.301 -1.327 -9.093 1.00 0.00 C ATOM 192 O LYS A 16 -8.179 -1.814 -10.216 1.00 0.00 O ATOM 193 CB LYS A 16 -9.901 -2.335 -7.365 1.00 0.00 C ATOM 194 CG LYS A 16 -10.023 -3.394 -6.267 1.00 0.00 C ATOM 195 CD LYS A 16 -11.368 -4.118 -6.350 1.00 0.00 C ATOM 196 CE LYS A 16 -12.428 -3.403 -5.511 1.00 0.00 C ATOM 197 NZ LYS A 16 -13.390 -2.694 -6.385 1.00 0.00 N ATOM 0 H LYS A 16 -8.067 -1.435 -5.969 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.179 -3.236 -8.175 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.228 -1.369 -6.981 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.562 -2.588 -8.194 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.211 -4.115 -6.361 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.919 -2.923 -5.290 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.694 -4.168 -7.389 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.255 -5.144 -6.001 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.957 -4.126 -4.890 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -11.949 -2.693 -4.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -14.103 -2.214 -5.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.884 -1.991 -6.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -13.860 -3.379 -7.011 1.00 0.00 H new ATOM 211 N ASP A 17 -8.309 -0.027 -8.836 1.00 0.00 N ATOM 212 CA ASP A 17 -8.167 0.948 -9.904 1.00 0.00 C ATOM 213 C ASP A 17 -6.905 0.635 -10.711 1.00 0.00 C ATOM 214 O ASP A 17 -5.793 0.744 -10.197 1.00 0.00 O ATOM 215 CB ASP A 17 -8.029 2.364 -9.342 1.00 0.00 C ATOM 216 CG ASP A 17 -8.678 3.462 -10.189 1.00 0.00 C ATOM 217 OD1 ASP A 17 -8.063 3.824 -11.215 1.00 0.00 O ATOM 218 OD2 ASP A 17 -9.773 3.913 -9.790 1.00 0.00 O ATOM 0 H ASP A 17 -8.412 0.374 -7.904 1.00 0.00 H new ATOM 0 HA ASP A 17 -9.057 0.893 -10.531 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.469 2.387 -8.345 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.969 2.592 -9.229 1.00 0.00 H new ATOM 223 N PRO A 18 -7.126 0.241 -11.993 1.00 0.00 N ATOM 224 CA PRO A 18 -6.020 -0.089 -12.876 1.00 0.00 C ATOM 225 C PRO A 18 -5.302 1.175 -13.351 1.00 0.00 C ATOM 226 O PRO A 18 -4.319 1.096 -14.087 1.00 0.00 O ATOM 227 CB PRO A 18 -6.646 -0.880 -14.013 1.00 0.00 C ATOM 228 CG PRO A 18 -8.133 -0.567 -13.969 1.00 0.00 C ATOM 229 CD PRO A 18 -8.430 0.099 -12.635 1.00 0.00 C ATOM 0 HA PRO A 18 -5.246 -0.675 -12.380 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.215 -0.593 -14.972 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -6.468 -1.948 -13.890 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.409 0.090 -14.794 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.719 -1.480 -14.079 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -8.910 1.067 -12.774 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -9.105 -0.508 -12.031 1.00 0.00 H new ATOM 237 N GLU A 19 -5.820 2.312 -12.911 1.00 0.00 N ATOM 238 CA GLU A 19 -5.240 3.592 -13.282 1.00 0.00 C ATOM 239 C GLU A 19 -4.747 4.333 -12.038 1.00 0.00 C ATOM 240 O GLU A 19 -3.585 4.731 -11.968 1.00 0.00 O ATOM 241 CB GLU A 19 -6.244 4.442 -14.064 1.00 0.00 C ATOM 242 CG GLU A 19 -6.119 4.193 -15.569 1.00 0.00 C ATOM 243 CD GLU A 19 -6.521 5.435 -16.366 1.00 0.00 C ATOM 244 OE1 GLU A 19 -5.676 6.353 -16.450 1.00 0.00 O ATOM 245 OE2 GLU A 19 -7.663 5.440 -16.872 1.00 0.00 O ATOM 0 H GLU A 19 -6.635 2.374 -12.301 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.385 3.406 -13.932 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.257 4.208 -13.736 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -6.076 5.498 -13.851 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -5.093 3.918 -15.811 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.751 3.352 -15.856 1.00 0.00 H new ATOM 252 N LYS A 20 -5.654 4.494 -11.086 1.00 0.00 N ATOM 253 CA LYS A 20 -5.326 5.180 -9.848 1.00 0.00 C ATOM 254 C LYS A 20 -4.936 4.149 -8.787 1.00 0.00 C ATOM 255 O LYS A 20 -4.852 4.472 -7.603 1.00 0.00 O ATOM 256 CB LYS A 20 -6.475 6.097 -9.422 1.00 0.00 C ATOM 257 CG LYS A 20 -6.576 7.313 -10.344 1.00 0.00 C ATOM 258 CD LYS A 20 -6.316 8.609 -9.572 1.00 0.00 C ATOM 259 CE LYS A 20 -7.160 9.757 -10.128 1.00 0.00 C ATOM 260 NZ LYS A 20 -8.405 9.912 -9.343 1.00 0.00 N ATOM 0 H LYS A 20 -6.616 4.161 -11.147 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.465 5.833 -9.991 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.413 5.543 -9.441 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.320 6.427 -8.395 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.856 7.219 -11.157 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.566 7.348 -10.798 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.547 8.461 -8.517 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.259 8.867 -9.633 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.587 10.684 -10.100 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.403 9.564 -11.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.966 10.696 -9.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.958 9.032 -9.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.167 10.117 -8.352 1.00 0.00 H new ATOM 274 N GLY A 21 -4.709 2.928 -9.249 1.00 0.00 N ATOM 275 CA GLY A 21 -4.330 1.847 -8.355 1.00 0.00 C ATOM 276 C GLY A 21 -3.207 1.003 -8.960 1.00 0.00 C ATOM 277 O GLY A 21 -2.437 1.488 -9.788 1.00 0.00 O ATOM 0 H GLY A 21 -4.780 2.663 -10.231 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -4.006 2.258 -7.399 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.196 1.216 -8.154 1.00 0.00 H new ATOM 281 N ILE A 22 -3.150 -0.247 -8.524 1.00 0.00 N ATOM 282 CA ILE A 22 -2.134 -1.164 -9.013 1.00 0.00 C ATOM 283 C ILE A 22 -2.510 -1.632 -10.420 1.00 0.00 C ATOM 284 O ILE A 22 -3.689 -1.681 -10.768 1.00 0.00 O ATOM 285 CB ILE A 22 -1.924 -2.309 -8.020 1.00 0.00 C ATOM 286 CG1 ILE A 22 -0.531 -2.241 -7.391 1.00 0.00 C ATOM 287 CG2 ILE A 22 -2.189 -3.664 -8.681 1.00 0.00 C ATOM 288 CD1 ILE A 22 -0.406 -3.225 -6.226 1.00 0.00 C ATOM 0 H ILE A 22 -3.791 -0.646 -7.838 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.171 -0.659 -9.091 1.00 0.00 H new ATOM 0 HB ILE A 22 -2.648 -2.198 -7.213 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.223 -2.467 -8.145 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.336 -1.228 -7.038 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.033 -4.461 -7.954 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.217 -3.698 -9.041 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -1.506 -3.799 -9.520 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.594 -3.156 -5.797 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.146 -2.982 -5.463 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.577 -4.239 -6.587 1.00 0.00 H new ATOM 300 N LYS A 23 -1.485 -1.963 -11.193 1.00 0.00 N ATOM 301 CA LYS A 23 -1.693 -2.424 -12.554 1.00 0.00 C ATOM 302 C LYS A 23 -1.474 -3.937 -12.615 1.00 0.00 C ATOM 303 O LYS A 23 -0.850 -4.514 -11.725 1.00 0.00 O ATOM 304 CB LYS A 23 -0.813 -1.637 -13.528 1.00 0.00 C ATOM 305 CG LYS A 23 -1.581 -0.457 -14.128 1.00 0.00 C ATOM 306 CD LYS A 23 -1.842 -0.676 -15.620 1.00 0.00 C ATOM 307 CE LYS A 23 -1.345 0.514 -16.444 1.00 0.00 C ATOM 308 NZ LYS A 23 -2.217 0.730 -17.620 1.00 0.00 N ATOM 0 H LYS A 23 -0.508 -1.921 -10.902 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.721 -2.236 -12.865 1.00 0.00 H new ATOM 0 HB2 LYS A 23 0.074 -1.273 -13.010 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.468 -2.295 -14.326 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.528 -0.331 -13.604 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -1.013 0.462 -13.985 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -1.342 -1.586 -15.951 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -2.909 -0.820 -15.789 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -1.330 1.411 -15.825 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -0.321 0.335 -16.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -1.866 1.541 -18.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -2.211 -0.121 -18.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -3.188 0.922 -17.301 1.00 0.00 H new ATOM 322 N GLU A 24 -2.000 -4.538 -13.672 1.00 0.00 N ATOM 323 CA GLU A 24 -1.869 -5.973 -13.860 1.00 0.00 C ATOM 324 C GLU A 24 -1.419 -6.282 -15.289 1.00 0.00 C ATOM 325 O GLU A 24 -2.092 -5.913 -16.250 1.00 0.00 O ATOM 326 CB GLU A 24 -3.180 -6.690 -13.531 1.00 0.00 C ATOM 327 CG GLU A 24 -4.380 -5.766 -13.748 1.00 0.00 C ATOM 328 CD GLU A 24 -5.639 -6.570 -14.079 1.00 0.00 C ATOM 329 OE1 GLU A 24 -5.952 -7.486 -13.287 1.00 0.00 O ATOM 330 OE2 GLU A 24 -6.259 -6.252 -15.116 1.00 0.00 O ATOM 0 H GLU A 24 -2.518 -4.057 -14.407 1.00 0.00 H new ATOM 0 HA GLU A 24 -1.108 -6.342 -13.173 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.281 -7.576 -14.157 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -3.162 -7.032 -12.496 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.551 -5.169 -12.852 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.165 -5.070 -14.559 1.00 0.00 H new ATOM 337 N LEU A 25 -0.283 -6.958 -15.384 1.00 0.00 N ATOM 338 CA LEU A 25 0.266 -7.321 -16.679 1.00 0.00 C ATOM 339 C LEU A 25 0.154 -8.836 -16.869 1.00 0.00 C ATOM 340 O LEU A 25 -0.181 -9.559 -15.932 1.00 0.00 O ATOM 341 CB LEU A 25 1.692 -6.786 -16.827 1.00 0.00 C ATOM 342 CG LEU A 25 1.954 -5.403 -16.228 1.00 0.00 C ATOM 343 CD1 LEU A 25 3.200 -5.417 -15.341 1.00 0.00 C ATOM 344 CD2 LEU A 25 2.043 -4.339 -17.324 1.00 0.00 C ATOM 0 H LEU A 25 0.272 -7.264 -14.585 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.308 -6.855 -17.480 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.376 -7.497 -16.363 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.938 -6.753 -17.888 1.00 0.00 H new ATOM 0 HG LEU A 25 1.109 -5.141 -15.592 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.364 -4.422 -14.928 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.060 -6.129 -14.528 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.066 -5.710 -15.935 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.230 -3.365 -16.871 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.858 -4.585 -18.005 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.105 -4.308 -17.878 1.00 0.00 H new ATOM 356 N ASN A 26 0.442 -9.270 -18.087 1.00 0.00 N ATOM 357 CA ASN A 26 0.378 -10.685 -18.411 1.00 0.00 C ATOM 358 C ASN A 26 1.776 -11.295 -18.288 1.00 0.00 C ATOM 359 O ASN A 26 2.499 -11.404 -19.277 1.00 0.00 O ATOM 360 CB ASN A 26 -0.107 -10.900 -19.846 1.00 0.00 C ATOM 361 CG ASN A 26 0.651 -9.998 -20.822 1.00 0.00 C ATOM 362 OD1 ASN A 26 1.663 -10.369 -21.393 1.00 0.00 O ATOM 363 ND2 ASN A 26 0.106 -8.795 -20.981 1.00 0.00 N ATOM 0 H ASN A 26 0.720 -8.667 -18.861 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.320 -11.158 -17.720 1.00 0.00 H new ATOM 0 HB2 ASN A 26 0.031 -11.944 -20.128 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.175 -10.692 -19.908 1.00 0.00 H new ATOM 0 HD21 ASN A 26 0.537 -8.119 -21.612 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -0.743 -8.548 -20.472 1.00 0.00 H new ATOM 370 N LEU A 27 2.114 -11.678 -17.065 1.00 0.00 N ATOM 371 CA LEU A 27 3.412 -12.275 -16.800 1.00 0.00 C ATOM 372 C LEU A 27 3.365 -13.764 -17.147 1.00 0.00 C ATOM 373 O LEU A 27 2.379 -14.441 -16.858 1.00 0.00 O ATOM 374 CB LEU A 27 3.848 -11.992 -15.361 1.00 0.00 C ATOM 375 CG LEU A 27 3.761 -10.533 -14.908 1.00 0.00 C ATOM 376 CD1 LEU A 27 3.285 -10.437 -13.458 1.00 0.00 C ATOM 377 CD2 LEU A 27 5.094 -9.813 -15.123 1.00 0.00 C ATOM 0 H LEU A 27 1.512 -11.586 -16.247 1.00 0.00 H new ATOM 0 HA LEU A 27 4.175 -11.824 -17.434 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.236 -12.597 -14.692 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.878 -12.328 -15.242 1.00 0.00 H new ATOM 0 HG LEU A 27 3.018 -10.027 -15.524 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.232 -9.390 -13.161 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.298 -10.890 -13.368 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.986 -10.963 -12.809 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.006 -8.778 -14.793 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.874 -10.312 -14.548 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.353 -9.836 -16.181 1.00 0.00 H new ATOM 389 N GLU A 28 4.442 -14.230 -17.762 1.00 0.00 N ATOM 390 CA GLU A 28 4.535 -15.627 -18.151 1.00 0.00 C ATOM 391 C GLU A 28 5.840 -16.236 -17.635 1.00 0.00 C ATOM 392 O GLU A 28 6.843 -15.537 -17.494 1.00 0.00 O ATOM 393 CB GLU A 28 4.421 -15.782 -19.669 1.00 0.00 C ATOM 394 CG GLU A 28 4.854 -17.181 -20.112 1.00 0.00 C ATOM 395 CD GLU A 28 4.265 -17.530 -21.480 1.00 0.00 C ATOM 396 OE1 GLU A 28 4.214 -16.612 -22.327 1.00 0.00 O ATOM 397 OE2 GLU A 28 3.878 -18.707 -21.648 1.00 0.00 O ATOM 0 H GLU A 28 5.257 -13.665 -18.000 1.00 0.00 H new ATOM 0 HA GLU A 28 3.702 -16.166 -17.700 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.392 -15.600 -19.980 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.040 -15.033 -20.162 1.00 0.00 H new ATOM 0 HG2 GLU A 28 5.942 -17.232 -20.157 1.00 0.00 H new ATOM 0 HG3 GLU A 28 4.531 -17.916 -19.375 1.00 0.00 H new ATOM 404 N LYS A 29 5.786 -17.532 -17.367 1.00 0.00 N ATOM 405 CA LYS A 29 6.951 -18.243 -16.869 1.00 0.00 C ATOM 406 C LYS A 29 7.258 -19.422 -17.794 1.00 0.00 C ATOM 407 O LYS A 29 8.294 -19.444 -18.456 1.00 0.00 O ATOM 408 CB LYS A 29 6.750 -18.645 -15.407 1.00 0.00 C ATOM 409 CG LYS A 29 7.942 -19.453 -14.891 1.00 0.00 C ATOM 410 CD LYS A 29 7.857 -19.649 -13.375 1.00 0.00 C ATOM 411 CE LYS A 29 9.071 -20.421 -12.854 1.00 0.00 C ATOM 412 NZ LYS A 29 8.837 -20.878 -11.466 1.00 0.00 N ATOM 0 H LYS A 29 4.953 -18.109 -17.485 1.00 0.00 H new ATOM 0 HA LYS A 29 7.826 -17.593 -16.879 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.619 -17.752 -14.795 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.838 -19.234 -15.310 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.969 -20.424 -15.386 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.870 -18.940 -15.144 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.799 -18.679 -12.882 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.944 -20.189 -13.125 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.268 -21.279 -13.497 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.956 -19.786 -12.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.670 -21.400 -11.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.672 -20.055 -10.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.005 -21.501 -11.441 1.00 0.00 H new ATOM 426 N ASP A 30 6.337 -20.375 -17.810 1.00 0.00 N ATOM 427 CA ASP A 30 6.496 -21.555 -18.643 1.00 0.00 C ATOM 428 C ASP A 30 5.133 -21.965 -19.204 1.00 0.00 C ATOM 429 O ASP A 30 4.461 -22.828 -18.642 1.00 0.00 O ATOM 430 CB ASP A 30 7.048 -22.731 -17.834 1.00 0.00 C ATOM 431 CG ASP A 30 6.170 -23.178 -16.664 1.00 0.00 C ATOM 432 OD1 ASP A 30 6.233 -22.500 -15.616 1.00 0.00 O ATOM 433 OD2 ASP A 30 5.457 -24.189 -16.843 1.00 0.00 O ATOM 0 H ASP A 30 5.479 -20.354 -17.260 1.00 0.00 H new ATOM 0 HA ASP A 30 7.193 -21.310 -19.444 1.00 0.00 H new ATOM 0 HB2 ASP A 30 7.193 -23.578 -18.505 1.00 0.00 H new ATOM 0 HB3 ASP A 30 8.030 -22.458 -17.448 1.00 0.00 H new ATOM 438 N LYS A 31 4.766 -21.328 -20.306 1.00 0.00 N ATOM 439 CA LYS A 31 3.495 -21.615 -20.949 1.00 0.00 C ATOM 440 C LYS A 31 2.377 -20.870 -20.217 1.00 0.00 C ATOM 441 O LYS A 31 1.597 -20.149 -20.837 1.00 0.00 O ATOM 442 CB LYS A 31 3.270 -23.126 -21.039 1.00 0.00 C ATOM 443 CG LYS A 31 4.527 -23.839 -21.542 1.00 0.00 C ATOM 444 CD LYS A 31 4.444 -24.100 -23.047 1.00 0.00 C ATOM 445 CE LYS A 31 3.799 -25.458 -23.333 1.00 0.00 C ATOM 446 NZ LYS A 31 3.588 -25.635 -24.787 1.00 0.00 N ATOM 0 H LYS A 31 5.327 -20.614 -20.770 1.00 0.00 H new ATOM 0 HA LYS A 31 3.499 -21.254 -21.977 1.00 0.00 H new ATOM 0 HB2 LYS A 31 2.995 -23.515 -20.059 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.437 -23.334 -21.710 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.406 -23.233 -21.322 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.651 -24.783 -21.012 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.865 -23.310 -23.525 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.444 -24.069 -23.481 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.435 -26.257 -22.952 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.846 -25.532 -22.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.150 -26.561 -24.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.963 -24.883 -25.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 4.503 -25.585 -25.279 1.00 0.00 H new ATOM 460 N LYS A 32 2.336 -21.069 -18.907 1.00 0.00 N ATOM 461 CA LYS A 32 1.327 -20.425 -18.084 1.00 0.00 C ATOM 462 C LYS A 32 1.447 -18.907 -18.233 1.00 0.00 C ATOM 463 O LYS A 32 2.520 -18.342 -18.026 1.00 0.00 O ATOM 464 CB LYS A 32 1.426 -20.910 -16.637 1.00 0.00 C ATOM 465 CG LYS A 32 1.142 -22.411 -16.541 1.00 0.00 C ATOM 466 CD LYS A 32 1.798 -23.015 -15.298 1.00 0.00 C ATOM 467 CE LYS A 32 0.807 -23.884 -14.523 1.00 0.00 C ATOM 468 NZ LYS A 32 1.520 -24.743 -13.551 1.00 0.00 N ATOM 0 H LYS A 32 2.985 -21.667 -18.396 1.00 0.00 H new ATOM 0 HA LYS A 32 0.328 -20.701 -18.421 1.00 0.00 H new ATOM 0 HB2 LYS A 32 2.421 -20.699 -16.246 1.00 0.00 H new ATOM 0 HB3 LYS A 32 0.717 -20.362 -16.017 1.00 0.00 H new ATOM 0 HG2 LYS A 32 0.066 -22.580 -16.507 1.00 0.00 H new ATOM 0 HG3 LYS A 32 1.515 -22.913 -17.434 1.00 0.00 H new ATOM 0 HD2 LYS A 32 2.660 -23.614 -15.592 1.00 0.00 H new ATOM 0 HD3 LYS A 32 2.169 -22.217 -14.654 1.00 0.00 H new ATOM 0 HE2 LYS A 32 0.090 -23.251 -14.000 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.238 -24.504 -15.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 0.832 -25.326 -13.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 2.187 -25.361 -14.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.043 -24.146 -12.879 1.00 0.00 H new ATOM 482 N VAL A 33 0.330 -18.289 -18.591 1.00 0.00 N ATOM 483 CA VAL A 33 0.297 -16.848 -18.770 1.00 0.00 C ATOM 484 C VAL A 33 -0.697 -16.238 -17.779 1.00 0.00 C ATOM 485 O VAL A 33 -1.895 -16.183 -18.051 1.00 0.00 O ATOM 486 CB VAL A 33 -0.026 -16.508 -20.226 1.00 0.00 C ATOM 487 CG1 VAL A 33 -0.289 -15.010 -20.395 1.00 0.00 C ATOM 488 CG2 VAL A 33 1.091 -16.978 -21.160 1.00 0.00 C ATOM 0 H VAL A 33 -0.558 -18.761 -18.762 1.00 0.00 H new ATOM 0 HA VAL A 33 1.275 -16.415 -18.559 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.937 -17.040 -20.499 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -0.516 -14.796 -21.439 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.134 -14.716 -19.772 1.00 0.00 H new ATOM 0 HG13 VAL A 33 0.596 -14.449 -20.094 1.00 0.00 H new ATOM 0 HG21 VAL A 33 0.836 -16.724 -22.189 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.025 -16.487 -20.886 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.209 -18.058 -21.072 1.00 0.00 H new ATOM 498 N PHE A 34 -0.163 -15.795 -16.651 1.00 0.00 N ATOM 499 CA PHE A 34 -0.988 -15.191 -15.618 1.00 0.00 C ATOM 500 C PHE A 34 -1.500 -13.819 -16.059 1.00 0.00 C ATOM 501 O PHE A 34 -0.767 -12.833 -16.008 1.00 0.00 O ATOM 502 CB PHE A 34 -0.103 -15.019 -14.382 1.00 0.00 C ATOM 503 CG PHE A 34 0.351 -16.338 -13.753 1.00 0.00 C ATOM 504 CD1 PHE A 34 -0.554 -17.145 -13.137 1.00 0.00 C ATOM 505 CD2 PHE A 34 1.660 -16.704 -13.811 1.00 0.00 C ATOM 506 CE1 PHE A 34 -0.132 -18.369 -12.553 1.00 0.00 C ATOM 507 CE2 PHE A 34 2.081 -17.928 -13.228 1.00 0.00 C ATOM 508 CZ PHE A 34 1.176 -18.735 -12.611 1.00 0.00 C ATOM 0 H PHE A 34 0.831 -15.842 -16.429 1.00 0.00 H new ATOM 0 HA PHE A 34 -1.852 -15.824 -15.414 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.777 -14.437 -14.656 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.648 -14.441 -13.636 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -1.593 -16.855 -13.092 1.00 0.00 H new ATOM 0 HD2 PHE A 34 2.379 -16.064 -14.300 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -0.850 -19.009 -12.063 1.00 0.00 H new ATOM 0 HE2 PHE A 34 3.120 -18.219 -13.274 1.00 0.00 H new ATOM 0 HZ PHE A 34 1.497 -19.666 -12.167 1.00 0.00 H new ATOM 518 N ASN A 35 -2.756 -13.799 -16.480 1.00 0.00 N ATOM 519 CA ASN A 35 -3.376 -12.564 -16.929 1.00 0.00 C ATOM 520 C ASN A 35 -4.113 -11.912 -15.757 1.00 0.00 C ATOM 521 O ASN A 35 -4.572 -12.602 -14.848 1.00 0.00 O ATOM 522 CB ASN A 35 -4.394 -12.830 -18.039 1.00 0.00 C ATOM 523 CG ASN A 35 -3.724 -13.466 -19.258 1.00 0.00 C ATOM 524 OD1 ASN A 35 -3.527 -14.668 -19.335 1.00 0.00 O ATOM 525 ND2 ASN A 35 -3.384 -12.595 -20.205 1.00 0.00 N ATOM 0 H ASN A 35 -3.361 -14.619 -16.520 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.590 -11.912 -17.310 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.179 -13.488 -17.667 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -4.873 -11.895 -18.330 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.930 -12.921 -21.058 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -3.578 -11.602 -20.078 1.00 0.00 H new ATOM 532 N HIS A 36 -4.202 -10.592 -15.817 1.00 0.00 N ATOM 533 CA HIS A 36 -4.876 -9.840 -14.772 1.00 0.00 C ATOM 534 C HIS A 36 -4.283 -10.210 -13.410 1.00 0.00 C ATOM 535 O HIS A 36 -5.011 -10.343 -12.428 1.00 0.00 O ATOM 536 CB HIS A 36 -6.389 -10.054 -14.837 1.00 0.00 C ATOM 537 CG HIS A 36 -7.037 -9.483 -16.076 1.00 0.00 C ATOM 538 ND1 HIS A 36 -6.730 -8.227 -16.572 1.00 0.00 N ATOM 539 CD2 HIS A 36 -7.976 -10.008 -16.914 1.00 0.00 C ATOM 540 CE1 HIS A 36 -7.459 -8.017 -17.658 1.00 0.00 C ATOM 541 NE2 HIS A 36 -8.231 -9.122 -17.868 1.00 0.00 N ATOM 0 H HIS A 36 -3.819 -10.024 -16.572 1.00 0.00 H new ATOM 0 HA HIS A 36 -4.712 -8.773 -14.924 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -6.597 -11.123 -14.790 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.848 -9.601 -13.958 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -6.057 -7.575 -16.170 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -8.435 -10.981 -16.817 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -7.445 -7.127 -18.270 1.00 0.00 H new ATOM 549 N CYS A 37 -2.967 -10.365 -13.396 1.00 0.00 N ATOM 550 CA CYS A 37 -2.269 -10.717 -12.172 1.00 0.00 C ATOM 551 C CYS A 37 -1.341 -9.559 -11.798 1.00 0.00 C ATOM 552 O CYS A 37 -1.215 -8.593 -12.549 1.00 0.00 O ATOM 553 CB CYS A 37 -1.506 -12.036 -12.314 1.00 0.00 C ATOM 554 SG CYS A 37 -2.574 -13.434 -11.810 1.00 0.00 S ATOM 0 H CYS A 37 -2.366 -10.253 -14.213 1.00 0.00 H new ATOM 0 HA CYS A 37 -2.992 -10.876 -11.372 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.182 -12.169 -13.346 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.607 -12.014 -11.698 1.00 0.00 H new ATOM 0 HG CYS A 37 -1.861 -14.519 -11.733 1.00 0.00 H new ATOM 560 N LEU A 38 -0.715 -9.695 -10.638 1.00 0.00 N ATOM 561 CA LEU A 38 0.197 -8.672 -10.156 1.00 0.00 C ATOM 562 C LEU A 38 1.536 -9.318 -9.796 1.00 0.00 C ATOM 563 O LEU A 38 1.923 -10.325 -10.388 1.00 0.00 O ATOM 564 CB LEU A 38 -0.437 -7.888 -9.005 1.00 0.00 C ATOM 565 CG LEU A 38 -1.966 -7.894 -8.951 1.00 0.00 C ATOM 566 CD1 LEU A 38 -2.472 -7.218 -7.676 1.00 0.00 C ATOM 567 CD2 LEU A 38 -2.561 -7.262 -10.211 1.00 0.00 C ATOM 0 H LEU A 38 -0.822 -10.498 -10.018 1.00 0.00 H new ATOM 0 HA LEU A 38 0.396 -7.939 -10.938 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.059 -8.291 -8.066 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.100 -6.853 -9.067 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.303 -8.930 -8.921 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.562 -7.236 -7.663 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.090 -7.751 -6.805 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.126 -6.185 -7.650 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.649 -7.279 -10.147 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.218 -6.231 -10.297 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.240 -7.826 -11.087 1.00 0.00 H new ATOM 579 N THR A 39 2.209 -8.712 -8.829 1.00 0.00 N ATOM 580 CA THR A 39 3.497 -9.215 -8.383 1.00 0.00 C ATOM 581 C THR A 39 3.639 -9.050 -6.869 1.00 0.00 C ATOM 582 O THR A 39 2.666 -8.748 -6.179 1.00 0.00 O ATOM 583 CB THR A 39 4.587 -8.494 -9.178 1.00 0.00 C ATOM 584 OG1 THR A 39 4.138 -7.143 -9.237 1.00 0.00 O ATOM 585 CG2 THR A 39 4.632 -8.935 -10.643 1.00 0.00 C ATOM 0 H THR A 39 1.886 -7.876 -8.341 1.00 0.00 H new ATOM 0 HA THR A 39 3.591 -10.284 -8.572 1.00 0.00 H new ATOM 0 HB THR A 39 5.556 -8.677 -8.713 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.788 -6.604 -9.734 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.423 -8.393 -11.162 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.831 -10.005 -10.695 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.674 -8.721 -11.117 1.00 0.00 H new ATOM 593 N GLY A 40 4.860 -9.255 -6.396 1.00 0.00 N ATOM 594 CA GLY A 40 5.142 -9.132 -4.976 1.00 0.00 C ATOM 595 C GLY A 40 5.872 -7.822 -4.673 1.00 0.00 C ATOM 596 O GLY A 40 5.536 -7.127 -3.715 1.00 0.00 O ATOM 0 H GLY A 40 5.665 -9.505 -6.971 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.210 -9.172 -4.412 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.750 -9.975 -4.648 1.00 0.00 H new ATOM 600 N SER A 41 6.856 -7.523 -5.508 1.00 0.00 N ATOM 601 CA SER A 41 7.636 -6.309 -5.342 1.00 0.00 C ATOM 602 C SER A 41 6.827 -5.099 -5.812 1.00 0.00 C ATOM 603 O SER A 41 6.674 -4.125 -5.076 1.00 0.00 O ATOM 604 CB SER A 41 8.958 -6.394 -6.108 1.00 0.00 C ATOM 605 OG SER A 41 9.486 -5.104 -6.406 1.00 0.00 O ATOM 0 H SER A 41 7.131 -8.101 -6.302 1.00 0.00 H new ATOM 0 HA SER A 41 7.868 -6.194 -4.283 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.683 -6.955 -5.519 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.805 -6.946 -7.035 1.00 0.00 H new ATOM 0 HG SER A 41 10.239 -5.194 -7.026 1.00 0.00 H new ATOM 611 N GLY A 42 6.329 -5.199 -7.036 1.00 0.00 N ATOM 612 CA GLY A 42 5.539 -4.125 -7.614 1.00 0.00 C ATOM 613 C GLY A 42 4.460 -3.652 -6.637 1.00 0.00 C ATOM 614 O GLY A 42 4.289 -2.452 -6.430 1.00 0.00 O ATOM 0 H GLY A 42 6.458 -6.008 -7.644 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.189 -3.290 -7.875 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.073 -4.468 -8.538 1.00 0.00 H new ATOM 618 N VAL A 43 3.761 -4.620 -6.063 1.00 0.00 N ATOM 619 CA VAL A 43 2.704 -4.317 -5.114 1.00 0.00 C ATOM 620 C VAL A 43 3.202 -3.265 -4.121 1.00 0.00 C ATOM 621 O VAL A 43 2.469 -2.342 -3.769 1.00 0.00 O ATOM 622 CB VAL A 43 2.227 -5.602 -4.434 1.00 0.00 C ATOM 623 CG1 VAL A 43 1.347 -5.288 -3.222 1.00 0.00 C ATOM 624 CG2 VAL A 43 1.492 -6.506 -5.426 1.00 0.00 C ATOM 0 H VAL A 43 3.906 -5.615 -6.237 1.00 0.00 H new ATOM 0 HA VAL A 43 1.839 -3.896 -5.627 1.00 0.00 H new ATOM 0 HB VAL A 43 3.106 -6.139 -4.078 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.022 -6.219 -2.758 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.917 -4.702 -2.501 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.475 -4.719 -3.543 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.163 -7.412 -4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.625 -5.979 -5.825 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.163 -6.771 -6.243 1.00 0.00 H new ATOM 634 N ILE A 44 4.445 -3.440 -3.696 1.00 0.00 N ATOM 635 CA ILE A 44 5.050 -2.517 -2.751 1.00 0.00 C ATOM 636 C ILE A 44 5.470 -1.242 -3.486 1.00 0.00 C ATOM 637 O ILE A 44 5.275 -0.138 -2.982 1.00 0.00 O ATOM 638 CB ILE A 44 6.194 -3.197 -1.996 1.00 0.00 C ATOM 639 CG1 ILE A 44 5.776 -4.582 -1.499 1.00 0.00 C ATOM 640 CG2 ILE A 44 6.704 -2.309 -0.858 1.00 0.00 C ATOM 641 CD1 ILE A 44 7.000 -5.443 -1.182 1.00 0.00 C ATOM 0 H ILE A 44 5.050 -4.208 -3.989 1.00 0.00 H new ATOM 0 HA ILE A 44 4.327 -2.223 -1.990 1.00 0.00 H new ATOM 0 HB ILE A 44 7.023 -3.341 -2.689 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.157 -4.481 -0.607 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.166 -5.075 -2.256 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.517 -2.816 -0.337 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.067 -1.366 -1.267 1.00 0.00 H new ATOM 0 HG23 ILE A 44 5.892 -2.112 -0.158 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.675 -6.422 -0.831 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.604 -5.562 -2.082 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.595 -4.959 -0.407 1.00 0.00 H new ATOM 653 N ASP A 45 6.039 -1.439 -4.666 1.00 0.00 N ATOM 654 CA ASP A 45 6.488 -0.319 -5.476 1.00 0.00 C ATOM 655 C ASP A 45 5.347 0.690 -5.622 1.00 0.00 C ATOM 656 O ASP A 45 5.571 1.898 -5.569 1.00 0.00 O ATOM 657 CB ASP A 45 6.893 -0.780 -6.877 1.00 0.00 C ATOM 658 CG ASP A 45 8.019 0.029 -7.524 1.00 0.00 C ATOM 659 OD1 ASP A 45 9.068 0.174 -6.859 1.00 0.00 O ATOM 660 OD2 ASP A 45 7.806 0.485 -8.668 1.00 0.00 O ATOM 0 H ASP A 45 6.199 -2.357 -5.081 1.00 0.00 H new ATOM 0 HA ASP A 45 7.349 0.131 -4.981 1.00 0.00 H new ATOM 0 HB2 ASP A 45 7.200 -1.824 -6.825 1.00 0.00 H new ATOM 0 HB3 ASP A 45 6.017 -0.737 -7.524 1.00 0.00 H new ATOM 665 N TRP A 46 4.147 0.156 -5.802 1.00 0.00 N ATOM 666 CA TRP A 46 2.971 0.995 -5.956 1.00 0.00 C ATOM 667 C TRP A 46 2.747 1.741 -4.639 1.00 0.00 C ATOM 668 O TRP A 46 2.400 2.921 -4.642 1.00 0.00 O ATOM 669 CB TRP A 46 1.759 0.166 -6.386 1.00 0.00 C ATOM 670 CG TRP A 46 0.451 0.957 -6.440 1.00 0.00 C ATOM 671 CD1 TRP A 46 -0.064 1.629 -7.478 1.00 0.00 C ATOM 672 CD2 TRP A 46 -0.493 1.132 -5.363 1.00 0.00 C ATOM 673 NE1 TRP A 46 -1.266 2.223 -7.151 1.00 0.00 N ATOM 674 CE2 TRP A 46 -1.535 1.911 -5.823 1.00 0.00 C ATOM 675 CE3 TRP A 46 -0.467 0.649 -4.043 1.00 0.00 C ATOM 676 CZ2 TRP A 46 -2.629 2.275 -5.029 1.00 0.00 C ATOM 677 CZ3 TRP A 46 -1.568 1.021 -3.261 1.00 0.00 C ATOM 678 CH2 TRP A 46 -2.625 1.804 -3.710 1.00 0.00 C ATOM 0 H TRP A 46 3.965 -0.847 -5.845 1.00 0.00 H new ATOM 0 HA TRP A 46 3.120 1.727 -6.750 1.00 0.00 H new ATOM 0 HB2 TRP A 46 1.954 -0.261 -7.370 1.00 0.00 H new ATOM 0 HB3 TRP A 46 1.639 -0.668 -5.695 1.00 0.00 H new ATOM 0 HD1 TRP A 46 0.403 1.697 -8.449 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -1.849 2.787 -7.769 1.00 0.00 H new ATOM 0 HE3 TRP A 46 0.339 0.039 -3.662 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -3.433 2.886 -5.413 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.598 0.675 -2.238 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -3.440 2.048 -3.045 1.00 0.00 H new ATOM 689 N LEU A 47 2.955 1.023 -3.545 1.00 0.00 N ATOM 690 CA LEU A 47 2.780 1.602 -2.225 1.00 0.00 C ATOM 691 C LEU A 47 3.731 2.790 -2.064 1.00 0.00 C ATOM 692 O LEU A 47 3.325 3.857 -1.607 1.00 0.00 O ATOM 693 CB LEU A 47 2.944 0.532 -1.144 1.00 0.00 C ATOM 694 CG LEU A 47 1.866 -0.553 -1.105 1.00 0.00 C ATOM 695 CD1 LEU A 47 2.420 -1.857 -0.529 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.629 -0.070 -0.344 1.00 0.00 C ATOM 0 H LEU A 47 3.243 0.045 -3.546 1.00 0.00 H new ATOM 0 HA LEU A 47 1.767 1.986 -2.109 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.912 0.050 -1.282 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.969 1.026 -0.173 1.00 0.00 H new ATOM 0 HG LEU A 47 1.554 -0.761 -2.129 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.633 -2.611 -0.513 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.245 -2.207 -1.149 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.777 -1.684 0.486 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.122 -0.860 -0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 47 0.907 0.183 0.679 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.220 0.812 -0.837 1.00 0.00 H new ATOM 708 N VAL A 48 4.979 2.564 -2.448 1.00 0.00 N ATOM 709 CA VAL A 48 5.991 3.601 -2.351 1.00 0.00 C ATOM 710 C VAL A 48 5.725 4.668 -3.416 1.00 0.00 C ATOM 711 O VAL A 48 5.795 5.863 -3.133 1.00 0.00 O ATOM 712 CB VAL A 48 7.387 2.983 -2.461 1.00 0.00 C ATOM 713 CG1 VAL A 48 8.471 4.061 -2.391 1.00 0.00 C ATOM 714 CG2 VAL A 48 7.601 1.919 -1.383 1.00 0.00 C ATOM 0 H VAL A 48 5.312 1.677 -2.827 1.00 0.00 H new ATOM 0 HA VAL A 48 5.943 4.091 -1.379 1.00 0.00 H new ATOM 0 HB VAL A 48 7.462 2.495 -3.433 1.00 0.00 H new ATOM 0 HG11 VAL A 48 9.453 3.595 -2.471 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.336 4.767 -3.211 1.00 0.00 H new ATOM 0 HG13 VAL A 48 8.397 4.590 -1.441 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.600 1.495 -1.483 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.496 2.373 -0.398 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.859 1.129 -1.499 1.00 0.00 H new ATOM 724 N SER A 49 5.424 4.197 -4.617 1.00 0.00 N ATOM 725 CA SER A 49 5.147 5.095 -5.725 1.00 0.00 C ATOM 726 C SER A 49 4.145 6.168 -5.291 1.00 0.00 C ATOM 727 O SER A 49 4.363 7.356 -5.523 1.00 0.00 O ATOM 728 CB SER A 49 4.612 4.328 -6.936 1.00 0.00 C ATOM 729 OG SER A 49 5.581 4.229 -7.976 1.00 0.00 O ATOM 0 H SER A 49 5.366 3.205 -4.847 1.00 0.00 H new ATOM 0 HA SER A 49 6.081 5.575 -6.017 1.00 0.00 H new ATOM 0 HB2 SER A 49 4.309 3.328 -6.627 1.00 0.00 H new ATOM 0 HB3 SER A 49 3.721 4.828 -7.317 1.00 0.00 H new ATOM 0 HG SER A 49 5.202 3.731 -8.730 1.00 0.00 H new ATOM 735 N ASN A 50 3.069 5.709 -4.669 1.00 0.00 N ATOM 736 CA ASN A 50 2.033 6.614 -4.201 1.00 0.00 C ATOM 737 C ASN A 50 2.462 7.226 -2.865 1.00 0.00 C ATOM 738 O ASN A 50 1.945 8.266 -2.460 1.00 0.00 O ATOM 739 CB ASN A 50 0.713 5.873 -3.979 1.00 0.00 C ATOM 740 CG ASN A 50 -0.152 5.904 -5.241 1.00 0.00 C ATOM 741 OD1 ASN A 50 -0.923 6.820 -5.474 1.00 0.00 O ATOM 742 ND2 ASN A 50 0.019 4.855 -6.040 1.00 0.00 N ATOM 0 H ASN A 50 2.892 4.723 -4.478 1.00 0.00 H new ATOM 0 HA ASN A 50 1.891 7.384 -4.959 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.915 4.840 -3.697 1.00 0.00 H new ATOM 0 HB3 ASN A 50 0.171 6.329 -3.151 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.512 4.783 -6.908 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.681 4.122 -5.785 1.00 0.00 H new ATOM 749 N LYS A 51 3.403 6.554 -2.218 1.00 0.00 N ATOM 750 CA LYS A 51 3.907 7.019 -0.937 1.00 0.00 C ATOM 751 C LYS A 51 2.939 6.597 0.170 1.00 0.00 C ATOM 752 O LYS A 51 2.281 7.440 0.778 1.00 0.00 O ATOM 753 CB LYS A 51 4.174 8.524 -0.980 1.00 0.00 C ATOM 754 CG LYS A 51 4.926 8.912 -2.255 1.00 0.00 C ATOM 755 CD LYS A 51 6.432 9.003 -1.997 1.00 0.00 C ATOM 756 CE LYS A 51 7.226 8.659 -3.258 1.00 0.00 C ATOM 757 NZ LYS A 51 8.307 9.647 -3.475 1.00 0.00 N ATOM 0 H LYS A 51 3.829 5.692 -2.557 1.00 0.00 H new ATOM 0 HA LYS A 51 4.868 6.555 -0.715 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.229 9.066 -0.932 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.756 8.819 -0.107 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.731 8.176 -3.035 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.558 9.870 -2.622 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.688 10.009 -1.665 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.708 8.322 -1.192 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.652 7.660 -3.166 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.561 8.644 -4.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 8.836 9.399 -4.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 7.894 10.595 -3.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.951 9.642 -2.658 1.00 0.00 H new ATOM 771 N LEU A 52 2.882 5.293 0.398 1.00 0.00 N ATOM 772 CA LEU A 52 2.005 4.750 1.421 1.00 0.00 C ATOM 773 C LEU A 52 2.832 4.394 2.658 1.00 0.00 C ATOM 774 O LEU A 52 2.295 4.293 3.761 1.00 0.00 O ATOM 775 CB LEU A 52 1.194 3.578 0.865 1.00 0.00 C ATOM 776 CG LEU A 52 -0.080 3.946 0.103 1.00 0.00 C ATOM 777 CD1 LEU A 52 -0.862 2.692 -0.295 1.00 0.00 C ATOM 778 CD2 LEU A 52 -0.938 4.924 0.908 1.00 0.00 C ATOM 0 H LEU A 52 3.429 4.597 -0.108 1.00 0.00 H new ATOM 0 HA LEU A 52 1.272 5.496 1.730 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.837 3.000 0.201 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.922 2.925 1.694 1.00 0.00 H new ATOM 0 HG LEU A 52 0.208 4.453 -0.818 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.763 2.981 -0.835 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.242 2.064 -0.934 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.139 2.136 0.601 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.837 5.169 0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.219 4.466 1.857 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.370 5.835 1.099 1.00 0.00 H new ATOM 790 N VAL A 53 4.125 4.212 2.435 1.00 0.00 N ATOM 791 CA VAL A 53 5.031 3.869 3.518 1.00 0.00 C ATOM 792 C VAL A 53 6.257 4.782 3.459 1.00 0.00 C ATOM 793 O VAL A 53 6.289 5.736 2.684 1.00 0.00 O ATOM 794 CB VAL A 53 5.388 2.383 3.450 1.00 0.00 C ATOM 795 CG1 VAL A 53 4.288 1.525 4.077 1.00 0.00 C ATOM 796 CG2 VAL A 53 5.666 1.951 2.009 1.00 0.00 C ATOM 0 H VAL A 53 4.567 4.296 1.520 1.00 0.00 H new ATOM 0 HA VAL A 53 4.552 4.030 4.484 1.00 0.00 H new ATOM 0 HB VAL A 53 6.300 2.232 4.027 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.567 0.473 4.015 1.00 0.00 H new ATOM 0 HG12 VAL A 53 4.159 1.805 5.122 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.352 1.684 3.541 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.917 0.891 1.989 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.779 2.125 1.399 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.500 2.529 1.610 1.00 0.00 H new ATOM 806 N ARG A 54 7.237 4.458 4.290 1.00 0.00 N ATOM 807 CA ARG A 54 8.462 5.237 4.343 1.00 0.00 C ATOM 808 C ARG A 54 9.552 4.569 3.503 1.00 0.00 C ATOM 809 O ARG A 54 10.490 5.229 3.058 1.00 0.00 O ATOM 810 CB ARG A 54 8.958 5.387 5.783 1.00 0.00 C ATOM 811 CG ARG A 54 8.187 6.487 6.516 1.00 0.00 C ATOM 812 CD ARG A 54 8.998 7.032 7.693 1.00 0.00 C ATOM 813 NE ARG A 54 8.086 7.514 8.755 1.00 0.00 N ATOM 814 CZ ARG A 54 8.496 8.110 9.883 1.00 0.00 C ATOM 815 NH1 ARG A 54 9.804 8.303 10.103 1.00 0.00 N ATOM 816 NH2 ARG A 54 7.598 8.514 10.792 1.00 0.00 N ATOM 0 H ARG A 54 7.207 3.666 4.932 1.00 0.00 H new ATOM 0 HA ARG A 54 8.243 6.226 3.941 1.00 0.00 H new ATOM 0 HB2 ARG A 54 8.841 4.441 6.312 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.022 5.622 5.782 1.00 0.00 H new ATOM 0 HG2 ARG A 54 7.954 7.296 5.824 1.00 0.00 H new ATOM 0 HG3 ARG A 54 7.237 6.092 6.876 1.00 0.00 H new ATOM 0 HD2 ARG A 54 9.650 6.253 8.088 1.00 0.00 H new ATOM 0 HD3 ARG A 54 9.641 7.846 7.357 1.00 0.00 H new ATOM 0 HE ARG A 54 7.083 7.384 8.620 1.00 0.00 H new ATOM 0 HH11 ARG A 54 10.488 7.996 9.412 1.00 0.00 H new ATOM 0 HH12 ARG A 54 10.115 8.757 10.962 1.00 0.00 H new ATOM 0 HH21 ARG A 54 6.602 8.368 10.625 1.00 0.00 H new ATOM 0 HH22 ARG A 54 7.910 8.968 11.651 1.00 0.00 H new ATOM 830 N ASN A 55 9.393 3.268 3.310 1.00 0.00 N ATOM 831 CA ASN A 55 10.352 2.504 2.531 1.00 0.00 C ATOM 832 C ASN A 55 9.694 1.210 2.046 1.00 0.00 C ATOM 833 O ASN A 55 8.556 0.914 2.409 1.00 0.00 O ATOM 834 CB ASN A 55 11.571 2.126 3.375 1.00 0.00 C ATOM 835 CG ASN A 55 11.158 1.304 4.598 1.00 0.00 C ATOM 836 OD1 ASN A 55 11.646 0.211 4.837 1.00 0.00 O ATOM 837 ND2 ASN A 55 10.235 1.888 5.355 1.00 0.00 N ATOM 0 H ASN A 55 8.614 2.723 3.680 1.00 0.00 H new ATOM 0 HA ASN A 55 10.672 3.121 1.691 1.00 0.00 H new ATOM 0 HB2 ASN A 55 12.274 1.555 2.769 1.00 0.00 H new ATOM 0 HB3 ASN A 55 12.089 3.029 3.698 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.893 1.420 6.194 1.00 0.00 H new ATOM 0 HD22 ASN A 55 9.869 2.804 5.097 1.00 0.00 H new ATOM 844 N ARG A 56 10.437 0.474 1.233 1.00 0.00 N ATOM 845 CA ARG A 56 9.940 -0.780 0.695 1.00 0.00 C ATOM 846 C ARG A 56 9.644 -1.764 1.828 1.00 0.00 C ATOM 847 O ARG A 56 8.630 -2.460 1.803 1.00 0.00 O ATOM 848 CB ARG A 56 10.953 -1.408 -0.265 1.00 0.00 C ATOM 849 CG ARG A 56 10.432 -1.385 -1.704 1.00 0.00 C ATOM 850 CD ARG A 56 9.452 -2.533 -1.950 1.00 0.00 C ATOM 851 NE ARG A 56 10.167 -3.695 -2.525 1.00 0.00 N ATOM 852 CZ ARG A 56 10.398 -3.862 -3.834 1.00 0.00 C ATOM 853 NH1 ARG A 56 9.971 -2.944 -4.713 1.00 0.00 N ATOM 854 NH2 ARG A 56 11.055 -4.947 -4.265 1.00 0.00 N ATOM 0 H ARG A 56 11.380 0.722 0.934 1.00 0.00 H new ATOM 0 HA ARG A 56 9.023 -0.565 0.147 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.898 -0.867 -0.208 1.00 0.00 H new ATOM 0 HB3 ARG A 56 11.156 -2.436 0.036 1.00 0.00 H new ATOM 0 HG2 ARG A 56 9.939 -0.433 -1.901 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.268 -1.461 -2.399 1.00 0.00 H new ATOM 0 HD2 ARG A 56 8.971 -2.818 -1.014 1.00 0.00 H new ATOM 0 HD3 ARG A 56 8.663 -2.209 -2.628 1.00 0.00 H new ATOM 0 HE ARG A 56 10.505 -4.413 -1.884 1.00 0.00 H new ATOM 0 HH11 ARG A 56 9.470 -2.118 -4.385 1.00 0.00 H new ATOM 0 HH12 ARG A 56 10.147 -3.071 -5.710 1.00 0.00 H new ATOM 0 HH21 ARG A 56 11.379 -5.646 -3.597 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.231 -5.074 -5.262 1.00 0.00 H new ATOM 868 N GLN A 57 10.549 -1.792 2.796 1.00 0.00 N ATOM 869 CA GLN A 57 10.398 -2.679 3.937 1.00 0.00 C ATOM 870 C GLN A 57 8.984 -2.570 4.510 1.00 0.00 C ATOM 871 O GLN A 57 8.204 -3.519 4.434 1.00 0.00 O ATOM 872 CB GLN A 57 11.449 -2.379 5.008 1.00 0.00 C ATOM 873 CG GLN A 57 11.907 -3.664 5.701 1.00 0.00 C ATOM 874 CD GLN A 57 10.964 -4.034 6.848 1.00 0.00 C ATOM 875 OE1 GLN A 57 10.617 -3.220 7.688 1.00 0.00 O ATOM 876 NE2 GLN A 57 10.569 -5.304 6.836 1.00 0.00 N ATOM 0 H GLN A 57 11.390 -1.214 2.813 1.00 0.00 H new ATOM 0 HA GLN A 57 10.554 -3.704 3.599 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.306 -1.882 4.553 1.00 0.00 H new ATOM 0 HB3 GLN A 57 11.036 -1.691 5.746 1.00 0.00 H new ATOM 0 HG2 GLN A 57 11.943 -4.479 4.978 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.919 -3.534 6.085 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.897 -5.933 6.103 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.938 -5.649 7.559 1.00 0.00 H new ATOM 885 N GLU A 58 8.696 -1.405 5.072 1.00 0.00 N ATOM 886 CA GLU A 58 7.389 -1.160 5.658 1.00 0.00 C ATOM 887 C GLU A 58 6.295 -1.810 4.808 1.00 0.00 C ATOM 888 O GLU A 58 5.444 -2.529 5.329 1.00 0.00 O ATOM 889 CB GLU A 58 7.136 0.340 5.826 1.00 0.00 C ATOM 890 CG GLU A 58 6.789 0.679 7.277 1.00 0.00 C ATOM 891 CD GLU A 58 6.158 2.069 7.379 1.00 0.00 C ATOM 892 OE1 GLU A 58 6.928 3.050 7.287 1.00 0.00 O ATOM 893 OE2 GLU A 58 4.921 2.120 7.547 1.00 0.00 O ATOM 0 H GLU A 58 9.345 -0.621 5.134 1.00 0.00 H new ATOM 0 HA GLU A 58 7.367 -1.612 6.650 1.00 0.00 H new ATOM 0 HB2 GLU A 58 8.021 0.898 5.520 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.321 0.650 5.172 1.00 0.00 H new ATOM 0 HG2 GLU A 58 6.100 -0.067 7.674 1.00 0.00 H new ATOM 0 HG3 GLU A 58 7.690 0.639 7.889 1.00 0.00 H new ATOM 900 N GLY A 59 6.354 -1.533 3.514 1.00 0.00 N ATOM 901 CA GLY A 59 5.379 -2.081 2.587 1.00 0.00 C ATOM 902 C GLY A 59 5.319 -3.606 2.692 1.00 0.00 C ATOM 903 O GLY A 59 4.236 -4.188 2.721 1.00 0.00 O ATOM 0 H GLY A 59 7.062 -0.936 3.086 1.00 0.00 H new ATOM 0 HA2 GLY A 59 4.396 -1.660 2.797 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.639 -1.793 1.568 1.00 0.00 H new ATOM 907 N LEU A 60 6.497 -4.210 2.747 1.00 0.00 N ATOM 908 CA LEU A 60 6.592 -5.657 2.849 1.00 0.00 C ATOM 909 C LEU A 60 5.667 -6.147 3.965 1.00 0.00 C ATOM 910 O LEU A 60 4.809 -6.998 3.736 1.00 0.00 O ATOM 911 CB LEU A 60 8.050 -6.086 3.025 1.00 0.00 C ATOM 912 CG LEU A 60 8.318 -7.592 2.961 1.00 0.00 C ATOM 913 CD1 LEU A 60 8.422 -8.190 4.365 1.00 0.00 C ATOM 914 CD2 LEU A 60 7.260 -8.301 2.113 1.00 0.00 C ATOM 0 H LEU A 60 7.394 -3.724 2.723 1.00 0.00 H new ATOM 0 HA LEU A 60 6.254 -6.128 1.926 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.647 -5.598 2.255 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.404 -5.714 3.987 1.00 0.00 H new ATOM 0 HG LEU A 60 9.280 -7.748 2.473 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.613 -9.261 4.291 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.240 -7.712 4.904 1.00 0.00 H new ATOM 0 HD13 LEU A 60 7.488 -8.024 4.901 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.473 -9.370 2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.275 -8.140 2.551 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.277 -7.900 1.100 1.00 0.00 H new ATOM 926 N MET A 61 5.874 -5.589 5.149 1.00 0.00 N ATOM 927 CA MET A 61 5.070 -5.959 6.301 1.00 0.00 C ATOM 928 C MET A 61 3.580 -5.750 6.020 1.00 0.00 C ATOM 929 O MET A 61 2.778 -6.667 6.189 1.00 0.00 O ATOM 930 CB MET A 61 5.485 -5.113 7.507 1.00 0.00 C ATOM 931 CG MET A 61 7.004 -5.135 7.695 1.00 0.00 C ATOM 932 SD MET A 61 7.417 -4.698 9.375 1.00 0.00 S ATOM 933 CE MET A 61 6.685 -3.072 9.461 1.00 0.00 C ATOM 0 H MET A 61 6.587 -4.884 5.335 1.00 0.00 H new ATOM 0 HA MET A 61 5.237 -7.015 6.512 1.00 0.00 H new ATOM 0 HB2 MET A 61 5.147 -4.086 7.369 1.00 0.00 H new ATOM 0 HB3 MET A 61 4.998 -5.491 8.406 1.00 0.00 H new ATOM 0 HG2 MET A 61 7.393 -6.126 7.462 1.00 0.00 H new ATOM 0 HG3 MET A 61 7.475 -4.437 7.003 1.00 0.00 H new ATOM 0 HE1 MET A 61 7.319 -2.419 10.061 1.00 0.00 H new ATOM 0 HE2 MET A 61 6.590 -2.662 8.455 1.00 0.00 H new ATOM 0 HE3 MET A 61 5.699 -3.141 9.920 1.00 0.00 H new ATOM 943 N ILE A 62 3.255 -4.537 5.596 1.00 0.00 N ATOM 944 CA ILE A 62 1.876 -4.196 5.290 1.00 0.00 C ATOM 945 C ILE A 62 1.328 -5.184 4.258 1.00 0.00 C ATOM 946 O ILE A 62 0.271 -5.778 4.462 1.00 0.00 O ATOM 947 CB ILE A 62 1.770 -2.733 4.857 1.00 0.00 C ATOM 948 CG1 ILE A 62 2.334 -1.801 5.932 1.00 0.00 C ATOM 949 CG2 ILE A 62 0.330 -2.374 4.486 1.00 0.00 C ATOM 950 CD1 ILE A 62 1.437 -1.787 7.171 1.00 0.00 C ATOM 0 H ILE A 62 3.923 -3.779 5.457 1.00 0.00 H new ATOM 0 HA ILE A 62 1.254 -4.287 6.181 1.00 0.00 H new ATOM 0 HB ILE A 62 2.377 -2.597 3.962 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.337 -2.124 6.209 1.00 0.00 H new ATOM 0 HG13 ILE A 62 2.424 -0.791 5.532 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.283 -1.328 4.182 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.002 -3.007 3.663 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.318 -2.531 5.348 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.861 -1.117 7.919 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.441 -1.440 6.895 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.369 -2.794 7.583 1.00 0.00 H new ATOM 962 N SER A 63 2.073 -5.329 3.172 1.00 0.00 N ATOM 963 CA SER A 63 1.675 -6.235 2.107 1.00 0.00 C ATOM 964 C SER A 63 1.076 -7.511 2.702 1.00 0.00 C ATOM 965 O SER A 63 -0.057 -7.873 2.389 1.00 0.00 O ATOM 966 CB SER A 63 2.861 -6.577 1.203 1.00 0.00 C ATOM 967 OG SER A 63 3.254 -5.470 0.396 1.00 0.00 O ATOM 0 H SER A 63 2.950 -4.835 3.006 1.00 0.00 H new ATOM 0 HA SER A 63 0.921 -5.737 1.498 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.704 -6.896 1.816 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.597 -7.418 0.561 1.00 0.00 H new ATOM 0 HG SER A 63 3.668 -4.784 0.961 1.00 0.00 H new ATOM 973 N ALA A 64 1.863 -8.157 3.550 1.00 0.00 N ATOM 974 CA ALA A 64 1.425 -9.384 4.191 1.00 0.00 C ATOM 975 C ALA A 64 0.014 -9.187 4.750 1.00 0.00 C ATOM 976 O ALA A 64 -0.868 -10.014 4.524 1.00 0.00 O ATOM 977 CB ALA A 64 2.431 -9.782 5.274 1.00 0.00 C ATOM 0 H ALA A 64 2.802 -7.853 3.808 1.00 0.00 H new ATOM 0 HA ALA A 64 1.383 -10.200 3.469 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.102 -10.703 5.755 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.410 -9.939 4.821 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.498 -8.988 6.018 1.00 0.00 H new ATOM 983 N SER A 65 -0.154 -8.087 5.469 1.00 0.00 N ATOM 984 CA SER A 65 -1.443 -7.771 6.062 1.00 0.00 C ATOM 985 C SER A 65 -2.532 -7.793 4.988 1.00 0.00 C ATOM 986 O SER A 65 -3.652 -8.235 5.244 1.00 0.00 O ATOM 987 CB SER A 65 -1.410 -6.407 6.756 1.00 0.00 C ATOM 988 OG SER A 65 -1.780 -6.498 8.129 1.00 0.00 O ATOM 0 H SER A 65 0.580 -7.404 5.654 1.00 0.00 H new ATOM 0 HA SER A 65 -1.668 -8.527 6.815 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.408 -5.984 6.678 1.00 0.00 H new ATOM 0 HB3 SER A 65 -2.086 -5.723 6.243 1.00 0.00 H new ATOM 0 HG SER A 65 -1.745 -5.608 8.537 1.00 0.00 H new ATOM 994 N LEU A 66 -2.167 -7.312 3.809 1.00 0.00 N ATOM 995 CA LEU A 66 -3.100 -7.271 2.696 1.00 0.00 C ATOM 996 C LEU A 66 -3.385 -8.698 2.222 1.00 0.00 C ATOM 997 O LEU A 66 -4.540 -9.113 2.149 1.00 0.00 O ATOM 998 CB LEU A 66 -2.577 -6.350 1.592 1.00 0.00 C ATOM 999 CG LEU A 66 -2.618 -4.851 1.893 1.00 0.00 C ATOM 1000 CD1 LEU A 66 -1.456 -4.123 1.215 1.00 0.00 C ATOM 1001 CD2 LEU A 66 -3.972 -4.251 1.510 1.00 0.00 C ATOM 0 H LEU A 66 -1.238 -6.947 3.600 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.051 -6.843 3.012 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.546 -6.628 1.372 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.157 -6.535 0.687 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.499 -4.716 2.968 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.509 -3.059 1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.511 -4.526 1.580 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.518 -4.264 0.136 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.974 -3.184 1.734 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.147 -4.398 0.444 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -4.762 -4.743 2.078 1.00 0.00 H new ATOM 1013 N LEU A 67 -2.311 -9.410 1.913 1.00 0.00 N ATOM 1014 CA LEU A 67 -2.431 -10.782 1.449 1.00 0.00 C ATOM 1015 C LEU A 67 -3.204 -11.601 2.485 1.00 0.00 C ATOM 1016 O LEU A 67 -4.235 -12.193 2.171 1.00 0.00 O ATOM 1017 CB LEU A 67 -1.053 -11.357 1.114 1.00 0.00 C ATOM 1018 CG LEU A 67 -0.995 -12.869 0.886 1.00 0.00 C ATOM 1019 CD1 LEU A 67 -0.795 -13.192 -0.596 1.00 0.00 C ATOM 1020 CD2 LEU A 67 0.079 -13.515 1.763 1.00 0.00 C ATOM 0 H LEU A 67 -1.354 -9.063 1.975 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.001 -10.822 0.521 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.682 -10.860 0.218 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.369 -11.105 1.925 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.953 -13.296 1.183 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.757 -14.273 -0.731 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.625 -12.783 -1.173 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.140 -12.750 -0.942 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.099 -14.590 1.581 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.052 -13.088 1.521 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.148 -13.329 2.813 1.00 0.00 H new ATOM 1032 N SER A 68 -2.676 -11.608 3.701 1.00 0.00 N ATOM 1033 CA SER A 68 -3.303 -12.344 4.785 1.00 0.00 C ATOM 1034 C SER A 68 -4.819 -12.148 4.742 1.00 0.00 C ATOM 1035 O SER A 68 -5.566 -13.097 4.507 1.00 0.00 O ATOM 1036 CB SER A 68 -2.749 -11.905 6.142 1.00 0.00 C ATOM 1037 OG SER A 68 -1.978 -12.931 6.761 1.00 0.00 O ATOM 0 H SER A 68 -1.821 -11.115 3.959 1.00 0.00 H new ATOM 0 HA SER A 68 -3.076 -13.402 4.656 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.131 -11.016 6.011 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.574 -11.626 6.797 1.00 0.00 H new ATOM 0 HG SER A 68 -1.641 -12.611 7.624 1.00 0.00 H new ATOM 1043 N GLU A 69 -5.231 -10.909 4.973 1.00 0.00 N ATOM 1044 CA GLU A 69 -6.645 -10.576 4.963 1.00 0.00 C ATOM 1045 C GLU A 69 -7.361 -11.335 3.844 1.00 0.00 C ATOM 1046 O GLU A 69 -8.489 -11.793 4.023 1.00 0.00 O ATOM 1047 CB GLU A 69 -6.852 -9.067 4.823 1.00 0.00 C ATOM 1048 CG GLU A 69 -6.549 -8.347 6.139 1.00 0.00 C ATOM 1049 CD GLU A 69 -7.630 -8.636 7.183 1.00 0.00 C ATOM 1050 OE1 GLU A 69 -8.815 -8.419 6.848 1.00 0.00 O ATOM 1051 OE2 GLU A 69 -7.247 -9.067 8.292 1.00 0.00 O ATOM 0 H GLU A 69 -4.610 -10.124 5.168 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.077 -10.881 5.916 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.206 -8.679 4.035 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -7.880 -8.864 4.521 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.578 -8.667 6.517 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.485 -7.273 5.964 1.00 0.00 H new ATOM 1058 N GLY A 70 -6.678 -11.443 2.714 1.00 0.00 N ATOM 1059 CA GLY A 70 -7.235 -12.137 1.566 1.00 0.00 C ATOM 1060 C GLY A 70 -7.488 -11.168 0.409 1.00 0.00 C ATOM 1061 O GLY A 70 -8.305 -11.444 -0.468 1.00 0.00 O ATOM 0 H GLY A 70 -5.743 -11.061 2.569 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -6.551 -12.922 1.244 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.169 -12.623 1.848 1.00 0.00 H new ATOM 1065 N TYR A 71 -6.773 -10.054 0.445 1.00 0.00 N ATOM 1066 CA TYR A 71 -6.910 -9.043 -0.589 1.00 0.00 C ATOM 1067 C TYR A 71 -6.074 -9.400 -1.820 1.00 0.00 C ATOM 1068 O TYR A 71 -6.260 -8.823 -2.890 1.00 0.00 O ATOM 1069 CB TYR A 71 -6.375 -7.744 0.017 1.00 0.00 C ATOM 1070 CG TYR A 71 -7.331 -7.081 1.011 1.00 0.00 C ATOM 1071 CD1 TYR A 71 -8.595 -6.704 0.606 1.00 0.00 C ATOM 1072 CD2 TYR A 71 -6.929 -6.860 2.312 1.00 0.00 C ATOM 1073 CE1 TYR A 71 -9.495 -6.080 1.541 1.00 0.00 C ATOM 1074 CE2 TYR A 71 -7.828 -6.236 3.248 1.00 0.00 C ATOM 1075 CZ TYR A 71 -9.067 -5.877 2.816 1.00 0.00 C ATOM 1076 OH TYR A 71 -9.916 -5.288 3.700 1.00 0.00 O ATOM 0 H TYR A 71 -6.096 -9.829 1.174 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.949 -8.959 -0.907 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -5.431 -7.952 0.520 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -6.159 -7.041 -0.788 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -8.909 -6.877 -0.413 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.940 -7.155 2.629 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -10.487 -5.780 1.237 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -7.526 -6.057 4.269 1.00 0.00 H new ATOM 0 HH TYR A 71 -9.476 -5.208 4.572 1.00 0.00 H new ATOM 1086 N LEU A 72 -5.170 -10.350 -1.626 1.00 0.00 N ATOM 1087 CA LEU A 72 -4.305 -10.790 -2.706 1.00 0.00 C ATOM 1088 C LEU A 72 -4.196 -12.316 -2.677 1.00 0.00 C ATOM 1089 O LEU A 72 -3.709 -12.889 -1.703 1.00 0.00 O ATOM 1090 CB LEU A 72 -2.953 -10.076 -2.636 1.00 0.00 C ATOM 1091 CG LEU A 72 -3.002 -8.547 -2.633 1.00 0.00 C ATOM 1092 CD1 LEU A 72 -1.725 -7.959 -2.031 1.00 0.00 C ATOM 1093 CD2 LEU A 72 -3.277 -8.005 -4.037 1.00 0.00 C ATOM 0 H LEU A 72 -5.019 -10.826 -0.737 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.733 -10.518 -3.671 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.437 -10.405 -1.734 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.350 -10.399 -3.484 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.831 -8.233 -1.999 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.786 -6.871 -2.041 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.613 -8.307 -1.004 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.865 -8.280 -2.618 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.307 -6.916 -4.007 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.485 -8.328 -4.713 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -4.235 -8.385 -4.392 1.00 0.00 H new ATOM 1105 N GLN A 73 -4.657 -12.932 -3.755 1.00 0.00 N ATOM 1106 CA GLN A 73 -4.618 -14.380 -3.865 1.00 0.00 C ATOM 1107 C GLN A 73 -3.290 -14.830 -4.477 1.00 0.00 C ATOM 1108 O GLN A 73 -2.800 -14.218 -5.425 1.00 0.00 O ATOM 1109 CB GLN A 73 -5.803 -14.900 -4.682 1.00 0.00 C ATOM 1110 CG GLN A 73 -7.122 -14.673 -3.941 1.00 0.00 C ATOM 1111 CD GLN A 73 -7.413 -15.823 -2.974 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -7.274 -16.991 -3.299 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -7.823 -15.429 -1.772 1.00 0.00 N ATOM 0 H GLN A 73 -5.060 -12.454 -4.561 1.00 0.00 H new ATOM 0 HA GLN A 73 -4.696 -14.803 -2.864 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.833 -14.395 -5.648 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.673 -15.964 -4.882 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.077 -13.733 -3.391 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.936 -14.583 -4.660 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.918 -14.434 -1.566 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -8.043 -16.121 -1.056 1.00 0.00 H new ATOM 1122 N PRO A 74 -2.731 -15.926 -3.896 1.00 0.00 N ATOM 1123 CA PRO A 74 -1.469 -16.465 -4.374 1.00 0.00 C ATOM 1124 C PRO A 74 -1.660 -17.218 -5.692 1.00 0.00 C ATOM 1125 O PRO A 74 -2.670 -17.893 -5.885 1.00 0.00 O ATOM 1126 CB PRO A 74 -0.970 -17.355 -3.248 1.00 0.00 C ATOM 1127 CG PRO A 74 -2.182 -17.648 -2.380 1.00 0.00 C ATOM 1128 CD PRO A 74 -3.283 -16.677 -2.773 1.00 0.00 C ATOM 0 HA PRO A 74 -0.739 -15.689 -4.603 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -0.539 -18.276 -3.640 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -0.189 -16.857 -2.673 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.513 -18.677 -2.521 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -1.932 -17.535 -1.325 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -4.193 -17.205 -3.059 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.543 -16.017 -1.945 1.00 0.00 H new ATOM 1136 N ALA A 75 -0.673 -17.078 -6.565 1.00 0.00 N ATOM 1137 CA ALA A 75 -0.719 -17.737 -7.860 1.00 0.00 C ATOM 1138 C ALA A 75 0.653 -18.338 -8.170 1.00 0.00 C ATOM 1139 O ALA A 75 1.625 -17.609 -8.362 1.00 0.00 O ATOM 1140 CB ALA A 75 -1.172 -16.737 -8.926 1.00 0.00 C ATOM 0 H ALA A 75 0.164 -16.518 -6.401 1.00 0.00 H new ATOM 0 HA ALA A 75 -1.442 -18.553 -7.850 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.207 -17.231 -9.897 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -2.164 -16.361 -8.674 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.469 -15.905 -8.967 1.00 0.00 H new ATOM 1146 N GLY A 76 0.688 -19.662 -8.209 1.00 0.00 N ATOM 1147 CA GLY A 76 1.925 -20.370 -8.493 1.00 0.00 C ATOM 1148 C GLY A 76 2.195 -21.446 -7.440 1.00 0.00 C ATOM 1149 O GLY A 76 1.387 -22.355 -7.255 1.00 0.00 O ATOM 0 H GLY A 76 -0.120 -20.263 -8.049 1.00 0.00 H new ATOM 0 HA2 GLY A 76 1.867 -20.829 -9.480 1.00 0.00 H new ATOM 0 HA3 GLY A 76 2.755 -19.664 -8.518 1.00 0.00 H new ATOM 1153 N ASP A 77 3.334 -21.309 -6.777 1.00 0.00 N ATOM 1154 CA ASP A 77 3.720 -22.258 -5.747 1.00 0.00 C ATOM 1155 C ASP A 77 4.548 -21.539 -4.681 1.00 0.00 C ATOM 1156 O ASP A 77 4.280 -21.672 -3.487 1.00 0.00 O ATOM 1157 CB ASP A 77 4.576 -23.385 -6.330 1.00 0.00 C ATOM 1158 CG ASP A 77 3.834 -24.700 -6.576 1.00 0.00 C ATOM 1159 OD1 ASP A 77 3.247 -24.823 -7.673 1.00 0.00 O ATOM 1160 OD2 ASP A 77 3.870 -25.552 -5.662 1.00 0.00 O ATOM 0 H ASP A 77 4.002 -20.554 -6.933 1.00 0.00 H new ATOM 0 HA ASP A 77 2.810 -22.680 -5.319 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.004 -23.045 -7.273 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.408 -23.576 -5.653 1.00 0.00 H new ATOM 1165 N LEU A 78 5.536 -20.791 -5.149 1.00 0.00 N ATOM 1166 CA LEU A 78 6.405 -20.050 -4.250 1.00 0.00 C ATOM 1167 C LEU A 78 5.551 -19.307 -3.221 1.00 0.00 C ATOM 1168 O LEU A 78 5.476 -19.713 -2.062 1.00 0.00 O ATOM 1169 CB LEU A 78 7.345 -19.140 -5.043 1.00 0.00 C ATOM 1170 CG LEU A 78 8.144 -18.125 -4.223 1.00 0.00 C ATOM 1171 CD1 LEU A 78 9.648 -18.371 -4.361 1.00 0.00 C ATOM 1172 CD2 LEU A 78 7.762 -16.692 -4.601 1.00 0.00 C ATOM 0 H LEU A 78 5.754 -20.682 -6.139 1.00 0.00 H new ATOM 0 HA LEU A 78 7.051 -20.731 -3.696 1.00 0.00 H new ATOM 0 HB2 LEU A 78 8.047 -19.767 -5.593 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.756 -18.597 -5.782 1.00 0.00 H new ATOM 0 HG LEU A 78 7.890 -18.260 -3.172 1.00 0.00 H new ATOM 0 HD11 LEU A 78 10.193 -17.636 -3.768 1.00 0.00 H new ATOM 0 HD12 LEU A 78 9.887 -19.373 -4.005 1.00 0.00 H new ATOM 0 HD13 LEU A 78 9.937 -18.279 -5.408 1.00 0.00 H new ATOM 0 HD21 LEU A 78 8.344 -15.991 -4.004 1.00 0.00 H new ATOM 0 HD22 LEU A 78 7.969 -16.527 -5.658 1.00 0.00 H new ATOM 0 HD23 LEU A 78 6.700 -16.536 -4.411 1.00 0.00 H new ATOM 1184 N SER A 79 4.930 -18.231 -3.681 1.00 0.00 N ATOM 1185 CA SER A 79 4.085 -17.427 -2.815 1.00 0.00 C ATOM 1186 C SER A 79 3.135 -18.330 -2.025 1.00 0.00 C ATOM 1187 O SER A 79 2.836 -18.057 -0.864 1.00 0.00 O ATOM 1188 CB SER A 79 3.291 -16.397 -3.621 1.00 0.00 C ATOM 1189 OG SER A 79 4.041 -15.885 -4.719 1.00 0.00 O ATOM 0 H SER A 79 4.995 -17.897 -4.643 1.00 0.00 H new ATOM 0 HA SER A 79 4.726 -16.887 -2.118 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.374 -16.855 -3.991 1.00 0.00 H new ATOM 0 HB3 SER A 79 2.996 -15.575 -2.969 1.00 0.00 H new ATOM 0 HG SER A 79 3.499 -15.232 -5.209 1.00 0.00 H new ATOM 1195 N LYS A 80 2.688 -19.387 -2.687 1.00 0.00 N ATOM 1196 CA LYS A 80 1.778 -20.332 -2.062 1.00 0.00 C ATOM 1197 C LYS A 80 2.441 -20.922 -0.816 1.00 0.00 C ATOM 1198 O LYS A 80 1.825 -20.988 0.247 1.00 0.00 O ATOM 1199 CB LYS A 80 1.321 -21.385 -3.073 1.00 0.00 C ATOM 1200 CG LYS A 80 -0.185 -21.288 -3.323 1.00 0.00 C ATOM 1201 CD LYS A 80 -0.623 -22.263 -4.418 1.00 0.00 C ATOM 1202 CE LYS A 80 -2.124 -22.547 -4.331 1.00 0.00 C ATOM 1203 NZ LYS A 80 -2.794 -22.188 -5.601 1.00 0.00 N ATOM 0 H LYS A 80 2.939 -19.610 -3.650 1.00 0.00 H new ATOM 0 HA LYS A 80 0.870 -19.826 -1.732 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.858 -21.250 -4.012 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.569 -22.380 -2.704 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.725 -21.504 -2.401 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.444 -20.270 -3.613 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.384 -21.847 -5.397 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.067 -23.196 -4.323 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.288 -23.602 -4.112 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.561 -21.979 -3.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.812 -22.387 -5.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.653 -21.176 -5.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.389 -22.749 -6.378 1.00 0.00 H new ATOM 1217 N ASN A 81 3.687 -21.337 -0.988 1.00 0.00 N ATOM 1218 CA ASN A 81 4.440 -21.920 0.110 1.00 0.00 C ATOM 1219 C ASN A 81 4.506 -20.919 1.265 1.00 0.00 C ATOM 1220 O ASN A 81 4.796 -21.295 2.400 1.00 0.00 O ATOM 1221 CB ASN A 81 5.873 -22.246 -0.316 1.00 0.00 C ATOM 1222 CG ASN A 81 5.968 -23.664 -0.882 1.00 0.00 C ATOM 1223 OD1 ASN A 81 5.309 -24.586 -0.430 1.00 0.00 O ATOM 1224 ND2 ASN A 81 6.822 -23.787 -1.894 1.00 0.00 N ATOM 0 H ASN A 81 4.194 -21.281 -1.871 1.00 0.00 H new ATOM 0 HA ASN A 81 3.937 -22.838 0.414 1.00 0.00 H new ATOM 0 HB2 ASN A 81 6.205 -21.528 -1.066 1.00 0.00 H new ATOM 0 HB3 ASN A 81 6.542 -22.146 0.539 1.00 0.00 H new ATOM 0 HD21 ASN A 81 6.956 -24.694 -2.340 1.00 0.00 H new ATOM 0 HD22 ASN A 81 7.343 -22.974 -2.224 1.00 0.00 H new ATOM 1231 N ALA A 82 4.232 -19.666 0.937 1.00 0.00 N ATOM 1232 CA ALA A 82 4.257 -18.608 1.933 1.00 0.00 C ATOM 1233 C ALA A 82 3.043 -18.752 2.853 1.00 0.00 C ATOM 1234 O ALA A 82 3.191 -18.865 4.069 1.00 0.00 O ATOM 1235 CB ALA A 82 4.300 -17.248 1.233 1.00 0.00 C ATOM 0 H ALA A 82 3.991 -19.359 -0.005 1.00 0.00 H new ATOM 0 HA ALA A 82 5.151 -18.684 2.552 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.319 -16.455 1.980 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.195 -17.185 0.615 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.417 -17.134 0.605 1.00 0.00 H new ATOM 1241 N ALA A 83 1.869 -18.743 2.238 1.00 0.00 N ATOM 1242 CA ALA A 83 0.631 -18.871 2.986 1.00 0.00 C ATOM 1243 C ALA A 83 0.607 -20.225 3.697 1.00 0.00 C ATOM 1244 O ALA A 83 -0.214 -20.450 4.586 1.00 0.00 O ATOM 1245 CB ALA A 83 -0.558 -18.687 2.042 1.00 0.00 C ATOM 0 H ALA A 83 1.750 -18.649 1.229 1.00 0.00 H new ATOM 0 HA ALA A 83 0.563 -18.096 3.750 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.487 -18.783 2.604 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.511 -17.698 1.586 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.525 -19.448 1.263 1.00 0.00 H new ATOM 1251 N ASP A 84 1.517 -21.093 3.279 1.00 0.00 N ATOM 1252 CA ASP A 84 1.611 -22.419 3.865 1.00 0.00 C ATOM 1253 C ASP A 84 1.739 -22.294 5.384 1.00 0.00 C ATOM 1254 O ASP A 84 0.853 -22.721 6.123 1.00 0.00 O ATOM 1255 CB ASP A 84 2.843 -23.164 3.347 1.00 0.00 C ATOM 1256 CG ASP A 84 2.828 -24.677 3.577 1.00 0.00 C ATOM 1257 OD1 ASP A 84 1.869 -25.316 3.092 1.00 0.00 O ATOM 1258 OD2 ASP A 84 3.776 -25.160 4.233 1.00 0.00 O ATOM 0 H ASP A 84 2.196 -20.904 2.541 1.00 0.00 H new ATOM 0 HA ASP A 84 0.713 -22.972 3.591 1.00 0.00 H new ATOM 0 HB2 ASP A 84 2.940 -22.975 2.278 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.729 -22.748 3.826 1.00 0.00 H new ATOM 1263 N GLY A 85 2.849 -21.705 5.806 1.00 0.00 N ATOM 1264 CA GLY A 85 3.104 -21.518 7.224 1.00 0.00 C ATOM 1265 C GLY A 85 4.600 -21.343 7.493 1.00 0.00 C ATOM 1266 O GLY A 85 5.137 -21.925 8.435 1.00 0.00 O ATOM 0 H GLY A 85 3.581 -21.351 5.191 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.562 -20.643 7.583 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.729 -22.376 7.781 1.00 0.00 H new ATOM 1270 N ILE A 86 5.231 -20.540 6.650 1.00 0.00 N ATOM 1271 CA ILE A 86 6.654 -20.281 6.785 1.00 0.00 C ATOM 1272 C ILE A 86 6.911 -19.539 8.098 1.00 0.00 C ATOM 1273 O ILE A 86 7.438 -20.115 9.048 1.00 0.00 O ATOM 1274 CB ILE A 86 7.186 -19.549 5.550 1.00 0.00 C ATOM 1275 CG1 ILE A 86 7.381 -20.517 4.381 1.00 0.00 C ATOM 1276 CG2 ILE A 86 8.467 -18.780 5.878 1.00 0.00 C ATOM 1277 CD1 ILE A 86 7.390 -19.769 3.047 1.00 0.00 C ATOM 0 H ILE A 86 4.783 -20.060 5.870 1.00 0.00 H new ATOM 0 HA ILE A 86 7.208 -21.218 6.834 1.00 0.00 H new ATOM 0 HB ILE A 86 6.441 -18.816 5.240 1.00 0.00 H new ATOM 0 HG12 ILE A 86 8.319 -21.059 4.505 1.00 0.00 H new ATOM 0 HG13 ILE A 86 6.582 -21.259 4.381 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.824 -18.269 4.984 1.00 0.00 H new ATOM 0 HG22 ILE A 86 8.261 -18.046 6.657 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.230 -19.476 6.227 1.00 0.00 H new ATOM 0 HD11 ILE A 86 7.530 -20.480 2.232 1.00 0.00 H new ATOM 0 HD12 ILE A 86 6.441 -19.248 2.915 1.00 0.00 H new ATOM 0 HD13 ILE A 86 8.205 -19.045 3.041 1.00 0.00 H new ATOM 1289 N ALA A 87 6.527 -18.271 8.108 1.00 0.00 N ATOM 1290 CA ALA A 87 6.709 -17.444 9.289 1.00 0.00 C ATOM 1291 C ALA A 87 5.540 -16.463 9.405 1.00 0.00 C ATOM 1292 O ALA A 87 4.390 -16.832 9.169 1.00 0.00 O ATOM 1293 CB ALA A 87 8.061 -16.732 9.211 1.00 0.00 C ATOM 0 H ALA A 87 6.091 -17.796 7.318 1.00 0.00 H new ATOM 0 HA ALA A 87 6.715 -18.058 10.190 1.00 0.00 H new ATOM 0 HB1 ALA A 87 8.197 -16.112 10.097 1.00 0.00 H new ATOM 0 HB2 ALA A 87 8.860 -17.472 9.160 1.00 0.00 H new ATOM 0 HB3 ALA A 87 8.091 -16.104 8.320 1.00 0.00 H new ATOM 1299 N GLU A 88 5.874 -15.234 9.768 1.00 0.00 N ATOM 1300 CA GLU A 88 4.866 -14.198 9.918 1.00 0.00 C ATOM 1301 C GLU A 88 4.888 -13.257 8.711 1.00 0.00 C ATOM 1302 O GLU A 88 4.260 -12.200 8.733 1.00 0.00 O ATOM 1303 CB GLU A 88 5.067 -13.422 11.221 1.00 0.00 C ATOM 1304 CG GLU A 88 3.810 -13.478 12.092 1.00 0.00 C ATOM 1305 CD GLU A 88 3.706 -12.240 12.985 1.00 0.00 C ATOM 1306 OE1 GLU A 88 4.709 -11.950 13.672 1.00 0.00 O ATOM 1307 OE2 GLU A 88 2.626 -11.611 12.960 1.00 0.00 O ATOM 0 H GLU A 88 6.829 -14.932 9.963 1.00 0.00 H new ATOM 0 HA GLU A 88 3.887 -14.675 9.965 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.912 -13.838 11.769 1.00 0.00 H new ATOM 0 HB3 GLU A 88 5.312 -12.384 10.996 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.926 -13.548 11.458 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.831 -14.376 12.710 1.00 0.00 H new ATOM 1314 N ASN A 89 5.617 -13.677 7.688 1.00 0.00 N ATOM 1315 CA ASN A 89 5.729 -12.885 6.474 1.00 0.00 C ATOM 1316 C ASN A 89 5.421 -13.769 5.264 1.00 0.00 C ATOM 1317 O ASN A 89 6.331 -14.318 4.645 1.00 0.00 O ATOM 1318 CB ASN A 89 7.145 -12.331 6.307 1.00 0.00 C ATOM 1319 CG ASN A 89 7.404 -11.184 7.287 1.00 0.00 C ATOM 1320 OD1 ASN A 89 7.826 -11.381 8.415 1.00 0.00 O ATOM 1321 ND2 ASN A 89 7.128 -9.980 6.796 1.00 0.00 N ATOM 0 H ASN A 89 6.136 -14.555 7.674 1.00 0.00 H new ATOM 0 HA ASN A 89 5.024 -12.057 6.545 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.872 -13.126 6.472 1.00 0.00 H new ATOM 0 HB3 ASN A 89 7.284 -11.979 5.285 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.267 -9.150 7.372 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.777 -9.886 5.843 1.00 0.00 H new ATOM 1328 N PRO A 90 4.102 -13.882 4.955 1.00 0.00 N ATOM 1329 CA PRO A 90 3.663 -14.689 3.829 1.00 0.00 C ATOM 1330 C PRO A 90 3.949 -13.982 2.503 1.00 0.00 C ATOM 1331 O PRO A 90 4.017 -14.624 1.455 1.00 0.00 O ATOM 1332 CB PRO A 90 2.181 -14.925 4.069 1.00 0.00 C ATOM 1333 CG PRO A 90 1.745 -13.862 5.063 1.00 0.00 C ATOM 1334 CD PRO A 90 2.997 -13.245 5.665 1.00 0.00 C ATOM 0 HA PRO A 90 4.197 -15.636 3.757 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.617 -14.845 3.139 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.004 -15.925 4.464 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.144 -13.099 4.567 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.123 -14.301 5.843 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.010 -12.164 5.529 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.055 -13.432 6.737 1.00 0.00 H new ATOM 1342 N PHE A 91 4.109 -12.670 2.590 1.00 0.00 N ATOM 1343 CA PHE A 91 4.386 -11.869 1.410 1.00 0.00 C ATOM 1344 C PHE A 91 5.882 -11.871 1.085 1.00 0.00 C ATOM 1345 O PHE A 91 6.711 -11.642 1.964 1.00 0.00 O ATOM 1346 CB PHE A 91 3.947 -10.439 1.727 1.00 0.00 C ATOM 1347 CG PHE A 91 3.521 -9.632 0.498 1.00 0.00 C ATOM 1348 CD1 PHE A 91 2.267 -9.774 -0.007 1.00 0.00 C ATOM 1349 CD2 PHE A 91 4.398 -8.773 -0.088 1.00 0.00 C ATOM 1350 CE1 PHE A 91 1.872 -9.025 -1.148 1.00 0.00 C ATOM 1351 CE2 PHE A 91 4.003 -8.024 -1.228 1.00 0.00 C ATOM 1352 CZ PHE A 91 2.748 -8.166 -1.734 1.00 0.00 C ATOM 0 H PHE A 91 4.052 -12.141 3.460 1.00 0.00 H new ATOM 0 HA PHE A 91 3.854 -12.276 0.550 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.117 -10.473 2.433 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.767 -9.920 2.224 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.571 -10.456 0.459 1.00 0.00 H new ATOM 0 HD2 PHE A 91 5.394 -8.661 0.314 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.876 -9.138 -1.550 1.00 0.00 H new ATOM 0 HE2 PHE A 91 4.699 -7.342 -1.693 1.00 0.00 H new ATOM 0 HZ PHE A 91 2.448 -7.596 -2.601 1.00 0.00 H new ATOM 1362 N LEU A 92 6.180 -12.132 -0.179 1.00 0.00 N ATOM 1363 CA LEU A 92 7.560 -12.166 -0.631 1.00 0.00 C ATOM 1364 C LEU A 92 7.855 -10.909 -1.453 1.00 0.00 C ATOM 1365 O LEU A 92 7.369 -10.769 -2.574 1.00 0.00 O ATOM 1366 CB LEU A 92 7.848 -13.470 -1.377 1.00 0.00 C ATOM 1367 CG LEU A 92 7.615 -14.760 -0.587 1.00 0.00 C ATOM 1368 CD1 LEU A 92 6.209 -14.787 0.016 1.00 0.00 C ATOM 1369 CD2 LEU A 92 7.891 -15.991 -1.454 1.00 0.00 C ATOM 0 H LEU A 92 5.489 -12.322 -0.905 1.00 0.00 H new ATOM 0 HA LEU A 92 8.240 -12.157 0.221 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.227 -13.498 -2.272 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.886 -13.454 -1.710 1.00 0.00 H new ATOM 0 HG LEU A 92 8.322 -14.785 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.069 -15.714 0.572 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.085 -13.938 0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.469 -14.728 -0.783 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.718 -16.894 -0.869 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.225 -15.985 -2.317 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.926 -15.972 -1.794 1.00 0.00 H new ATOM 1381 N ASP A 93 8.649 -10.028 -0.863 1.00 0.00 N ATOM 1382 CA ASP A 93 9.014 -8.788 -1.527 1.00 0.00 C ATOM 1383 C ASP A 93 9.940 -9.098 -2.704 1.00 0.00 C ATOM 1384 O ASP A 93 11.117 -8.741 -2.683 1.00 0.00 O ATOM 1385 CB ASP A 93 9.758 -7.851 -0.573 1.00 0.00 C ATOM 1386 CG ASP A 93 10.467 -6.674 -1.246 1.00 0.00 C ATOM 1387 OD1 ASP A 93 9.918 -6.182 -2.255 1.00 0.00 O ATOM 1388 OD2 ASP A 93 11.543 -6.293 -0.735 1.00 0.00 O ATOM 0 H ASP A 93 9.050 -10.148 0.067 1.00 0.00 H new ATOM 0 HA ASP A 93 8.098 -8.304 -1.866 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.048 -7.460 0.155 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.496 -8.432 -0.019 1.00 0.00 H new ATOM 1393 N SER A 94 9.374 -9.759 -3.703 1.00 0.00 N ATOM 1394 CA SER A 94 10.135 -10.122 -4.886 1.00 0.00 C ATOM 1395 C SER A 94 9.241 -10.047 -6.126 1.00 0.00 C ATOM 1396 O SER A 94 8.027 -10.219 -6.032 1.00 0.00 O ATOM 1397 CB SER A 94 10.734 -11.523 -4.749 1.00 0.00 C ATOM 1398 OG SER A 94 12.065 -11.586 -5.254 1.00 0.00 O ATOM 0 H SER A 94 8.397 -10.053 -3.717 1.00 0.00 H new ATOM 0 HA SER A 94 10.957 -9.414 -4.994 1.00 0.00 H new ATOM 0 HB2 SER A 94 10.730 -11.818 -3.700 1.00 0.00 H new ATOM 0 HB3 SER A 94 10.109 -12.238 -5.284 1.00 0.00 H new ATOM 0 HG SER A 94 12.413 -12.496 -5.147 1.00 0.00 H new ATOM 1404 N PRO A 95 9.894 -9.782 -7.290 1.00 0.00 N ATOM 1405 CA PRO A 95 9.171 -9.682 -8.546 1.00 0.00 C ATOM 1406 C PRO A 95 8.758 -11.065 -9.053 1.00 0.00 C ATOM 1407 O PRO A 95 8.005 -11.177 -10.019 1.00 0.00 O ATOM 1408 CB PRO A 95 10.122 -8.964 -9.490 1.00 0.00 C ATOM 1409 CG PRO A 95 11.505 -9.102 -8.874 1.00 0.00 C ATOM 1410 CD PRO A 95 11.331 -9.572 -7.439 1.00 0.00 C ATOM 0 HA PRO A 95 8.235 -9.133 -8.450 1.00 0.00 H new ATOM 0 HB2 PRO A 95 10.092 -9.407 -10.486 1.00 0.00 H new ATOM 0 HB3 PRO A 95 9.846 -7.915 -9.599 1.00 0.00 H new ATOM 0 HG2 PRO A 95 12.105 -9.815 -9.439 1.00 0.00 H new ATOM 0 HG3 PRO A 95 12.032 -8.148 -8.902 1.00 0.00 H new ATOM 0 HD2 PRO A 95 11.887 -10.491 -7.253 1.00 0.00 H new ATOM 0 HD3 PRO A 95 11.698 -8.829 -6.731 1.00 0.00 H new ATOM 1418 N ASP A 96 9.267 -12.084 -8.377 1.00 0.00 N ATOM 1419 CA ASP A 96 8.960 -13.456 -8.746 1.00 0.00 C ATOM 1420 C ASP A 96 7.554 -13.808 -8.256 1.00 0.00 C ATOM 1421 O ASP A 96 6.704 -14.222 -9.043 1.00 0.00 O ATOM 1422 CB ASP A 96 9.945 -14.433 -8.102 1.00 0.00 C ATOM 1423 CG ASP A 96 11.420 -14.054 -8.244 1.00 0.00 C ATOM 1424 OD1 ASP A 96 11.694 -13.134 -9.046 1.00 0.00 O ATOM 1425 OD2 ASP A 96 12.240 -14.692 -7.549 1.00 0.00 O ATOM 0 H ASP A 96 9.890 -11.987 -7.575 1.00 0.00 H new ATOM 0 HA ASP A 96 9.030 -13.538 -9.831 1.00 0.00 H new ATOM 0 HB2 ASP A 96 9.708 -14.518 -7.041 1.00 0.00 H new ATOM 0 HB3 ASP A 96 9.795 -15.419 -8.542 1.00 0.00 H new ATOM 1430 N ALA A 97 7.353 -13.633 -6.959 1.00 0.00 N ATOM 1431 CA ALA A 97 6.065 -13.927 -6.354 1.00 0.00 C ATOM 1432 C ALA A 97 4.972 -13.145 -7.086 1.00 0.00 C ATOM 1433 O ALA A 97 5.089 -11.935 -7.273 1.00 0.00 O ATOM 1434 CB ALA A 97 6.115 -13.600 -4.861 1.00 0.00 C ATOM 0 H ALA A 97 8.061 -13.291 -6.309 1.00 0.00 H new ATOM 0 HA ALA A 97 5.831 -14.987 -6.447 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.149 -13.821 -4.408 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.887 -14.203 -4.382 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.345 -12.543 -4.728 1.00 0.00 H new ATOM 1440 N PHE A 98 3.935 -13.869 -7.481 1.00 0.00 N ATOM 1441 CA PHE A 98 2.822 -13.259 -8.188 1.00 0.00 C ATOM 1442 C PHE A 98 1.533 -13.355 -7.370 1.00 0.00 C ATOM 1443 O PHE A 98 1.246 -14.393 -6.776 1.00 0.00 O ATOM 1444 CB PHE A 98 2.643 -14.035 -9.494 1.00 0.00 C ATOM 1445 CG PHE A 98 3.932 -14.203 -10.301 1.00 0.00 C ATOM 1446 CD1 PHE A 98 4.647 -13.109 -10.675 1.00 0.00 C ATOM 1447 CD2 PHE A 98 4.362 -15.447 -10.644 1.00 0.00 C ATOM 1448 CE1 PHE A 98 5.844 -13.265 -11.424 1.00 0.00 C ATOM 1449 CE2 PHE A 98 5.559 -15.603 -11.393 1.00 0.00 C ATOM 1450 CZ PHE A 98 6.274 -14.508 -11.767 1.00 0.00 C ATOM 0 H PHE A 98 3.842 -14.873 -7.325 1.00 0.00 H new ATOM 0 HA PHE A 98 3.028 -12.204 -8.367 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.238 -15.021 -9.266 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.905 -13.522 -10.111 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.305 -12.121 -10.403 1.00 0.00 H new ATOM 0 HD2 PHE A 98 3.794 -16.316 -10.347 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.412 -12.396 -11.721 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.901 -16.591 -11.665 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.184 -14.626 -12.337 1.00 0.00 H new ATOM 1460 N TYR A 99 0.790 -12.258 -7.365 1.00 0.00 N ATOM 1461 CA TYR A 99 -0.462 -12.205 -6.629 1.00 0.00 C ATOM 1462 C TYR A 99 -1.560 -11.541 -7.462 1.00 0.00 C ATOM 1463 O TYR A 99 -1.270 -10.792 -8.394 1.00 0.00 O ATOM 1464 CB TYR A 99 -0.188 -11.348 -5.392 1.00 0.00 C ATOM 1465 CG TYR A 99 0.754 -12.002 -4.378 1.00 0.00 C ATOM 1466 CD1 TYR A 99 0.481 -13.266 -3.898 1.00 0.00 C ATOM 1467 CD2 TYR A 99 1.876 -11.326 -3.944 1.00 0.00 C ATOM 1468 CE1 TYR A 99 1.367 -13.881 -2.944 1.00 0.00 C ATOM 1469 CE2 TYR A 99 2.763 -11.941 -2.990 1.00 0.00 C ATOM 1470 CZ TYR A 99 2.464 -13.189 -2.538 1.00 0.00 C ATOM 1471 OH TYR A 99 3.301 -13.769 -1.637 1.00 0.00 O ATOM 0 H TYR A 99 1.031 -11.399 -7.859 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.801 -13.209 -6.375 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.240 -10.397 -5.709 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -1.135 -11.124 -4.901 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.397 -13.794 -4.238 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.089 -10.336 -4.319 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.164 -14.870 -2.560 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.645 -11.424 -2.642 1.00 0.00 H new ATOM 0 HH TYR A 99 2.791 -14.373 -1.058 1.00 0.00 H new ATOM 1481 N TYR A 100 -2.798 -11.839 -7.097 1.00 0.00 N ATOM 1482 CA TYR A 100 -3.941 -11.280 -7.799 1.00 0.00 C ATOM 1483 C TYR A 100 -5.154 -11.174 -6.873 1.00 0.00 C ATOM 1484 O TYR A 100 -5.327 -11.995 -5.973 1.00 0.00 O ATOM 1485 CB TYR A 100 -4.261 -12.259 -8.930 1.00 0.00 C ATOM 1486 CG TYR A 100 -4.848 -13.590 -8.454 1.00 0.00 C ATOM 1487 CD1 TYR A 100 -4.012 -14.589 -7.999 1.00 0.00 C ATOM 1488 CD2 TYR A 100 -6.213 -13.790 -8.479 1.00 0.00 C ATOM 1489 CE1 TYR A 100 -4.564 -15.842 -7.551 1.00 0.00 C ATOM 1490 CE2 TYR A 100 -6.765 -15.042 -8.031 1.00 0.00 C ATOM 1491 CZ TYR A 100 -5.914 -16.006 -7.589 1.00 0.00 C ATOM 1492 OH TYR A 100 -6.435 -17.189 -7.166 1.00 0.00 O ATOM 0 H TYR A 100 -3.035 -12.461 -6.324 1.00 0.00 H new ATOM 0 HA TYR A 100 -3.715 -10.278 -8.165 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.965 -11.788 -9.616 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.350 -12.457 -9.494 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -2.944 -14.432 -7.979 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -6.867 -13.008 -8.835 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -3.921 -16.633 -7.193 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.831 -15.212 -8.046 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.411 -17.165 -7.248 1.00 0.00 H new ATOM 1502 N PHE A 101 -5.964 -10.156 -7.126 1.00 0.00 N ATOM 1503 CA PHE A 101 -7.156 -9.932 -6.326 1.00 0.00 C ATOM 1504 C PHE A 101 -8.176 -11.053 -6.537 1.00 0.00 C ATOM 1505 O PHE A 101 -8.235 -11.650 -7.610 1.00 0.00 O ATOM 1506 CB PHE A 101 -7.766 -8.609 -6.794 1.00 0.00 C ATOM 1507 CG PHE A 101 -6.775 -7.445 -6.829 1.00 0.00 C ATOM 1508 CD1 PHE A 101 -6.051 -7.133 -5.720 1.00 0.00 C ATOM 1509 CD2 PHE A 101 -6.616 -6.721 -7.970 1.00 0.00 C ATOM 1510 CE1 PHE A 101 -5.131 -6.052 -5.753 1.00 0.00 C ATOM 1511 CE2 PHE A 101 -5.696 -5.640 -8.003 1.00 0.00 C ATOM 1512 CZ PHE A 101 -4.972 -5.329 -6.894 1.00 0.00 C ATOM 0 H PHE A 101 -5.818 -9.477 -7.873 1.00 0.00 H new ATOM 0 HA PHE A 101 -6.895 -9.908 -5.268 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.185 -8.746 -7.791 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.593 -8.349 -6.134 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -6.176 -7.708 -4.814 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.190 -6.969 -8.851 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -4.558 -5.804 -4.872 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.571 -5.065 -8.908 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.271 -4.508 -6.920 1.00 0.00 H new ATOM 1522 N PRO A 102 -8.976 -11.311 -5.467 1.00 0.00 N ATOM 1523 CA PRO A 102 -9.990 -12.349 -5.524 1.00 0.00 C ATOM 1524 C PRO A 102 -11.192 -11.897 -6.357 1.00 0.00 C ATOM 1525 O PRO A 102 -12.251 -11.593 -5.810 1.00 0.00 O ATOM 1526 CB PRO A 102 -10.346 -12.633 -4.074 1.00 0.00 C ATOM 1527 CG PRO A 102 -9.862 -11.427 -3.283 1.00 0.00 C ATOM 1528 CD PRO A 102 -8.935 -10.623 -4.180 1.00 0.00 C ATOM 0 HA PRO A 102 -9.637 -13.254 -6.018 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -11.421 -12.772 -3.956 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -9.866 -13.547 -3.726 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.706 -10.817 -2.962 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -9.339 -11.747 -2.382 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -9.271 -9.590 -4.272 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -7.922 -10.594 -3.778 1.00 0.00 H new ATOM 1536 N ASP A 103 -10.987 -11.867 -7.666 1.00 0.00 N ATOM 1537 CA ASP A 103 -12.040 -11.457 -8.579 1.00 0.00 C ATOM 1538 C ASP A 103 -11.480 -11.396 -10.001 1.00 0.00 C ATOM 1539 O ASP A 103 -12.133 -11.830 -10.949 1.00 0.00 O ATOM 1540 CB ASP A 103 -12.570 -10.068 -8.219 1.00 0.00 C ATOM 1541 CG ASP A 103 -11.495 -9.004 -7.991 1.00 0.00 C ATOM 1542 OD1 ASP A 103 -10.848 -8.627 -8.992 1.00 0.00 O ATOM 1543 OD2 ASP A 103 -11.344 -8.592 -6.820 1.00 0.00 O ATOM 0 H ASP A 103 -10.107 -12.120 -8.116 1.00 0.00 H new ATOM 0 HA ASP A 103 -12.851 -12.182 -8.507 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -13.231 -9.730 -9.017 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -13.176 -10.150 -7.317 1.00 0.00 H new ATOM 1548 N SER A 104 -10.276 -10.853 -10.106 1.00 0.00 N ATOM 1549 CA SER A 104 -9.621 -10.729 -11.397 1.00 0.00 C ATOM 1550 C SER A 104 -8.494 -11.757 -11.513 1.00 0.00 C ATOM 1551 O SER A 104 -8.145 -12.414 -10.533 1.00 0.00 O ATOM 1552 CB SER A 104 -9.073 -9.315 -11.603 1.00 0.00 C ATOM 1553 OG SER A 104 -9.959 -8.506 -12.372 1.00 0.00 O ATOM 0 H SER A 104 -9.737 -10.494 -9.318 1.00 0.00 H new ATOM 0 HA SER A 104 -10.360 -10.920 -12.175 1.00 0.00 H new ATOM 0 HB2 SER A 104 -8.904 -8.847 -10.633 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.106 -9.370 -12.103 1.00 0.00 H new ATOM 0 HG SER A 104 -9.574 -7.611 -12.480 1.00 0.00 H new ATOM 1559 N GLY A 105 -7.956 -11.865 -12.719 1.00 0.00 N ATOM 1560 CA GLY A 105 -6.876 -12.802 -12.975 1.00 0.00 C ATOM 1561 C GLY A 105 -7.073 -13.514 -14.316 1.00 0.00 C ATOM 1562 O GLY A 105 -7.707 -12.974 -15.221 1.00 0.00 O ATOM 0 H GLY A 105 -8.248 -11.319 -13.529 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -5.923 -12.272 -12.977 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -6.830 -13.538 -12.172 1.00 0.00 H new ATOM 1566 N PRO A 106 -6.504 -14.746 -14.402 1.00 0.00 N ATOM 1567 CA PRO A 106 -6.612 -15.536 -15.616 1.00 0.00 C ATOM 1568 C PRO A 106 -8.012 -16.135 -15.759 1.00 0.00 C ATOM 1569 O PRO A 106 -8.826 -16.047 -14.840 1.00 0.00 O ATOM 1570 CB PRO A 106 -5.524 -16.591 -15.496 1.00 0.00 C ATOM 1571 CG PRO A 106 -5.156 -16.645 -14.022 1.00 0.00 C ATOM 1572 CD PRO A 106 -5.746 -15.417 -13.350 1.00 0.00 C ATOM 0 HA PRO A 106 -6.474 -14.941 -16.519 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -5.880 -17.560 -15.845 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -4.659 -16.330 -16.105 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -5.545 -17.555 -13.564 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -4.073 -16.664 -13.899 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -6.389 -15.693 -12.514 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -4.965 -14.770 -12.951 1.00 0.00 H new ATOM 1580 N SER A 107 -8.251 -16.732 -16.917 1.00 0.00 N ATOM 1581 CA SER A 107 -9.540 -17.345 -17.192 1.00 0.00 C ATOM 1582 C SER A 107 -9.340 -18.764 -17.727 1.00 0.00 C ATOM 1583 O SER A 107 -8.670 -18.961 -18.740 1.00 0.00 O ATOM 1584 CB SER A 107 -10.346 -16.510 -18.188 1.00 0.00 C ATOM 1585 OG SER A 107 -11.335 -15.714 -17.541 1.00 0.00 O ATOM 0 H SER A 107 -7.574 -16.805 -17.676 1.00 0.00 H new ATOM 0 HA SER A 107 -10.103 -17.391 -16.260 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.671 -15.864 -18.749 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.827 -17.171 -18.909 1.00 0.00 H new ATOM 0 HG SER A 107 -11.827 -15.195 -18.211 1.00 0.00 H new ATOM 1591 N SER A 108 -9.934 -19.717 -17.024 1.00 0.00 N ATOM 1592 CA SER A 108 -9.830 -21.112 -17.416 1.00 0.00 C ATOM 1593 C SER A 108 -10.936 -21.928 -16.743 1.00 0.00 C ATOM 1594 O SER A 108 -11.468 -21.526 -15.710 1.00 0.00 O ATOM 1595 CB SER A 108 -8.457 -21.683 -17.060 1.00 0.00 C ATOM 1596 OG SER A 108 -8.240 -21.714 -15.651 1.00 0.00 O ATOM 0 H SER A 108 -10.489 -19.550 -16.185 1.00 0.00 H new ATOM 0 HA SER A 108 -9.949 -21.174 -18.498 1.00 0.00 H new ATOM 0 HB2 SER A 108 -8.369 -22.692 -17.463 1.00 0.00 H new ATOM 0 HB3 SER A 108 -7.681 -21.082 -17.533 1.00 0.00 H new ATOM 0 HG SER A 108 -7.353 -22.087 -15.465 1.00 0.00 H new ATOM 1602 N GLY A 109 -11.248 -23.060 -17.357 1.00 0.00 N ATOM 1603 CA GLY A 109 -12.281 -23.937 -16.831 1.00 0.00 C ATOM 1604 C GLY A 109 -13.627 -23.214 -16.755 1.00 0.00 C ATOM 1605 O GLY A 109 -14.561 -23.557 -17.479 1.00 0.00 O ATOM 0 H GLY A 109 -10.804 -23.390 -18.214 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -12.373 -24.818 -17.466 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -11.996 -24.287 -15.839 1.00 0.00 H new TER 1609 GLY A 109