USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 949 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 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 34:sc= 0.0858 USER MOD Single : A 8 MET CE :methyl -155:sc= -1.71! (180deg=-2.45!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= -0.926 USER MOD Single : A 21 LYS NZ :NH3+ 160:sc= -0.0242 (180deg=-0.254) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= -0.0272 USER MOD Single : A 36 LYS NZ :NH3+ -137:sc= 0.00276 (180deg=-0.00847) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0486) USER MOD Single : A 42 THR OG1 : rot 146:sc= 1.85 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 174:sc= 0.659 (180deg=0.635) USER MOD Single : A 47 ASN : amide:sc= 0.278 K(o=0.28,f=-2.5!) USER MOD Single : A 50 ASN : amide:sc= -4.79! K(o=-4.8!,f=-1.2) USER MOD Single : A 54 ASN : amide:sc= -4.77 K(o=-4.8,f=-2.6) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -104:sc= 0.125 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 150:sc= -0.12 (180deg=-1.3) USER MOD Single : A 90 THR OG1 : rot -51:sc= 0.547 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.145) USER MOD Single : A 99 THR OG1 : rot -66:sc= 1.12 USER MOD Single : A 102 GLN : amide:sc= -1.03 K(o=-1,f=-5.1!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 41:sc= 0.327 USER MOD Single : A 108 TYR OH : rot 128:sc= 1.17 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -1.52! C(o=-1.5!,f=-17!) USER MOD Single : A 117 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.719) USER MOD Single : A 119 GLN : amide:sc= -0.0972 K(o=-0.097,f=-1.3) USER MOD Single : A 121 THR OG1 : rot -34:sc= 1.11 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.234 -22.424 2.265 1.00 0.00 N ATOM 49 CA SER A 6 -7.913 -22.540 0.847 1.00 0.00 C ATOM 50 C SER A 6 -6.936 -21.448 0.421 1.00 0.00 C ATOM 51 O SER A 6 -7.094 -20.834 -0.634 1.00 0.00 O ATOM 52 CB SER A 6 -9.187 -22.457 0.005 1.00 0.00 C ATOM 53 OG SER A 6 -10.117 -23.455 0.387 1.00 0.00 O ATOM 0 HA SER A 6 -7.442 -23.509 0.684 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.639 -21.472 0.120 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.938 -22.573 -1.050 1.00 0.00 H new ATOM 0 HG SER A 6 -10.046 -23.616 1.351 1.00 0.00 H new ATOM 59 N GLY A 7 -5.924 -21.211 1.250 1.00 0.00 N ATOM 60 CA GLY A 7 -4.935 -20.194 0.943 1.00 0.00 C ATOM 61 C GLY A 7 -5.545 -18.812 0.818 1.00 0.00 C ATOM 62 O GLY A 7 -6.450 -18.596 0.012 1.00 0.00 O ATOM 0 H GLY A 7 -5.771 -21.705 2.129 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.175 -20.183 1.724 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.431 -20.451 0.011 1.00 0.00 H new ATOM 66 N MET A 8 -5.050 -17.874 1.618 1.00 0.00 N ATOM 67 CA MET A 8 -5.554 -16.505 1.593 1.00 0.00 C ATOM 68 C MET A 8 -4.412 -15.504 1.738 1.00 0.00 C ATOM 69 O MET A 8 -3.528 -15.672 2.579 1.00 0.00 O ATOM 70 CB MET A 8 -6.577 -16.295 2.711 1.00 0.00 C ATOM 71 CG MET A 8 -6.804 -14.833 3.060 1.00 0.00 C ATOM 72 SD MET A 8 -8.437 -14.532 3.763 1.00 0.00 S ATOM 73 CE MET A 8 -9.377 -14.156 2.286 1.00 0.00 C ATOM 0 H MET A 8 -4.301 -18.036 2.291 1.00 0.00 H new ATOM 0 HA MET A 8 -6.039 -16.340 0.631 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.526 -16.740 2.412 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.243 -16.825 3.603 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.042 -14.510 3.770 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.681 -14.226 2.163 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.236 -13.538 2.549 1.00 0.00 H new ATOM 0 HE2 MET A 8 -8.745 -13.618 1.580 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.723 -15.083 1.829 1.00 0.00 H new ATOM 83 N LEU A 9 -4.438 -14.461 0.915 1.00 0.00 N ATOM 84 CA LEU A 9 -3.404 -13.432 0.952 1.00 0.00 C ATOM 85 C LEU A 9 -3.948 -12.136 1.544 1.00 0.00 C ATOM 86 O LEU A 9 -4.915 -11.567 1.037 1.00 0.00 O ATOM 87 CB LEU A 9 -2.863 -13.175 -0.456 1.00 0.00 C ATOM 88 CG LEU A 9 -1.765 -12.117 -0.569 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.393 -12.752 -0.405 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.861 -11.390 -1.902 1.00 0.00 C ATOM 0 H LEU A 9 -5.163 -14.306 0.215 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.593 -13.788 1.587 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.477 -14.114 -0.853 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.695 -12.877 -1.095 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.904 -11.390 0.231 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.376 -11.984 -0.488 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.327 -13.227 0.574 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.243 -13.501 -1.183 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -1.072 -10.641 -1.965 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.748 -12.106 -2.716 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.832 -10.902 -1.981 1.00 0.00 H new ATOM 102 N ARG A 10 -3.318 -11.673 2.619 1.00 0.00 N ATOM 103 CA ARG A 10 -3.738 -10.443 3.280 1.00 0.00 C ATOM 104 C ARG A 10 -2.783 -9.298 2.956 1.00 0.00 C ATOM 105 O ARG A 10 -1.567 -9.485 2.910 1.00 0.00 O ATOM 106 CB ARG A 10 -3.807 -10.651 4.794 1.00 0.00 C ATOM 107 CG ARG A 10 -5.161 -11.140 5.281 1.00 0.00 C ATOM 108 CD ARG A 10 -5.222 -11.191 6.800 1.00 0.00 C ATOM 109 NE ARG A 10 -6.330 -12.016 7.275 1.00 0.00 N ATOM 110 CZ ARG A 10 -6.593 -12.222 8.561 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.833 -11.666 9.494 1.00 0.00 N ATOM 112 NH2 ARG A 10 -7.619 -12.986 8.915 1.00 0.00 N ATOM 0 H ARG A 10 -2.515 -12.131 3.051 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.729 -10.182 2.910 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.043 -11.371 5.088 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.569 -9.711 5.292 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.944 -10.480 4.906 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.359 -12.132 4.874 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.283 -11.587 7.188 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.328 -10.180 7.193 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.934 -12.458 6.582 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.044 -11.078 9.225 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.037 -11.826 10.480 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.206 -13.415 8.200 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.821 -13.144 9.902 1.00 0.00 H new ATOM 126 N VAL A 11 -3.342 -8.114 2.731 1.00 0.00 N ATOM 127 CA VAL A 11 -2.540 -6.938 2.412 1.00 0.00 C ATOM 128 C VAL A 11 -2.957 -5.742 3.260 1.00 0.00 C ATOM 129 O VAL A 11 -3.857 -4.988 2.888 1.00 0.00 O ATOM 130 CB VAL A 11 -2.661 -6.565 0.922 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.782 -5.366 0.600 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.299 -7.753 0.044 1.00 0.00 C ATOM 0 H VAL A 11 -4.347 -7.943 2.764 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.503 -7.192 2.633 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.696 -6.293 0.716 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.880 -5.116 -0.457 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.093 -4.514 1.204 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.742 -5.607 0.821 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.390 -7.471 -1.005 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.273 -8.058 0.250 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.974 -8.582 0.257 1.00 0.00 H new ATOM 142 N ILE A 12 -2.296 -5.573 4.400 1.00 0.00 N ATOM 143 CA ILE A 12 -2.597 -4.467 5.301 1.00 0.00 C ATOM 144 C ILE A 12 -1.971 -3.168 4.804 1.00 0.00 C ATOM 145 O ILE A 12 -0.781 -3.118 4.495 1.00 0.00 O ATOM 146 CB ILE A 12 -2.096 -4.752 6.729 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.652 -6.085 7.232 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.493 -3.620 7.665 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.759 -6.770 8.242 1.00 0.00 C ATOM 0 H ILE A 12 -1.548 -6.188 4.722 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.682 -4.361 5.320 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.008 -4.818 6.710 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.631 -5.915 7.681 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.803 -6.750 6.382 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.132 -3.836 8.671 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.053 -2.686 7.314 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.579 -3.526 7.682 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.216 -7.709 8.554 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.788 -6.972 7.791 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.629 -6.124 9.110 1.00 0.00 H new ATOM 161 N VAL A 13 -2.782 -2.118 4.730 1.00 0.00 N ATOM 162 CA VAL A 13 -2.308 -0.817 4.274 1.00 0.00 C ATOM 163 C VAL A 13 -2.195 0.165 5.435 1.00 0.00 C ATOM 164 O VAL A 13 -3.192 0.734 5.878 1.00 0.00 O ATOM 165 CB VAL A 13 -3.242 -0.223 3.203 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.697 1.103 2.694 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.431 -1.206 2.057 1.00 0.00 C ATOM 0 H VAL A 13 -3.771 -2.143 4.980 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.321 -0.975 3.838 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.215 -0.038 3.657 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.370 1.507 1.938 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.618 1.806 3.523 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.711 0.947 2.256 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.094 -0.770 1.309 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.465 -1.425 1.602 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.870 -2.128 2.437 1.00 0.00 H new ATOM 177 N GLU A 14 -0.973 0.360 5.921 1.00 0.00 N ATOM 178 CA GLU A 14 -0.731 1.274 7.031 1.00 0.00 C ATOM 179 C GLU A 14 -1.019 2.715 6.622 1.00 0.00 C ATOM 180 O GLU A 14 -2.041 3.287 7.002 1.00 0.00 O ATOM 181 CB GLU A 14 0.715 1.149 7.517 1.00 0.00 C ATOM 182 CG GLU A 14 1.001 -0.152 8.249 1.00 0.00 C ATOM 183 CD GLU A 14 0.050 -0.392 9.405 1.00 0.00 C ATOM 184 OE1 GLU A 14 0.217 0.262 10.455 1.00 0.00 O ATOM 185 OE2 GLU A 14 -0.860 -1.234 9.259 1.00 0.00 O ATOM 0 H GLU A 14 -0.137 -0.102 5.564 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.405 1.004 7.844 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.385 1.229 6.661 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.941 1.985 8.178 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.930 -0.983 7.547 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.025 -0.137 8.623 1.00 0.00 H new ATOM 192 N SER A 15 -0.110 3.297 5.846 1.00 0.00 N ATOM 193 CA SER A 15 -0.263 4.673 5.389 1.00 0.00 C ATOM 194 C SER A 15 0.855 5.052 4.422 1.00 0.00 C ATOM 195 O SER A 15 1.872 4.366 4.333 1.00 0.00 O ATOM 196 CB SER A 15 -0.268 5.632 6.581 1.00 0.00 C ATOM 197 OG SER A 15 0.823 5.374 7.448 1.00 0.00 O ATOM 0 H SER A 15 0.740 2.837 5.521 1.00 0.00 H new ATOM 0 HA SER A 15 -1.216 4.751 4.865 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.218 6.661 6.224 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.204 5.530 7.130 1.00 0.00 H new ATOM 0 HG SER A 15 0.798 6.001 8.201 1.00 0.00 H new ATOM 203 N ALA A 16 0.657 6.150 3.700 1.00 0.00 N ATOM 204 CA ALA A 16 1.648 6.622 2.741 1.00 0.00 C ATOM 205 C ALA A 16 2.195 7.987 3.145 1.00 0.00 C ATOM 206 O ALA A 16 1.626 8.667 3.998 1.00 0.00 O ATOM 207 CB ALA A 16 1.045 6.685 1.346 1.00 0.00 C ATOM 0 H ALA A 16 -0.180 6.729 3.761 1.00 0.00 H new ATOM 0 HA ALA A 16 2.477 5.914 2.734 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.797 7.039 0.640 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.709 5.691 1.050 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.197 7.370 1.347 1.00 0.00 H new ATOM 213 N SER A 17 3.303 8.382 2.526 1.00 0.00 N ATOM 214 CA SER A 17 3.930 9.665 2.824 1.00 0.00 C ATOM 215 C SER A 17 4.829 10.110 1.675 1.00 0.00 C ATOM 216 O SER A 17 5.166 9.321 0.794 1.00 0.00 O ATOM 217 CB SER A 17 4.744 9.570 4.116 1.00 0.00 C ATOM 218 OG SER A 17 3.901 9.626 5.255 1.00 0.00 O ATOM 0 H SER A 17 3.785 7.832 1.815 1.00 0.00 H new ATOM 0 HA SER A 17 3.141 10.406 2.953 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.311 8.639 4.125 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.467 10.384 4.155 1.00 0.00 H new ATOM 0 HG SER A 17 4.445 9.562 6.068 1.00 0.00 H new ATOM 224 N ASN A 18 5.214 11.383 1.692 1.00 0.00 N ATOM 225 CA ASN A 18 6.073 11.935 0.651 1.00 0.00 C ATOM 226 C ASN A 18 5.398 11.850 -0.714 1.00 0.00 C ATOM 227 O ASN A 18 6.002 11.403 -1.690 1.00 0.00 O ATOM 228 CB ASN A 18 7.411 11.193 0.618 1.00 0.00 C ATOM 229 CG ASN A 18 8.260 11.478 1.842 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.870 12.541 1.954 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.303 10.526 2.767 1.00 0.00 N ATOM 0 H ASN A 18 4.945 12.050 2.415 1.00 0.00 H new ATOM 0 HA ASN A 18 6.253 12.985 0.882 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.227 10.121 0.548 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.961 11.481 -0.278 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.858 10.661 3.612 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.781 9.660 2.632 1.00 0.00 H new ATOM 238 N ILE A 19 4.143 12.282 -0.775 1.00 0.00 N ATOM 239 CA ILE A 19 3.387 12.256 -2.021 1.00 0.00 C ATOM 240 C ILE A 19 3.469 13.597 -2.743 1.00 0.00 C ATOM 241 O ILE A 19 3.389 14.664 -2.133 1.00 0.00 O ATOM 242 CB ILE A 19 1.906 11.909 -1.774 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.782 10.510 -1.168 1.00 0.00 C ATOM 244 CG2 ILE A 19 1.117 12.002 -3.071 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.363 9.986 -1.143 1.00 0.00 C ATOM 0 H ILE A 19 3.628 12.654 0.023 1.00 0.00 H new ATOM 0 HA ILE A 19 3.835 11.482 -2.645 1.00 0.00 H new ATOM 0 HB ILE A 19 1.492 12.629 -1.068 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.406 9.820 -1.737 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.172 10.528 -0.150 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.073 11.754 -2.880 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.183 13.016 -3.465 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.529 11.303 -3.798 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.351 8.990 -0.700 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.261 10.654 -0.550 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.024 9.936 -2.161 1.00 0.00 H new ATOM 257 N PRO A 20 3.632 13.544 -4.073 1.00 0.00 N ATOM 258 CA PRO A 20 3.726 14.746 -4.907 1.00 0.00 C ATOM 259 C PRO A 20 2.400 15.493 -5.001 1.00 0.00 C ATOM 260 O PRO A 20 1.508 15.103 -5.753 1.00 0.00 O ATOM 261 CB PRO A 20 4.127 14.195 -6.278 1.00 0.00 C ATOM 262 CG PRO A 20 3.626 12.792 -6.284 1.00 0.00 C ATOM 263 CD PRO A 20 3.735 12.307 -4.865 1.00 0.00 C ATOM 0 HA PRO A 20 4.431 15.470 -4.499 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.682 14.778 -7.084 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.207 14.230 -6.418 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.594 12.748 -6.633 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.217 12.169 -6.956 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.939 11.604 -4.618 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.680 11.794 -4.687 1.00 0.00 H new ATOM 271 N LYS A 21 2.278 16.569 -4.231 1.00 0.00 N ATOM 272 CA LYS A 21 1.061 17.373 -4.228 1.00 0.00 C ATOM 273 C LYS A 21 0.678 17.786 -5.645 1.00 0.00 C ATOM 274 O LYS A 21 1.333 17.402 -6.614 1.00 0.00 O ATOM 275 CB LYS A 21 1.249 18.616 -3.355 1.00 0.00 C ATOM 276 CG LYS A 21 2.513 19.396 -3.673 1.00 0.00 C ATOM 277 CD LYS A 21 2.856 20.377 -2.564 1.00 0.00 C ATOM 278 CE LYS A 21 3.758 19.741 -1.517 1.00 0.00 C ATOM 279 NZ LYS A 21 5.128 19.491 -2.043 1.00 0.00 N ATOM 0 H LYS A 21 3.007 16.905 -3.601 1.00 0.00 H new ATOM 0 HA LYS A 21 0.255 16.766 -3.816 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.387 19.271 -3.479 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.272 18.314 -2.308 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.342 18.704 -3.817 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.382 19.936 -4.611 1.00 0.00 H new ATOM 0 HD2 LYS A 21 3.350 21.251 -2.989 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.939 20.728 -2.091 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.817 20.392 -0.645 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.320 18.800 -1.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 5.791 19.384 -1.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.128 18.621 -2.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.424 20.293 -2.636 1.00 0.00 H new ATOM 293 N THR A 22 -0.387 18.574 -5.759 1.00 0.00 N ATOM 294 CA THR A 22 -0.856 19.041 -7.058 1.00 0.00 C ATOM 295 C THR A 22 -0.713 20.553 -7.184 1.00 0.00 C ATOM 296 O THR A 22 -0.671 21.269 -6.183 1.00 0.00 O ATOM 297 CB THR A 22 -2.329 18.654 -7.295 1.00 0.00 C ATOM 298 OG1 THR A 22 -2.751 19.103 -8.587 1.00 0.00 O ATOM 299 CG2 THR A 22 -3.225 19.258 -6.225 1.00 0.00 C ATOM 0 H THR A 22 -0.941 18.902 -4.968 1.00 0.00 H new ATOM 0 HA THR A 22 -0.234 18.557 -7.811 1.00 0.00 H new ATOM 0 HB THR A 22 -2.410 17.568 -7.244 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.687 18.852 -8.731 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.260 18.972 -6.413 1.00 0.00 H new ATOM 0 HG22 THR A 22 -2.919 18.892 -5.245 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.139 20.344 -6.249 1.00 0.00 H new ATOM 356 N LYS A 26 -3.591 19.752 -3.025 1.00 0.00 N ATOM 357 CA LYS A 26 -3.246 18.399 -2.604 1.00 0.00 C ATOM 358 C LYS A 26 -4.232 17.384 -3.173 1.00 0.00 C ATOM 359 O LYS A 26 -5.434 17.434 -2.910 1.00 0.00 O ATOM 360 CB LYS A 26 -3.228 18.307 -1.077 1.00 0.00 C ATOM 361 CG LYS A 26 -2.094 19.085 -0.434 1.00 0.00 C ATOM 362 CD LYS A 26 -2.009 18.817 1.060 1.00 0.00 C ATOM 363 CE LYS A 26 -0.868 19.591 1.701 1.00 0.00 C ATOM 364 NZ LYS A 26 -1.279 20.970 2.084 1.00 0.00 N ATOM 0 HA LYS A 26 -2.252 18.168 -2.988 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.177 18.676 -0.688 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.150 17.260 -0.785 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.151 18.813 -0.907 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.240 20.151 -0.605 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -2.950 19.095 1.535 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -1.868 17.750 1.232 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.519 19.057 2.585 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.029 19.642 1.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.473 21.465 2.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.588 21.488 1.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -2.063 20.922 2.766 1.00 0.00 H new ATOM 378 N PRO A 27 -3.715 16.439 -3.972 1.00 0.00 N ATOM 379 CA PRO A 27 -4.532 15.393 -4.594 1.00 0.00 C ATOM 380 C PRO A 27 -5.055 14.385 -3.576 1.00 0.00 C ATOM 381 O PRO A 27 -4.737 14.464 -2.389 1.00 0.00 O ATOM 382 CB PRO A 27 -3.564 14.716 -5.567 1.00 0.00 C ATOM 383 CG PRO A 27 -2.212 14.972 -4.995 1.00 0.00 C ATOM 384 CD PRO A 27 -2.291 16.318 -4.330 1.00 0.00 C ATOM 0 HA PRO A 27 -5.421 15.802 -5.073 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.765 13.648 -5.646 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.655 15.133 -6.570 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.939 14.198 -4.278 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.451 14.966 -5.775 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.650 16.370 -3.450 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.976 17.117 -5.001 1.00 0.00 H new ATOM 392 N ASP A 28 -5.859 13.438 -4.048 1.00 0.00 N ATOM 393 CA ASP A 28 -6.425 12.413 -3.178 1.00 0.00 C ATOM 394 C ASP A 28 -5.811 11.048 -3.477 1.00 0.00 C ATOM 395 O ASP A 28 -6.220 10.345 -4.401 1.00 0.00 O ATOM 396 CB ASP A 28 -7.944 12.351 -3.349 1.00 0.00 C ATOM 397 CG ASP A 28 -8.568 13.727 -3.473 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.628 14.446 -2.453 1.00 0.00 O ATOM 399 OD2 ASP A 28 -8.997 14.085 -4.590 1.00 0.00 O ATOM 0 H ASP A 28 -6.133 13.359 -5.027 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.194 12.678 -2.146 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.183 11.765 -4.236 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.382 11.832 -2.497 1.00 0.00 H new ATOM 404 N PRO A 29 -4.806 10.663 -2.676 1.00 0.00 N ATOM 405 CA PRO A 29 -4.115 9.380 -2.835 1.00 0.00 C ATOM 406 C PRO A 29 -4.998 8.195 -2.460 1.00 0.00 C ATOM 407 O PRO A 29 -5.819 8.286 -1.547 1.00 0.00 O ATOM 408 CB PRO A 29 -2.932 9.493 -1.870 1.00 0.00 C ATOM 409 CG PRO A 29 -3.376 10.473 -0.839 1.00 0.00 C ATOM 410 CD PRO A 29 -4.268 11.450 -1.554 1.00 0.00 C ATOM 0 HA PRO A 29 -3.823 9.199 -3.870 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.693 8.528 -1.422 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.034 9.838 -2.383 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -3.912 9.974 -0.031 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.522 10.980 -0.390 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.062 11.819 -0.905 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.712 12.320 -1.904 1.00 0.00 H new ATOM 418 N ILE A 30 -4.823 7.085 -3.169 1.00 0.00 N ATOM 419 CA ILE A 30 -5.603 5.882 -2.908 1.00 0.00 C ATOM 420 C ILE A 30 -4.833 4.629 -3.311 1.00 0.00 C ATOM 421 O ILE A 30 -4.397 4.497 -4.455 1.00 0.00 O ATOM 422 CB ILE A 30 -6.947 5.909 -3.660 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.714 4.606 -3.425 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.718 6.134 -5.147 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.216 4.768 -3.490 1.00 0.00 C ATOM 0 H ILE A 30 -4.148 6.994 -3.928 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.796 5.857 -1.836 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.545 6.735 -3.275 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.404 3.872 -4.169 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.442 4.205 -2.449 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.677 6.151 -5.664 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.208 7.086 -5.297 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.104 5.327 -5.547 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.694 3.804 -3.314 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.539 5.477 -2.728 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.500 5.139 -4.475 1.00 0.00 H new ATOM 437 N VAL A 31 -4.672 3.710 -2.365 1.00 0.00 N ATOM 438 CA VAL A 31 -3.957 2.466 -2.621 1.00 0.00 C ATOM 439 C VAL A 31 -4.848 1.458 -3.339 1.00 0.00 C ATOM 440 O VAL A 31 -5.944 1.143 -2.876 1.00 0.00 O ATOM 441 CB VAL A 31 -3.438 1.837 -1.315 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.713 0.531 -1.601 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.530 2.810 -0.579 1.00 0.00 C ATOM 0 H VAL A 31 -5.027 3.804 -1.414 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.108 2.715 -3.258 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.292 1.617 -0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.354 0.102 -0.666 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.398 -0.168 -2.081 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.867 0.722 -2.261 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.172 2.349 0.342 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.680 3.064 -1.212 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.086 3.716 -0.339 1.00 0.00 H new ATOM 453 N SER A 32 -4.370 0.955 -4.472 1.00 0.00 N ATOM 454 CA SER A 32 -5.124 -0.016 -5.256 1.00 0.00 C ATOM 455 C SER A 32 -4.330 -1.306 -5.434 1.00 0.00 C ATOM 456 O SER A 32 -3.430 -1.384 -6.271 1.00 0.00 O ATOM 457 CB SER A 32 -5.481 0.570 -6.624 1.00 0.00 C ATOM 458 OG SER A 32 -6.279 1.733 -6.489 1.00 0.00 O ATOM 0 H SER A 32 -3.464 1.204 -4.868 1.00 0.00 H new ATOM 0 HA SER A 32 -6.042 -0.248 -4.716 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.568 0.813 -7.168 1.00 0.00 H new ATOM 0 HB3 SER A 32 -6.015 -0.175 -7.214 1.00 0.00 H new ATOM 0 HG SER A 32 -6.492 2.089 -7.377 1.00 0.00 H new ATOM 464 N VAL A 33 -4.670 -2.317 -4.641 1.00 0.00 N ATOM 465 CA VAL A 33 -3.990 -3.605 -4.710 1.00 0.00 C ATOM 466 C VAL A 33 -4.682 -4.539 -5.697 1.00 0.00 C ATOM 467 O VAL A 33 -5.910 -4.579 -5.773 1.00 0.00 O ATOM 468 CB VAL A 33 -3.935 -4.285 -3.329 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.231 -5.630 -3.424 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.245 -3.383 -2.318 1.00 0.00 C ATOM 0 H VAL A 33 -5.412 -2.269 -3.943 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.973 -3.409 -5.051 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.956 -4.459 -2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.202 -6.096 -2.439 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.773 -6.276 -4.115 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.214 -5.483 -3.786 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.215 -3.880 -1.348 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.228 -3.175 -2.651 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.796 -2.447 -2.230 1.00 0.00 H new ATOM 480 N ILE A 34 -3.885 -5.288 -6.452 1.00 0.00 N ATOM 481 CA ILE A 34 -4.420 -6.223 -7.434 1.00 0.00 C ATOM 482 C ILE A 34 -3.719 -7.574 -7.346 1.00 0.00 C ATOM 483 O ILE A 34 -2.494 -7.656 -7.426 1.00 0.00 O ATOM 484 CB ILE A 34 -4.280 -5.676 -8.867 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.146 -4.428 -9.048 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.661 -6.744 -9.881 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.449 -3.146 -8.652 1.00 0.00 C ATOM 0 H ILE A 34 -2.866 -5.265 -6.402 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.478 -6.350 -7.205 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.239 -5.399 -9.034 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.454 -4.357 -10.091 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.054 -4.537 -8.455 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.557 -6.342 -10.889 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.005 -7.607 -9.765 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.694 -7.049 -9.717 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.122 -2.303 -8.807 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.165 -3.196 -7.601 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.556 -3.014 -9.263 1.00 0.00 H new ATOM 499 N PHE A 35 -4.505 -8.633 -7.182 1.00 0.00 N ATOM 500 CA PHE A 35 -3.961 -9.982 -7.084 1.00 0.00 C ATOM 501 C PHE A 35 -5.036 -11.025 -7.372 1.00 0.00 C ATOM 502 O PHE A 35 -6.174 -10.903 -6.917 1.00 0.00 O ATOM 503 CB PHE A 35 -3.367 -10.215 -5.693 1.00 0.00 C ATOM 504 CG PHE A 35 -2.497 -11.437 -5.609 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.195 -11.409 -6.082 1.00 0.00 C ATOM 506 CD2 PHE A 35 -2.981 -12.612 -5.057 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.393 -12.532 -6.007 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.183 -13.738 -4.980 1.00 0.00 C ATOM 509 CZ PHE A 35 -0.887 -13.698 -5.454 1.00 0.00 C ATOM 0 H PHE A 35 -5.521 -8.583 -7.114 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.173 -10.084 -7.830 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.781 -9.342 -5.406 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.178 -10.306 -4.971 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.803 -10.500 -6.514 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -3.993 -12.649 -4.683 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.620 -12.498 -6.381 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.573 -14.648 -4.549 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.261 -14.576 -5.393 1.00 0.00 H new ATOM 519 N LYS A 36 -4.668 -12.051 -8.131 1.00 0.00 N ATOM 520 CA LYS A 36 -5.599 -13.118 -8.481 1.00 0.00 C ATOM 521 C LYS A 36 -6.862 -12.549 -9.120 1.00 0.00 C ATOM 522 O LYS A 36 -7.977 -12.882 -8.718 1.00 0.00 O ATOM 523 CB LYS A 36 -5.966 -13.931 -7.237 1.00 0.00 C ATOM 524 CG LYS A 36 -4.788 -14.667 -6.623 1.00 0.00 C ATOM 525 CD LYS A 36 -4.632 -16.059 -7.212 1.00 0.00 C ATOM 526 CE LYS A 36 -3.217 -16.586 -7.028 1.00 0.00 C ATOM 527 NZ LYS A 36 -2.270 -15.987 -8.009 1.00 0.00 N ATOM 0 H LYS A 36 -3.731 -12.167 -8.516 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.110 -13.771 -9.203 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.396 -13.263 -6.490 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.738 -14.654 -7.500 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.874 -14.096 -6.789 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.926 -14.741 -5.544 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.339 -16.738 -6.736 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.878 -16.036 -8.274 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.877 -16.368 -6.016 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.216 -17.670 -7.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.643 -16.728 -8.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.805 -15.559 -8.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.700 -15.256 -7.539 1.00 0.00 H new ATOM 541 N ASP A 37 -6.680 -11.692 -10.118 1.00 0.00 N ATOM 542 CA ASP A 37 -7.805 -11.080 -10.815 1.00 0.00 C ATOM 543 C ASP A 37 -8.783 -10.457 -9.825 1.00 0.00 C ATOM 544 O ASP A 37 -9.997 -10.502 -10.025 1.00 0.00 O ATOM 545 CB ASP A 37 -8.524 -12.118 -11.678 1.00 0.00 C ATOM 546 CG ASP A 37 -9.648 -11.513 -12.495 1.00 0.00 C ATOM 547 OD1 ASP A 37 -9.351 -10.754 -13.442 1.00 0.00 O ATOM 548 OD2 ASP A 37 -10.825 -11.797 -12.188 1.00 0.00 O ATOM 0 H ASP A 37 -5.764 -11.405 -10.463 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.416 -10.291 -11.459 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.805 -12.590 -12.348 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.926 -12.903 -11.038 1.00 0.00 H new ATOM 553 N GLU A 38 -8.247 -9.876 -8.756 1.00 0.00 N ATOM 554 CA GLU A 38 -9.074 -9.246 -7.734 1.00 0.00 C ATOM 555 C GLU A 38 -8.611 -7.818 -7.463 1.00 0.00 C ATOM 556 O GLU A 38 -7.586 -7.596 -6.817 1.00 0.00 O ATOM 557 CB GLU A 38 -9.033 -10.061 -6.439 1.00 0.00 C ATOM 558 CG GLU A 38 -10.240 -9.841 -5.543 1.00 0.00 C ATOM 559 CD GLU A 38 -11.521 -10.385 -6.145 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.537 -11.573 -6.532 1.00 0.00 O ATOM 561 OE2 GLU A 38 -12.507 -9.624 -6.228 1.00 0.00 O ATOM 0 H GLU A 38 -7.244 -9.829 -8.576 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.099 -9.213 -8.103 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -8.964 -11.120 -6.688 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.129 -9.804 -5.886 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.064 -10.319 -4.579 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.357 -8.774 -5.353 1.00 0.00 H new ATOM 568 N LYS A 39 -9.373 -6.851 -7.963 1.00 0.00 N ATOM 569 CA LYS A 39 -9.043 -5.443 -7.776 1.00 0.00 C ATOM 570 C LYS A 39 -9.613 -4.920 -6.461 1.00 0.00 C ATOM 571 O LYS A 39 -10.827 -4.915 -6.257 1.00 0.00 O ATOM 572 CB LYS A 39 -9.582 -4.612 -8.943 1.00 0.00 C ATOM 573 CG LYS A 39 -8.943 -3.240 -9.060 1.00 0.00 C ATOM 574 CD LYS A 39 -8.942 -2.745 -10.496 1.00 0.00 C ATOM 575 CE LYS A 39 -7.920 -3.489 -11.342 1.00 0.00 C ATOM 576 NZ LYS A 39 -8.297 -3.502 -12.783 1.00 0.00 N ATOM 0 H LYS A 39 -10.224 -7.017 -8.501 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.957 -5.352 -7.743 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.421 -5.159 -9.872 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.659 -4.493 -8.826 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.482 -2.532 -8.431 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.919 -3.282 -8.688 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.935 -2.873 -10.927 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.722 -1.677 -10.514 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.943 -3.020 -11.226 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.827 -4.513 -10.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.576 -4.018 -13.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.218 -3.972 -12.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.361 -2.525 -13.134 1.00 0.00 H new ATOM 590 N LYS A 40 -8.729 -4.480 -5.572 1.00 0.00 N ATOM 591 CA LYS A 40 -9.143 -3.953 -4.277 1.00 0.00 C ATOM 592 C LYS A 40 -8.368 -2.685 -3.933 1.00 0.00 C ATOM 593 O LYS A 40 -7.137 -2.685 -3.906 1.00 0.00 O ATOM 594 CB LYS A 40 -8.933 -5.004 -3.184 1.00 0.00 C ATOM 595 CG LYS A 40 -9.952 -6.130 -3.219 1.00 0.00 C ATOM 596 CD LYS A 40 -9.717 -7.129 -2.099 1.00 0.00 C ATOM 597 CE LYS A 40 -10.836 -8.157 -2.026 1.00 0.00 C ATOM 598 NZ LYS A 40 -12.015 -7.642 -1.277 1.00 0.00 N ATOM 0 H LYS A 40 -7.721 -4.478 -5.725 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.203 -3.706 -4.336 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.933 -5.427 -3.285 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -8.976 -4.517 -2.210 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -10.957 -5.716 -3.133 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.899 -6.641 -4.181 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.765 -7.636 -2.256 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.644 -6.601 -1.148 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.140 -8.435 -3.035 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.467 -9.062 -1.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.755 -8.372 -1.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.731 -7.401 -0.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.384 -6.793 -1.751 1.00 0.00 H new ATOM 612 N LYS A 41 -9.097 -1.605 -3.669 1.00 0.00 N ATOM 613 CA LYS A 41 -8.479 -0.331 -3.324 1.00 0.00 C ATOM 614 C LYS A 41 -8.995 0.178 -1.982 1.00 0.00 C ATOM 615 O LYS A 41 -10.148 -0.055 -1.619 1.00 0.00 O ATOM 616 CB LYS A 41 -8.756 0.706 -4.415 1.00 0.00 C ATOM 617 CG LYS A 41 -10.201 0.725 -4.883 1.00 0.00 C ATOM 618 CD LYS A 41 -10.462 1.876 -5.840 1.00 0.00 C ATOM 619 CE LYS A 41 -11.951 2.131 -6.012 1.00 0.00 C ATOM 620 NZ LYS A 41 -12.538 2.813 -4.826 1.00 0.00 N ATOM 0 H LYS A 41 -10.117 -1.588 -3.688 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.403 -0.487 -3.245 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.491 1.695 -4.040 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.109 0.505 -5.269 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.438 -0.219 -5.374 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.863 0.810 -4.021 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -9.978 2.778 -5.466 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.016 1.653 -6.809 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.115 2.742 -6.900 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.465 1.184 -6.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.501 3.135 -5.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.574 2.149 -4.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -11.950 3.632 -4.570 1.00 0.00 H new ATOM 634 N THR A 42 -8.134 0.877 -1.248 1.00 0.00 N ATOM 635 CA THR A 42 -8.502 1.419 0.053 1.00 0.00 C ATOM 636 C THR A 42 -9.310 2.703 -0.095 1.00 0.00 C ATOM 637 O THR A 42 -9.281 3.351 -1.142 1.00 0.00 O ATOM 638 CB THR A 42 -7.258 1.705 0.916 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.466 2.732 0.308 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.420 0.448 1.091 1.00 0.00 C ATOM 0 H THR A 42 -7.176 1.081 -1.534 1.00 0.00 H new ATOM 0 HA THR A 42 -9.112 0.664 0.548 1.00 0.00 H new ATOM 0 HB THR A 42 -7.593 2.038 1.898 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.042 3.274 1.006 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.547 0.675 1.704 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.017 -0.322 1.580 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.094 0.089 0.115 1.00 0.00 H new ATOM 648 N LYS A 43 -10.032 3.068 0.960 1.00 0.00 N ATOM 649 CA LYS A 43 -10.847 4.277 0.949 1.00 0.00 C ATOM 650 C LYS A 43 -9.991 5.508 0.670 1.00 0.00 C ATOM 651 O LYS A 43 -9.109 5.855 1.457 1.00 0.00 O ATOM 652 CB LYS A 43 -11.573 4.439 2.286 1.00 0.00 C ATOM 653 CG LYS A 43 -10.641 4.696 3.457 1.00 0.00 C ATOM 654 CD LYS A 43 -11.359 4.536 4.787 1.00 0.00 C ATOM 655 CE LYS A 43 -10.381 4.543 5.952 1.00 0.00 C ATOM 656 NZ LYS A 43 -11.064 4.288 7.251 1.00 0.00 N ATOM 0 H LYS A 43 -10.069 2.543 1.834 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.584 4.181 0.152 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.281 5.264 2.208 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -12.154 3.539 2.486 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.799 4.005 3.412 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.231 5.703 3.383 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -12.081 5.343 4.912 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.921 3.602 4.788 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.616 3.784 5.789 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.871 5.506 5.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.364 4.301 8.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.777 5.027 7.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.529 3.358 7.222 1.00 0.00 H new ATOM 670 N LYS A 44 -10.257 6.167 -0.452 1.00 0.00 N ATOM 671 CA LYS A 44 -9.513 7.361 -0.834 1.00 0.00 C ATOM 672 C LYS A 44 -9.319 8.287 0.363 1.00 0.00 C ATOM 673 O LYS A 44 -10.066 8.221 1.339 1.00 0.00 O ATOM 674 CB LYS A 44 -10.244 8.106 -1.954 1.00 0.00 C ATOM 675 CG LYS A 44 -11.411 8.945 -1.465 1.00 0.00 C ATOM 676 CD LYS A 44 -11.965 9.827 -2.572 1.00 0.00 C ATOM 677 CE LYS A 44 -13.345 10.363 -2.220 1.00 0.00 C ATOM 678 NZ LYS A 44 -14.415 9.368 -2.504 1.00 0.00 N ATOM 0 H LYS A 44 -10.984 5.894 -1.114 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.532 7.048 -1.193 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.535 8.752 -2.472 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.608 7.382 -2.683 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.199 8.291 -1.090 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.089 9.567 -0.630 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.285 10.660 -2.750 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.021 9.257 -3.499 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.371 10.633 -1.164 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.536 11.274 -2.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.326 9.730 -2.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -14.474 9.205 -3.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.193 8.473 -2.024 1.00 0.00 H new ATOM 692 N VAL A 45 -8.311 9.150 0.281 1.00 0.00 N ATOM 693 CA VAL A 45 -8.020 10.090 1.357 1.00 0.00 C ATOM 694 C VAL A 45 -8.109 11.531 0.866 1.00 0.00 C ATOM 695 O VAL A 45 -7.473 11.902 -0.121 1.00 0.00 O ATOM 696 CB VAL A 45 -6.621 9.847 1.951 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.280 10.923 2.971 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.541 8.463 2.577 1.00 0.00 C ATOM 0 H VAL A 45 -7.682 9.217 -0.519 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.769 9.926 2.132 1.00 0.00 H new ATOM 0 HB VAL A 45 -5.889 9.899 1.145 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.287 10.735 3.380 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.294 11.900 2.488 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.014 10.906 3.777 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.545 8.308 2.992 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.282 8.380 3.372 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.738 7.708 1.816 1.00 0.00 H new ATOM 708 N ASP A 46 -8.902 12.339 1.561 1.00 0.00 N ATOM 709 CA ASP A 46 -9.073 13.741 1.197 1.00 0.00 C ATOM 710 C ASP A 46 -7.723 14.410 0.962 1.00 0.00 C ATOM 711 O ASP A 46 -6.678 13.858 1.304 1.00 0.00 O ATOM 712 CB ASP A 46 -9.841 14.484 2.291 1.00 0.00 C ATOM 713 CG ASP A 46 -9.001 14.717 3.531 1.00 0.00 C ATOM 714 OD1 ASP A 46 -8.884 13.784 4.354 1.00 0.00 O ATOM 715 OD2 ASP A 46 -8.460 15.833 3.679 1.00 0.00 O ATOM 0 H ASP A 46 -9.436 12.047 2.379 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.645 13.783 0.270 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.184 15.443 1.903 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.729 13.912 2.560 1.00 0.00 H new ATOM 720 N ASN A 47 -7.753 15.602 0.375 1.00 0.00 N ATOM 721 CA ASN A 47 -6.531 16.346 0.093 1.00 0.00 C ATOM 722 C ASN A 47 -5.491 16.119 1.186 1.00 0.00 C ATOM 723 O ASN A 47 -5.523 16.769 2.230 1.00 0.00 O ATOM 724 CB ASN A 47 -6.836 17.840 -0.034 1.00 0.00 C ATOM 725 CG ASN A 47 -8.226 18.101 -0.581 1.00 0.00 C ATOM 726 OD1 ASN A 47 -9.226 17.879 0.102 1.00 0.00 O ATOM 727 ND2 ASN A 47 -8.295 18.575 -1.820 1.00 0.00 N ATOM 0 H ASN A 47 -8.610 16.073 0.085 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.125 15.983 -0.851 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.738 18.312 0.943 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.098 18.305 -0.688 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -9.203 18.770 -2.242 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.440 18.744 -2.350 1.00 0.00 H new ATOM 734 N GLU A 48 -4.570 15.193 0.937 1.00 0.00 N ATOM 735 CA GLU A 48 -3.521 14.881 1.900 1.00 0.00 C ATOM 736 C GLU A 48 -2.398 14.085 1.243 1.00 0.00 C ATOM 737 O GLU A 48 -2.647 13.116 0.523 1.00 0.00 O ATOM 738 CB GLU A 48 -4.098 14.093 3.078 1.00 0.00 C ATOM 739 CG GLU A 48 -3.042 13.587 4.047 1.00 0.00 C ATOM 740 CD GLU A 48 -2.273 14.712 4.711 1.00 0.00 C ATOM 741 OE1 GLU A 48 -1.238 15.133 4.152 1.00 0.00 O ATOM 742 OE2 GLU A 48 -2.703 15.171 5.789 1.00 0.00 O ATOM 0 H GLU A 48 -4.529 14.646 0.077 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.109 15.821 2.267 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.801 14.727 3.618 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.664 13.244 2.694 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.520 12.977 4.813 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.345 12.941 3.514 1.00 0.00 H new ATOM 749 N LEU A 49 -1.161 14.500 1.493 1.00 0.00 N ATOM 750 CA LEU A 49 0.002 13.827 0.926 1.00 0.00 C ATOM 751 C LEU A 49 0.253 12.493 1.623 1.00 0.00 C ATOM 752 O LEU A 49 0.511 11.481 0.973 1.00 0.00 O ATOM 753 CB LEU A 49 1.240 14.718 1.044 1.00 0.00 C ATOM 754 CG LEU A 49 1.329 15.877 0.051 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.785 15.460 -1.307 1.00 0.00 C ATOM 756 CD2 LEU A 49 0.577 17.091 0.579 1.00 0.00 C ATOM 0 H LEU A 49 -0.938 15.300 2.085 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.199 13.633 -0.128 1.00 0.00 H new ATOM 0 HB2 LEU A 49 1.274 15.127 2.054 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.125 14.094 0.924 1.00 0.00 H new ATOM 0 HG LEU A 49 2.378 16.148 -0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.857 16.298 -2.001 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.366 14.621 -1.690 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.258 15.162 -1.205 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.651 17.906 -0.141 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.471 16.833 0.728 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.012 17.404 1.528 1.00 0.00 H new ATOM 768 N ASN A 50 0.173 12.501 2.950 1.00 0.00 N ATOM 769 CA ASN A 50 0.390 11.291 3.735 1.00 0.00 C ATOM 770 C ASN A 50 -0.927 10.765 4.299 1.00 0.00 C ATOM 771 O ASN A 50 -1.283 11.020 5.450 1.00 0.00 O ATOM 772 CB ASN A 50 1.372 11.568 4.876 1.00 0.00 C ATOM 773 CG ASN A 50 2.374 12.651 4.526 1.00 0.00 C ATOM 774 OD1 ASN A 50 2.861 13.368 5.400 1.00 0.00 O ATOM 775 ND2 ASN A 50 2.686 12.775 3.241 1.00 0.00 N ATOM 0 H ASN A 50 -0.040 13.331 3.503 1.00 0.00 H new ATOM 0 HA ASN A 50 0.812 10.531 3.077 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.817 11.864 5.766 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.905 10.650 5.124 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.354 13.487 2.945 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.258 12.159 2.550 1.00 0.00 H new ATOM 782 N PRO A 51 -1.667 10.014 3.471 1.00 0.00 N ATOM 783 CA PRO A 51 -2.954 9.435 3.865 1.00 0.00 C ATOM 784 C PRO A 51 -2.799 8.321 4.894 1.00 0.00 C ATOM 785 O PRO A 51 -1.705 7.790 5.089 1.00 0.00 O ATOM 786 CB PRO A 51 -3.509 8.876 2.552 1.00 0.00 C ATOM 787 CG PRO A 51 -2.305 8.613 1.714 1.00 0.00 C ATOM 788 CD PRO A 51 -1.303 9.670 2.086 1.00 0.00 C ATOM 0 HA PRO A 51 -3.603 10.171 4.339 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.081 7.964 2.720 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.179 9.588 2.070 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.908 7.615 1.903 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.549 8.663 0.653 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.281 9.296 2.020 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.369 10.535 1.427 1.00 0.00 H new ATOM 796 N VAL A 52 -3.900 7.971 5.552 1.00 0.00 N ATOM 797 CA VAL A 52 -3.885 6.919 6.561 1.00 0.00 C ATOM 798 C VAL A 52 -5.068 5.973 6.385 1.00 0.00 C ATOM 799 O VAL A 52 -6.206 6.320 6.701 1.00 0.00 O ATOM 800 CB VAL A 52 -3.919 7.506 7.985 1.00 0.00 C ATOM 801 CG1 VAL A 52 -4.052 6.397 9.017 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.676 8.342 8.246 1.00 0.00 C ATOM 0 H VAL A 52 -4.813 8.401 5.404 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.956 6.365 6.427 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.790 8.155 8.071 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -4.074 6.831 10.017 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.975 5.845 8.841 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -3.202 5.719 8.935 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.717 8.749 9.256 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.789 7.717 8.142 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.630 9.160 7.527 1.00 0.00 H new ATOM 812 N TRP A 53 -4.790 4.776 5.880 1.00 0.00 N ATOM 813 CA TRP A 53 -5.832 3.778 5.663 1.00 0.00 C ATOM 814 C TRP A 53 -5.887 2.788 6.820 1.00 0.00 C ATOM 815 O TRP A 53 -6.966 2.405 7.271 1.00 0.00 O ATOM 816 CB TRP A 53 -5.587 3.034 4.349 1.00 0.00 C ATOM 817 CG TRP A 53 -5.505 3.941 3.159 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.551 4.491 2.474 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.313 4.400 2.512 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.081 5.265 1.441 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.711 5.227 1.443 1.00 0.00 C ATOM 822 CE3 TRP A 53 -2.949 4.196 2.733 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.793 5.845 0.599 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.039 4.810 1.894 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.464 5.628 0.838 1.00 0.00 C ATOM 0 H TRP A 53 -3.853 4.473 5.613 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.790 4.295 5.607 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.660 2.466 4.429 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.390 2.313 4.193 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.594 4.340 2.710 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.658 5.784 0.779 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.612 3.569 3.545 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.119 6.474 -0.216 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -0.982 4.657 2.055 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.728 6.096 0.201 1.00 0.00 H new ATOM 836 N ASN A 54 -4.717 2.376 7.298 1.00 0.00 N ATOM 837 CA ASN A 54 -4.633 1.429 8.403 1.00 0.00 C ATOM 838 C ASN A 54 -5.728 0.371 8.298 1.00 0.00 C ATOM 839 O ASN A 54 -6.301 -0.044 9.304 1.00 0.00 O ATOM 840 CB ASN A 54 -4.745 2.163 9.741 1.00 0.00 C ATOM 841 CG ASN A 54 -6.149 2.671 10.006 1.00 0.00 C ATOM 842 OD1 ASN A 54 -6.919 2.047 10.737 1.00 0.00 O ATOM 843 ND2 ASN A 54 -6.489 3.809 9.411 1.00 0.00 N ATOM 0 H ASN A 54 -3.814 2.684 6.937 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.665 0.931 8.349 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -4.446 1.492 10.546 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -4.050 3.003 9.751 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -7.421 4.200 9.552 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -5.818 4.292 8.813 1.00 0.00 H new ATOM 850 N GLU A 55 -6.012 -0.059 7.073 1.00 0.00 N ATOM 851 CA GLU A 55 -7.038 -1.068 6.837 1.00 0.00 C ATOM 852 C GLU A 55 -6.408 -2.409 6.471 1.00 0.00 C ATOM 853 O GLU A 55 -5.207 -2.493 6.215 1.00 0.00 O ATOM 854 CB GLU A 55 -7.983 -0.615 5.722 1.00 0.00 C ATOM 855 CG GLU A 55 -7.530 -1.033 4.333 1.00 0.00 C ATOM 856 CD GLU A 55 -8.555 -0.710 3.263 1.00 0.00 C ATOM 857 OE1 GLU A 55 -8.846 0.488 3.064 1.00 0.00 O ATOM 858 OE2 GLU A 55 -9.065 -1.655 2.625 1.00 0.00 O ATOM 0 H GLU A 55 -5.547 0.275 6.229 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.608 -1.193 7.758 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.976 -1.024 5.910 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.075 0.471 5.754 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.592 -0.532 4.095 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.330 -2.104 4.327 1.00 0.00 H new ATOM 865 N ILE A 56 -7.228 -3.455 6.451 1.00 0.00 N ATOM 866 CA ILE A 56 -6.753 -4.791 6.117 1.00 0.00 C ATOM 867 C ILE A 56 -7.496 -5.354 4.910 1.00 0.00 C ATOM 868 O ILE A 56 -8.701 -5.148 4.758 1.00 0.00 O ATOM 869 CB ILE A 56 -6.916 -5.760 7.303 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.334 -5.142 8.577 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.243 -7.090 6.998 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.596 -5.963 9.820 1.00 0.00 C ATOM 0 H ILE A 56 -8.224 -3.402 6.662 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.694 -4.697 5.877 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.979 -5.942 7.461 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.258 -5.019 8.453 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.755 -4.146 8.713 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.367 -7.764 7.846 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.698 -7.534 6.113 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.181 -6.927 6.817 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.156 -5.466 10.684 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.671 -6.065 9.969 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.150 -6.951 9.704 1.00 0.00 H new ATOM 884 N LEU A 57 -6.771 -6.066 4.055 1.00 0.00 N ATOM 885 CA LEU A 57 -7.362 -6.662 2.862 1.00 0.00 C ATOM 886 C LEU A 57 -7.152 -8.172 2.845 1.00 0.00 C ATOM 887 O LEU A 57 -6.234 -8.687 3.483 1.00 0.00 O ATOM 888 CB LEU A 57 -6.757 -6.037 1.603 1.00 0.00 C ATOM 889 CG LEU A 57 -6.818 -4.512 1.515 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.661 -3.979 0.684 1.00 0.00 C ATOM 891 CD2 LEU A 57 -8.148 -4.064 0.929 1.00 0.00 C ATOM 0 H LEU A 57 -5.773 -6.245 4.165 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.434 -6.464 2.880 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.713 -6.343 1.535 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.268 -6.452 0.734 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.733 -4.106 2.523 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.721 -2.892 0.632 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.717 -4.269 1.146 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.715 -4.394 -0.323 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.173 -2.976 0.874 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.264 -4.481 -0.072 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.962 -4.414 1.564 1.00 0.00 H new ATOM 903 N GLU A 58 -8.007 -8.876 2.110 1.00 0.00 N ATOM 904 CA GLU A 58 -7.913 -10.328 2.010 1.00 0.00 C ATOM 905 C GLU A 58 -8.192 -10.794 0.584 1.00 0.00 C ATOM 906 O GLU A 58 -9.044 -10.236 -0.108 1.00 0.00 O ATOM 907 CB GLU A 58 -8.895 -10.992 2.977 1.00 0.00 C ATOM 908 CG GLU A 58 -8.999 -10.288 4.319 1.00 0.00 C ATOM 909 CD GLU A 58 -10.197 -10.746 5.127 1.00 0.00 C ATOM 910 OE1 GLU A 58 -10.204 -11.913 5.569 1.00 0.00 O ATOM 911 OE2 GLU A 58 -11.128 -9.935 5.317 1.00 0.00 O ATOM 0 H GLU A 58 -8.772 -8.465 1.575 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.898 -10.621 2.277 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.882 -11.023 2.515 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.588 -12.025 3.141 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.089 -10.469 4.891 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.065 -9.212 4.156 1.00 0.00 H new ATOM 918 N PHE A 59 -7.467 -11.820 0.151 1.00 0.00 N ATOM 919 CA PHE A 59 -7.634 -12.361 -1.193 1.00 0.00 C ATOM 920 C PHE A 59 -7.763 -13.881 -1.155 1.00 0.00 C ATOM 921 O PHE A 59 -7.168 -14.544 -0.306 1.00 0.00 O ATOM 922 CB PHE A 59 -6.453 -11.960 -2.079 1.00 0.00 C ATOM 923 CG PHE A 59 -6.390 -10.486 -2.363 1.00 0.00 C ATOM 924 CD1 PHE A 59 -5.718 -9.629 -1.507 1.00 0.00 C ATOM 925 CD2 PHE A 59 -7.005 -9.958 -3.487 1.00 0.00 C ATOM 926 CE1 PHE A 59 -5.658 -8.273 -1.766 1.00 0.00 C ATOM 927 CE2 PHE A 59 -6.948 -8.603 -3.752 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.275 -7.759 -2.890 1.00 0.00 C ATOM 0 H PHE A 59 -6.758 -12.294 0.711 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.550 -11.946 -1.613 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.526 -12.269 -1.596 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.517 -12.501 -3.023 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.235 -10.026 -0.626 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.535 -10.613 -4.163 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.130 -7.616 -1.091 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -7.429 -8.204 -4.633 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.231 -6.699 -3.094 1.00 0.00 H new ATOM 938 N ASP A 60 -8.544 -14.426 -2.081 1.00 0.00 N ATOM 939 CA ASP A 60 -8.751 -15.867 -2.155 1.00 0.00 C ATOM 940 C ASP A 60 -7.748 -16.512 -3.107 1.00 0.00 C ATOM 941 O ASP A 60 -7.662 -16.143 -4.279 1.00 0.00 O ATOM 942 CB ASP A 60 -10.178 -16.176 -2.612 1.00 0.00 C ATOM 943 CG ASP A 60 -10.678 -17.509 -2.089 1.00 0.00 C ATOM 944 OD1 ASP A 60 -10.050 -18.541 -2.403 1.00 0.00 O ATOM 945 OD2 ASP A 60 -11.697 -17.519 -1.367 1.00 0.00 O ATOM 0 H ASP A 60 -9.044 -13.891 -2.791 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.599 -16.283 -1.159 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.845 -15.383 -2.273 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.215 -16.180 -3.701 1.00 0.00 H new ATOM 950 N LEU A 61 -6.992 -17.477 -2.596 1.00 0.00 N ATOM 951 CA LEU A 61 -5.993 -18.174 -3.399 1.00 0.00 C ATOM 952 C LEU A 61 -6.598 -19.400 -4.075 1.00 0.00 C ATOM 953 O LEU A 61 -6.100 -19.864 -5.101 1.00 0.00 O ATOM 954 CB LEU A 61 -4.808 -18.590 -2.527 1.00 0.00 C ATOM 955 CG LEU A 61 -4.113 -17.465 -1.758 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.013 -18.026 -0.870 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.548 -16.431 -2.720 1.00 0.00 C ATOM 0 H LEU A 61 -7.052 -17.795 -1.629 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.643 -17.491 -4.173 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.154 -19.334 -1.809 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.069 -19.079 -3.162 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.851 -16.976 -1.123 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.530 -17.211 -0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.444 -18.728 -0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.276 -18.541 -1.486 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.057 -15.638 -2.155 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -2.824 -16.907 -3.382 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.357 -16.006 -3.314 1.00 0.00 H new ATOM 969 N ARG A 62 -7.674 -19.920 -3.493 1.00 0.00 N ATOM 970 CA ARG A 62 -8.346 -21.092 -4.040 1.00 0.00 C ATOM 971 C ARG A 62 -7.461 -22.330 -3.925 1.00 0.00 C ATOM 972 O ARG A 62 -7.481 -23.203 -4.792 1.00 0.00 O ATOM 973 CB ARG A 62 -8.722 -20.855 -5.504 1.00 0.00 C ATOM 974 CG ARG A 62 -9.462 -19.548 -5.738 1.00 0.00 C ATOM 975 CD ARG A 62 -9.339 -19.089 -7.183 1.00 0.00 C ATOM 976 NE ARG A 62 -10.089 -19.948 -8.095 1.00 0.00 N ATOM 977 CZ ARG A 62 -10.463 -19.576 -9.314 1.00 0.00 C ATOM 978 NH1 ARG A 62 -10.157 -18.367 -9.765 1.00 0.00 N ATOM 979 NH2 ARG A 62 -11.143 -20.414 -10.086 1.00 0.00 N ATOM 0 H ARG A 62 -8.099 -19.548 -2.643 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.254 -21.261 -3.462 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -7.815 -20.863 -6.109 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.343 -21.681 -5.849 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.514 -19.674 -5.483 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.064 -18.779 -5.076 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.701 -18.064 -7.270 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.288 -19.082 -7.473 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.339 -20.885 -7.779 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.633 -17.720 -9.175 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.445 -18.084 -10.702 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.379 -21.345 -9.744 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.430 -20.127 -11.022 1.00 0.00 H new ATOM 993 N GLY A 63 -6.684 -22.398 -2.849 1.00 0.00 N ATOM 994 CA GLY A 63 -5.802 -23.531 -2.641 1.00 0.00 C ATOM 995 C GLY A 63 -4.509 -23.411 -3.423 1.00 0.00 C ATOM 996 O GLY A 63 -3.633 -24.271 -3.323 1.00 0.00 O ATOM 0 H GLY A 63 -6.650 -21.688 -2.117 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.574 -23.619 -1.579 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.316 -24.446 -2.934 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.389 -22.344 -4.205 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.195 -22.115 -5.008 1.00 0.00 C ATOM 1002 C ILE A 64 -2.116 -21.404 -4.199 1.00 0.00 C ATOM 1003 O ILE A 64 -2.259 -20.245 -3.809 1.00 0.00 O ATOM 1004 CB ILE A 64 -3.511 -21.282 -6.264 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -4.534 -22.008 -7.140 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.238 -21.002 -7.049 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -3.924 -23.069 -8.028 1.00 0.00 C ATOM 0 H ILE A 64 -5.105 -21.624 -4.300 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.830 -23.095 -5.315 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.939 -20.329 -5.951 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.286 -22.470 -6.500 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.051 -21.278 -7.763 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.478 -20.412 -7.934 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.539 -20.448 -6.423 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.784 -21.945 -7.354 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.707 -23.542 -8.620 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.193 -22.610 -8.693 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.432 -23.821 -7.411 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.007 -22.113 -3.940 1.00 0.00 N ATOM 1020 CA PRO A 65 0.120 -21.569 -3.176 1.00 0.00 C ATOM 1021 C PRO A 65 0.872 -20.488 -3.944 1.00 0.00 C ATOM 1022 O PRO A 65 0.543 -20.183 -5.091 1.00 0.00 O ATOM 1023 CB PRO A 65 1.018 -22.788 -2.951 1.00 0.00 C ATOM 1024 CG PRO A 65 0.691 -23.711 -4.074 1.00 0.00 C ATOM 1025 CD PRO A 65 -0.767 -23.500 -4.373 1.00 0.00 C ATOM 0 HA PRO A 65 -0.207 -21.088 -2.254 1.00 0.00 H new ATOM 0 HB2 PRO A 65 2.072 -22.511 -2.961 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.820 -23.253 -1.985 1.00 0.00 H new ATOM 0 HG2 PRO A 65 1.304 -23.494 -4.949 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.887 -24.747 -3.797 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -0.983 -23.633 -5.433 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.395 -24.205 -3.829 1.00 0.00 H new ATOM 1033 N LEU A 66 1.885 -19.911 -3.305 1.00 0.00 N ATOM 1034 CA LEU A 66 2.685 -18.863 -3.929 1.00 0.00 C ATOM 1035 C LEU A 66 3.973 -19.436 -4.512 1.00 0.00 C ATOM 1036 O LEU A 66 4.436 -20.498 -4.096 1.00 0.00 O ATOM 1037 CB LEU A 66 3.015 -17.771 -2.909 1.00 0.00 C ATOM 1038 CG LEU A 66 1.826 -16.977 -2.368 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.297 -15.910 -1.391 1.00 0.00 C ATOM 1040 CD2 LEU A 66 1.040 -16.348 -3.509 1.00 0.00 C ATOM 0 H LEU A 66 2.171 -20.151 -2.356 1.00 0.00 H new ATOM 0 HA LEU A 66 2.102 -18.429 -4.741 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.532 -18.232 -2.067 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.714 -17.072 -3.368 1.00 0.00 H new ATOM 0 HG LEU A 66 1.168 -17.664 -1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.437 -15.355 -1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.815 -16.384 -0.557 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.977 -15.226 -1.899 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.198 -15.787 -3.105 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.688 -15.675 -4.070 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.670 -17.131 -4.171 1.00 0.00 H new ATOM 1052 N ASP A 67 4.546 -18.725 -5.477 1.00 0.00 N ATOM 1053 CA ASP A 67 5.783 -19.161 -6.116 1.00 0.00 C ATOM 1054 C ASP A 67 6.787 -18.015 -6.193 1.00 0.00 C ATOM 1055 O ASP A 67 6.455 -16.864 -5.909 1.00 0.00 O ATOM 1056 CB ASP A 67 5.495 -19.699 -7.518 1.00 0.00 C ATOM 1057 CG ASP A 67 4.628 -20.943 -7.494 1.00 0.00 C ATOM 1058 OD1 ASP A 67 3.418 -20.817 -7.213 1.00 0.00 O ATOM 1059 OD2 ASP A 67 5.160 -22.041 -7.758 1.00 0.00 O ATOM 0 H ASP A 67 4.174 -17.845 -5.834 1.00 0.00 H new ATOM 0 HA ASP A 67 6.215 -19.958 -5.511 1.00 0.00 H new ATOM 0 HB2 ASP A 67 5.000 -18.926 -8.106 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.437 -19.926 -8.018 1.00 0.00 H new ATOM 1064 N PHE A 68 8.017 -18.338 -6.579 1.00 0.00 N ATOM 1065 CA PHE A 68 9.071 -17.337 -6.692 1.00 0.00 C ATOM 1066 C PHE A 68 8.676 -16.241 -7.677 1.00 0.00 C ATOM 1067 O PHE A 68 9.328 -15.199 -7.757 1.00 0.00 O ATOM 1068 CB PHE A 68 10.380 -17.992 -7.138 1.00 0.00 C ATOM 1069 CG PHE A 68 11.100 -18.707 -6.031 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.723 -19.985 -5.653 1.00 0.00 C ATOM 1071 CD2 PHE A 68 12.155 -18.100 -5.368 1.00 0.00 C ATOM 1072 CE1 PHE A 68 11.384 -20.645 -4.634 1.00 0.00 C ATOM 1073 CE2 PHE A 68 12.820 -18.755 -4.348 1.00 0.00 C ATOM 1074 CZ PHE A 68 12.434 -20.030 -3.982 1.00 0.00 C ATOM 0 H PHE A 68 8.308 -19.286 -6.819 1.00 0.00 H new ATOM 0 HA PHE A 68 9.215 -16.885 -5.711 1.00 0.00 H new ATOM 0 HB2 PHE A 68 10.168 -18.700 -7.939 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.037 -17.227 -7.553 1.00 0.00 H new ATOM 0 HD1 PHE A 68 9.903 -20.472 -6.160 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.461 -17.104 -5.651 1.00 0.00 H new ATOM 0 HE1 PHE A 68 11.079 -21.641 -4.348 1.00 0.00 H new ATOM 0 HE2 PHE A 68 13.640 -18.271 -3.838 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.953 -20.545 -3.187 1.00 0.00 H new ATOM 1084 N SER A 69 7.605 -16.484 -8.426 1.00 0.00 N ATOM 1085 CA SER A 69 7.125 -15.520 -9.409 1.00 0.00 C ATOM 1086 C SER A 69 6.049 -14.621 -8.808 1.00 0.00 C ATOM 1087 O SER A 69 5.922 -13.454 -9.178 1.00 0.00 O ATOM 1088 CB SER A 69 6.572 -16.245 -10.638 1.00 0.00 C ATOM 1089 OG SER A 69 7.608 -16.891 -11.357 1.00 0.00 O ATOM 0 H SER A 69 7.053 -17.340 -8.371 1.00 0.00 H new ATOM 0 HA SER A 69 7.967 -14.897 -9.712 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.828 -16.979 -10.327 1.00 0.00 H new ATOM 0 HB3 SER A 69 6.064 -15.532 -11.287 1.00 0.00 H new ATOM 0 HG SER A 69 7.229 -17.348 -12.137 1.00 0.00 H new ATOM 1095 N SER A 70 5.276 -15.174 -7.879 1.00 0.00 N ATOM 1096 CA SER A 70 4.207 -14.425 -7.228 1.00 0.00 C ATOM 1097 C SER A 70 4.662 -13.006 -6.898 1.00 0.00 C ATOM 1098 O SER A 70 5.834 -12.770 -6.607 1.00 0.00 O ATOM 1099 CB SER A 70 3.759 -15.139 -5.952 1.00 0.00 C ATOM 1100 OG SER A 70 4.818 -15.222 -5.015 1.00 0.00 O ATOM 0 H SER A 70 5.370 -16.138 -7.560 1.00 0.00 H new ATOM 0 HA SER A 70 3.365 -14.367 -7.918 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.918 -14.605 -5.509 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.407 -16.141 -6.197 1.00 0.00 H new ATOM 0 HG SER A 70 5.177 -16.134 -5.007 1.00 0.00 H new ATOM 1106 N SER A 71 3.724 -12.065 -6.945 1.00 0.00 N ATOM 1107 CA SER A 71 4.028 -10.668 -6.655 1.00 0.00 C ATOM 1108 C SER A 71 2.749 -9.840 -6.575 1.00 0.00 C ATOM 1109 O SER A 71 1.729 -10.191 -7.171 1.00 0.00 O ATOM 1110 CB SER A 71 4.955 -10.093 -7.727 1.00 0.00 C ATOM 1111 OG SER A 71 4.469 -10.374 -9.028 1.00 0.00 O ATOM 0 H SER A 71 2.748 -12.244 -7.181 1.00 0.00 H new ATOM 0 HA SER A 71 4.530 -10.624 -5.689 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.044 -9.015 -7.594 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.954 -10.512 -7.611 1.00 0.00 H new ATOM 0 HG SER A 71 5.079 -9.994 -9.694 1.00 0.00 H new ATOM 1117 N LEU A 72 2.811 -8.739 -5.835 1.00 0.00 N ATOM 1118 CA LEU A 72 1.658 -7.859 -5.676 1.00 0.00 C ATOM 1119 C LEU A 72 1.866 -6.548 -6.428 1.00 0.00 C ATOM 1120 O LEU A 72 2.997 -6.108 -6.629 1.00 0.00 O ATOM 1121 CB LEU A 72 1.409 -7.575 -4.193 1.00 0.00 C ATOM 1122 CG LEU A 72 0.060 -6.944 -3.848 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -1.011 -8.016 -3.711 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.165 -6.127 -2.569 1.00 0.00 C ATOM 0 H LEU A 72 3.647 -8.434 -5.336 1.00 0.00 H new ATOM 0 HA LEU A 72 0.787 -8.363 -6.095 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.500 -8.512 -3.644 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.199 -6.916 -3.832 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.225 -6.275 -4.660 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.964 -7.548 -3.465 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.105 -8.559 -4.652 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.732 -8.710 -2.918 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.805 -5.685 -2.339 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.473 -6.774 -1.748 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.902 -5.335 -2.703 1.00 0.00 H new ATOM 1136 N GLY A 73 0.765 -5.927 -6.840 1.00 0.00 N ATOM 1137 CA GLY A 73 0.848 -4.671 -7.563 1.00 0.00 C ATOM 1138 C GLY A 73 0.205 -3.524 -6.810 1.00 0.00 C ATOM 1139 O GLY A 73 -0.997 -3.546 -6.540 1.00 0.00 O ATOM 0 H GLY A 73 -0.183 -6.271 -6.686 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.895 -4.434 -7.754 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.364 -4.781 -8.533 1.00 0.00 H new ATOM 1143 N ILE A 74 1.005 -2.521 -6.467 1.00 0.00 N ATOM 1144 CA ILE A 74 0.506 -1.360 -5.739 1.00 0.00 C ATOM 1145 C ILE A 74 0.485 -0.122 -6.628 1.00 0.00 C ATOM 1146 O ILE A 74 1.533 0.425 -6.973 1.00 0.00 O ATOM 1147 CB ILE A 74 1.361 -1.069 -4.491 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.395 -2.291 -3.573 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.817 0.143 -3.750 1.00 0.00 C ATOM 1150 CD1 ILE A 74 0.048 -2.636 -2.976 1.00 0.00 C ATOM 0 H ILE A 74 2.002 -2.488 -6.681 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.511 -1.596 -5.426 1.00 0.00 H new ATOM 0 HB ILE A 74 2.380 -0.850 -4.809 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.764 -3.148 -4.136 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.105 -2.110 -2.766 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.431 0.337 -2.870 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.840 1.012 -4.408 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.210 -0.051 -3.440 1.00 0.00 H new ATOM 0 HD11 ILE A 74 0.147 -3.513 -2.336 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.314 -1.795 -2.385 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.661 -2.849 -3.776 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.715 0.317 -6.994 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.872 1.493 -7.840 1.00 0.00 C ATOM 1164 C ILE A 75 -1.606 2.607 -7.101 1.00 0.00 C ATOM 1165 O ILE A 75 -2.767 2.456 -6.722 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.639 1.158 -9.133 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -0.961 0.001 -9.869 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.727 2.384 -10.029 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -1.856 -0.680 -10.880 1.00 0.00 C ATOM 0 H ILE A 75 -1.592 -0.124 -6.718 1.00 0.00 H new ATOM 0 HA ILE A 75 0.131 1.831 -8.100 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.651 0.852 -8.869 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.072 0.375 -10.377 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.625 -0.736 -9.139 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.272 2.131 -10.939 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.250 3.183 -9.503 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.722 2.718 -10.289 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.309 -1.490 -11.363 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.733 -1.085 -10.375 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.172 0.043 -11.632 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.921 3.729 -6.902 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.508 4.871 -6.211 1.00 0.00 C ATOM 1183 C VAL A 76 -1.834 5.995 -7.187 1.00 0.00 C ATOM 1184 O VAL A 76 -0.942 6.561 -7.821 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.566 5.411 -5.119 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.179 6.626 -4.438 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.250 4.324 -4.103 1.00 0.00 C ATOM 0 H VAL A 76 0.041 3.871 -7.210 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.429 4.520 -5.745 1.00 0.00 H new ATOM 0 HB VAL A 76 0.368 5.720 -5.589 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.499 6.994 -3.669 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.350 7.409 -5.176 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.128 6.346 -3.980 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.417 4.723 -3.339 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.174 3.983 -3.636 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.234 3.486 -4.605 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.118 6.316 -7.305 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.564 7.375 -8.203 1.00 0.00 C ATOM 1199 C LYS A 77 -4.481 8.354 -7.477 1.00 0.00 C ATOM 1200 O LYS A 77 -4.810 8.159 -6.306 1.00 0.00 O ATOM 1201 CB LYS A 77 -4.291 6.776 -9.409 1.00 0.00 C ATOM 1202 CG LYS A 77 -3.419 5.864 -10.253 1.00 0.00 C ATOM 1203 CD LYS A 77 -3.883 5.831 -11.700 1.00 0.00 C ATOM 1204 CE LYS A 77 -4.982 4.801 -11.910 1.00 0.00 C ATOM 1205 NZ LYS A 77 -6.272 5.235 -11.306 1.00 0.00 N ATOM 0 H LYS A 77 -3.869 5.857 -6.789 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.685 7.918 -8.550 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.157 6.214 -9.058 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.668 7.585 -10.034 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.385 6.205 -10.209 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.439 4.855 -9.840 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.247 6.817 -11.989 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.038 5.600 -12.349 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -5.120 4.630 -12.978 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.677 3.851 -11.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -7.062 4.835 -11.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.325 4.900 -10.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.331 6.273 -11.322 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.892 9.404 -8.179 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.774 10.412 -7.601 1.00 0.00 C ATOM 1221 C ASP A 78 -7.231 10.123 -7.951 1.00 0.00 C ATOM 1222 O ASP A 78 -7.618 10.156 -9.119 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.384 11.805 -8.096 1.00 0.00 C ATOM 1224 CG ASP A 78 -6.151 12.906 -7.391 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -7.290 12.646 -6.949 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -5.613 14.027 -7.280 1.00 0.00 O ATOM 0 H ASP A 78 -4.629 9.580 -9.149 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.665 10.377 -6.517 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.315 11.956 -7.943 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -5.565 11.870 -9.169 1.00 0.00 H new ATOM 1231 N PHE A 79 -8.034 9.840 -6.931 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.447 9.544 -7.130 1.00 0.00 C ATOM 1233 C PHE A 79 -10.039 10.426 -8.226 1.00 0.00 C ATOM 1234 O PHE A 79 -10.551 9.928 -9.228 1.00 0.00 O ATOM 1235 CB PHE A 79 -10.221 9.744 -5.826 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.610 9.174 -5.859 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.810 7.809 -5.985 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.716 10.003 -5.764 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -13.087 7.282 -6.017 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.996 9.482 -5.794 1.00 0.00 C ATOM 1241 CZ PHE A 79 -14.182 8.119 -5.920 1.00 0.00 C ATOM 0 H PHE A 79 -7.730 9.809 -5.958 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.533 8.502 -7.440 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.667 9.282 -5.009 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.280 10.810 -5.608 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -10.958 7.149 -6.059 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.576 11.069 -5.665 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -13.229 6.216 -6.118 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.849 10.140 -5.719 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.181 7.709 -5.943 1.00 0.00 H new ATOM 1378 N ILE A 88 0.441 8.955 -9.707 1.00 0.00 N ATOM 1379 CA ILE A 88 1.249 9.421 -8.586 1.00 0.00 C ATOM 1380 C ILE A 88 2.506 8.574 -8.425 1.00 0.00 C ATOM 1381 O ILE A 88 3.620 9.095 -8.398 1.00 0.00 O ATOM 1382 CB ILE A 88 0.452 9.394 -7.268 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.712 10.385 -7.330 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.363 9.711 -6.092 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.670 10.266 -6.165 1.00 0.00 C ATOM 0 HA ILE A 88 1.533 10.450 -8.808 1.00 0.00 H new ATOM 0 HB ILE A 88 0.045 8.393 -7.127 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.314 11.399 -7.360 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.261 10.230 -8.259 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.785 9.688 -5.168 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.161 8.970 -6.040 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.797 10.702 -6.224 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.470 10.999 -6.275 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -2.097 9.263 -6.146 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.135 10.450 -5.234 1.00 0.00 H new ATOM 1397 N GLY A 89 2.319 7.261 -8.320 1.00 0.00 N ATOM 1398 CA GLY A 89 3.447 6.362 -8.164 1.00 0.00 C ATOM 1399 C GLY A 89 3.019 4.915 -8.015 1.00 0.00 C ATOM 1400 O GLY A 89 2.017 4.620 -7.363 1.00 0.00 O ATOM 0 H GLY A 89 1.407 6.805 -8.340 1.00 0.00 H new ATOM 0 HA2 GLY A 89 4.105 6.456 -9.028 1.00 0.00 H new ATOM 0 HA3 GLY A 89 4.026 6.658 -7.289 1.00 0.00 H new ATOM 1404 N THR A 90 3.779 4.009 -8.623 1.00 0.00 N ATOM 1405 CA THR A 90 3.471 2.586 -8.557 1.00 0.00 C ATOM 1406 C THR A 90 4.630 1.800 -7.955 1.00 0.00 C ATOM 1407 O THR A 90 5.760 2.285 -7.901 1.00 0.00 O ATOM 1408 CB THR A 90 3.148 2.016 -9.951 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.320 2.041 -10.774 1.00 0.00 O ATOM 1410 CG2 THR A 90 2.037 2.813 -10.618 1.00 0.00 C ATOM 0 H THR A 90 4.612 4.236 -9.166 1.00 0.00 H new ATOM 0 HA THR A 90 2.594 2.482 -7.918 1.00 0.00 H new ATOM 0 HB THR A 90 2.812 0.986 -9.829 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.719 2.936 -10.748 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.827 2.392 -11.601 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.138 2.768 -10.004 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.350 3.851 -10.728 1.00 0.00 H new ATOM 1418 N ALA A 91 4.344 0.583 -7.505 1.00 0.00 N ATOM 1419 CA ALA A 91 5.364 -0.271 -6.910 1.00 0.00 C ATOM 1420 C ALA A 91 4.909 -1.727 -6.875 1.00 0.00 C ATOM 1421 O ALA A 91 3.787 -2.028 -6.467 1.00 0.00 O ATOM 1422 CB ALA A 91 5.704 0.211 -5.507 1.00 0.00 C ATOM 0 H ALA A 91 3.414 0.166 -7.541 1.00 0.00 H new ATOM 0 HA ALA A 91 6.259 -0.211 -7.530 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.467 -0.436 -5.075 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.080 1.233 -5.554 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.809 0.182 -4.885 1.00 0.00 H new ATOM 1428 N THR A 92 5.788 -2.627 -7.306 1.00 0.00 N ATOM 1429 CA THR A 92 5.476 -4.050 -7.326 1.00 0.00 C ATOM 1430 C THR A 92 6.244 -4.797 -6.242 1.00 0.00 C ATOM 1431 O THR A 92 7.468 -4.700 -6.155 1.00 0.00 O ATOM 1432 CB THR A 92 5.802 -4.678 -8.695 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.085 -3.996 -9.730 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.444 -6.156 -8.711 1.00 0.00 C ATOM 0 H THR A 92 6.721 -2.395 -7.646 1.00 0.00 H new ATOM 0 HA THR A 92 4.406 -4.141 -7.138 1.00 0.00 H new ATOM 0 HB THR A 92 6.873 -4.578 -8.870 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.299 -4.400 -10.597 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.683 -6.578 -9.687 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.014 -6.677 -7.941 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.378 -6.274 -8.516 1.00 0.00 H new ATOM 1442 N VAL A 93 5.518 -5.542 -5.415 1.00 0.00 N ATOM 1443 CA VAL A 93 6.132 -6.307 -4.336 1.00 0.00 C ATOM 1444 C VAL A 93 6.348 -7.760 -4.747 1.00 0.00 C ATOM 1445 O VAL A 93 5.548 -8.333 -5.485 1.00 0.00 O ATOM 1446 CB VAL A 93 5.270 -6.269 -3.060 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.946 -7.039 -1.936 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.998 -4.831 -2.644 1.00 0.00 C ATOM 0 H VAL A 93 4.504 -5.632 -5.471 1.00 0.00 H new ATOM 0 HA VAL A 93 7.096 -5.844 -4.128 1.00 0.00 H new ATOM 0 HB VAL A 93 4.315 -6.748 -3.273 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.322 -7.001 -1.043 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.085 -8.077 -2.238 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.916 -6.591 -1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.388 -4.823 -1.741 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.943 -4.324 -2.448 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.468 -4.315 -3.445 1.00 0.00 H new ATOM 1458 N ALA A 94 7.437 -8.349 -4.262 1.00 0.00 N ATOM 1459 CA ALA A 94 7.758 -9.736 -4.577 1.00 0.00 C ATOM 1460 C ALA A 94 7.364 -10.664 -3.432 1.00 0.00 C ATOM 1461 O ALA A 94 7.958 -10.622 -2.354 1.00 0.00 O ATOM 1462 CB ALA A 94 9.241 -9.877 -4.887 1.00 0.00 C ATOM 0 H ALA A 94 8.111 -7.888 -3.650 1.00 0.00 H new ATOM 0 HA ALA A 94 7.185 -10.025 -5.458 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.467 -10.918 -5.120 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.495 -9.250 -5.742 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.825 -9.565 -4.021 1.00 0.00 H new ATOM 1468 N LEU A 95 6.360 -11.499 -3.673 1.00 0.00 N ATOM 1469 CA LEU A 95 5.886 -12.437 -2.661 1.00 0.00 C ATOM 1470 C LEU A 95 6.726 -13.711 -2.663 1.00 0.00 C ATOM 1471 O LEU A 95 6.337 -14.725 -2.085 1.00 0.00 O ATOM 1472 CB LEU A 95 4.416 -12.782 -2.906 1.00 0.00 C ATOM 1473 CG LEU A 95 3.469 -11.595 -3.089 1.00 0.00 C ATOM 1474 CD1 LEU A 95 2.122 -12.063 -3.616 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.299 -10.842 -1.778 1.00 0.00 C ATOM 0 H LEU A 95 5.858 -11.546 -4.560 1.00 0.00 H new ATOM 0 HA LEU A 95 5.984 -11.961 -1.685 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.354 -13.411 -3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.059 -13.380 -2.067 1.00 0.00 H new ATOM 0 HG LEU A 95 3.906 -10.916 -3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.462 -11.205 -3.740 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.259 -12.557 -4.578 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.678 -12.763 -2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.622 -10.001 -1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.885 -11.512 -1.025 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.268 -10.473 -1.442 1.00 0.00 H new ATOM 1487 N LYS A 96 7.881 -13.650 -3.317 1.00 0.00 N ATOM 1488 CA LYS A 96 8.779 -14.796 -3.392 1.00 0.00 C ATOM 1489 C LYS A 96 9.342 -15.138 -2.016 1.00 0.00 C ATOM 1490 O LYS A 96 9.701 -16.285 -1.749 1.00 0.00 O ATOM 1491 CB LYS A 96 9.925 -14.509 -4.366 1.00 0.00 C ATOM 1492 CG LYS A 96 10.958 -13.538 -3.821 1.00 0.00 C ATOM 1493 CD LYS A 96 12.306 -13.721 -4.498 1.00 0.00 C ATOM 1494 CE LYS A 96 12.420 -12.869 -5.753 1.00 0.00 C ATOM 1495 NZ LYS A 96 11.846 -13.556 -6.943 1.00 0.00 N ATOM 0 H LYS A 96 8.217 -12.819 -3.803 1.00 0.00 H new ATOM 0 HA LYS A 96 8.207 -15.650 -3.754 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.419 -15.447 -4.619 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.512 -14.106 -5.291 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.611 -12.515 -3.969 1.00 0.00 H new ATOM 0 HG3 LYS A 96 11.066 -13.686 -2.746 1.00 0.00 H new ATOM 0 HD2 LYS A 96 13.102 -13.455 -3.803 1.00 0.00 H new ATOM 0 HD3 LYS A 96 12.445 -14.771 -4.756 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.905 -11.921 -5.597 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.468 -12.635 -5.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.189 -13.094 -7.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.140 -14.554 -6.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 10.808 -13.501 -6.909 1.00 0.00 H new ATOM 1509 N ASP A 97 9.414 -14.136 -1.146 1.00 0.00 N ATOM 1510 CA ASP A 97 9.930 -14.332 0.204 1.00 0.00 C ATOM 1511 C ASP A 97 8.905 -15.045 1.080 1.00 0.00 C ATOM 1512 O ASP A 97 9.263 -15.840 1.951 1.00 0.00 O ATOM 1513 CB ASP A 97 10.306 -12.987 0.829 1.00 0.00 C ATOM 1514 CG ASP A 97 11.642 -12.471 0.331 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.591 -13.276 0.237 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.738 -11.261 0.037 1.00 0.00 O ATOM 0 H ASP A 97 9.122 -13.181 -1.351 1.00 0.00 H new ATOM 0 HA ASP A 97 10.821 -14.956 0.139 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.530 -12.255 0.604 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.341 -13.091 1.913 1.00 0.00 H new ATOM 1521 N LEU A 98 7.630 -14.757 0.844 1.00 0.00 N ATOM 1522 CA LEU A 98 6.552 -15.370 1.612 1.00 0.00 C ATOM 1523 C LEU A 98 6.396 -16.844 1.250 1.00 0.00 C ATOM 1524 O LEU A 98 5.744 -17.605 1.966 1.00 0.00 O ATOM 1525 CB LEU A 98 5.237 -14.630 1.363 1.00 0.00 C ATOM 1526 CG LEU A 98 5.254 -13.124 1.628 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.098 -12.443 0.912 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.197 -12.844 3.123 1.00 0.00 C ATOM 0 H LEU A 98 7.317 -14.103 0.127 1.00 0.00 H new ATOM 0 HA LEU A 98 6.807 -15.299 2.669 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.942 -14.793 0.326 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.466 -15.080 1.988 1.00 0.00 H new ATOM 0 HG LEU A 98 6.187 -12.717 1.238 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.126 -11.372 1.112 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.183 -12.614 -0.161 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.155 -12.854 1.271 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.210 -11.767 3.292 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.281 -13.265 3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.059 -13.298 3.611 1.00 0.00 H new ATOM 1540 N THR A 99 6.999 -17.241 0.134 1.00 0.00 N ATOM 1541 CA THR A 99 6.928 -18.623 -0.323 1.00 0.00 C ATOM 1542 C THR A 99 7.343 -19.589 0.781 1.00 0.00 C ATOM 1543 O THR A 99 8.234 -19.294 1.576 1.00 0.00 O ATOM 1544 CB THR A 99 7.824 -18.854 -1.555 1.00 0.00 C ATOM 1545 OG1 THR A 99 9.198 -18.651 -1.206 1.00 0.00 O ATOM 1546 CG2 THR A 99 7.438 -17.916 -2.688 1.00 0.00 C ATOM 0 H THR A 99 7.542 -16.624 -0.470 1.00 0.00 H new ATOM 0 HA THR A 99 5.890 -18.812 -0.597 1.00 0.00 H new ATOM 0 HB THR A 99 7.684 -19.881 -1.892 1.00 0.00 H new ATOM 0 HG1 THR A 99 9.340 -17.711 -0.970 1.00 0.00 H new ATOM 0 HG21 THR A 99 8.084 -18.098 -3.547 1.00 0.00 H new ATOM 0 HG22 THR A 99 6.400 -18.094 -2.970 1.00 0.00 H new ATOM 0 HG23 THR A 99 7.552 -16.883 -2.360 1.00 0.00 H new ATOM 1554 N GLY A 100 6.690 -20.747 0.824 1.00 0.00 N ATOM 1555 CA GLY A 100 7.005 -21.739 1.835 1.00 0.00 C ATOM 1556 C GLY A 100 5.834 -22.653 2.136 1.00 0.00 C ATOM 1557 O GLY A 100 4.818 -22.620 1.442 1.00 0.00 O ATOM 0 H GLY A 100 5.949 -21.015 0.177 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.852 -22.338 1.501 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.313 -21.235 2.751 1.00 0.00 H new ATOM 1561 N ASP A 101 5.976 -23.472 3.172 1.00 0.00 N ATOM 1562 CA ASP A 101 4.921 -24.400 3.563 1.00 0.00 C ATOM 1563 C ASP A 101 4.246 -23.943 4.852 1.00 0.00 C ATOM 1564 O ASP A 101 3.403 -24.648 5.406 1.00 0.00 O ATOM 1565 CB ASP A 101 5.492 -25.808 3.744 1.00 0.00 C ATOM 1566 CG ASP A 101 6.351 -26.238 2.571 1.00 0.00 C ATOM 1567 OD1 ASP A 101 5.810 -26.361 1.453 1.00 0.00 O ATOM 1568 OD2 ASP A 101 7.565 -26.454 2.773 1.00 0.00 O ATOM 0 H ASP A 101 6.811 -23.512 3.756 1.00 0.00 H new ATOM 0 HA ASP A 101 4.174 -24.418 2.769 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.086 -25.842 4.657 1.00 0.00 H new ATOM 0 HB3 ASP A 101 4.673 -26.516 3.870 1.00 0.00 H new ATOM 1573 N GLN A 102 4.623 -22.759 5.324 1.00 0.00 N ATOM 1574 CA GLN A 102 4.054 -22.209 6.549 1.00 0.00 C ATOM 1575 C GLN A 102 3.793 -20.714 6.405 1.00 0.00 C ATOM 1576 O GLN A 102 4.437 -20.036 5.605 1.00 0.00 O ATOM 1577 CB GLN A 102 4.992 -22.463 7.731 1.00 0.00 C ATOM 1578 CG GLN A 102 4.768 -23.806 8.408 1.00 0.00 C ATOM 1579 CD GLN A 102 3.471 -23.854 9.192 1.00 0.00 C ATOM 1580 OE1 GLN A 102 2.480 -23.228 8.815 1.00 0.00 O ATOM 1581 NE2 GLN A 102 3.471 -24.600 10.291 1.00 0.00 N ATOM 0 H GLN A 102 5.319 -22.163 4.877 1.00 0.00 H new ATOM 0 HA GLN A 102 3.103 -22.709 6.734 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.024 -22.408 7.384 1.00 0.00 H new ATOM 0 HB3 GLN A 102 4.860 -21.669 8.466 1.00 0.00 H new ATOM 0 HG2 GLN A 102 4.762 -24.593 7.653 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.602 -24.014 9.079 1.00 0.00 H new ATOM 0 HE21 GLN A 102 4.315 -25.102 10.566 1.00 0.00 H new ATOM 0 HE22 GLN A 102 2.627 -24.671 10.859 1.00 0.00 H new ATOM 1590 N SER A 103 2.843 -20.206 7.184 1.00 0.00 N ATOM 1591 CA SER A 103 2.494 -18.791 7.139 1.00 0.00 C ATOM 1592 C SER A 103 3.739 -17.919 7.272 1.00 0.00 C ATOM 1593 O SER A 103 4.610 -18.183 8.101 1.00 0.00 O ATOM 1594 CB SER A 103 1.501 -18.454 8.253 1.00 0.00 C ATOM 1595 OG SER A 103 1.430 -17.055 8.468 1.00 0.00 O ATOM 0 H SER A 103 2.302 -20.753 7.853 1.00 0.00 H new ATOM 0 HA SER A 103 2.031 -18.587 6.174 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.514 -18.835 7.992 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.801 -18.952 9.175 1.00 0.00 H new ATOM 0 HG SER A 103 0.788 -16.866 9.184 1.00 0.00 H new ATOM 1601 N ARG A 104 3.815 -16.879 6.448 1.00 0.00 N ATOM 1602 CA ARG A 104 4.954 -15.968 6.471 1.00 0.00 C ATOM 1603 C ARG A 104 4.515 -14.542 6.152 1.00 0.00 C ATOM 1604 O ARG A 104 3.998 -14.269 5.069 1.00 0.00 O ATOM 1605 CB ARG A 104 6.018 -16.423 5.470 1.00 0.00 C ATOM 1606 CG ARG A 104 7.439 -16.105 5.906 1.00 0.00 C ATOM 1607 CD ARG A 104 8.449 -16.488 4.835 1.00 0.00 C ATOM 1608 NE ARG A 104 9.815 -16.502 5.352 1.00 0.00 N ATOM 1609 CZ ARG A 104 10.866 -16.887 4.637 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.709 -17.286 3.382 1.00 0.00 N ATOM 1611 NH2 ARG A 104 12.078 -16.872 5.177 1.00 0.00 N ATOM 0 H ARG A 104 3.102 -16.646 5.757 1.00 0.00 H new ATOM 0 HA ARG A 104 5.380 -15.983 7.474 1.00 0.00 H new ATOM 0 HB2 ARG A 104 5.926 -17.498 5.318 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.827 -15.947 4.508 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.524 -15.040 6.124 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.666 -16.639 6.829 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.201 -17.473 4.438 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.382 -15.784 4.005 1.00 0.00 H new ATOM 0 HE ARG A 104 9.970 -16.200 6.314 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.779 -17.298 2.963 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.518 -17.581 2.836 1.00 0.00 H new ATOM 0 HH21 ARG A 104 12.203 -16.565 6.142 1.00 0.00 H new ATOM 0 HH22 ARG A 104 12.885 -17.168 4.628 1.00 0.00 H new ATOM 1625 N SER A 105 4.726 -13.637 7.102 1.00 0.00 N ATOM 1626 CA SER A 105 4.349 -12.240 6.924 1.00 0.00 C ATOM 1627 C SER A 105 5.584 -11.344 6.885 1.00 0.00 C ATOM 1628 O SER A 105 6.243 -11.131 7.903 1.00 0.00 O ATOM 1629 CB SER A 105 3.417 -11.793 8.052 1.00 0.00 C ATOM 1630 OG SER A 105 3.968 -12.100 9.321 1.00 0.00 O ATOM 0 H SER A 105 5.156 -13.846 8.003 1.00 0.00 H new ATOM 0 HA SER A 105 3.826 -12.150 5.972 1.00 0.00 H new ATOM 0 HB2 SER A 105 3.241 -10.720 7.979 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.449 -12.283 7.944 1.00 0.00 H new ATOM 0 HG SER A 105 4.929 -11.909 9.315 1.00 0.00 H new ATOM 1636 N LEU A 106 5.891 -10.823 5.702 1.00 0.00 N ATOM 1637 CA LEU A 106 7.047 -9.950 5.528 1.00 0.00 C ATOM 1638 C LEU A 106 6.614 -8.493 5.400 1.00 0.00 C ATOM 1639 O LEU A 106 5.889 -8.114 4.480 1.00 0.00 O ATOM 1640 CB LEU A 106 7.844 -10.368 4.292 1.00 0.00 C ATOM 1641 CG LEU A 106 8.671 -11.648 4.426 1.00 0.00 C ATOM 1642 CD1 LEU A 106 10.079 -11.326 4.901 1.00 0.00 C ATOM 1643 CD2 LEU A 106 7.994 -12.621 5.380 1.00 0.00 C ATOM 0 H LEU A 106 5.356 -10.990 4.850 1.00 0.00 H new ATOM 0 HA LEU A 106 7.680 -10.045 6.410 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.149 -10.494 3.462 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.515 -9.552 4.025 1.00 0.00 H new ATOM 0 HG LEU A 106 8.739 -12.119 3.445 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.653 -12.248 4.991 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.564 -10.666 4.182 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.032 -10.833 5.872 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.595 -13.526 5.464 1.00 0.00 H new ATOM 0 HD22 LEU A 106 7.895 -12.158 6.362 1.00 0.00 H new ATOM 0 HD23 LEU A 106 7.005 -12.876 4.998 1.00 0.00 H new ATOM 1655 N PRO A 107 7.070 -7.655 6.343 1.00 0.00 N ATOM 1656 CA PRO A 107 6.746 -6.226 6.356 1.00 0.00 C ATOM 1657 C PRO A 107 7.420 -5.468 5.218 1.00 0.00 C ATOM 1658 O PRO A 107 8.642 -5.318 5.197 1.00 0.00 O ATOM 1659 CB PRO A 107 7.286 -5.752 7.708 1.00 0.00 C ATOM 1660 CG PRO A 107 8.370 -6.717 8.042 1.00 0.00 C ATOM 1661 CD PRO A 107 7.939 -8.039 7.469 1.00 0.00 C ATOM 0 HA PRO A 107 5.679 -6.049 6.222 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.668 -4.733 7.646 1.00 0.00 H new ATOM 0 HB3 PRO A 107 6.506 -5.754 8.469 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.321 -6.398 7.615 1.00 0.00 H new ATOM 0 HG3 PRO A 107 8.512 -6.787 9.120 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.792 -8.630 7.135 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.403 -8.640 8.204 1.00 0.00 H new ATOM 1669 N TYR A 108 6.617 -4.992 4.273 1.00 0.00 N ATOM 1670 CA TYR A 108 7.136 -4.250 3.130 1.00 0.00 C ATOM 1671 C TYR A 108 6.953 -2.749 3.326 1.00 0.00 C ATOM 1672 O TYR A 108 5.863 -2.212 3.123 1.00 0.00 O ATOM 1673 CB TYR A 108 6.437 -4.698 1.845 1.00 0.00 C ATOM 1674 CG TYR A 108 6.768 -6.116 1.438 1.00 0.00 C ATOM 1675 CD1 TYR A 108 6.019 -7.187 1.908 1.00 0.00 C ATOM 1676 CD2 TYR A 108 7.830 -6.384 0.583 1.00 0.00 C ATOM 1677 CE1 TYR A 108 6.318 -8.485 1.539 1.00 0.00 C ATOM 1678 CE2 TYR A 108 8.135 -7.678 0.208 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.377 -8.725 0.689 1.00 0.00 C ATOM 1680 OH TYR A 108 7.677 -10.016 0.318 1.00 0.00 O ATOM 0 H TYR A 108 5.603 -5.107 4.276 1.00 0.00 H new ATOM 0 HA TYR A 108 8.203 -4.459 3.047 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.359 -4.610 1.978 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.715 -4.023 1.036 1.00 0.00 H new ATOM 0 HD1 TYR A 108 5.189 -7.002 2.573 1.00 0.00 H new ATOM 0 HD2 TYR A 108 8.427 -5.567 0.205 1.00 0.00 H new ATOM 0 HE1 TYR A 108 5.726 -9.306 1.914 1.00 0.00 H new ATOM 0 HE2 TYR A 108 8.963 -7.869 -0.459 1.00 0.00 H new ATOM 0 HH TYR A 108 7.726 -10.072 -0.659 1.00 0.00 H new ATOM 1690 N LYS A 109 8.028 -2.074 3.720 1.00 0.00 N ATOM 1691 CA LYS A 109 7.989 -0.634 3.942 1.00 0.00 C ATOM 1692 C LYS A 109 9.109 0.065 3.177 1.00 0.00 C ATOM 1693 O LYS A 109 10.009 -0.585 2.642 1.00 0.00 O ATOM 1694 CB LYS A 109 8.108 -0.324 5.436 1.00 0.00 C ATOM 1695 CG LYS A 109 7.445 -1.360 6.327 1.00 0.00 C ATOM 1696 CD LYS A 109 6.975 -0.750 7.637 1.00 0.00 C ATOM 1697 CE LYS A 109 6.544 -1.821 8.627 1.00 0.00 C ATOM 1698 NZ LYS A 109 5.622 -1.280 9.664 1.00 0.00 N ATOM 0 H LYS A 109 8.938 -2.502 3.892 1.00 0.00 H new ATOM 0 HA LYS A 109 7.033 -0.261 3.574 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.163 -0.251 5.700 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.662 0.651 5.633 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.596 -1.801 5.805 1.00 0.00 H new ATOM 0 HG3 LYS A 109 8.147 -2.168 6.532 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.778 -0.154 8.071 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.142 -0.073 7.446 1.00 0.00 H new ATOM 0 HE2 LYS A 109 6.052 -2.633 8.092 1.00 0.00 H new ATOM 0 HE3 LYS A 109 7.425 -2.245 9.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 5.352 -2.041 10.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 6.100 -0.522 10.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 4.770 -0.899 9.206 1.00 0.00 H new ATOM 1712 N LEU A 110 9.048 1.391 3.129 1.00 0.00 N ATOM 1713 CA LEU A 110 10.058 2.178 2.430 1.00 0.00 C ATOM 1714 C LEU A 110 10.055 1.865 0.937 1.00 0.00 C ATOM 1715 O LEU A 110 11.086 1.964 0.270 1.00 0.00 O ATOM 1716 CB LEU A 110 11.444 1.903 3.017 1.00 0.00 C ATOM 1717 CG LEU A 110 11.599 2.155 4.517 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.758 1.346 5.078 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.800 3.639 4.791 1.00 0.00 C ATOM 0 H LEU A 110 8.310 1.944 3.566 1.00 0.00 H new ATOM 0 HA LEU A 110 9.817 3.233 2.562 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.703 0.864 2.815 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.170 2.521 2.488 1.00 0.00 H new ATOM 0 HG LEU A 110 10.684 1.834 5.016 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.853 1.539 6.147 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.573 0.284 4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.681 1.635 4.574 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.908 3.800 5.864 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.698 3.985 4.280 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.937 4.196 4.426 1.00 0.00 H new ATOM 1731 N ILE A 111 8.891 1.491 0.419 1.00 0.00 N ATOM 1732 CA ILE A 111 8.753 1.168 -0.996 1.00 0.00 C ATOM 1733 C ILE A 111 8.787 2.428 -1.854 1.00 0.00 C ATOM 1734 O ILE A 111 7.970 3.332 -1.680 1.00 0.00 O ATOM 1735 CB ILE A 111 7.444 0.406 -1.275 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.393 -0.882 -0.450 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.317 0.096 -2.759 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.068 -1.607 -0.544 1.00 0.00 C ATOM 0 H ILE A 111 8.029 1.404 0.958 1.00 0.00 H new ATOM 0 HA ILE A 111 9.598 0.531 -1.257 1.00 0.00 H new ATOM 0 HB ILE A 111 6.604 1.037 -0.983 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.188 -1.549 -0.783 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.594 -0.643 0.594 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.387 -0.443 -2.940 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.313 1.027 -3.326 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.160 -0.519 -3.076 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.103 -2.510 0.065 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.271 -0.957 -0.183 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.874 -1.877 -1.582 1.00 0.00 H new ATOM 1750 N SER A 112 9.738 2.481 -2.781 1.00 0.00 N ATOM 1751 CA SER A 112 9.880 3.631 -3.666 1.00 0.00 C ATOM 1752 C SER A 112 8.930 3.524 -4.854 1.00 0.00 C ATOM 1753 O SER A 112 9.070 2.637 -5.698 1.00 0.00 O ATOM 1754 CB SER A 112 11.323 3.745 -4.161 1.00 0.00 C ATOM 1755 OG SER A 112 12.101 4.544 -3.286 1.00 0.00 O ATOM 0 H SER A 112 10.422 1.741 -2.939 1.00 0.00 H new ATOM 0 HA SER A 112 9.625 4.527 -3.100 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.764 2.751 -4.239 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.335 4.178 -5.161 1.00 0.00 H new ATOM 0 HG SER A 112 13.019 4.600 -3.624 1.00 0.00 H new ATOM 1761 N LEU A 113 7.963 4.433 -4.914 1.00 0.00 N ATOM 1762 CA LEU A 113 6.988 4.442 -5.999 1.00 0.00 C ATOM 1763 C LEU A 113 7.564 5.108 -7.244 1.00 0.00 C ATOM 1764 O LEU A 113 8.403 6.005 -7.149 1.00 0.00 O ATOM 1765 CB LEU A 113 5.715 5.168 -5.561 1.00 0.00 C ATOM 1766 CG LEU A 113 5.023 4.616 -4.313 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.869 5.517 -3.900 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.532 3.197 -4.559 1.00 0.00 C ATOM 0 H LEU A 113 7.833 5.173 -4.224 1.00 0.00 H new ATOM 0 HA LEU A 113 6.744 3.408 -6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.961 6.215 -5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.004 5.144 -6.387 1.00 0.00 H new ATOM 0 HG LEU A 113 5.748 4.592 -3.499 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.389 5.109 -3.011 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.247 6.516 -3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.143 5.573 -4.711 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.043 2.821 -3.661 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.823 3.196 -5.386 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.379 2.557 -4.806 1.00 0.00 H new ATOM 1780 N LEU A 114 7.107 4.667 -8.410 1.00 0.00 N ATOM 1781 CA LEU A 114 7.575 5.223 -9.675 1.00 0.00 C ATOM 1782 C LEU A 114 6.402 5.550 -10.594 1.00 0.00 C ATOM 1783 O LEU A 114 5.429 4.800 -10.665 1.00 0.00 O ATOM 1784 CB LEU A 114 8.521 4.240 -10.367 1.00 0.00 C ATOM 1785 CG LEU A 114 9.490 3.486 -9.456 1.00 0.00 C ATOM 1786 CD1 LEU A 114 10.054 2.267 -10.169 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.613 4.404 -8.996 1.00 0.00 C ATOM 0 H LEU A 114 6.413 3.926 -8.506 1.00 0.00 H new ATOM 0 HA LEU A 114 8.113 6.147 -9.461 1.00 0.00 H new ATOM 0 HB2 LEU A 114 7.920 3.509 -10.909 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.103 4.788 -11.109 1.00 0.00 H new ATOM 0 HG LEU A 114 8.942 3.146 -8.577 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.742 1.743 -9.505 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.239 1.599 -10.448 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.586 2.584 -11.066 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.293 3.851 -8.348 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.159 4.774 -9.864 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.193 5.246 -8.446 1.00 0.00 H new ATOM 1799 N ASN A 115 6.503 6.674 -11.296 1.00 0.00 N ATOM 1800 CA ASN A 115 5.451 7.099 -12.212 1.00 0.00 C ATOM 1801 C ASN A 115 5.291 6.104 -13.357 1.00 0.00 C ATOM 1802 O ASN A 115 5.930 5.053 -13.372 1.00 0.00 O ATOM 1803 CB ASN A 115 5.763 8.489 -12.770 1.00 0.00 C ATOM 1804 CG ASN A 115 7.227 8.653 -13.128 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.022 7.725 -12.977 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.591 9.838 -13.605 1.00 0.00 N ATOM 0 H ASN A 115 7.302 7.306 -11.248 1.00 0.00 H new ATOM 0 HA ASN A 115 4.514 7.139 -11.656 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.153 8.667 -13.656 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.485 9.244 -12.034 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.563 10.007 -13.863 1.00 0.00 H new ATOM 0 HD22 ASN A 115 6.898 10.579 -13.714 1.00 0.00 H new ATOM 1813 N GLU A 116 4.433 6.444 -14.314 1.00 0.00 N ATOM 1814 CA GLU A 116 4.189 5.579 -15.463 1.00 0.00 C ATOM 1815 C GLU A 116 5.477 5.337 -16.245 1.00 0.00 C ATOM 1816 O GLU A 116 5.595 4.358 -16.982 1.00 0.00 O ATOM 1817 CB GLU A 116 3.132 6.198 -16.380 1.00 0.00 C ATOM 1818 CG GLU A 116 3.615 7.436 -17.117 1.00 0.00 C ATOM 1819 CD GLU A 116 2.589 7.968 -18.099 1.00 0.00 C ATOM 1820 OE1 GLU A 116 2.058 7.164 -18.894 1.00 0.00 O ATOM 1821 OE2 GLU A 116 2.317 9.186 -18.073 1.00 0.00 O ATOM 0 H GLU A 116 3.896 7.311 -14.317 1.00 0.00 H new ATOM 0 HA GLU A 116 3.823 4.621 -15.093 1.00 0.00 H new ATOM 0 HB2 GLU A 116 2.814 5.453 -17.109 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.255 6.458 -15.787 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.857 8.214 -16.393 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.535 7.200 -17.651 1.00 0.00 H new ATOM 1828 N LYS A 117 6.441 6.236 -16.078 1.00 0.00 N ATOM 1829 CA LYS A 117 7.722 6.122 -16.767 1.00 0.00 C ATOM 1830 C LYS A 117 8.676 5.219 -15.993 1.00 0.00 C ATOM 1831 O LYS A 117 9.516 4.538 -16.581 1.00 0.00 O ATOM 1832 CB LYS A 117 8.349 7.506 -16.952 1.00 0.00 C ATOM 1833 CG LYS A 117 7.626 8.370 -17.970 1.00 0.00 C ATOM 1834 CD LYS A 117 7.881 7.892 -19.390 1.00 0.00 C ATOM 1835 CE LYS A 117 6.817 8.401 -20.350 1.00 0.00 C ATOM 1836 NZ LYS A 117 5.591 7.557 -20.317 1.00 0.00 N ATOM 0 H LYS A 117 6.360 7.052 -15.471 1.00 0.00 H new ATOM 0 HA LYS A 117 7.543 5.677 -17.746 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.359 8.022 -15.992 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.387 7.387 -17.261 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.555 8.354 -17.767 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.954 9.404 -17.869 1.00 0.00 H new ATOM 0 HD2 LYS A 117 8.862 8.233 -19.719 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.899 6.802 -19.410 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.558 9.428 -20.093 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.220 8.417 -21.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 5.235 7.424 -21.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.818 6.631 -19.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 4.862 8.025 -19.741 1.00 0.00 H new ATOM 1850 N GLY A 118 8.542 5.217 -14.670 1.00 0.00 N ATOM 1851 CA GLY A 118 9.398 4.393 -13.838 1.00 0.00 C ATOM 1852 C GLY A 118 10.390 5.212 -13.036 1.00 0.00 C ATOM 1853 O GLY A 118 11.289 4.661 -12.401 1.00 0.00 O ATOM 0 H GLY A 118 7.855 5.772 -14.160 1.00 0.00 H new ATOM 0 HA2 GLY A 118 8.782 3.806 -13.157 1.00 0.00 H new ATOM 0 HA3 GLY A 118 9.939 3.686 -14.467 1.00 0.00 H new ATOM 1857 N GLN A 119 10.227 6.531 -13.066 1.00 0.00 N ATOM 1858 CA GLN A 119 11.117 7.427 -12.337 1.00 0.00 C ATOM 1859 C GLN A 119 10.745 7.481 -10.859 1.00 0.00 C ATOM 1860 O GLN A 119 9.570 7.400 -10.502 1.00 0.00 O ATOM 1861 CB GLN A 119 11.067 8.831 -12.941 1.00 0.00 C ATOM 1862 CG GLN A 119 11.958 9.002 -14.160 1.00 0.00 C ATOM 1863 CD GLN A 119 13.432 9.024 -13.808 1.00 0.00 C ATOM 1864 OE1 GLN A 119 13.806 9.305 -12.669 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.279 8.726 -14.786 1.00 0.00 N ATOM 0 H GLN A 119 9.487 7.002 -13.587 1.00 0.00 H new ATOM 0 HA GLN A 119 12.132 7.039 -12.422 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.038 9.062 -13.218 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.362 9.555 -12.181 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.768 8.189 -14.861 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.696 9.930 -14.669 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.925 8.499 -15.715 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.283 8.724 -14.608 1.00 0.00 H new ATOM 1874 N ASP A 120 11.753 7.619 -10.005 1.00 0.00 N ATOM 1875 CA ASP A 120 11.531 7.685 -8.565 1.00 0.00 C ATOM 1876 C ASP A 120 10.650 8.877 -8.205 1.00 0.00 C ATOM 1877 O ASP A 120 11.148 9.966 -7.917 1.00 0.00 O ATOM 1878 CB ASP A 120 12.867 7.780 -7.826 1.00 0.00 C ATOM 1879 CG ASP A 120 13.857 8.685 -8.533 1.00 0.00 C ATOM 1880 OD1 ASP A 120 13.481 9.828 -8.868 1.00 0.00 O ATOM 1881 OD2 ASP A 120 15.007 8.250 -8.752 1.00 0.00 O ATOM 0 H ASP A 120 12.732 7.687 -10.285 1.00 0.00 H new ATOM 0 HA ASP A 120 11.019 6.773 -8.259 1.00 0.00 H new ATOM 0 HB2 ASP A 120 12.695 8.153 -6.817 1.00 0.00 H new ATOM 0 HB3 ASP A 120 13.296 6.783 -7.728 1.00 0.00 H new ATOM 1886 N THR A 121 9.338 8.665 -8.225 1.00 0.00 N ATOM 1887 CA THR A 121 8.388 9.721 -7.903 1.00 0.00 C ATOM 1888 C THR A 121 8.758 10.415 -6.598 1.00 0.00 C ATOM 1889 O THR A 121 8.641 11.634 -6.476 1.00 0.00 O ATOM 1890 CB THR A 121 6.953 9.171 -7.790 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.904 8.127 -6.812 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.470 8.639 -9.131 1.00 0.00 C ATOM 0 H THR A 121 8.909 7.770 -8.461 1.00 0.00 H new ATOM 0 HA THR A 121 8.430 10.442 -8.719 1.00 0.00 H new ATOM 0 HB THR A 121 6.298 9.987 -7.483 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.744 7.623 -6.830 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.455 8.256 -9.026 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.480 9.443 -9.867 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.128 7.836 -9.462 1.00 0.00 H new ATOM 1900 N GLY A 122 9.206 9.631 -5.622 1.00 0.00 N ATOM 1901 CA GLY A 122 9.588 10.188 -4.338 1.00 0.00 C ATOM 1902 C GLY A 122 8.529 9.972 -3.275 1.00 0.00 C ATOM 1903 O GLY A 122 8.414 10.759 -2.336 1.00 0.00 O ATOM 0 H GLY A 122 9.311 8.619 -5.698 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.524 9.734 -4.012 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.774 11.256 -4.450 1.00 0.00 H new ATOM 1907 N ALA A 123 7.754 8.903 -3.422 1.00 0.00 N ATOM 1908 CA ALA A 123 6.700 8.586 -2.467 1.00 0.00 C ATOM 1909 C ALA A 123 6.913 7.207 -1.852 1.00 0.00 C ATOM 1910 O ALA A 123 7.242 6.247 -2.551 1.00 0.00 O ATOM 1911 CB ALA A 123 5.337 8.660 -3.140 1.00 0.00 C ATOM 0 H ALA A 123 7.836 8.241 -4.194 1.00 0.00 H new ATOM 0 HA ALA A 123 6.738 9.323 -1.665 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.560 8.421 -2.414 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.176 9.667 -3.526 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.298 7.946 -3.962 1.00 0.00 H new ATOM 1917 N THR A 124 6.726 7.114 -0.539 1.00 0.00 N ATOM 1918 CA THR A 124 6.900 5.853 0.170 1.00 0.00 C ATOM 1919 C THR A 124 5.597 5.404 0.822 1.00 0.00 C ATOM 1920 O THR A 124 4.798 6.229 1.266 1.00 0.00 O ATOM 1921 CB THR A 124 7.991 5.963 1.253 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.560 6.847 2.294 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.295 6.470 0.657 1.00 0.00 C ATOM 0 H THR A 124 6.454 7.898 0.055 1.00 0.00 H new ATOM 0 HA THR A 124 7.206 5.114 -0.571 1.00 0.00 H new ATOM 0 HB THR A 124 8.162 4.970 1.668 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.258 6.910 2.979 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.050 6.540 1.440 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.635 5.779 -0.115 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.136 7.455 0.218 1.00 0.00 H new ATOM 1931 N ILE A 125 5.389 4.093 0.877 1.00 0.00 N ATOM 1932 CA ILE A 125 4.183 3.536 1.477 1.00 0.00 C ATOM 1933 C ILE A 125 4.490 2.248 2.234 1.00 0.00 C ATOM 1934 O ILE A 125 5.249 1.403 1.759 1.00 0.00 O ATOM 1935 CB ILE A 125 3.107 3.249 0.413 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.858 2.655 1.068 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.651 2.308 -0.651 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.655 2.617 0.151 1.00 0.00 C ATOM 0 H ILE A 125 6.040 3.397 0.513 1.00 0.00 H new ATOM 0 HA ILE A 125 3.803 4.283 2.175 1.00 0.00 H new ATOM 0 HB ILE A 125 2.832 4.188 -0.067 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.081 1.642 1.404 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.610 3.238 1.955 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.879 2.115 -1.395 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.514 2.765 -1.134 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.950 1.368 -0.187 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.193 2.184 0.681 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.406 3.630 -0.165 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.884 2.009 -0.725 1.00 0.00 H new ATOM 1950 N ASP A 126 3.894 2.105 3.412 1.00 0.00 N ATOM 1951 CA ASP A 126 4.100 0.918 4.234 1.00 0.00 C ATOM 1952 C ASP A 126 3.003 -0.112 3.988 1.00 0.00 C ATOM 1953 O ASP A 126 1.822 0.229 3.913 1.00 0.00 O ATOM 1954 CB ASP A 126 4.137 1.298 5.715 1.00 0.00 C ATOM 1955 CG ASP A 126 5.246 2.281 6.034 1.00 0.00 C ATOM 1956 OD1 ASP A 126 5.690 2.995 5.110 1.00 0.00 O ATOM 1957 OD2 ASP A 126 5.670 2.337 7.207 1.00 0.00 O ATOM 0 H ASP A 126 3.264 2.796 3.820 1.00 0.00 H new ATOM 0 HA ASP A 126 5.057 0.476 3.956 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.178 1.732 6.000 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.270 0.398 6.315 1.00 0.00 H new ATOM 1962 N LEU A 127 3.401 -1.373 3.861 1.00 0.00 N ATOM 1963 CA LEU A 127 2.451 -2.454 3.621 1.00 0.00 C ATOM 1964 C LEU A 127 2.914 -3.744 4.290 1.00 0.00 C ATOM 1965 O LEU A 127 4.109 -4.034 4.344 1.00 0.00 O ATOM 1966 CB LEU A 127 2.275 -2.681 2.118 1.00 0.00 C ATOM 1967 CG LEU A 127 1.858 -1.458 1.300 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.275 -1.623 -0.154 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.357 -1.233 1.404 1.00 0.00 C ATOM 0 H LEU A 127 4.374 -1.672 3.920 1.00 0.00 H new ATOM 0 HA LEU A 127 1.493 -2.165 4.053 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.214 -3.060 1.715 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.528 -3.462 1.973 1.00 0.00 H new ATOM 0 HG LEU A 127 2.365 -0.582 1.706 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.971 -0.744 -0.722 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.358 -1.735 -0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.796 -2.508 -0.572 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.079 -0.359 0.816 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.169 -2.109 1.024 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.085 -1.070 2.447 1.00 0.00 H new ATOM 1981 N VAL A 128 1.959 -4.517 4.798 1.00 0.00 N ATOM 1982 CA VAL A 128 2.268 -5.778 5.462 1.00 0.00 C ATOM 1983 C VAL A 128 1.481 -6.930 4.847 1.00 0.00 C ATOM 1984 O VAL A 128 0.311 -7.138 5.171 1.00 0.00 O ATOM 1985 CB VAL A 128 1.963 -5.709 6.970 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.398 -6.992 7.662 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.642 -4.500 7.595 1.00 0.00 C ATOM 0 H VAL A 128 0.965 -4.292 4.762 1.00 0.00 H new ATOM 0 HA VAL A 128 3.334 -5.955 5.323 1.00 0.00 H new ATOM 0 HB VAL A 128 0.886 -5.601 7.101 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.175 -6.925 8.727 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.862 -7.838 7.231 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.470 -7.134 7.524 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.416 -4.466 8.661 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.720 -4.575 7.455 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.277 -3.591 7.118 1.00 0.00 H new ATOM 1997 N ILE A 129 2.130 -7.675 3.959 1.00 0.00 N ATOM 1998 CA ILE A 129 1.490 -8.808 3.300 1.00 0.00 C ATOM 1999 C ILE A 129 1.788 -10.111 4.034 1.00 0.00 C ATOM 2000 O ILE A 129 2.920 -10.359 4.445 1.00 0.00 O ATOM 2001 CB ILE A 129 1.949 -8.940 1.836 1.00 0.00 C ATOM 2002 CG1 ILE A 129 1.943 -7.571 1.151 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.056 -9.917 1.087 1.00 0.00 C ATOM 2004 CD1 ILE A 129 2.975 -7.440 0.054 1.00 0.00 C ATOM 0 H ILE A 129 3.098 -7.515 3.679 1.00 0.00 H new ATOM 0 HA ILE A 129 0.417 -8.620 3.320 1.00 0.00 H new ATOM 0 HB ILE A 129 2.968 -9.327 1.824 1.00 0.00 H new ATOM 0 HG12 ILE A 129 0.954 -7.388 0.732 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.120 -6.799 1.899 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.393 -9.999 0.054 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.107 -10.896 1.564 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.027 -9.557 1.105 1.00 0.00 H new ATOM 0 HD11 ILE A 129 2.913 -6.445 -0.387 1.00 0.00 H new ATOM 0 HD12 ILE A 129 3.971 -7.591 0.471 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.786 -8.189 -0.715 1.00 0.00 H new ATOM 2016 N GLY A 130 0.762 -10.941 4.194 1.00 0.00 N ATOM 2017 CA GLY A 130 0.934 -12.210 4.877 1.00 0.00 C ATOM 2018 C GLY A 130 0.430 -13.382 4.058 1.00 0.00 C ATOM 2019 O GLY A 130 -0.717 -13.389 3.612 1.00 0.00 O ATOM 0 H GLY A 130 -0.185 -10.757 3.863 1.00 0.00 H new ATOM 0 HA2 GLY A 130 1.990 -12.357 5.104 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.404 -12.181 5.829 1.00 0.00 H new ATOM 2023 N TYR A 131 1.289 -14.376 3.859 1.00 0.00 N ATOM 2024 CA TYR A 131 0.926 -15.557 3.085 1.00 0.00 C ATOM 2025 C TYR A 131 0.408 -16.666 3.995 1.00 0.00 C ATOM 2026 O TYR A 131 0.811 -16.773 5.154 1.00 0.00 O ATOM 2027 CB TYR A 131 2.129 -16.058 2.285 1.00 0.00 C ATOM 2028 CG TYR A 131 1.947 -17.452 1.727 1.00 0.00 C ATOM 2029 CD1 TYR A 131 0.865 -17.759 0.911 1.00 0.00 C ATOM 2030 CD2 TYR A 131 2.856 -18.462 2.017 1.00 0.00 C ATOM 2031 CE1 TYR A 131 0.695 -19.031 0.400 1.00 0.00 C ATOM 2032 CE2 TYR A 131 2.694 -19.736 1.509 1.00 0.00 C ATOM 2033 CZ TYR A 131 1.612 -20.015 0.701 1.00 0.00 C ATOM 2034 OH TYR A 131 1.446 -21.284 0.194 1.00 0.00 O ATOM 0 H TYR A 131 2.242 -14.387 4.223 1.00 0.00 H new ATOM 0 HA TYR A 131 0.130 -15.277 2.394 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.320 -15.369 1.463 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.011 -16.044 2.925 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.145 -16.990 0.672 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.704 -18.247 2.651 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -0.152 -19.253 -0.232 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.411 -20.509 1.743 1.00 0.00 H new ATOM 0 HH TYR A 131 2.179 -21.857 0.500 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.487 -17.490 3.462 1.00 0.00 N ATOM 2045 CA ASP A 132 -1.060 -18.594 4.224 1.00 0.00 C ATOM 2046 C ASP A 132 -1.238 -19.827 3.344 1.00 0.00 C ATOM 2047 O ASP A 132 -2.029 -19.839 2.401 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.406 -18.183 4.824 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.915 -19.184 5.842 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -2.112 -19.636 6.684 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -4.118 -19.518 5.796 1.00 0.00 O ATOM 0 H ASP A 132 -0.832 -17.415 2.505 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.371 -18.842 5.031 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.307 -17.206 5.297 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -3.140 -18.077 4.025 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.483 -20.891 3.657 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.539 -22.150 2.906 1.00 0.00 C ATOM 2058 C PRO A 133 -1.852 -22.895 3.120 1.00 0.00 C ATOM 2059 O PRO A 133 -2.316 -23.073 4.247 1.00 0.00 O ATOM 2060 CB PRO A 133 0.632 -22.955 3.476 1.00 0.00 C ATOM 2061 CG PRO A 133 0.836 -22.408 4.847 1.00 0.00 C ATOM 2062 CD PRO A 133 0.482 -20.948 4.768 1.00 0.00 C ATOM 0 HA PRO A 133 -0.478 -21.986 1.830 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.403 -24.020 3.505 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.527 -22.838 2.866 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.205 -22.924 5.571 1.00 0.00 H new ATOM 0 HG3 PRO A 133 1.868 -22.542 5.171 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.044 -20.590 5.700 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.359 -20.332 4.570 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.467 -23.341 2.015 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.735 -24.075 2.056 1.00 0.00 C ATOM 2072 C PRO A 134 -3.578 -25.470 2.651 1.00 0.00 C ATOM 2073 O PRO A 134 -2.560 -26.131 2.446 1.00 0.00 O ATOM 2074 CB PRO A 134 -4.142 -24.164 0.583 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.860 -24.067 -0.170 1.00 0.00 C ATOM 2076 CD PRO A 134 -1.971 -23.163 0.640 1.00 0.00 C ATOM 0 HA PRO A 134 -4.473 -23.579 2.686 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.656 -25.101 0.370 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.823 -23.358 0.311 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.406 -25.050 -0.296 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -3.024 -23.661 -1.168 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -0.922 -23.446 0.551 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -2.050 -22.125 0.315 1.00 0.00 H new