USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 973 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 97 TYR OH : rot -51:sc= 1.57 USER MOD Set 1.2: A 128 ASN : amide:sc= -3.65! C(o=-2.1!,f=-3.9!) USER MOD Set 2.1: A 64 LYS NZ :NH3+ -124:sc= 0.471 (180deg=-1.26) USER MOD Set 2.2: A 104 TYR OH : rot 180:sc= 0.455 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0.00359 USER MOD Single : A 25 SER OG : rot 23:sc= 0.0542 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 85:sc= 1.19 USER MOD Single : A 39 HIS : no HD1:sc= -0.09 K(o=-0.09,f=-1.3) USER MOD Single : A 52 MET CE :methyl -142:sc= -5.11! (180deg=-8.4!) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.856 K(o=-0.86,f=-7.3!) USER MOD Single : A 73 MET CE :methyl 164:sc= -0.0049 (180deg=-0.258) USER MOD Single : A 75 MET CE :methyl 160:sc= -3.63 (180deg=-4.44!) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.0605 USER MOD Single : A 83 LYS NZ :NH3+ -158:sc= 0.217 (180deg=0.095) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.0146 X(o=-0.015,f=-0.015) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot -170:sc= 0 USER MOD Single : A 107 MET CE :methyl -167:sc= -4.69 (180deg=-5.01!) USER MOD Single : A 109 GLN : amide:sc= -0.716 K(o=-0.72,f=-1.5) USER MOD Single : A 112 ASN : amide:sc= 0.274 K(o=0.27,f=-5.3!) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 168:sc= -2.98! (180deg=-3.62!) USER MOD Single : A 125 TYR OH : rot 150:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 153:sc= -0.127 (180deg=-0.653) USER MOD Single : A 129 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= -0.138 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 21 11.719 1.439 -21.595 1.00 0.00 N ATOM 2 CA GLY A 21 10.319 1.678 -21.296 1.00 0.00 C ATOM 3 C GLY A 21 10.051 1.772 -19.808 1.00 0.00 C ATOM 4 O GLY A 21 9.462 0.866 -19.218 1.00 0.00 O ATOM 0 HA2 GLY A 21 10.001 2.602 -21.778 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.718 0.874 -21.720 1.00 0.00 H new ATOM 8 N SER A 22 10.485 2.871 -19.198 1.00 0.00 N ATOM 9 CA SER A 22 10.293 3.077 -17.767 1.00 0.00 C ATOM 10 C SER A 22 9.021 3.876 -17.500 1.00 0.00 C ATOM 11 O SER A 22 9.046 5.106 -17.456 1.00 0.00 O ATOM 12 CB SER A 22 11.500 3.801 -17.168 1.00 0.00 C ATOM 13 OG SER A 22 12.630 2.947 -17.111 1.00 0.00 O ATOM 0 H SER A 22 10.972 3.632 -19.672 1.00 0.00 H new ATOM 0 HA SER A 22 10.194 2.100 -17.294 1.00 0.00 H new ATOM 0 HB2 SER A 22 11.735 4.681 -17.767 1.00 0.00 H new ATOM 0 HB3 SER A 22 11.256 4.154 -16.166 1.00 0.00 H new ATOM 0 HG SER A 22 13.389 3.434 -16.726 1.00 0.00 H new ATOM 19 N SER A 23 7.911 3.168 -17.320 1.00 0.00 N ATOM 20 CA SER A 23 6.628 3.811 -17.059 1.00 0.00 C ATOM 21 C SER A 23 6.549 4.304 -15.618 1.00 0.00 C ATOM 22 O SER A 23 6.095 5.416 -15.353 1.00 0.00 O ATOM 23 CB SER A 23 5.481 2.840 -17.343 1.00 0.00 C ATOM 24 OG SER A 23 5.672 1.613 -16.661 1.00 0.00 O ATOM 0 H SER A 23 7.874 2.149 -17.350 1.00 0.00 H new ATOM 0 HA SER A 23 6.539 4.671 -17.722 1.00 0.00 H new ATOM 0 HB2 SER A 23 4.536 3.288 -17.035 1.00 0.00 H new ATOM 0 HB3 SER A 23 5.412 2.657 -18.415 1.00 0.00 H new ATOM 0 HG SER A 23 4.925 1.010 -16.857 1.00 0.00 H new ATOM 30 N GLY A 24 6.997 3.465 -14.687 1.00 0.00 N ATOM 31 CA GLY A 24 6.969 3.831 -13.284 1.00 0.00 C ATOM 32 C GLY A 24 7.379 5.272 -13.052 1.00 0.00 C ATOM 33 O GLY A 24 8.081 5.863 -13.871 1.00 0.00 O ATOM 0 H GLY A 24 7.378 2.539 -14.881 1.00 0.00 H new ATOM 0 HA2 GLY A 24 5.964 3.675 -12.891 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.635 3.173 -12.727 1.00 0.00 H new ATOM 37 N SER A 25 6.936 5.839 -11.934 1.00 0.00 N ATOM 38 CA SER A 25 7.257 7.221 -11.599 1.00 0.00 C ATOM 39 C SER A 25 7.435 7.389 -10.093 1.00 0.00 C ATOM 40 O SER A 25 7.115 6.490 -9.315 1.00 0.00 O ATOM 41 CB SER A 25 6.156 8.158 -12.102 1.00 0.00 C ATOM 42 OG SER A 25 6.361 8.502 -13.461 1.00 0.00 O ATOM 0 H SER A 25 6.354 5.362 -11.245 1.00 0.00 H new ATOM 0 HA SER A 25 8.196 7.479 -12.088 1.00 0.00 H new ATOM 0 HB2 SER A 25 5.185 7.677 -11.988 1.00 0.00 H new ATOM 0 HB3 SER A 25 6.137 9.062 -11.494 1.00 0.00 H new ATOM 0 HG SER A 25 6.910 7.815 -13.893 1.00 0.00 H new ATOM 48 N SER A 26 7.946 8.546 -9.689 1.00 0.00 N ATOM 49 CA SER A 26 8.171 8.832 -8.277 1.00 0.00 C ATOM 50 C SER A 26 6.925 9.440 -7.641 1.00 0.00 C ATOM 51 O SER A 26 6.007 9.873 -8.337 1.00 0.00 O ATOM 52 CB SER A 26 9.359 9.782 -8.109 1.00 0.00 C ATOM 53 OG SER A 26 10.587 9.102 -8.305 1.00 0.00 O ATOM 0 H SER A 26 8.213 9.302 -10.320 1.00 0.00 H new ATOM 0 HA SER A 26 8.394 7.892 -7.773 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.276 10.603 -8.822 1.00 0.00 H new ATOM 0 HB3 SER A 26 9.339 10.222 -7.112 1.00 0.00 H new ATOM 0 HG SER A 26 11.330 9.731 -8.194 1.00 0.00 H new ATOM 59 N GLY A 27 6.901 9.472 -6.312 1.00 0.00 N ATOM 60 CA GLY A 27 5.764 10.029 -5.604 1.00 0.00 C ATOM 61 C GLY A 27 4.677 9.003 -5.354 1.00 0.00 C ATOM 62 O GLY A 27 4.249 8.805 -4.215 1.00 0.00 O ATOM 0 H GLY A 27 7.649 9.122 -5.713 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.099 10.439 -4.651 1.00 0.00 H new ATOM 0 HA3 GLY A 27 5.352 10.857 -6.180 1.00 0.00 H new ATOM 66 N LEU A 28 4.228 8.349 -6.418 1.00 0.00 N ATOM 67 CA LEU A 28 3.181 7.337 -6.310 1.00 0.00 C ATOM 68 C LEU A 28 3.657 6.149 -5.480 1.00 0.00 C ATOM 69 O LEU A 28 2.935 5.657 -4.610 1.00 0.00 O ATOM 70 CB LEU A 28 2.755 6.864 -7.700 1.00 0.00 C ATOM 71 CG LEU A 28 2.333 7.959 -8.681 1.00 0.00 C ATOM 72 CD1 LEU A 28 3.529 8.448 -9.483 1.00 0.00 C ATOM 73 CD2 LEU A 28 1.238 7.451 -9.608 1.00 0.00 C ATOM 0 H LEU A 28 4.572 8.500 -7.366 1.00 0.00 H new ATOM 0 HA LEU A 28 2.324 7.788 -5.809 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.581 6.307 -8.142 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.925 6.166 -7.586 1.00 0.00 H new ATOM 0 HG LEU A 28 1.937 8.799 -8.110 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.209 9.227 -10.175 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.281 8.852 -8.805 1.00 0.00 H new ATOM 0 HD13 LEU A 28 3.955 7.616 -10.044 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.950 8.243 -10.299 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.607 6.594 -10.172 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.372 7.152 -9.018 1.00 0.00 H new ATOM 85 N LEU A 29 4.875 5.693 -5.752 1.00 0.00 N ATOM 86 CA LEU A 29 5.448 4.565 -5.028 1.00 0.00 C ATOM 87 C LEU A 29 5.526 4.858 -3.534 1.00 0.00 C ATOM 88 O LEU A 29 5.144 4.029 -2.707 1.00 0.00 O ATOM 89 CB LEU A 29 6.841 4.241 -5.570 1.00 0.00 C ATOM 90 CG LEU A 29 6.888 3.384 -6.835 1.00 0.00 C ATOM 91 CD1 LEU A 29 8.190 3.613 -7.588 1.00 0.00 C ATOM 92 CD2 LEU A 29 6.723 1.912 -6.489 1.00 0.00 C ATOM 0 H LEU A 29 5.484 6.087 -6.469 1.00 0.00 H new ATOM 0 HA LEU A 29 4.798 3.703 -5.175 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.357 5.179 -5.772 1.00 0.00 H new ATOM 0 HB3 LEU A 29 7.403 3.730 -4.788 1.00 0.00 H new ATOM 0 HG LEU A 29 6.061 3.680 -7.481 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.205 2.994 -8.485 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.267 4.663 -7.870 1.00 0.00 H new ATOM 0 HD13 LEU A 29 9.032 3.346 -6.949 1.00 0.00 H new ATOM 0 HD21 LEU A 29 6.759 1.317 -7.402 1.00 0.00 H new ATOM 0 HD22 LEU A 29 7.528 1.602 -5.822 1.00 0.00 H new ATOM 0 HD23 LEU A 29 5.764 1.760 -5.995 1.00 0.00 H new ATOM 104 N ARG A 30 6.023 6.043 -3.193 1.00 0.00 N ATOM 105 CA ARG A 30 6.151 6.447 -1.798 1.00 0.00 C ATOM 106 C ARG A 30 4.789 6.453 -1.109 1.00 0.00 C ATOM 107 O ARG A 30 4.653 5.984 0.021 1.00 0.00 O ATOM 108 CB ARG A 30 6.790 7.832 -1.702 1.00 0.00 C ATOM 109 CG ARG A 30 8.308 7.799 -1.627 1.00 0.00 C ATOM 110 CD ARG A 30 8.880 9.171 -1.306 1.00 0.00 C ATOM 111 NE ARG A 30 8.887 9.439 0.130 1.00 0.00 N ATOM 112 CZ ARG A 30 9.568 10.434 0.688 1.00 0.00 C ATOM 113 NH1 ARG A 30 10.292 11.250 -0.064 1.00 0.00 N ATOM 114 NH2 ARG A 30 9.524 10.614 2.003 1.00 0.00 N ATOM 0 H ARG A 30 6.344 6.740 -3.865 1.00 0.00 H new ATOM 0 HA ARG A 30 6.792 5.725 -1.293 1.00 0.00 H new ATOM 0 HB2 ARG A 30 6.490 8.422 -2.568 1.00 0.00 H new ATOM 0 HB3 ARG A 30 6.402 8.341 -0.820 1.00 0.00 H new ATOM 0 HG2 ARG A 30 8.620 7.086 -0.864 1.00 0.00 H new ATOM 0 HG3 ARG A 30 8.713 7.448 -2.576 1.00 0.00 H new ATOM 0 HD2 ARG A 30 9.897 9.239 -1.692 1.00 0.00 H new ATOM 0 HD3 ARG A 30 8.294 9.936 -1.815 1.00 0.00 H new ATOM 0 HE ARG A 30 8.339 8.829 0.737 1.00 0.00 H new ATOM 0 HH11 ARG A 30 10.328 11.115 -1.074 1.00 0.00 H new ATOM 0 HH12 ARG A 30 10.814 12.013 0.368 1.00 0.00 H new ATOM 0 HH21 ARG A 30 8.967 9.988 2.585 1.00 0.00 H new ATOM 0 HH22 ARG A 30 10.047 11.378 2.431 1.00 0.00 H new ATOM 128 N ASN A 31 3.786 6.989 -1.796 1.00 0.00 N ATOM 129 CA ASN A 31 2.436 7.059 -1.248 1.00 0.00 C ATOM 130 C ASN A 31 1.798 5.674 -1.197 1.00 0.00 C ATOM 131 O ASN A 31 0.997 5.379 -0.308 1.00 0.00 O ATOM 132 CB ASN A 31 1.571 8.001 -2.088 1.00 0.00 C ATOM 133 CG ASN A 31 0.451 8.630 -1.281 1.00 0.00 C ATOM 134 OD1 ASN A 31 0.588 9.739 -0.766 1.00 0.00 O ATOM 135 ND2 ASN A 31 -0.667 7.920 -1.167 1.00 0.00 N ATOM 0 H ASN A 31 3.882 7.381 -2.733 1.00 0.00 H new ATOM 0 HA ASN A 31 2.502 7.447 -0.232 1.00 0.00 H new ATOM 0 HB2 ASN A 31 2.198 8.787 -2.509 1.00 0.00 H new ATOM 0 HB3 ASN A 31 1.146 7.449 -2.926 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.455 8.291 -0.636 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -0.737 7.004 -1.611 1.00 0.00 H new ATOM 142 N LEU A 32 2.157 4.827 -2.157 1.00 0.00 N ATOM 143 CA LEU A 32 1.620 3.473 -2.222 1.00 0.00 C ATOM 144 C LEU A 32 2.095 2.641 -1.035 1.00 0.00 C ATOM 145 O LEU A 32 1.309 1.929 -0.408 1.00 0.00 O ATOM 146 CB LEU A 32 2.039 2.800 -3.531 1.00 0.00 C ATOM 147 CG LEU A 32 1.269 3.227 -4.781 1.00 0.00 C ATOM 148 CD1 LEU A 32 1.984 2.753 -6.036 1.00 0.00 C ATOM 149 CD2 LEU A 32 -0.155 2.689 -4.740 1.00 0.00 C ATOM 0 H LEU A 32 2.817 5.055 -2.900 1.00 0.00 H new ATOM 0 HA LEU A 32 0.533 3.538 -2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 32 3.098 2.998 -3.696 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.931 1.722 -3.413 1.00 0.00 H new ATOM 0 HG LEU A 32 1.224 4.316 -4.803 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.421 3.066 -6.916 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.983 3.187 -6.071 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.061 1.666 -6.022 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.688 3.003 -5.637 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.131 1.600 -4.694 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.666 3.079 -3.859 1.00 0.00 H new ATOM 161 N LEU A 33 3.384 2.737 -0.730 1.00 0.00 N ATOM 162 CA LEU A 33 3.965 1.995 0.384 1.00 0.00 C ATOM 163 C LEU A 33 3.388 2.470 1.714 1.00 0.00 C ATOM 164 O LEU A 33 3.032 1.663 2.572 1.00 0.00 O ATOM 165 CB LEU A 33 5.486 2.153 0.389 1.00 0.00 C ATOM 166 CG LEU A 33 6.221 1.622 -0.842 1.00 0.00 C ATOM 167 CD1 LEU A 33 7.696 1.985 -0.781 1.00 0.00 C ATOM 168 CD2 LEU A 33 6.045 0.116 -0.960 1.00 0.00 C ATOM 0 H LEU A 33 4.047 3.322 -1.238 1.00 0.00 H new ATOM 0 HA LEU A 33 3.716 0.942 0.257 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.721 3.212 0.499 1.00 0.00 H new ATOM 0 HB3 LEU A 33 5.881 1.646 1.270 1.00 0.00 H new ATOM 0 HG LEU A 33 5.790 2.088 -1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 33 8.203 1.599 -1.665 1.00 0.00 H new ATOM 0 HD12 LEU A 33 7.803 3.069 -0.746 1.00 0.00 H new ATOM 0 HD13 LEU A 33 8.142 1.548 0.112 1.00 0.00 H new ATOM 0 HD21 LEU A 33 6.575 -0.244 -1.842 1.00 0.00 H new ATOM 0 HD22 LEU A 33 6.449 -0.368 -0.071 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.985 -0.120 -1.052 1.00 0.00 H new ATOM 180 N THR A 34 3.297 3.787 1.877 1.00 0.00 N ATOM 181 CA THR A 34 2.763 4.370 3.100 1.00 0.00 C ATOM 182 C THR A 34 1.303 3.978 3.305 1.00 0.00 C ATOM 183 O THR A 34 0.910 3.556 4.392 1.00 0.00 O ATOM 184 CB THR A 34 2.871 5.906 3.085 1.00 0.00 C ATOM 185 OG1 THR A 34 4.199 6.299 2.718 1.00 0.00 O ATOM 186 CG2 THR A 34 2.524 6.488 4.448 1.00 0.00 C ATOM 0 H THR A 34 3.587 4.469 1.176 1.00 0.00 H new ATOM 0 HA THR A 34 3.361 3.979 3.923 1.00 0.00 H new ATOM 0 HB THR A 34 2.161 6.291 2.353 1.00 0.00 H new ATOM 0 HG1 THR A 34 4.274 6.324 1.741 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.608 7.574 4.412 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.503 6.211 4.713 1.00 0.00 H new ATOM 0 HG23 THR A 34 3.212 6.096 5.197 1.00 0.00 H new ATOM 194 N GLY A 35 0.504 4.119 2.253 1.00 0.00 N ATOM 195 CA GLY A 35 -0.903 3.774 2.338 1.00 0.00 C ATOM 196 C GLY A 35 -1.124 2.288 2.547 1.00 0.00 C ATOM 197 O GLY A 35 -2.047 1.885 3.257 1.00 0.00 O ATOM 0 H GLY A 35 0.806 4.466 1.343 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -1.360 4.325 3.160 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.407 4.088 1.424 1.00 0.00 H new ATOM 201 N LEU A 36 -0.279 1.473 1.928 1.00 0.00 N ATOM 202 CA LEU A 36 -0.387 0.023 2.048 1.00 0.00 C ATOM 203 C LEU A 36 -0.264 -0.413 3.505 1.00 0.00 C ATOM 204 O LEU A 36 -1.068 -1.206 3.996 1.00 0.00 O ATOM 205 CB LEU A 36 0.692 -0.660 1.207 1.00 0.00 C ATOM 206 CG LEU A 36 1.083 -2.075 1.636 1.00 0.00 C ATOM 207 CD1 LEU A 36 -0.033 -3.057 1.316 1.00 0.00 C ATOM 208 CD2 LEU A 36 2.379 -2.499 0.961 1.00 0.00 C ATOM 0 H LEU A 36 0.489 1.791 1.337 1.00 0.00 H new ATOM 0 HA LEU A 36 -1.369 -0.275 1.680 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.349 -0.697 0.173 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.586 -0.037 1.224 1.00 0.00 H new ATOM 0 HG LEU A 36 1.242 -2.076 2.714 1.00 0.00 H new ATOM 0 HD11 LEU A 36 0.263 -4.059 1.628 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.939 -2.764 1.847 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.224 -3.053 0.243 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.641 -3.508 1.278 1.00 0.00 H new ATOM 0 HD22 LEU A 36 2.248 -2.481 -0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.177 -1.812 1.241 1.00 0.00 H new ATOM 220 N VAL A 37 0.746 0.112 4.190 1.00 0.00 N ATOM 221 CA VAL A 37 0.971 -0.220 5.592 1.00 0.00 C ATOM 222 C VAL A 37 -0.166 0.293 6.470 1.00 0.00 C ATOM 223 O VAL A 37 -0.603 -0.388 7.397 1.00 0.00 O ATOM 224 CB VAL A 37 2.302 0.367 6.101 1.00 0.00 C ATOM 225 CG1 VAL A 37 2.544 -0.033 7.548 1.00 0.00 C ATOM 226 CG2 VAL A 37 3.455 -0.082 5.216 1.00 0.00 C ATOM 0 H VAL A 37 1.421 0.768 3.798 1.00 0.00 H new ATOM 0 HA VAL A 37 1.012 -1.307 5.656 1.00 0.00 H new ATOM 0 HB VAL A 37 2.240 1.454 6.055 1.00 0.00 H new ATOM 0 HG11 VAL A 37 3.488 0.391 7.890 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.732 0.343 8.170 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.586 -1.120 7.623 1.00 0.00 H new ATOM 0 HG21 VAL A 37 4.387 0.342 5.590 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.520 -1.170 5.228 1.00 0.00 H new ATOM 0 HG23 VAL A 37 3.285 0.260 4.195 1.00 0.00 H new ATOM 236 N ARG A 38 -0.641 1.497 6.168 1.00 0.00 N ATOM 237 CA ARG A 38 -1.727 2.101 6.929 1.00 0.00 C ATOM 238 C ARG A 38 -2.966 1.210 6.911 1.00 0.00 C ATOM 239 O ARG A 38 -3.521 0.880 7.958 1.00 0.00 O ATOM 240 CB ARG A 38 -2.069 3.480 6.362 1.00 0.00 C ATOM 241 CG ARG A 38 -3.085 4.247 7.194 1.00 0.00 C ATOM 242 CD ARG A 38 -2.946 5.748 7.000 1.00 0.00 C ATOM 243 NE ARG A 38 -3.488 6.187 5.718 1.00 0.00 N ATOM 244 CZ ARG A 38 -3.104 7.298 5.099 1.00 0.00 C ATOM 245 NH1 ARG A 38 -2.178 8.077 5.641 1.00 0.00 N ATOM 246 NH2 ARG A 38 -3.644 7.630 3.933 1.00 0.00 N ATOM 0 H ARG A 38 -0.291 2.073 5.402 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.396 2.212 7.962 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -1.155 4.069 6.287 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -2.456 3.361 5.350 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -4.092 3.935 6.918 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -2.953 4.002 8.248 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -3.461 6.267 7.808 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -1.894 6.026 7.063 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.201 5.609 5.273 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -1.758 7.824 6.536 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -1.885 8.929 5.163 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -4.355 7.032 3.511 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -3.348 8.483 3.459 1.00 0.00 H new ATOM 260 N HIS A 39 -3.394 0.826 5.712 1.00 0.00 N ATOM 261 CA HIS A 39 -4.568 -0.026 5.556 1.00 0.00 C ATOM 262 C HIS A 39 -4.157 -1.468 5.271 1.00 0.00 C ATOM 263 O HIS A 39 -4.980 -2.288 4.865 1.00 0.00 O ATOM 264 CB HIS A 39 -5.457 0.495 4.428 1.00 0.00 C ATOM 265 CG HIS A 39 -5.519 1.990 4.357 1.00 0.00 C ATOM 266 ND1 HIS A 39 -6.299 2.752 5.201 1.00 0.00 N ATOM 267 CD2 HIS A 39 -4.893 2.864 3.536 1.00 0.00 C ATOM 268 CE1 HIS A 39 -6.150 4.030 4.902 1.00 0.00 C ATOM 269 NE2 HIS A 39 -5.302 4.125 3.895 1.00 0.00 N ATOM 0 H HIS A 39 -2.946 1.091 4.835 1.00 0.00 H new ATOM 0 HA HIS A 39 -5.130 -0.003 6.490 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -5.088 0.109 3.478 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -6.466 0.103 4.561 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -4.200 2.616 2.745 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -6.639 4.856 5.397 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -4.999 4.994 3.455 1.00 0.00 H new ATOM 277 N GLU A 40 -2.880 -1.768 5.487 1.00 0.00 N ATOM 278 CA GLU A 40 -2.362 -3.111 5.251 1.00 0.00 C ATOM 279 C GLU A 40 -2.971 -3.716 3.990 1.00 0.00 C ATOM 280 O GLU A 40 -3.047 -4.937 3.848 1.00 0.00 O ATOM 281 CB GLU A 40 -2.652 -4.012 6.454 1.00 0.00 C ATOM 282 CG GLU A 40 -1.567 -3.977 7.517 1.00 0.00 C ATOM 283 CD GLU A 40 -2.031 -4.547 8.843 1.00 0.00 C ATOM 284 OE1 GLU A 40 -2.700 -3.815 9.601 1.00 0.00 O ATOM 285 OE2 GLU A 40 -1.723 -5.724 9.124 1.00 0.00 O ATOM 0 H GLU A 40 -2.186 -1.101 5.824 1.00 0.00 H new ATOM 0 HA GLU A 40 -1.283 -3.037 5.113 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.598 -3.711 6.903 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -2.776 -5.038 6.107 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -0.702 -4.540 7.167 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.240 -2.948 7.663 1.00 0.00 H new ATOM 292 N ARG A 41 -3.404 -2.853 3.076 1.00 0.00 N ATOM 293 CA ARG A 41 -4.009 -3.301 1.828 1.00 0.00 C ATOM 294 C ARG A 41 -4.403 -2.112 0.957 1.00 0.00 C ATOM 295 O ARG A 41 -5.035 -1.167 1.429 1.00 0.00 O ATOM 296 CB ARG A 41 -5.238 -4.166 2.113 1.00 0.00 C ATOM 297 CG ARG A 41 -5.967 -4.621 0.859 1.00 0.00 C ATOM 298 CD ARG A 41 -7.394 -5.045 1.168 1.00 0.00 C ATOM 299 NE ARG A 41 -7.866 -6.082 0.254 1.00 0.00 N ATOM 300 CZ ARG A 41 -9.151 -6.308 0.000 1.00 0.00 C ATOM 301 NH1 ARG A 41 -10.085 -5.574 0.588 1.00 0.00 N ATOM 302 NH2 ARG A 41 -9.502 -7.270 -0.844 1.00 0.00 N ATOM 0 H ARG A 41 -3.347 -1.840 3.177 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.271 -3.896 1.290 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.930 -5.043 2.683 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -5.929 -3.604 2.741 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.977 -3.812 0.129 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.429 -5.453 0.406 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -7.449 -5.412 2.193 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -8.052 -4.178 1.104 1.00 0.00 H new ATOM 0 HE ARG A 41 -7.172 -6.664 -0.215 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -9.818 -4.834 1.237 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -11.070 -5.749 0.391 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -8.786 -7.836 -1.298 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -10.488 -7.443 -1.039 1.00 0.00 H new ATOM 316 N ILE A 42 -4.023 -2.166 -0.315 1.00 0.00 N ATOM 317 CA ILE A 42 -4.336 -1.094 -1.252 1.00 0.00 C ATOM 318 C ILE A 42 -4.571 -1.641 -2.656 1.00 0.00 C ATOM 319 O ILE A 42 -4.140 -2.747 -2.980 1.00 0.00 O ATOM 320 CB ILE A 42 -3.211 -0.045 -1.304 1.00 0.00 C ATOM 321 CG1 ILE A 42 -1.844 -0.731 -1.329 1.00 0.00 C ATOM 322 CG2 ILE A 42 -3.313 0.901 -0.116 1.00 0.00 C ATOM 323 CD1 ILE A 42 -0.721 0.175 -1.781 1.00 0.00 C ATOM 0 H ILE A 42 -3.498 -2.941 -0.721 1.00 0.00 H new ATOM 0 HA ILE A 42 -5.249 -0.618 -0.893 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.321 0.538 -2.219 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.617 -1.107 -0.331 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -1.892 -1.595 -1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -2.511 1.637 -0.167 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -4.276 1.412 -0.139 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.226 0.333 0.810 1.00 0.00 H new ATOM 0 HD11 ILE A 42 0.218 -0.378 -1.774 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -0.925 0.531 -2.791 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -0.646 1.026 -1.104 1.00 0.00 H new ATOM 335 N GLU A 43 -5.255 -0.858 -3.484 1.00 0.00 N ATOM 336 CA GLU A 43 -5.545 -1.265 -4.854 1.00 0.00 C ATOM 337 C GLU A 43 -4.681 -0.492 -5.846 1.00 0.00 C ATOM 338 O GLU A 43 -4.708 0.738 -5.883 1.00 0.00 O ATOM 339 CB GLU A 43 -7.026 -1.045 -5.172 1.00 0.00 C ATOM 340 CG GLU A 43 -7.404 -1.417 -6.595 1.00 0.00 C ATOM 341 CD GLU A 43 -8.794 -0.943 -6.973 1.00 0.00 C ATOM 342 OE1 GLU A 43 -9.607 -0.701 -6.055 1.00 0.00 O ATOM 343 OE2 GLU A 43 -9.070 -0.816 -8.184 1.00 0.00 O ATOM 0 H GLU A 43 -5.618 0.061 -3.231 1.00 0.00 H new ATOM 0 HA GLU A 43 -5.314 -2.326 -4.947 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -7.629 -1.632 -4.479 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -7.274 0.003 -5.001 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -6.678 -0.986 -7.284 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -7.350 -2.500 -6.710 1.00 0.00 H new ATOM 350 N ALA A 44 -3.912 -1.222 -6.648 1.00 0.00 N ATOM 351 CA ALA A 44 -3.042 -0.606 -7.641 1.00 0.00 C ATOM 352 C ALA A 44 -2.838 -1.526 -8.839 1.00 0.00 C ATOM 353 O ALA A 44 -3.078 -2.733 -8.774 1.00 0.00 O ATOM 354 CB ALA A 44 -1.702 -0.246 -7.016 1.00 0.00 C ATOM 0 H ALA A 44 -3.874 -2.241 -6.629 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.524 0.306 -7.995 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.061 0.213 -7.769 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.859 0.455 -6.196 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.224 -1.148 -6.635 1.00 0.00 H new ATOM 360 N PRO A 45 -2.385 -0.947 -9.961 1.00 0.00 N ATOM 361 CA PRO A 45 -2.140 -1.698 -11.196 1.00 0.00 C ATOM 362 C PRO A 45 -0.941 -2.633 -11.078 1.00 0.00 C ATOM 363 O PRO A 45 -0.222 -2.612 -10.079 1.00 0.00 O ATOM 364 CB PRO A 45 -1.864 -0.603 -12.228 1.00 0.00 C ATOM 365 CG PRO A 45 -1.362 0.552 -11.431 1.00 0.00 C ATOM 366 CD PRO A 45 -2.078 0.485 -10.110 1.00 0.00 C ATOM 0 HA PRO A 45 -2.980 -2.344 -11.453 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -1.126 -0.928 -12.962 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -2.768 -0.341 -12.778 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -0.282 0.492 -11.293 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -1.566 1.495 -11.938 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -1.452 0.849 -9.295 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.983 1.092 -10.112 1.00 0.00 H new ATOM 374 N TRP A 46 -0.731 -3.450 -12.103 1.00 0.00 N ATOM 375 CA TRP A 46 0.383 -4.392 -12.113 1.00 0.00 C ATOM 376 C TRP A 46 1.718 -3.658 -12.064 1.00 0.00 C ATOM 377 O TRP A 46 2.651 -4.091 -11.388 1.00 0.00 O ATOM 378 CB TRP A 46 0.318 -5.275 -13.361 1.00 0.00 C ATOM 379 CG TRP A 46 0.907 -6.638 -13.154 1.00 0.00 C ATOM 380 CD1 TRP A 46 2.233 -6.967 -13.155 1.00 0.00 C ATOM 381 CD2 TRP A 46 0.191 -7.854 -12.919 1.00 0.00 C ATOM 382 NE1 TRP A 46 2.383 -8.314 -12.935 1.00 0.00 N ATOM 383 CE2 TRP A 46 1.146 -8.881 -12.786 1.00 0.00 C ATOM 384 CE3 TRP A 46 -1.164 -8.176 -12.806 1.00 0.00 C ATOM 385 CZ2 TRP A 46 0.786 -10.205 -12.547 1.00 0.00 C ATOM 386 CZ3 TRP A 46 -1.520 -9.491 -12.569 1.00 0.00 C ATOM 387 CH2 TRP A 46 -0.547 -10.492 -12.441 1.00 0.00 C ATOM 0 H TRP A 46 -1.317 -3.480 -12.938 1.00 0.00 H new ATOM 0 HA TRP A 46 0.303 -5.020 -11.226 1.00 0.00 H new ATOM 0 HB2 TRP A 46 -0.722 -5.379 -13.670 1.00 0.00 H new ATOM 0 HB3 TRP A 46 0.845 -4.779 -14.176 1.00 0.00 H new ATOM 0 HD1 TRP A 46 3.044 -6.270 -13.307 1.00 0.00 H new ATOM 0 HE1 TRP A 46 3.272 -8.812 -12.890 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -1.920 -7.411 -12.902 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 1.534 -10.978 -12.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -2.565 -9.751 -12.481 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -0.856 -11.510 -12.255 1.00 0.00 H new ATOM 398 N ALA A 47 1.802 -2.543 -12.783 1.00 0.00 N ATOM 399 CA ALA A 47 3.023 -1.748 -12.819 1.00 0.00 C ATOM 400 C ALA A 47 3.369 -1.210 -11.434 1.00 0.00 C ATOM 401 O ALA A 47 4.529 -1.227 -11.023 1.00 0.00 O ATOM 402 CB ALA A 47 2.879 -0.602 -13.810 1.00 0.00 C ATOM 0 H ALA A 47 1.039 -2.170 -13.348 1.00 0.00 H new ATOM 0 HA ALA A 47 3.838 -2.395 -13.144 1.00 0.00 H new ATOM 0 HB1 ALA A 47 3.799 -0.017 -13.826 1.00 0.00 H new ATOM 0 HB2 ALA A 47 2.687 -1.003 -14.805 1.00 0.00 H new ATOM 0 HB3 ALA A 47 2.048 0.036 -13.510 1.00 0.00 H new ATOM 408 N ARG A 48 2.355 -0.734 -10.719 1.00 0.00 N ATOM 409 CA ARG A 48 2.552 -0.191 -9.380 1.00 0.00 C ATOM 410 C ARG A 48 2.744 -1.309 -8.361 1.00 0.00 C ATOM 411 O ARG A 48 3.560 -1.198 -7.446 1.00 0.00 O ATOM 412 CB ARG A 48 1.359 0.680 -8.980 1.00 0.00 C ATOM 413 CG ARG A 48 1.507 2.138 -9.384 1.00 0.00 C ATOM 414 CD ARG A 48 1.526 2.298 -10.896 1.00 0.00 C ATOM 415 NE ARG A 48 2.269 3.485 -11.312 1.00 0.00 N ATOM 416 CZ ARG A 48 2.827 3.621 -12.509 1.00 0.00 C ATOM 417 NH1 ARG A 48 2.726 2.649 -13.405 1.00 0.00 N ATOM 418 NH2 ARG A 48 3.486 4.732 -12.814 1.00 0.00 N ATOM 0 H ARG A 48 1.389 -0.713 -11.044 1.00 0.00 H new ATOM 0 HA ARG A 48 3.453 0.422 -9.393 1.00 0.00 H new ATOM 0 HB2 ARG A 48 0.455 0.275 -9.436 1.00 0.00 H new ATOM 0 HB3 ARG A 48 1.224 0.623 -7.900 1.00 0.00 H new ATOM 0 HG2 ARG A 48 0.684 2.718 -8.966 1.00 0.00 H new ATOM 0 HG3 ARG A 48 2.428 2.542 -8.963 1.00 0.00 H new ATOM 0 HD2 ARG A 48 1.974 1.413 -11.348 1.00 0.00 H new ATOM 0 HD3 ARG A 48 0.503 2.362 -11.267 1.00 0.00 H new ATOM 0 HE ARG A 48 2.364 4.252 -10.646 1.00 0.00 H new ATOM 0 HH11 ARG A 48 2.219 1.794 -13.175 1.00 0.00 H new ATOM 0 HH12 ARG A 48 3.156 2.756 -14.324 1.00 0.00 H new ATOM 0 HH21 ARG A 48 3.564 5.483 -12.128 1.00 0.00 H new ATOM 0 HH22 ARG A 48 3.914 4.835 -13.734 1.00 0.00 H new ATOM 432 N VAL A 49 1.986 -2.389 -8.526 1.00 0.00 N ATOM 433 CA VAL A 49 2.072 -3.529 -7.621 1.00 0.00 C ATOM 434 C VAL A 49 3.458 -4.162 -7.665 1.00 0.00 C ATOM 435 O VAL A 49 4.100 -4.349 -6.631 1.00 0.00 O ATOM 436 CB VAL A 49 1.020 -4.600 -7.966 1.00 0.00 C ATOM 437 CG1 VAL A 49 1.157 -5.800 -7.043 1.00 0.00 C ATOM 438 CG2 VAL A 49 -0.382 -4.015 -7.887 1.00 0.00 C ATOM 0 H VAL A 49 1.306 -2.498 -9.278 1.00 0.00 H new ATOM 0 HA VAL A 49 1.880 -3.151 -6.617 1.00 0.00 H new ATOM 0 HB VAL A 49 1.192 -4.936 -8.988 1.00 0.00 H new ATOM 0 HG11 VAL A 49 0.406 -6.546 -7.302 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.151 -6.233 -7.154 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.013 -5.483 -6.010 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -1.112 -4.786 -8.134 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.567 -3.650 -6.877 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.472 -3.190 -8.594 1.00 0.00 H new ATOM 448 N ASP A 50 3.914 -4.490 -8.869 1.00 0.00 N ATOM 449 CA ASP A 50 5.227 -5.100 -9.049 1.00 0.00 C ATOM 450 C ASP A 50 6.333 -4.160 -8.580 1.00 0.00 C ATOM 451 O ASP A 50 7.222 -4.559 -7.829 1.00 0.00 O ATOM 452 CB ASP A 50 5.444 -5.471 -10.517 1.00 0.00 C ATOM 453 CG ASP A 50 6.588 -6.447 -10.705 1.00 0.00 C ATOM 454 OD1 ASP A 50 6.376 -7.659 -10.487 1.00 0.00 O ATOM 455 OD2 ASP A 50 7.696 -6.000 -11.068 1.00 0.00 O ATOM 0 H ASP A 50 3.394 -4.344 -9.735 1.00 0.00 H new ATOM 0 HA ASP A 50 5.265 -6.006 -8.444 1.00 0.00 H new ATOM 0 HB2 ASP A 50 4.529 -5.907 -10.917 1.00 0.00 H new ATOM 0 HB3 ASP A 50 5.644 -4.567 -11.091 1.00 0.00 H new ATOM 460 N GLU A 51 6.271 -2.910 -9.030 1.00 0.00 N ATOM 461 CA GLU A 51 7.269 -1.915 -8.657 1.00 0.00 C ATOM 462 C GLU A 51 7.285 -1.699 -7.147 1.00 0.00 C ATOM 463 O GLU A 51 8.347 -1.665 -6.526 1.00 0.00 O ATOM 464 CB GLU A 51 6.990 -0.590 -9.370 1.00 0.00 C ATOM 465 CG GLU A 51 8.208 0.310 -9.480 1.00 0.00 C ATOM 466 CD GLU A 51 7.981 1.489 -10.407 1.00 0.00 C ATOM 467 OE1 GLU A 51 7.132 2.346 -10.081 1.00 0.00 O ATOM 468 OE2 GLU A 51 8.652 1.554 -11.458 1.00 0.00 O ATOM 0 H GLU A 51 5.541 -2.563 -9.652 1.00 0.00 H new ATOM 0 HA GLU A 51 8.247 -2.286 -8.963 1.00 0.00 H new ATOM 0 HB2 GLU A 51 6.611 -0.798 -10.371 1.00 0.00 H new ATOM 0 HB3 GLU A 51 6.203 -0.058 -8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 51 8.474 0.678 -8.489 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.055 -0.274 -9.841 1.00 0.00 H new ATOM 475 N MET A 52 6.100 -1.555 -6.562 1.00 0.00 N ATOM 476 CA MET A 52 5.978 -1.344 -5.125 1.00 0.00 C ATOM 477 C MET A 52 6.320 -2.617 -4.358 1.00 0.00 C ATOM 478 O MET A 52 6.856 -2.561 -3.251 1.00 0.00 O ATOM 479 CB MET A 52 4.561 -0.889 -4.774 1.00 0.00 C ATOM 480 CG MET A 52 3.581 -2.036 -4.591 1.00 0.00 C ATOM 481 SD MET A 52 1.994 -1.496 -3.928 1.00 0.00 S ATOM 482 CE MET A 52 2.478 -0.956 -2.290 1.00 0.00 C ATOM 0 H MET A 52 5.211 -1.581 -7.061 1.00 0.00 H new ATOM 0 HA MET A 52 6.684 -0.566 -4.836 1.00 0.00 H new ATOM 0 HB2 MET A 52 4.594 -0.301 -3.857 1.00 0.00 H new ATOM 0 HB3 MET A 52 4.194 -0.231 -5.562 1.00 0.00 H new ATOM 0 HG2 MET A 52 3.421 -2.528 -5.550 1.00 0.00 H new ATOM 0 HG3 MET A 52 4.017 -2.777 -3.921 1.00 0.00 H new ATOM 0 HE1 MET A 52 1.703 -1.229 -1.573 1.00 0.00 H new ATOM 0 HE2 MET A 52 3.416 -1.436 -2.011 1.00 0.00 H new ATOM 0 HE3 MET A 52 2.609 0.126 -2.288 1.00 0.00 H new ATOM 492 N ARG A 53 6.007 -3.764 -4.952 1.00 0.00 N ATOM 493 CA ARG A 53 6.281 -5.050 -4.324 1.00 0.00 C ATOM 494 C ARG A 53 7.766 -5.192 -4.000 1.00 0.00 C ATOM 495 O ARG A 53 8.136 -5.587 -2.894 1.00 0.00 O ATOM 496 CB ARG A 53 5.836 -6.194 -5.237 1.00 0.00 C ATOM 497 CG ARG A 53 6.005 -7.570 -4.616 1.00 0.00 C ATOM 498 CD ARG A 53 5.872 -8.671 -5.657 1.00 0.00 C ATOM 499 NE ARG A 53 7.156 -9.010 -6.264 1.00 0.00 N ATOM 500 CZ ARG A 53 7.278 -9.546 -7.473 1.00 0.00 C ATOM 501 NH1 ARG A 53 6.200 -9.801 -8.201 1.00 0.00 N ATOM 502 NH2 ARG A 53 8.482 -9.826 -7.957 1.00 0.00 N ATOM 0 H ARG A 53 5.563 -3.828 -5.868 1.00 0.00 H new ATOM 0 HA ARG A 53 5.717 -5.098 -3.393 1.00 0.00 H new ATOM 0 HB2 ARG A 53 4.788 -6.050 -5.501 1.00 0.00 H new ATOM 0 HB3 ARG A 53 6.407 -6.151 -6.164 1.00 0.00 H new ATOM 0 HG2 ARG A 53 6.982 -7.637 -4.137 1.00 0.00 H new ATOM 0 HG3 ARG A 53 5.257 -7.713 -3.836 1.00 0.00 H new ATOM 0 HD2 ARG A 53 5.445 -9.560 -5.192 1.00 0.00 H new ATOM 0 HD3 ARG A 53 5.177 -8.353 -6.434 1.00 0.00 H new ATOM 0 HE ARG A 53 8.005 -8.825 -5.730 1.00 0.00 H new ATOM 0 HH11 ARG A 53 5.273 -9.586 -7.833 1.00 0.00 H new ATOM 0 HH12 ARG A 53 6.297 -10.213 -9.129 1.00 0.00 H new ATOM 0 HH21 ARG A 53 9.314 -9.630 -7.400 1.00 0.00 H new ATOM 0 HH22 ARG A 53 8.575 -10.238 -8.886 1.00 0.00 H new ATOM 516 N GLY A 54 8.612 -4.868 -4.972 1.00 0.00 N ATOM 517 CA GLY A 54 10.046 -4.967 -4.771 1.00 0.00 C ATOM 518 C GLY A 54 10.541 -4.056 -3.666 1.00 0.00 C ATOM 519 O GLY A 54 11.360 -4.459 -2.840 1.00 0.00 O ATOM 0 H GLY A 54 8.330 -4.539 -5.895 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.306 -5.998 -4.531 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.558 -4.717 -5.700 1.00 0.00 H new ATOM 523 N TYR A 55 10.045 -2.824 -3.650 1.00 0.00 N ATOM 524 CA TYR A 55 10.444 -1.851 -2.641 1.00 0.00 C ATOM 525 C TYR A 55 9.882 -2.224 -1.272 1.00 0.00 C ATOM 526 O TYR A 55 10.533 -2.026 -0.247 1.00 0.00 O ATOM 527 CB TYR A 55 9.969 -0.452 -3.034 1.00 0.00 C ATOM 528 CG TYR A 55 10.676 0.108 -4.249 1.00 0.00 C ATOM 529 CD1 TYR A 55 12.047 0.332 -4.238 1.00 0.00 C ATOM 530 CD2 TYR A 55 9.972 0.412 -5.407 1.00 0.00 C ATOM 531 CE1 TYR A 55 12.696 0.843 -5.345 1.00 0.00 C ATOM 532 CE2 TYR A 55 10.613 0.922 -6.519 1.00 0.00 C ATOM 533 CZ TYR A 55 11.975 1.137 -6.483 1.00 0.00 C ATOM 534 OH TYR A 55 12.618 1.645 -7.588 1.00 0.00 O ATOM 0 H TYR A 55 9.365 -2.475 -4.326 1.00 0.00 H new ATOM 0 HA TYR A 55 11.532 -1.854 -2.581 1.00 0.00 H new ATOM 0 HB2 TYR A 55 8.897 -0.483 -3.230 1.00 0.00 H new ATOM 0 HB3 TYR A 55 10.120 0.224 -2.192 1.00 0.00 H new ATOM 0 HD1 TYR A 55 12.615 0.103 -3.349 1.00 0.00 H new ATOM 0 HD2 TYR A 55 8.905 0.247 -5.438 1.00 0.00 H new ATOM 0 HE1 TYR A 55 13.762 1.011 -5.319 1.00 0.00 H new ATOM 0 HE2 TYR A 55 10.051 1.151 -7.412 1.00 0.00 H new ATOM 0 HH TYR A 55 11.967 1.796 -8.305 1.00 0.00 H new ATOM 544 N ALA A 56 8.669 -2.768 -1.266 1.00 0.00 N ATOM 545 CA ALA A 56 8.020 -3.173 -0.025 1.00 0.00 C ATOM 546 C ALA A 56 8.807 -4.277 0.672 1.00 0.00 C ATOM 547 O ALA A 56 8.972 -4.258 1.891 1.00 0.00 O ATOM 548 CB ALA A 56 6.595 -3.631 -0.300 1.00 0.00 C ATOM 0 H ALA A 56 8.116 -2.938 -2.106 1.00 0.00 H new ATOM 0 HA ALA A 56 7.991 -2.309 0.639 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.122 -3.931 0.635 1.00 0.00 H new ATOM 0 HB2 ALA A 56 6.030 -2.813 -0.747 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.611 -4.478 -0.986 1.00 0.00 H new ATOM 554 N GLU A 57 9.291 -5.236 -0.110 1.00 0.00 N ATOM 555 CA GLU A 57 10.060 -6.350 0.435 1.00 0.00 C ATOM 556 C GLU A 57 11.391 -5.865 1.001 1.00 0.00 C ATOM 557 O GLU A 57 11.761 -6.205 2.125 1.00 0.00 O ATOM 558 CB GLU A 57 10.306 -7.405 -0.645 1.00 0.00 C ATOM 559 CG GLU A 57 9.042 -8.115 -1.101 1.00 0.00 C ATOM 560 CD GLU A 57 9.332 -9.300 -2.003 1.00 0.00 C ATOM 561 OE1 GLU A 57 9.829 -10.326 -1.493 1.00 0.00 O ATOM 562 OE2 GLU A 57 9.061 -9.200 -3.217 1.00 0.00 O ATOM 0 H GLU A 57 9.165 -5.265 -1.122 1.00 0.00 H new ATOM 0 HA GLU A 57 9.482 -6.797 1.244 1.00 0.00 H new ATOM 0 HB2 GLU A 57 10.776 -6.929 -1.506 1.00 0.00 H new ATOM 0 HB3 GLU A 57 11.011 -8.144 -0.265 1.00 0.00 H new ATOM 0 HG2 GLU A 57 8.486 -8.455 -0.228 1.00 0.00 H new ATOM 0 HG3 GLU A 57 8.403 -7.408 -1.630 1.00 0.00 H new ATOM 569 N LYS A 58 12.108 -5.070 0.214 1.00 0.00 N ATOM 570 CA LYS A 58 13.398 -4.537 0.635 1.00 0.00 C ATOM 571 C LYS A 58 13.249 -3.673 1.884 1.00 0.00 C ATOM 572 O LYS A 58 14.100 -3.699 2.774 1.00 0.00 O ATOM 573 CB LYS A 58 14.026 -3.717 -0.494 1.00 0.00 C ATOM 574 CG LYS A 58 15.498 -3.408 -0.275 1.00 0.00 C ATOM 575 CD LYS A 58 16.358 -4.649 -0.438 1.00 0.00 C ATOM 576 CE LYS A 58 16.725 -4.884 -1.896 1.00 0.00 C ATOM 577 NZ LYS A 58 17.382 -6.206 -2.096 1.00 0.00 N ATOM 0 H LYS A 58 11.817 -4.780 -0.720 1.00 0.00 H new ATOM 0 HA LYS A 58 14.051 -5.377 0.872 1.00 0.00 H new ATOM 0 HB2 LYS A 58 13.913 -4.260 -1.432 1.00 0.00 H new ATOM 0 HB3 LYS A 58 13.478 -2.780 -0.600 1.00 0.00 H new ATOM 0 HG2 LYS A 58 15.820 -2.645 -0.984 1.00 0.00 H new ATOM 0 HG3 LYS A 58 15.639 -2.995 0.724 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.267 -4.544 0.155 1.00 0.00 H new ATOM 0 HD3 LYS A 58 15.824 -5.517 -0.051 1.00 0.00 H new ATOM 0 HE2 LYS A 58 15.826 -4.828 -2.510 1.00 0.00 H new ATOM 0 HE3 LYS A 58 17.392 -4.092 -2.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 17.617 -6.328 -3.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 18.253 -6.250 -1.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 16.736 -6.964 -1.797 1.00 0.00 H new ATOM 591 N LEU A 59 12.164 -2.910 1.943 1.00 0.00 N ATOM 592 CA LEU A 59 11.902 -2.039 3.084 1.00 0.00 C ATOM 593 C LEU A 59 11.781 -2.849 4.371 1.00 0.00 C ATOM 594 O LEU A 59 12.425 -2.538 5.374 1.00 0.00 O ATOM 595 CB LEU A 59 10.622 -1.233 2.853 1.00 0.00 C ATOM 596 CG LEU A 59 10.022 -0.560 4.088 1.00 0.00 C ATOM 597 CD1 LEU A 59 11.032 0.376 4.731 1.00 0.00 C ATOM 598 CD2 LEU A 59 8.752 0.195 3.719 1.00 0.00 C ATOM 0 H LEU A 59 11.451 -2.876 1.214 1.00 0.00 H new ATOM 0 HA LEU A 59 12.743 -1.353 3.186 1.00 0.00 H new ATOM 0 HB2 LEU A 59 10.830 -0.464 2.109 1.00 0.00 H new ATOM 0 HB3 LEU A 59 9.871 -1.896 2.424 1.00 0.00 H new ATOM 0 HG LEU A 59 9.765 -1.334 4.811 1.00 0.00 H new ATOM 0 HD11 LEU A 59 10.586 0.845 5.608 1.00 0.00 H new ATOM 0 HD12 LEU A 59 11.913 -0.191 5.031 1.00 0.00 H new ATOM 0 HD13 LEU A 59 11.322 1.146 4.016 1.00 0.00 H new ATOM 0 HD21 LEU A 59 8.338 0.668 4.610 1.00 0.00 H new ATOM 0 HD22 LEU A 59 8.985 0.959 2.978 1.00 0.00 H new ATOM 0 HD23 LEU A 59 8.022 -0.501 3.305 1.00 0.00 H new ATOM 610 N ILE A 60 10.957 -3.889 4.335 1.00 0.00 N ATOM 611 CA ILE A 60 10.754 -4.745 5.497 1.00 0.00 C ATOM 612 C ILE A 60 12.072 -5.352 5.968 1.00 0.00 C ATOM 613 O ILE A 60 12.343 -5.420 7.166 1.00 0.00 O ATOM 614 CB ILE A 60 9.759 -5.881 5.193 1.00 0.00 C ATOM 615 CG1 ILE A 60 8.373 -5.305 4.893 1.00 0.00 C ATOM 616 CG2 ILE A 60 9.693 -6.853 6.361 1.00 0.00 C ATOM 617 CD1 ILE A 60 7.825 -4.437 6.005 1.00 0.00 C ATOM 0 H ILE A 60 10.418 -4.160 3.513 1.00 0.00 H new ATOM 0 HA ILE A 60 10.343 -4.115 6.286 1.00 0.00 H new ATOM 0 HB ILE A 60 10.105 -6.424 4.313 1.00 0.00 H new ATOM 0 HG12 ILE A 60 8.423 -4.718 3.976 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.680 -6.126 4.708 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.986 -7.650 6.131 1.00 0.00 H new ATOM 0 HG22 ILE A 60 10.680 -7.282 6.534 1.00 0.00 H new ATOM 0 HG23 ILE A 60 9.366 -6.324 7.256 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.840 -4.063 5.723 1.00 0.00 H new ATOM 0 HD12 ILE A 60 7.742 -5.026 6.919 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.497 -3.596 6.175 1.00 0.00 H new ATOM 629 N ASP A 61 12.888 -5.790 5.015 1.00 0.00 N ATOM 630 CA ASP A 61 14.180 -6.388 5.332 1.00 0.00 C ATOM 631 C ASP A 61 15.045 -5.421 6.134 1.00 0.00 C ATOM 632 O ASP A 61 15.683 -5.809 7.114 1.00 0.00 O ATOM 633 CB ASP A 61 14.905 -6.796 4.049 1.00 0.00 C ATOM 634 CG ASP A 61 16.156 -7.608 4.324 1.00 0.00 C ATOM 635 OD1 ASP A 61 16.027 -8.809 4.641 1.00 0.00 O ATOM 636 OD2 ASP A 61 17.265 -7.042 4.223 1.00 0.00 O ATOM 0 H ASP A 61 12.678 -5.742 4.018 1.00 0.00 H new ATOM 0 HA ASP A 61 14.002 -7.276 5.938 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.229 -7.377 3.422 1.00 0.00 H new ATOM 0 HB3 ASP A 61 15.172 -5.902 3.486 1.00 0.00 H new ATOM 641 N TYR A 62 15.063 -4.163 5.712 1.00 0.00 N ATOM 642 CA TYR A 62 15.853 -3.140 6.389 1.00 0.00 C ATOM 643 C TYR A 62 15.398 -2.969 7.835 1.00 0.00 C ATOM 644 O TYR A 62 16.216 -2.900 8.751 1.00 0.00 O ATOM 645 CB TYR A 62 15.745 -1.807 5.646 1.00 0.00 C ATOM 646 CG TYR A 62 16.624 -1.725 4.419 1.00 0.00 C ATOM 647 CD1 TYR A 62 18.001 -1.882 4.515 1.00 0.00 C ATOM 648 CD2 TYR A 62 16.077 -1.487 3.164 1.00 0.00 C ATOM 649 CE1 TYR A 62 18.808 -1.808 3.397 1.00 0.00 C ATOM 650 CE2 TYR A 62 16.877 -1.411 2.040 1.00 0.00 C ATOM 651 CZ TYR A 62 18.242 -1.572 2.161 1.00 0.00 C ATOM 652 OH TYR A 62 19.041 -1.495 1.044 1.00 0.00 O ATOM 0 H TYR A 62 14.540 -3.826 4.904 1.00 0.00 H new ATOM 0 HA TYR A 62 16.894 -3.463 6.391 1.00 0.00 H new ATOM 0 HB2 TYR A 62 14.708 -1.648 5.351 1.00 0.00 H new ATOM 0 HB3 TYR A 62 16.010 -0.998 6.327 1.00 0.00 H new ATOM 0 HD1 TYR A 62 18.448 -2.065 5.481 1.00 0.00 H new ATOM 0 HD2 TYR A 62 15.009 -1.359 3.066 1.00 0.00 H new ATOM 0 HE1 TYR A 62 19.877 -1.934 3.490 1.00 0.00 H new ATOM 0 HE2 TYR A 62 16.436 -1.226 1.072 1.00 0.00 H new ATOM 0 HH TYR A 62 18.485 -1.325 0.255 1.00 0.00 H new ATOM 662 N GLY A 63 14.084 -2.900 8.031 1.00 0.00 N ATOM 663 CA GLY A 63 13.541 -2.738 9.366 1.00 0.00 C ATOM 664 C GLY A 63 13.934 -3.872 10.293 1.00 0.00 C ATOM 665 O GLY A 63 14.186 -3.655 11.479 1.00 0.00 O ATOM 0 H GLY A 63 13.387 -2.954 7.288 1.00 0.00 H new ATOM 0 HA2 GLY A 63 13.889 -1.794 9.784 1.00 0.00 H new ATOM 0 HA3 GLY A 63 12.454 -2.680 9.308 1.00 0.00 H new ATOM 669 N LYS A 64 13.985 -5.084 9.754 1.00 0.00 N ATOM 670 CA LYS A 64 14.349 -6.257 10.540 1.00 0.00 C ATOM 671 C LYS A 64 15.696 -6.055 11.227 1.00 0.00 C ATOM 672 O LYS A 64 15.943 -6.600 12.304 1.00 0.00 O ATOM 673 CB LYS A 64 14.401 -7.499 9.648 1.00 0.00 C ATOM 674 CG LYS A 64 13.049 -7.897 9.080 1.00 0.00 C ATOM 675 CD LYS A 64 13.012 -9.369 8.707 1.00 0.00 C ATOM 676 CE LYS A 64 13.529 -9.601 7.295 1.00 0.00 C ATOM 677 NZ LYS A 64 12.470 -9.372 6.272 1.00 0.00 N ATOM 0 H LYS A 64 13.779 -5.281 8.775 1.00 0.00 H new ATOM 0 HA LYS A 64 13.587 -6.400 11.307 1.00 0.00 H new ATOM 0 HB2 LYS A 64 15.092 -7.316 8.825 1.00 0.00 H new ATOM 0 HB3 LYS A 64 14.804 -8.333 10.223 1.00 0.00 H new ATOM 0 HG2 LYS A 64 12.270 -7.687 9.812 1.00 0.00 H new ATOM 0 HG3 LYS A 64 12.831 -7.292 8.200 1.00 0.00 H new ATOM 0 HD2 LYS A 64 13.614 -9.940 9.414 1.00 0.00 H new ATOM 0 HD3 LYS A 64 11.990 -9.740 8.787 1.00 0.00 H new ATOM 0 HE2 LYS A 64 14.370 -8.935 7.102 1.00 0.00 H new ATOM 0 HE3 LYS A 64 13.903 -10.621 7.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 12.364 -10.224 5.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 11.568 -9.163 6.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 12.738 -8.568 5.669 1.00 0.00 H new ATOM 691 N LEU A 65 16.563 -5.269 10.598 1.00 0.00 N ATOM 692 CA LEU A 65 17.886 -4.995 11.149 1.00 0.00 C ATOM 693 C LEU A 65 17.779 -4.211 12.454 1.00 0.00 C ATOM 694 O LEU A 65 18.527 -4.455 13.400 1.00 0.00 O ATOM 695 CB LEU A 65 18.728 -4.213 10.140 1.00 0.00 C ATOM 696 CG LEU A 65 18.948 -4.889 8.785 1.00 0.00 C ATOM 697 CD1 LEU A 65 19.359 -3.864 7.740 1.00 0.00 C ATOM 698 CD2 LEU A 65 19.996 -5.986 8.900 1.00 0.00 C ATOM 0 H LEU A 65 16.374 -4.810 9.707 1.00 0.00 H new ATOM 0 HA LEU A 65 18.371 -5.949 11.357 1.00 0.00 H new ATOM 0 HB2 LEU A 65 18.251 -3.248 9.969 1.00 0.00 H new ATOM 0 HB3 LEU A 65 19.702 -4.013 10.587 1.00 0.00 H new ATOM 0 HG LEU A 65 18.009 -5.344 8.470 1.00 0.00 H new ATOM 0 HD11 LEU A 65 19.511 -4.362 6.782 1.00 0.00 H new ATOM 0 HD12 LEU A 65 18.575 -3.114 7.638 1.00 0.00 H new ATOM 0 HD13 LEU A 65 20.286 -3.381 8.049 1.00 0.00 H new ATOM 0 HD21 LEU A 65 20.139 -6.456 7.927 1.00 0.00 H new ATOM 0 HD22 LEU A 65 20.939 -5.555 9.237 1.00 0.00 H new ATOM 0 HD23 LEU A 65 19.662 -6.735 9.618 1.00 0.00 H new ATOM 710 N GLY A 66 16.842 -3.268 12.498 1.00 0.00 N ATOM 711 CA GLY A 66 16.653 -2.465 13.691 1.00 0.00 C ATOM 712 C GLY A 66 16.308 -1.024 13.372 1.00 0.00 C ATOM 713 O GLY A 66 16.513 -0.563 12.249 1.00 0.00 O ATOM 0 H GLY A 66 16.211 -3.046 11.728 1.00 0.00 H new ATOM 0 HA2 GLY A 66 15.858 -2.900 14.296 1.00 0.00 H new ATOM 0 HA3 GLY A 66 17.562 -2.493 14.292 1.00 0.00 H new ATOM 717 N ASP A 67 15.780 -0.310 14.360 1.00 0.00 N ATOM 718 CA ASP A 67 15.405 1.087 14.178 1.00 0.00 C ATOM 719 C ASP A 67 16.608 2.003 14.381 1.00 0.00 C ATOM 720 O ASP A 67 16.659 3.108 13.839 1.00 0.00 O ATOM 721 CB ASP A 67 14.288 1.468 15.152 1.00 0.00 C ATOM 722 CG ASP A 67 14.674 1.227 16.598 1.00 0.00 C ATOM 723 OD1 ASP A 67 15.278 2.133 17.209 1.00 0.00 O ATOM 724 OD2 ASP A 67 14.372 0.132 17.119 1.00 0.00 O ATOM 0 H ASP A 67 15.602 -0.676 15.295 1.00 0.00 H new ATOM 0 HA ASP A 67 15.044 1.211 13.157 1.00 0.00 H new ATOM 0 HB2 ASP A 67 14.035 2.520 15.017 1.00 0.00 H new ATOM 0 HB3 ASP A 67 13.393 0.892 14.917 1.00 0.00 H new ATOM 729 N THR A 68 17.574 1.538 15.167 1.00 0.00 N ATOM 730 CA THR A 68 18.775 2.316 15.443 1.00 0.00 C ATOM 731 C THR A 68 19.637 2.459 14.194 1.00 0.00 C ATOM 732 O THR A 68 20.384 3.425 14.051 1.00 0.00 O ATOM 733 CB THR A 68 19.615 1.674 16.562 1.00 0.00 C ATOM 734 OG1 THR A 68 20.769 2.480 16.833 1.00 0.00 O ATOM 735 CG2 THR A 68 20.051 0.269 16.174 1.00 0.00 C ATOM 0 H THR A 68 17.548 0.626 15.624 1.00 0.00 H new ATOM 0 HA THR A 68 18.445 3.303 15.768 1.00 0.00 H new ATOM 0 HB THR A 68 18.998 1.611 17.458 1.00 0.00 H new ATOM 0 HG1 THR A 68 21.297 2.066 17.547 1.00 0.00 H new ATOM 0 HG21 THR A 68 20.643 -0.164 16.980 1.00 0.00 H new ATOM 0 HG22 THR A 68 19.171 -0.349 15.998 1.00 0.00 H new ATOM 0 HG23 THR A 68 20.652 0.312 15.266 1.00 0.00 H new ATOM 743 N ASN A 69 19.528 1.489 13.291 1.00 0.00 N ATOM 744 CA ASN A 69 20.298 1.507 12.054 1.00 0.00 C ATOM 745 C ASN A 69 19.981 2.754 11.234 1.00 0.00 C ATOM 746 O ASN A 69 18.840 2.973 10.834 1.00 0.00 O ATOM 747 CB ASN A 69 20.005 0.253 11.227 1.00 0.00 C ATOM 748 CG ASN A 69 21.088 -0.033 10.206 1.00 0.00 C ATOM 749 OD1 ASN A 69 21.592 0.877 9.546 1.00 0.00 O ATOM 750 ND2 ASN A 69 21.453 -1.302 10.069 1.00 0.00 N ATOM 0 H ASN A 69 18.914 0.681 13.394 1.00 0.00 H new ATOM 0 HA ASN A 69 21.356 1.523 12.315 1.00 0.00 H new ATOM 0 HB2 ASN A 69 19.903 -0.603 11.894 1.00 0.00 H new ATOM 0 HB3 ASN A 69 19.050 0.374 10.715 1.00 0.00 H new ATOM 0 HD21 ASN A 69 22.177 -1.555 9.397 1.00 0.00 H new ATOM 0 HD22 ASN A 69 21.009 -2.024 10.636 1.00 0.00 H new ATOM 757 N GLU A 70 21.004 3.569 10.988 1.00 0.00 N ATOM 758 CA GLU A 70 20.834 4.795 10.217 1.00 0.00 C ATOM 759 C GLU A 70 20.431 4.482 8.779 1.00 0.00 C ATOM 760 O GLU A 70 19.584 5.160 8.198 1.00 0.00 O ATOM 761 CB GLU A 70 22.126 5.615 10.229 1.00 0.00 C ATOM 762 CG GLU A 70 22.499 6.141 11.604 1.00 0.00 C ATOM 763 CD GLU A 70 23.863 6.804 11.625 1.00 0.00 C ATOM 764 OE1 GLU A 70 24.853 6.137 11.256 1.00 0.00 O ATOM 765 OE2 GLU A 70 23.941 7.990 12.008 1.00 0.00 O ATOM 0 H GLU A 70 21.957 3.402 11.311 1.00 0.00 H new ATOM 0 HA GLU A 70 20.038 5.378 10.681 1.00 0.00 H new ATOM 0 HB2 GLU A 70 22.942 4.998 9.852 1.00 0.00 H new ATOM 0 HB3 GLU A 70 22.019 6.456 9.544 1.00 0.00 H new ATOM 0 HG2 GLU A 70 21.746 6.858 11.931 1.00 0.00 H new ATOM 0 HG3 GLU A 70 22.488 5.318 12.319 1.00 0.00 H new ATOM 772 N ARG A 71 21.045 3.448 8.211 1.00 0.00 N ATOM 773 CA ARG A 71 20.753 3.045 6.840 1.00 0.00 C ATOM 774 C ARG A 71 19.270 2.725 6.672 1.00 0.00 C ATOM 775 O ARG A 71 18.639 3.151 5.705 1.00 0.00 O ATOM 776 CB ARG A 71 21.595 1.829 6.454 1.00 0.00 C ATOM 777 CG ARG A 71 22.985 2.185 5.952 1.00 0.00 C ATOM 778 CD ARG A 71 23.493 1.164 4.945 1.00 0.00 C ATOM 779 NE ARG A 71 24.764 1.569 4.350 1.00 0.00 N ATOM 780 CZ ARG A 71 25.588 0.727 3.735 1.00 0.00 C ATOM 781 NH1 ARG A 71 25.274 -0.558 3.634 1.00 0.00 N ATOM 782 NH2 ARG A 71 26.727 1.170 3.220 1.00 0.00 N ATOM 0 H ARG A 71 21.747 2.875 8.679 1.00 0.00 H new ATOM 0 HA ARG A 71 21.005 3.876 6.181 1.00 0.00 H new ATOM 0 HB2 ARG A 71 21.688 1.172 7.319 1.00 0.00 H new ATOM 0 HB3 ARG A 71 21.072 1.266 5.681 1.00 0.00 H new ATOM 0 HG2 ARG A 71 22.965 3.173 5.491 1.00 0.00 H new ATOM 0 HG3 ARG A 71 23.674 2.240 6.795 1.00 0.00 H new ATOM 0 HD2 ARG A 71 23.614 0.199 5.437 1.00 0.00 H new ATOM 0 HD3 ARG A 71 22.751 1.030 4.158 1.00 0.00 H new ATOM 0 HE ARG A 71 25.034 2.551 4.410 1.00 0.00 H new ATOM 0 HH11 ARG A 71 24.399 -0.902 4.029 1.00 0.00 H new ATOM 0 HH12 ARG A 71 25.908 -1.202 3.162 1.00 0.00 H new ATOM 0 HH21 ARG A 71 26.971 2.157 3.296 1.00 0.00 H new ATOM 0 HH22 ARG A 71 27.359 0.523 2.748 1.00 0.00 H new ATOM 796 N ALA A 72 18.721 1.972 7.621 1.00 0.00 N ATOM 797 CA ALA A 72 17.314 1.597 7.578 1.00 0.00 C ATOM 798 C ALA A 72 16.415 2.815 7.759 1.00 0.00 C ATOM 799 O ALA A 72 15.363 2.921 7.130 1.00 0.00 O ATOM 800 CB ALA A 72 17.014 0.554 8.645 1.00 0.00 C ATOM 0 H ALA A 72 19.230 1.611 8.428 1.00 0.00 H new ATOM 0 HA ALA A 72 17.107 1.169 6.597 1.00 0.00 H new ATOM 0 HB1 ALA A 72 15.959 0.283 8.602 1.00 0.00 H new ATOM 0 HB2 ALA A 72 17.624 -0.332 8.469 1.00 0.00 H new ATOM 0 HB3 ALA A 72 17.243 0.963 9.629 1.00 0.00 H new ATOM 806 N MET A 73 16.836 3.732 8.624 1.00 0.00 N ATOM 807 CA MET A 73 16.067 4.943 8.887 1.00 0.00 C ATOM 808 C MET A 73 15.901 5.768 7.615 1.00 0.00 C ATOM 809 O MET A 73 14.797 6.205 7.287 1.00 0.00 O ATOM 810 CB MET A 73 16.753 5.783 9.967 1.00 0.00 C ATOM 811 CG MET A 73 16.356 5.392 11.382 1.00 0.00 C ATOM 812 SD MET A 73 14.705 5.967 11.824 1.00 0.00 S ATOM 813 CE MET A 73 13.825 4.411 11.937 1.00 0.00 C ATOM 0 H MET A 73 17.704 3.660 9.154 1.00 0.00 H new ATOM 0 HA MET A 73 15.079 4.647 9.239 1.00 0.00 H new ATOM 0 HB2 MET A 73 17.833 5.685 9.861 1.00 0.00 H new ATOM 0 HB3 MET A 73 16.511 6.834 9.807 1.00 0.00 H new ATOM 0 HG2 MET A 73 16.397 4.307 11.480 1.00 0.00 H new ATOM 0 HG3 MET A 73 17.080 5.803 12.085 1.00 0.00 H new ATOM 0 HE1 MET A 73 12.886 4.562 12.469 1.00 0.00 H new ATOM 0 HE2 MET A 73 13.618 4.036 10.935 1.00 0.00 H new ATOM 0 HE3 MET A 73 14.435 3.686 12.476 1.00 0.00 H new ATOM 823 N ARG A 74 17.003 5.977 6.902 1.00 0.00 N ATOM 824 CA ARG A 74 16.978 6.751 5.667 1.00 0.00 C ATOM 825 C ARG A 74 16.091 6.080 4.622 1.00 0.00 C ATOM 826 O ARG A 74 15.301 6.740 3.949 1.00 0.00 O ATOM 827 CB ARG A 74 18.396 6.919 5.116 1.00 0.00 C ATOM 828 CG ARG A 74 19.373 7.509 6.120 1.00 0.00 C ATOM 829 CD ARG A 74 20.470 8.304 5.430 1.00 0.00 C ATOM 830 NE ARG A 74 19.997 9.610 4.979 1.00 0.00 N ATOM 831 CZ ARG A 74 20.549 10.286 3.977 1.00 0.00 C ATOM 832 NH1 ARG A 74 21.588 9.781 3.325 1.00 0.00 N ATOM 833 NH2 ARG A 74 20.062 11.469 3.625 1.00 0.00 N ATOM 0 H ARG A 74 17.924 5.621 7.158 1.00 0.00 H new ATOM 0 HA ARG A 74 16.564 7.734 5.893 1.00 0.00 H new ATOM 0 HB2 ARG A 74 18.767 5.948 4.788 1.00 0.00 H new ATOM 0 HB3 ARG A 74 18.361 7.561 4.235 1.00 0.00 H new ATOM 0 HG2 ARG A 74 18.836 8.155 6.815 1.00 0.00 H new ATOM 0 HG3 ARG A 74 19.819 6.708 6.709 1.00 0.00 H new ATOM 0 HD2 ARG A 74 21.307 8.438 6.116 1.00 0.00 H new ATOM 0 HD3 ARG A 74 20.845 7.739 4.576 1.00 0.00 H new ATOM 0 HE ARG A 74 19.199 10.026 5.459 1.00 0.00 H new ATOM 0 HH11 ARG A 74 21.965 8.872 3.592 1.00 0.00 H new ATOM 0 HH12 ARG A 74 22.010 10.302 2.556 1.00 0.00 H new ATOM 0 HH21 ARG A 74 19.263 11.861 4.124 1.00 0.00 H new ATOM 0 HH22 ARG A 74 20.487 11.987 2.856 1.00 0.00 H new ATOM 847 N MET A 75 16.232 4.765 4.492 1.00 0.00 N ATOM 848 CA MET A 75 15.443 4.004 3.530 1.00 0.00 C ATOM 849 C MET A 75 13.959 4.057 3.881 1.00 0.00 C ATOM 850 O MET A 75 13.112 4.266 3.012 1.00 0.00 O ATOM 851 CB MET A 75 15.916 2.551 3.486 1.00 0.00 C ATOM 852 CG MET A 75 14.997 1.636 2.692 1.00 0.00 C ATOM 853 SD MET A 75 15.440 1.550 0.947 1.00 0.00 S ATOM 854 CE MET A 75 14.265 0.332 0.358 1.00 0.00 C ATOM 0 H MET A 75 16.885 4.205 5.040 1.00 0.00 H new ATOM 0 HA MET A 75 15.582 4.454 2.547 1.00 0.00 H new ATOM 0 HB2 MET A 75 16.915 2.516 3.051 1.00 0.00 H new ATOM 0 HB3 MET A 75 15.999 2.174 4.505 1.00 0.00 H new ATOM 0 HG2 MET A 75 15.029 0.634 3.121 1.00 0.00 H new ATOM 0 HG3 MET A 75 13.970 1.990 2.785 1.00 0.00 H new ATOM 0 HE1 MET A 75 14.160 0.421 -0.723 1.00 0.00 H new ATOM 0 HE2 MET A 75 14.621 -0.668 0.607 1.00 0.00 H new ATOM 0 HE3 MET A 75 13.298 0.501 0.831 1.00 0.00 H new ATOM 864 N ALA A 76 13.650 3.865 5.160 1.00 0.00 N ATOM 865 CA ALA A 76 12.269 3.892 5.625 1.00 0.00 C ATOM 866 C ALA A 76 11.684 5.296 5.524 1.00 0.00 C ATOM 867 O ALA A 76 10.521 5.468 5.158 1.00 0.00 O ATOM 868 CB ALA A 76 12.185 3.385 7.057 1.00 0.00 C ATOM 0 H ALA A 76 14.338 3.689 5.892 1.00 0.00 H new ATOM 0 HA ALA A 76 11.682 3.235 4.983 1.00 0.00 H new ATOM 0 HB1 ALA A 76 11.148 3.411 7.392 1.00 0.00 H new ATOM 0 HB2 ALA A 76 12.556 2.361 7.103 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.791 4.020 7.704 1.00 0.00 H new ATOM 874 N ASP A 77 12.495 6.296 5.850 1.00 0.00 N ATOM 875 CA ASP A 77 12.057 7.685 5.795 1.00 0.00 C ATOM 876 C ASP A 77 11.916 8.153 4.350 1.00 0.00 C ATOM 877 O ASP A 77 10.994 8.899 4.016 1.00 0.00 O ATOM 878 CB ASP A 77 13.044 8.584 6.541 1.00 0.00 C ATOM 879 CG ASP A 77 12.594 10.031 6.582 1.00 0.00 C ATOM 880 OD1 ASP A 77 12.555 10.671 5.510 1.00 0.00 O ATOM 881 OD2 ASP A 77 12.279 10.523 7.686 1.00 0.00 O ATOM 0 H ASP A 77 13.460 6.170 6.155 1.00 0.00 H new ATOM 0 HA ASP A 77 11.082 7.752 6.277 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.167 8.216 7.560 1.00 0.00 H new ATOM 0 HB3 ASP A 77 14.020 8.524 6.060 1.00 0.00 H new ATOM 886 N PHE A 78 12.834 7.712 3.498 1.00 0.00 N ATOM 887 CA PHE A 78 12.813 8.088 2.089 1.00 0.00 C ATOM 888 C PHE A 78 11.583 7.516 1.392 1.00 0.00 C ATOM 889 O PHE A 78 10.934 8.197 0.597 1.00 0.00 O ATOM 890 CB PHE A 78 14.083 7.598 1.390 1.00 0.00 C ATOM 891 CG PHE A 78 14.309 8.229 0.046 1.00 0.00 C ATOM 892 CD1 PHE A 78 14.557 9.588 -0.062 1.00 0.00 C ATOM 893 CD2 PHE A 78 14.274 7.464 -1.109 1.00 0.00 C ATOM 894 CE1 PHE A 78 14.766 10.173 -1.297 1.00 0.00 C ATOM 895 CE2 PHE A 78 14.483 8.044 -2.346 1.00 0.00 C ATOM 896 CZ PHE A 78 14.728 9.400 -2.441 1.00 0.00 C ATOM 0 H PHE A 78 13.602 7.094 3.758 1.00 0.00 H new ATOM 0 HA PHE A 78 12.770 9.176 2.029 1.00 0.00 H new ATOM 0 HB2 PHE A 78 14.942 7.804 2.028 1.00 0.00 H new ATOM 0 HB3 PHE A 78 14.028 6.516 1.270 1.00 0.00 H new ATOM 0 HD1 PHE A 78 14.587 10.197 0.829 1.00 0.00 H new ATOM 0 HD2 PHE A 78 14.081 6.403 -1.042 1.00 0.00 H new ATOM 0 HE1 PHE A 78 14.959 11.233 -1.367 1.00 0.00 H new ATOM 0 HE2 PHE A 78 14.455 7.437 -3.239 1.00 0.00 H new ATOM 0 HZ PHE A 78 14.889 9.855 -3.407 1.00 0.00 H new ATOM 906 N TRP A 79 11.267 6.263 1.695 1.00 0.00 N ATOM 907 CA TRP A 79 10.115 5.598 1.097 1.00 0.00 C ATOM 908 C TRP A 79 8.828 5.992 1.813 1.00 0.00 C ATOM 909 O TRP A 79 7.834 6.345 1.177 1.00 0.00 O ATOM 910 CB TRP A 79 10.294 4.080 1.143 1.00 0.00 C ATOM 911 CG TRP A 79 11.256 3.565 0.115 1.00 0.00 C ATOM 912 CD1 TRP A 79 12.478 2.999 0.345 1.00 0.00 C ATOM 913 CD2 TRP A 79 11.074 3.568 -1.305 1.00 0.00 C ATOM 914 NE1 TRP A 79 13.067 2.652 -0.846 1.00 0.00 N ATOM 915 CE2 TRP A 79 12.226 2.990 -1.873 1.00 0.00 C ATOM 916 CE3 TRP A 79 10.051 4.003 -2.152 1.00 0.00 C ATOM 917 CZ2 TRP A 79 12.381 2.836 -3.249 1.00 0.00 C ATOM 918 CZ3 TRP A 79 10.206 3.850 -3.517 1.00 0.00 C ATOM 919 CH2 TRP A 79 11.363 3.270 -4.054 1.00 0.00 C ATOM 0 H TRP A 79 11.793 5.686 2.352 1.00 0.00 H new ATOM 0 HA TRP A 79 10.043 5.916 0.057 1.00 0.00 H new ATOM 0 HB2 TRP A 79 10.644 3.792 2.134 1.00 0.00 H new ATOM 0 HB3 TRP A 79 9.325 3.602 0.996 1.00 0.00 H new ATOM 0 HD1 TRP A 79 12.916 2.847 1.320 1.00 0.00 H new ATOM 0 HE1 TRP A 79 13.982 2.214 -0.949 1.00 0.00 H new ATOM 0 HE3 TRP A 79 9.155 4.451 -1.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 13.272 2.390 -3.665 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 9.422 4.183 -4.181 1.00 0.00 H new ATOM 0 HH2 TRP A 79 11.453 3.163 -5.125 1.00 0.00 H new ATOM 930 N LEU A 80 8.852 5.929 3.140 1.00 0.00 N ATOM 931 CA LEU A 80 7.685 6.280 3.944 1.00 0.00 C ATOM 932 C LEU A 80 7.784 7.715 4.449 1.00 0.00 C ATOM 933 O LEU A 80 8.810 8.123 4.997 1.00 0.00 O ATOM 934 CB LEU A 80 7.548 5.319 5.126 1.00 0.00 C ATOM 935 CG LEU A 80 7.493 3.832 4.778 1.00 0.00 C ATOM 936 CD1 LEU A 80 7.666 2.984 6.029 1.00 0.00 C ATOM 937 CD2 LEU A 80 6.183 3.494 4.081 1.00 0.00 C ATOM 0 H LEU A 80 9.666 5.638 3.682 1.00 0.00 H new ATOM 0 HA LEU A 80 6.801 6.197 3.312 1.00 0.00 H new ATOM 0 HB2 LEU A 80 8.388 5.483 5.801 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.643 5.577 5.675 1.00 0.00 H new ATOM 0 HG LEU A 80 8.313 3.609 4.095 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.624 1.928 5.762 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.630 3.204 6.487 1.00 0.00 H new ATOM 0 HD13 LEU A 80 6.868 3.211 6.736 1.00 0.00 H new ATOM 0 HD21 LEU A 80 6.162 2.431 3.841 1.00 0.00 H new ATOM 0 HD22 LEU A 80 5.348 3.734 4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 80 6.099 4.075 3.163 1.00 0.00 H new ATOM 949 N THR A 81 6.712 8.479 4.265 1.00 0.00 N ATOM 950 CA THR A 81 6.676 9.868 4.703 1.00 0.00 C ATOM 951 C THR A 81 6.181 9.979 6.140 1.00 0.00 C ATOM 952 O THR A 81 6.726 10.742 6.937 1.00 0.00 O ATOM 953 CB THR A 81 5.774 10.722 3.793 1.00 0.00 C ATOM 954 OG1 THR A 81 4.409 10.315 3.936 1.00 0.00 O ATOM 955 CG2 THR A 81 6.196 10.592 2.337 1.00 0.00 C ATOM 0 H THR A 81 5.855 8.158 3.814 1.00 0.00 H new ATOM 0 HA THR A 81 7.697 10.244 4.644 1.00 0.00 H new ATOM 0 HB THR A 81 5.876 11.765 4.093 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.841 10.864 3.355 1.00 0.00 H new ATOM 0 HG21 THR A 81 5.544 11.204 1.713 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.227 10.929 2.225 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.120 9.550 2.028 1.00 0.00 H new ATOM 963 N GLU A 82 5.144 9.214 6.464 1.00 0.00 N ATOM 964 CA GLU A 82 4.575 9.226 7.807 1.00 0.00 C ATOM 965 C GLU A 82 5.654 8.982 8.858 1.00 0.00 C ATOM 966 O GLU A 82 6.216 7.890 8.945 1.00 0.00 O ATOM 967 CB GLU A 82 3.478 8.168 7.931 1.00 0.00 C ATOM 968 CG GLU A 82 2.084 8.700 7.648 1.00 0.00 C ATOM 969 CD GLU A 82 2.032 9.576 6.412 1.00 0.00 C ATOM 970 OE1 GLU A 82 2.664 10.653 6.422 1.00 0.00 O ATOM 971 OE2 GLU A 82 1.361 9.184 5.434 1.00 0.00 O ATOM 0 H GLU A 82 4.680 8.578 5.815 1.00 0.00 H new ATOM 0 HA GLU A 82 4.140 10.211 7.980 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.693 7.352 7.242 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.501 7.750 8.937 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.398 7.862 7.524 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.736 9.272 8.508 1.00 0.00 H new ATOM 978 N LYS A 83 5.940 10.007 9.653 1.00 0.00 N ATOM 979 CA LYS A 83 6.951 9.905 10.699 1.00 0.00 C ATOM 980 C LYS A 83 6.548 8.873 11.747 1.00 0.00 C ATOM 981 O LYS A 83 7.394 8.344 12.468 1.00 0.00 O ATOM 982 CB LYS A 83 7.164 11.267 11.364 1.00 0.00 C ATOM 983 CG LYS A 83 7.632 12.347 10.403 1.00 0.00 C ATOM 984 CD LYS A 83 9.072 12.125 9.973 1.00 0.00 C ATOM 985 CE LYS A 83 9.371 12.818 8.652 1.00 0.00 C ATOM 986 NZ LYS A 83 10.804 13.207 8.542 1.00 0.00 N ATOM 0 H LYS A 83 5.486 10.918 9.593 1.00 0.00 H new ATOM 0 HA LYS A 83 7.884 9.582 10.238 1.00 0.00 H new ATOM 0 HB2 LYS A 83 6.231 11.585 11.828 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.898 11.161 12.163 1.00 0.00 H new ATOM 0 HG2 LYS A 83 6.987 12.358 9.525 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.540 13.323 10.879 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.745 12.501 10.743 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.264 11.056 9.876 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.110 12.155 7.827 1.00 0.00 H new ATOM 0 HE3 LYS A 83 8.745 13.706 8.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 10.903 13.974 7.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.147 13.533 9.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.364 12.386 8.235 1.00 0.00 H new ATOM 1000 N ASP A 84 5.252 8.591 11.825 1.00 0.00 N ATOM 1001 CA ASP A 84 4.737 7.619 12.783 1.00 0.00 C ATOM 1002 C ASP A 84 4.818 6.204 12.219 1.00 0.00 C ATOM 1003 O ASP A 84 4.984 5.236 12.963 1.00 0.00 O ATOM 1004 CB ASP A 84 3.291 7.953 13.153 1.00 0.00 C ATOM 1005 CG ASP A 84 3.196 9.101 14.139 1.00 0.00 C ATOM 1006 OD1 ASP A 84 3.700 8.953 15.271 1.00 0.00 O ATOM 1007 OD2 ASP A 84 2.616 10.147 13.777 1.00 0.00 O ATOM 0 H ASP A 84 4.539 9.022 11.236 1.00 0.00 H new ATOM 0 HA ASP A 84 5.354 7.668 13.680 1.00 0.00 H new ATOM 0 HB2 ASP A 84 2.737 8.207 12.249 1.00 0.00 H new ATOM 0 HB3 ASP A 84 2.815 7.070 13.581 1.00 0.00 H new ATOM 1012 N LEU A 85 4.697 6.091 10.901 1.00 0.00 N ATOM 1013 CA LEU A 85 4.755 4.793 10.236 1.00 0.00 C ATOM 1014 C LEU A 85 6.186 4.268 10.191 1.00 0.00 C ATOM 1015 O LEU A 85 6.415 3.058 10.222 1.00 0.00 O ATOM 1016 CB LEU A 85 4.194 4.900 8.817 1.00 0.00 C ATOM 1017 CG LEU A 85 2.671 4.889 8.695 1.00 0.00 C ATOM 1018 CD1 LEU A 85 2.251 5.014 7.238 1.00 0.00 C ATOM 1019 CD2 LEU A 85 2.095 3.621 9.310 1.00 0.00 C ATOM 0 H LEU A 85 4.558 6.882 10.272 1.00 0.00 H new ATOM 0 HA LEU A 85 4.148 4.091 10.808 1.00 0.00 H new ATOM 0 HB2 LEU A 85 4.568 5.821 8.369 1.00 0.00 H new ATOM 0 HB3 LEU A 85 4.592 4.074 8.227 1.00 0.00 H new ATOM 0 HG LEU A 85 2.276 5.746 9.241 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.163 5.004 7.171 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.632 5.950 6.829 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.657 4.178 6.669 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.009 3.631 9.214 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.497 2.750 8.792 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.365 3.573 10.365 1.00 0.00 H new ATOM 1031 N ILE A 86 7.146 5.184 10.122 1.00 0.00 N ATOM 1032 CA ILE A 86 8.555 4.812 10.078 1.00 0.00 C ATOM 1033 C ILE A 86 8.939 3.968 11.287 1.00 0.00 C ATOM 1034 O ILE A 86 9.471 2.864 11.162 1.00 0.00 O ATOM 1035 CB ILE A 86 9.463 6.055 10.023 1.00 0.00 C ATOM 1036 CG1 ILE A 86 9.495 6.630 8.605 1.00 0.00 C ATOM 1037 CG2 ILE A 86 10.868 5.704 10.490 1.00 0.00 C ATOM 1038 CD1 ILE A 86 10.145 7.993 8.520 1.00 0.00 C ATOM 0 H ILE A 86 6.974 6.189 10.095 1.00 0.00 H new ATOM 0 HA ILE A 86 8.699 4.226 9.170 1.00 0.00 H new ATOM 0 HB ILE A 86 9.057 6.813 10.692 1.00 0.00 H new ATOM 0 HG12 ILE A 86 10.031 5.940 7.954 1.00 0.00 H new ATOM 0 HG13 ILE A 86 8.475 6.699 8.226 1.00 0.00 H new ATOM 0 HG21 ILE A 86 11.499 6.592 10.446 1.00 0.00 H new ATOM 0 HG22 ILE A 86 10.829 5.337 11.516 1.00 0.00 H new ATOM 0 HG23 ILE A 86 11.284 4.931 9.844 1.00 0.00 H new ATOM 0 HD11 ILE A 86 10.132 8.338 7.486 1.00 0.00 H new ATOM 0 HD12 ILE A 86 9.596 8.698 9.145 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.176 7.927 8.868 1.00 0.00 H new ATOM 1050 N PRO A 87 8.664 4.496 12.489 1.00 0.00 N ATOM 1051 CA PRO A 87 8.970 3.806 13.746 1.00 0.00 C ATOM 1052 C PRO A 87 8.083 2.587 13.969 1.00 0.00 C ATOM 1053 O PRO A 87 8.550 1.539 14.416 1.00 0.00 O ATOM 1054 CB PRO A 87 8.694 4.871 14.811 1.00 0.00 C ATOM 1055 CG PRO A 87 7.705 5.789 14.182 1.00 0.00 C ATOM 1056 CD PRO A 87 8.031 5.807 12.714 1.00 0.00 C ATOM 0 HA PRO A 87 9.990 3.421 13.762 1.00 0.00 H new ATOM 0 HB2 PRO A 87 8.296 4.425 15.723 1.00 0.00 H new ATOM 0 HB3 PRO A 87 9.606 5.401 15.087 1.00 0.00 H new ATOM 0 HG2 PRO A 87 6.686 5.440 14.351 1.00 0.00 H new ATOM 0 HG3 PRO A 87 7.774 6.789 14.609 1.00 0.00 H new ATOM 0 HD2 PRO A 87 7.136 5.931 12.105 1.00 0.00 H new ATOM 0 HD3 PRO A 87 8.704 6.627 12.462 1.00 0.00 H new ATOM 1064 N LYS A 88 6.800 2.729 13.653 1.00 0.00 N ATOM 1065 CA LYS A 88 5.845 1.639 13.818 1.00 0.00 C ATOM 1066 C LYS A 88 6.236 0.440 12.959 1.00 0.00 C ATOM 1067 O LYS A 88 6.203 -0.703 13.418 1.00 0.00 O ATOM 1068 CB LYS A 88 4.436 2.107 13.449 1.00 0.00 C ATOM 1069 CG LYS A 88 3.439 0.972 13.292 1.00 0.00 C ATOM 1070 CD LYS A 88 2.231 1.400 12.476 1.00 0.00 C ATOM 1071 CE LYS A 88 1.558 0.209 11.811 1.00 0.00 C ATOM 1072 NZ LYS A 88 0.280 0.592 11.150 1.00 0.00 N ATOM 0 H LYS A 88 6.397 3.589 13.281 1.00 0.00 H new ATOM 0 HA LYS A 88 5.856 1.334 14.864 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.077 2.791 14.218 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.482 2.670 12.517 1.00 0.00 H new ATOM 0 HG2 LYS A 88 3.924 0.124 12.808 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.113 0.634 14.276 1.00 0.00 H new ATOM 0 HD2 LYS A 88 1.516 1.909 13.122 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.540 2.117 11.715 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.233 -0.224 11.073 1.00 0.00 H new ATOM 0 HE3 LYS A 88 1.364 -0.562 12.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -0.148 -0.247 10.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.374 0.982 11.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.468 1.309 10.420 1.00 0.00 H new ATOM 1086 N LEU A 89 6.606 0.708 11.712 1.00 0.00 N ATOM 1087 CA LEU A 89 7.004 -0.349 10.788 1.00 0.00 C ATOM 1088 C LEU A 89 8.128 -1.194 11.380 1.00 0.00 C ATOM 1089 O LEU A 89 8.198 -2.401 11.149 1.00 0.00 O ATOM 1090 CB LEU A 89 7.452 0.253 9.455 1.00 0.00 C ATOM 1091 CG LEU A 89 8.334 -0.636 8.579 1.00 0.00 C ATOM 1092 CD1 LEU A 89 7.530 -1.800 8.021 1.00 0.00 C ATOM 1093 CD2 LEU A 89 8.956 0.174 7.451 1.00 0.00 C ATOM 0 H LEU A 89 6.639 1.648 11.317 1.00 0.00 H new ATOM 0 HA LEU A 89 6.141 -0.992 10.617 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.563 0.523 8.885 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.992 1.177 9.660 1.00 0.00 H new ATOM 0 HG LEU A 89 9.138 -1.038 9.196 1.00 0.00 H new ATOM 0 HD11 LEU A 89 8.174 -2.422 7.400 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.133 -2.396 8.843 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.705 -1.417 7.420 1.00 0.00 H new ATOM 0 HD21 LEU A 89 9.581 -0.476 6.838 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.167 0.606 6.835 1.00 0.00 H new ATOM 0 HD23 LEU A 89 9.567 0.973 7.871 1.00 0.00 H new ATOM 1105 N PHE A 90 9.003 -0.552 12.146 1.00 0.00 N ATOM 1106 CA PHE A 90 10.123 -1.245 12.772 1.00 0.00 C ATOM 1107 C PHE A 90 9.676 -1.967 14.040 1.00 0.00 C ATOM 1108 O PHE A 90 10.308 -2.929 14.475 1.00 0.00 O ATOM 1109 CB PHE A 90 11.242 -0.256 13.104 1.00 0.00 C ATOM 1110 CG PHE A 90 12.024 0.190 11.902 1.00 0.00 C ATOM 1111 CD1 PHE A 90 11.380 0.747 10.808 1.00 0.00 C ATOM 1112 CD2 PHE A 90 13.402 0.053 11.864 1.00 0.00 C ATOM 1113 CE1 PHE A 90 12.097 1.158 9.700 1.00 0.00 C ATOM 1114 CE2 PHE A 90 14.124 0.462 10.758 1.00 0.00 C ATOM 1115 CZ PHE A 90 13.471 1.015 9.676 1.00 0.00 C ATOM 0 H PHE A 90 8.958 0.447 12.348 1.00 0.00 H new ATOM 0 HA PHE A 90 10.499 -1.985 12.066 1.00 0.00 H new ATOM 0 HB2 PHE A 90 10.811 0.618 13.592 1.00 0.00 H new ATOM 0 HB3 PHE A 90 11.923 -0.717 13.820 1.00 0.00 H new ATOM 0 HD1 PHE A 90 10.306 0.861 10.822 1.00 0.00 H new ATOM 0 HD2 PHE A 90 13.919 -0.379 12.709 1.00 0.00 H new ATOM 0 HE1 PHE A 90 11.584 1.590 8.854 1.00 0.00 H new ATOM 0 HE2 PHE A 90 15.198 0.349 10.741 1.00 0.00 H new ATOM 0 HZ PHE A 90 14.033 1.336 8.811 1.00 0.00 H new ATOM 1125 N GLN A 91 8.581 -1.495 14.628 1.00 0.00 N ATOM 1126 CA GLN A 91 8.049 -2.094 15.846 1.00 0.00 C ATOM 1127 C GLN A 91 6.708 -2.769 15.580 1.00 0.00 C ATOM 1128 O GLN A 91 5.948 -3.050 16.507 1.00 0.00 O ATOM 1129 CB GLN A 91 7.892 -1.032 16.936 1.00 0.00 C ATOM 1130 CG GLN A 91 9.210 -0.429 17.393 1.00 0.00 C ATOM 1131 CD GLN A 91 10.051 -1.406 18.192 1.00 0.00 C ATOM 1132 OE1 GLN A 91 10.954 -2.049 17.654 1.00 0.00 O ATOM 1133 NE2 GLN A 91 9.759 -1.523 19.482 1.00 0.00 N ATOM 0 H GLN A 91 8.045 -0.700 14.280 1.00 0.00 H new ATOM 0 HA GLN A 91 8.755 -2.852 16.186 1.00 0.00 H new ATOM 0 HB2 GLN A 91 7.247 -0.235 16.565 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.388 -1.476 17.795 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.775 -0.096 16.522 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.010 0.454 18.000 1.00 0.00 H new ATOM 0 HE21 GLN A 91 9.003 -0.971 19.886 1.00 0.00 H new ATOM 0 HE22 GLN A 91 10.291 -2.165 20.069 1.00 0.00 H new ATOM 1142 N VAL A 92 6.423 -3.026 14.307 1.00 0.00 N ATOM 1143 CA VAL A 92 5.174 -3.670 13.919 1.00 0.00 C ATOM 1144 C VAL A 92 5.428 -4.843 12.979 1.00 0.00 C ATOM 1145 O VAL A 92 5.227 -6.001 13.345 1.00 0.00 O ATOM 1146 CB VAL A 92 4.219 -2.675 13.233 1.00 0.00 C ATOM 1147 CG1 VAL A 92 3.133 -3.416 12.469 1.00 0.00 C ATOM 1148 CG2 VAL A 92 3.611 -1.729 14.258 1.00 0.00 C ATOM 0 H VAL A 92 7.040 -2.798 13.527 1.00 0.00 H new ATOM 0 HA VAL A 92 4.710 -4.036 14.835 1.00 0.00 H new ATOM 0 HB VAL A 92 4.791 -2.083 12.519 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.468 -2.696 11.991 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.590 -4.048 11.708 1.00 0.00 H new ATOM 0 HG13 VAL A 92 2.561 -4.036 13.159 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.939 -1.033 13.757 1.00 0.00 H new ATOM 0 HG22 VAL A 92 3.053 -2.304 14.997 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.405 -1.172 14.755 1.00 0.00 H new ATOM 1158 N LEU A 93 5.873 -4.535 11.766 1.00 0.00 N ATOM 1159 CA LEU A 93 6.157 -5.564 10.770 1.00 0.00 C ATOM 1160 C LEU A 93 7.543 -6.162 10.986 1.00 0.00 C ATOM 1161 O LEU A 93 7.733 -7.372 10.867 1.00 0.00 O ATOM 1162 CB LEU A 93 6.055 -4.980 9.361 1.00 0.00 C ATOM 1163 CG LEU A 93 4.766 -4.221 9.039 1.00 0.00 C ATOM 1164 CD1 LEU A 93 4.844 -3.601 7.653 1.00 0.00 C ATOM 1165 CD2 LEU A 93 3.563 -5.147 9.145 1.00 0.00 C ATOM 0 H LEU A 93 6.045 -3.581 11.448 1.00 0.00 H new ATOM 0 HA LEU A 93 5.418 -6.357 10.882 1.00 0.00 H new ATOM 0 HB2 LEU A 93 6.898 -4.306 9.207 1.00 0.00 H new ATOM 0 HB3 LEU A 93 6.162 -5.794 8.644 1.00 0.00 H new ATOM 0 HG LEU A 93 4.647 -3.418 9.767 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.919 -3.065 7.441 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.683 -2.906 7.612 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.987 -4.386 6.911 1.00 0.00 H new ATOM 0 HD21 LEU A 93 2.654 -4.591 8.913 1.00 0.00 H new ATOM 0 HD22 LEU A 93 3.675 -5.971 8.440 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.497 -5.543 10.158 1.00 0.00 H new ATOM 1177 N ALA A 94 8.507 -5.308 11.308 1.00 0.00 N ATOM 1178 CA ALA A 94 9.875 -5.752 11.546 1.00 0.00 C ATOM 1179 C ALA A 94 9.902 -7.000 12.422 1.00 0.00 C ATOM 1180 O ALA A 94 10.449 -8.038 12.049 1.00 0.00 O ATOM 1181 CB ALA A 94 10.689 -4.637 12.185 1.00 0.00 C ATOM 0 H ALA A 94 8.366 -4.303 11.410 1.00 0.00 H new ATOM 0 HA ALA A 94 10.321 -6.006 10.584 1.00 0.00 H new ATOM 0 HB1 ALA A 94 11.708 -4.983 12.357 1.00 0.00 H new ATOM 0 HB2 ALA A 94 10.706 -3.773 11.521 1.00 0.00 H new ATOM 0 HB3 ALA A 94 10.236 -4.355 13.136 1.00 0.00 H new ATOM 1187 N PRO A 95 9.300 -6.898 13.616 1.00 0.00 N ATOM 1188 CA PRO A 95 9.242 -8.009 14.570 1.00 0.00 C ATOM 1189 C PRO A 95 8.329 -9.134 14.095 1.00 0.00 C ATOM 1190 O PRO A 95 8.609 -10.311 14.323 1.00 0.00 O ATOM 1191 CB PRO A 95 8.676 -7.360 15.836 1.00 0.00 C ATOM 1192 CG PRO A 95 7.901 -6.185 15.346 1.00 0.00 C ATOM 1193 CD PRO A 95 8.628 -5.691 14.125 1.00 0.00 C ATOM 0 HA PRO A 95 10.217 -8.475 14.712 1.00 0.00 H new ATOM 0 HB2 PRO A 95 8.039 -8.053 16.385 1.00 0.00 H new ATOM 0 HB3 PRO A 95 9.473 -7.054 16.514 1.00 0.00 H new ATOM 0 HG2 PRO A 95 6.876 -6.467 15.103 1.00 0.00 H new ATOM 0 HG3 PRO A 95 7.846 -5.408 16.109 1.00 0.00 H new ATOM 0 HD2 PRO A 95 7.940 -5.274 13.389 1.00 0.00 H new ATOM 0 HD3 PRO A 95 9.344 -4.907 14.373 1.00 0.00 H new ATOM 1201 N ARG A 96 7.236 -8.765 13.434 1.00 0.00 N ATOM 1202 CA ARG A 96 6.282 -9.744 12.928 1.00 0.00 C ATOM 1203 C ARG A 96 6.917 -10.611 11.843 1.00 0.00 C ATOM 1204 O ARG A 96 6.581 -11.787 11.698 1.00 0.00 O ATOM 1205 CB ARG A 96 5.043 -9.040 12.373 1.00 0.00 C ATOM 1206 CG ARG A 96 3.794 -9.906 12.385 1.00 0.00 C ATOM 1207 CD ARG A 96 2.531 -9.064 12.300 1.00 0.00 C ATOM 1208 NE ARG A 96 2.036 -8.684 13.621 1.00 0.00 N ATOM 1209 CZ ARG A 96 1.235 -9.451 14.353 1.00 0.00 C ATOM 1210 NH1 ARG A 96 0.842 -10.632 13.896 1.00 0.00 N ATOM 1211 NH2 ARG A 96 0.827 -9.037 15.547 1.00 0.00 N ATOM 0 H ARG A 96 6.990 -7.795 13.237 1.00 0.00 H new ATOM 0 HA ARG A 96 5.985 -10.388 13.756 1.00 0.00 H new ATOM 0 HB2 ARG A 96 4.856 -8.139 12.957 1.00 0.00 H new ATOM 0 HB3 ARG A 96 5.244 -8.721 11.350 1.00 0.00 H new ATOM 0 HG2 ARG A 96 3.825 -10.603 11.547 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.773 -10.504 13.296 1.00 0.00 H new ATOM 0 HD2 ARG A 96 2.733 -8.166 11.716 1.00 0.00 H new ATOM 0 HD3 ARG A 96 1.759 -9.622 11.770 1.00 0.00 H new ATOM 0 HE ARG A 96 2.321 -7.782 14.002 1.00 0.00 H new ATOM 0 HH11 ARG A 96 1.155 -10.954 12.980 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.227 -11.218 14.460 1.00 0.00 H new ATOM 0 HH21 ARG A 96 1.128 -8.130 15.903 1.00 0.00 H new ATOM 0 HH22 ARG A 96 0.212 -9.626 16.108 1.00 0.00 H new ATOM 1225 N TYR A 97 7.833 -10.022 11.084 1.00 0.00 N ATOM 1226 CA TYR A 97 8.513 -10.739 10.011 1.00 0.00 C ATOM 1227 C TYR A 97 9.853 -11.289 10.486 1.00 0.00 C ATOM 1228 O TYR A 97 10.309 -12.334 10.022 1.00 0.00 O ATOM 1229 CB TYR A 97 8.724 -9.817 8.807 1.00 0.00 C ATOM 1230 CG TYR A 97 7.458 -9.532 8.032 1.00 0.00 C ATOM 1231 CD1 TYR A 97 6.790 -10.548 7.359 1.00 0.00 C ATOM 1232 CD2 TYR A 97 6.930 -8.249 7.972 1.00 0.00 C ATOM 1233 CE1 TYR A 97 5.632 -10.293 6.649 1.00 0.00 C ATOM 1234 CE2 TYR A 97 5.773 -7.985 7.265 1.00 0.00 C ATOM 1235 CZ TYR A 97 5.128 -9.010 6.606 1.00 0.00 C ATOM 1236 OH TYR A 97 3.975 -8.750 5.899 1.00 0.00 O ATOM 0 H TYR A 97 8.122 -9.050 11.191 1.00 0.00 H new ATOM 0 HA TYR A 97 7.883 -11.577 9.713 1.00 0.00 H new ATOM 0 HB2 TYR A 97 9.148 -8.874 9.152 1.00 0.00 H new ATOM 0 HB3 TYR A 97 9.455 -10.270 8.138 1.00 0.00 H new ATOM 0 HD1 TYR A 97 7.182 -11.554 7.391 1.00 0.00 H new ATOM 0 HD2 TYR A 97 7.433 -7.444 8.487 1.00 0.00 H new ATOM 0 HE1 TYR A 97 5.125 -11.094 6.131 1.00 0.00 H new ATOM 0 HE2 TYR A 97 5.376 -6.981 7.229 1.00 0.00 H new ATOM 0 HH TYR A 97 4.056 -9.117 4.994 1.00 0.00 H new ATOM 1246 N LYS A 98 10.481 -10.578 11.417 1.00 0.00 N ATOM 1247 CA LYS A 98 11.768 -10.994 11.960 1.00 0.00 C ATOM 1248 C LYS A 98 11.829 -12.509 12.117 1.00 0.00 C ATOM 1249 O LYS A 98 12.833 -13.140 11.785 1.00 0.00 O ATOM 1250 CB LYS A 98 12.018 -10.320 13.310 1.00 0.00 C ATOM 1251 CG LYS A 98 13.401 -10.589 13.879 1.00 0.00 C ATOM 1252 CD LYS A 98 13.413 -10.472 15.394 1.00 0.00 C ATOM 1253 CE LYS A 98 14.769 -10.013 15.906 1.00 0.00 C ATOM 1254 NZ LYS A 98 14.931 -8.536 15.799 1.00 0.00 N ATOM 0 H LYS A 98 10.118 -9.710 11.811 1.00 0.00 H new ATOM 0 HA LYS A 98 12.545 -10.688 11.259 1.00 0.00 H new ATOM 0 HB2 LYS A 98 11.883 -9.244 13.200 1.00 0.00 H new ATOM 0 HB3 LYS A 98 11.268 -10.664 14.022 1.00 0.00 H new ATOM 0 HG2 LYS A 98 13.727 -11.587 13.588 1.00 0.00 H new ATOM 0 HG3 LYS A 98 14.114 -9.883 13.453 1.00 0.00 H new ATOM 0 HD2 LYS A 98 12.645 -9.767 15.712 1.00 0.00 H new ATOM 0 HD3 LYS A 98 13.163 -11.436 15.837 1.00 0.00 H new ATOM 0 HE2 LYS A 98 14.886 -10.317 16.946 1.00 0.00 H new ATOM 0 HE3 LYS A 98 15.558 -10.507 15.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 15.868 -8.263 16.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 14.844 -8.248 14.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 14.194 -8.064 16.361 1.00 0.00 H new ATOM 1268 N ASP A 99 10.747 -13.091 12.624 1.00 0.00 N ATOM 1269 CA ASP A 99 10.675 -14.534 12.824 1.00 0.00 C ATOM 1270 C ASP A 99 10.590 -15.263 11.487 1.00 0.00 C ATOM 1271 O ASP A 99 11.291 -16.249 11.261 1.00 0.00 O ATOM 1272 CB ASP A 99 9.468 -14.891 13.692 1.00 0.00 C ATOM 1273 CG ASP A 99 9.588 -16.271 14.309 1.00 0.00 C ATOM 1274 OD1 ASP A 99 10.243 -16.393 15.366 1.00 0.00 O ATOM 1275 OD2 ASP A 99 9.026 -17.228 13.736 1.00 0.00 O ATOM 0 H ASP A 99 9.907 -12.585 12.904 1.00 0.00 H new ATOM 0 HA ASP A 99 11.585 -14.852 13.334 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.362 -14.150 14.484 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.562 -14.844 13.087 1.00 0.00 H new ATOM 1280 N GLN A 100 9.725 -14.772 10.605 1.00 0.00 N ATOM 1281 CA GLN A 100 9.547 -15.379 9.291 1.00 0.00 C ATOM 1282 C GLN A 100 10.844 -15.332 8.490 1.00 0.00 C ATOM 1283 O GLN A 100 11.779 -14.613 8.842 1.00 0.00 O ATOM 1284 CB GLN A 100 8.434 -14.665 8.523 1.00 0.00 C ATOM 1285 CG GLN A 100 7.035 -15.078 8.955 1.00 0.00 C ATOM 1286 CD GLN A 100 6.003 -13.998 8.697 1.00 0.00 C ATOM 1287 OE1 GLN A 100 5.470 -13.397 9.631 1.00 0.00 O ATOM 1288 NE2 GLN A 100 5.715 -13.746 7.426 1.00 0.00 N ATOM 0 H GLN A 100 9.137 -13.956 10.776 1.00 0.00 H new ATOM 0 HA GLN A 100 9.268 -16.423 9.435 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.544 -13.589 8.657 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.551 -14.867 7.458 1.00 0.00 H new ATOM 0 HG2 GLN A 100 6.747 -15.985 8.423 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.044 -15.321 10.018 1.00 0.00 H new ATOM 0 HE21 GLN A 100 6.181 -14.268 6.684 1.00 0.00 H new ATOM 0 HE22 GLN A 100 5.028 -13.030 7.191 1.00 0.00 H new ATOM 1297 N THR A 101 10.894 -16.106 7.409 1.00 0.00 N ATOM 1298 CA THR A 101 12.076 -16.154 6.558 1.00 0.00 C ATOM 1299 C THR A 101 11.711 -15.929 5.096 1.00 0.00 C ATOM 1300 O THR A 101 12.234 -16.597 4.205 1.00 0.00 O ATOM 1301 CB THR A 101 12.809 -17.503 6.691 1.00 0.00 C ATOM 1302 OG1 THR A 101 12.956 -17.847 8.074 1.00 0.00 O ATOM 1303 CG2 THR A 101 14.177 -17.444 6.029 1.00 0.00 C ATOM 0 H THR A 101 10.129 -16.708 7.103 1.00 0.00 H new ATOM 0 HA THR A 101 12.738 -15.354 6.891 1.00 0.00 H new ATOM 0 HB THR A 101 12.213 -18.266 6.189 1.00 0.00 H new ATOM 0 HG1 THR A 101 13.421 -18.706 8.150 1.00 0.00 H new ATOM 0 HG21 THR A 101 14.675 -18.408 6.136 1.00 0.00 H new ATOM 0 HG22 THR A 101 14.059 -17.212 4.970 1.00 0.00 H new ATOM 0 HG23 THR A 101 14.779 -16.670 6.505 1.00 0.00 H new ATOM 1311 N GLY A 102 10.809 -14.983 4.855 1.00 0.00 N ATOM 1312 CA GLY A 102 10.390 -14.685 3.498 1.00 0.00 C ATOM 1313 C GLY A 102 8.895 -14.463 3.388 1.00 0.00 C ATOM 1314 O GLY A 102 8.177 -14.518 4.386 1.00 0.00 O ATOM 0 H GLY A 102 10.361 -14.417 5.576 1.00 0.00 H new ATOM 0 HA2 GLY A 102 10.913 -13.796 3.147 1.00 0.00 H new ATOM 0 HA3 GLY A 102 10.681 -15.506 2.843 1.00 0.00 H new ATOM 1318 N GLY A 103 8.423 -14.208 2.171 1.00 0.00 N ATOM 1319 CA GLY A 103 7.006 -13.979 1.959 1.00 0.00 C ATOM 1320 C GLY A 103 6.444 -12.920 2.887 1.00 0.00 C ATOM 1321 O GLY A 103 5.978 -13.230 3.983 1.00 0.00 O ATOM 0 H GLY A 103 8.996 -14.156 1.329 1.00 0.00 H new ATOM 0 HA2 GLY A 103 6.841 -13.676 0.925 1.00 0.00 H new ATOM 0 HA3 GLY A 103 6.464 -14.913 2.108 1.00 0.00 H new ATOM 1325 N TYR A 104 6.489 -11.668 2.448 1.00 0.00 N ATOM 1326 CA TYR A 104 5.984 -10.559 3.248 1.00 0.00 C ATOM 1327 C TYR A 104 4.765 -9.922 2.590 1.00 0.00 C ATOM 1328 O TYR A 104 3.787 -9.584 3.258 1.00 0.00 O ATOM 1329 CB TYR A 104 7.077 -9.508 3.448 1.00 0.00 C ATOM 1330 CG TYR A 104 8.440 -10.097 3.733 1.00 0.00 C ATOM 1331 CD1 TYR A 104 8.602 -11.096 4.684 1.00 0.00 C ATOM 1332 CD2 TYR A 104 9.566 -9.656 3.049 1.00 0.00 C ATOM 1333 CE1 TYR A 104 9.846 -11.638 4.948 1.00 0.00 C ATOM 1334 CE2 TYR A 104 10.813 -10.192 3.305 1.00 0.00 C ATOM 1335 CZ TYR A 104 10.948 -11.182 4.255 1.00 0.00 C ATOM 1336 OH TYR A 104 12.188 -11.720 4.514 1.00 0.00 O ATOM 0 H TYR A 104 6.870 -11.395 1.542 1.00 0.00 H new ATOM 0 HA TYR A 104 5.685 -10.953 4.219 1.00 0.00 H new ATOM 0 HB2 TYR A 104 7.139 -8.886 2.555 1.00 0.00 H new ATOM 0 HB3 TYR A 104 6.794 -8.854 4.273 1.00 0.00 H new ATOM 0 HD1 TYR A 104 7.741 -11.456 5.227 1.00 0.00 H new ATOM 0 HD2 TYR A 104 9.465 -8.881 2.304 1.00 0.00 H new ATOM 0 HE1 TYR A 104 9.954 -12.413 5.692 1.00 0.00 H new ATOM 0 HE2 TYR A 104 11.678 -9.837 2.764 1.00 0.00 H new ATOM 0 HH TYR A 104 12.857 -11.291 3.941 1.00 0.00 H new ATOM 1346 N THR A 105 4.829 -9.761 1.272 1.00 0.00 N ATOM 1347 CA THR A 105 3.731 -9.164 0.520 1.00 0.00 C ATOM 1348 C THR A 105 3.107 -10.174 -0.436 1.00 0.00 C ATOM 1349 O THR A 105 3.701 -11.210 -0.734 1.00 0.00 O ATOM 1350 CB THR A 105 4.202 -7.937 -0.283 1.00 0.00 C ATOM 1351 OG1 THR A 105 5.214 -8.323 -1.218 1.00 0.00 O ATOM 1352 CG2 THR A 105 4.745 -6.860 0.644 1.00 0.00 C ATOM 0 H THR A 105 5.630 -10.036 0.703 1.00 0.00 H new ATOM 0 HA THR A 105 2.984 -8.847 1.248 1.00 0.00 H new ATOM 0 HB THR A 105 3.345 -7.532 -0.822 1.00 0.00 H new ATOM 0 HG1 THR A 105 5.619 -7.522 -1.611 1.00 0.00 H new ATOM 0 HG21 THR A 105 5.072 -6.003 0.054 1.00 0.00 H new ATOM 0 HG22 THR A 105 3.963 -6.547 1.336 1.00 0.00 H new ATOM 0 HG23 THR A 105 5.590 -7.257 1.207 1.00 0.00 H new ATOM 1360 N ARG A 106 1.906 -9.864 -0.914 1.00 0.00 N ATOM 1361 CA ARG A 106 1.202 -10.746 -1.837 1.00 0.00 C ATOM 1362 C ARG A 106 0.505 -9.942 -2.931 1.00 0.00 C ATOM 1363 O ARG A 106 -0.032 -8.865 -2.677 1.00 0.00 O ATOM 1364 CB ARG A 106 0.177 -11.596 -1.082 1.00 0.00 C ATOM 1365 CG ARG A 106 0.740 -12.906 -0.558 1.00 0.00 C ATOM 1366 CD ARG A 106 -0.330 -13.983 -0.485 1.00 0.00 C ATOM 1367 NE ARG A 106 0.089 -15.117 0.334 1.00 0.00 N ATOM 1368 CZ ARG A 106 -0.409 -16.342 0.205 1.00 0.00 C ATOM 1369 NH1 ARG A 106 -1.340 -16.589 -0.707 1.00 0.00 N ATOM 1370 NH2 ARG A 106 0.023 -17.322 0.989 1.00 0.00 N ATOM 0 H ARG A 106 1.401 -9.010 -0.678 1.00 0.00 H new ATOM 0 HA ARG A 106 1.936 -11.403 -2.304 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.215 -11.018 -0.245 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.663 -11.810 -1.743 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.550 -13.240 -1.206 1.00 0.00 H new ATOM 0 HG3 ARG A 106 1.168 -12.749 0.432 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.245 -13.557 -0.073 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -0.564 -14.330 -1.491 1.00 0.00 H new ATOM 0 HE ARG A 106 0.804 -14.960 1.045 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.675 -15.838 -1.311 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -1.721 -17.530 -0.805 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.738 -17.135 1.692 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -0.360 -18.262 0.889 1.00 0.00 H new ATOM 1384 N MET A 107 0.518 -10.474 -4.149 1.00 0.00 N ATOM 1385 CA MET A 107 -0.114 -9.807 -5.282 1.00 0.00 C ATOM 1386 C MET A 107 -1.341 -10.580 -5.752 1.00 0.00 C ATOM 1387 O MET A 107 -1.289 -11.796 -5.934 1.00 0.00 O ATOM 1388 CB MET A 107 0.883 -9.658 -6.433 1.00 0.00 C ATOM 1389 CG MET A 107 0.248 -9.177 -7.727 1.00 0.00 C ATOM 1390 SD MET A 107 1.350 -9.337 -9.144 1.00 0.00 S ATOM 1391 CE MET A 107 1.447 -7.635 -9.694 1.00 0.00 C ATOM 0 H MET A 107 0.959 -11.365 -4.377 1.00 0.00 H new ATOM 0 HA MET A 107 -0.434 -8.817 -4.958 1.00 0.00 H new ATOM 0 HB2 MET A 107 1.664 -8.957 -6.138 1.00 0.00 H new ATOM 0 HB3 MET A 107 1.367 -10.618 -6.610 1.00 0.00 H new ATOM 0 HG2 MET A 107 -0.662 -9.747 -7.914 1.00 0.00 H new ATOM 0 HG3 MET A 107 -0.046 -8.133 -7.617 1.00 0.00 H new ATOM 0 HE1 MET A 107 1.897 -7.598 -10.686 1.00 0.00 H new ATOM 0 HE2 MET A 107 0.445 -7.208 -9.734 1.00 0.00 H new ATOM 0 HE3 MET A 107 2.058 -7.062 -8.997 1.00 0.00 H new ATOM 1401 N LEU A 108 -2.445 -9.866 -5.947 1.00 0.00 N ATOM 1402 CA LEU A 108 -3.687 -10.486 -6.397 1.00 0.00 C ATOM 1403 C LEU A 108 -4.106 -9.938 -7.758 1.00 0.00 C ATOM 1404 O LEU A 108 -3.781 -8.804 -8.108 1.00 0.00 O ATOM 1405 CB LEU A 108 -4.799 -10.246 -5.374 1.00 0.00 C ATOM 1406 CG LEU A 108 -6.223 -10.531 -5.852 1.00 0.00 C ATOM 1407 CD1 LEU A 108 -6.368 -11.989 -6.259 1.00 0.00 C ATOM 1408 CD2 LEU A 108 -7.230 -10.175 -4.767 1.00 0.00 C ATOM 0 H LEU A 108 -2.505 -8.858 -5.801 1.00 0.00 H new ATOM 0 HA LEU A 108 -3.516 -11.558 -6.494 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -4.600 -10.865 -4.499 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -4.748 -9.207 -5.048 1.00 0.00 H new ATOM 0 HG LEU A 108 -6.424 -9.910 -6.725 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -7.388 -12.173 -6.596 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -5.673 -12.212 -7.068 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -6.147 -12.629 -5.405 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.238 -10.384 -5.124 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.030 -10.770 -3.876 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.143 -9.116 -4.524 1.00 0.00 H new ATOM 1420 N GLN A 109 -4.831 -10.751 -8.519 1.00 0.00 N ATOM 1421 CA GLN A 109 -5.297 -10.347 -9.841 1.00 0.00 C ATOM 1422 C GLN A 109 -6.783 -10.009 -9.814 1.00 0.00 C ATOM 1423 O GLN A 109 -7.591 -10.762 -9.272 1.00 0.00 O ATOM 1424 CB GLN A 109 -5.032 -11.458 -10.859 1.00 0.00 C ATOM 1425 CG GLN A 109 -5.233 -11.021 -12.301 1.00 0.00 C ATOM 1426 CD GLN A 109 -6.675 -11.139 -12.752 1.00 0.00 C ATOM 1427 OE1 GLN A 109 -7.344 -10.136 -13.003 1.00 0.00 O ATOM 1428 NE2 GLN A 109 -7.164 -12.369 -12.856 1.00 0.00 N ATOM 0 H GLN A 109 -5.109 -11.693 -8.243 1.00 0.00 H new ATOM 0 HA GLN A 109 -4.746 -9.454 -10.136 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -4.010 -11.816 -10.736 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -5.693 -12.299 -10.647 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -4.905 -9.987 -12.412 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -4.602 -11.627 -12.951 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -6.574 -13.172 -12.638 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -8.129 -12.511 -13.154 1.00 0.00 H new ATOM 1437 N ILE A 110 -7.136 -8.871 -10.404 1.00 0.00 N ATOM 1438 CA ILE A 110 -8.526 -8.434 -10.448 1.00 0.00 C ATOM 1439 C ILE A 110 -8.856 -7.785 -11.788 1.00 0.00 C ATOM 1440 O ILE A 110 -7.992 -7.228 -12.465 1.00 0.00 O ATOM 1441 CB ILE A 110 -8.839 -7.437 -9.317 1.00 0.00 C ATOM 1442 CG1 ILE A 110 -7.863 -6.260 -9.361 1.00 0.00 C ATOM 1443 CG2 ILE A 110 -8.777 -8.132 -7.965 1.00 0.00 C ATOM 1444 CD1 ILE A 110 -8.366 -5.029 -8.639 1.00 0.00 C ATOM 0 H ILE A 110 -6.479 -8.236 -10.857 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.141 -9.324 -10.317 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.849 -7.054 -9.461 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -6.915 -6.568 -8.920 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -7.662 -6.004 -10.401 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.001 -7.414 -7.176 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.508 -8.940 -7.938 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -7.778 -8.540 -7.811 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -7.622 -4.235 -8.712 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.298 -4.696 -9.095 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -8.540 -5.268 -7.590 1.00 0.00 H new ATOM 1456 N PRO A 111 -10.137 -7.856 -12.181 1.00 0.00 N ATOM 1457 CA PRO A 111 -10.611 -7.279 -13.442 1.00 0.00 C ATOM 1458 C PRO A 111 -10.600 -5.754 -13.422 1.00 0.00 C ATOM 1459 O PRO A 111 -10.405 -5.139 -12.375 1.00 0.00 O ATOM 1460 CB PRO A 111 -12.045 -7.802 -13.553 1.00 0.00 C ATOM 1461 CG PRO A 111 -12.462 -8.066 -12.148 1.00 0.00 C ATOM 1462 CD PRO A 111 -11.220 -8.504 -11.423 1.00 0.00 C ATOM 0 HA PRO A 111 -9.975 -7.556 -14.282 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -12.698 -7.070 -14.029 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -12.090 -8.709 -14.156 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -12.885 -7.171 -11.692 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -13.230 -8.838 -12.107 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -11.229 -8.184 -10.381 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -11.117 -9.589 -11.422 1.00 0.00 H new ATOM 1470 N ASN A 112 -10.807 -5.151 -14.588 1.00 0.00 N ATOM 1471 CA ASN A 112 -10.821 -3.697 -14.705 1.00 0.00 C ATOM 1472 C ASN A 112 -12.246 -3.176 -14.858 1.00 0.00 C ATOM 1473 O ASN A 112 -12.933 -3.498 -15.828 1.00 0.00 O ATOM 1474 CB ASN A 112 -9.971 -3.252 -15.896 1.00 0.00 C ATOM 1475 CG ASN A 112 -10.368 -3.952 -17.182 1.00 0.00 C ATOM 1476 OD1 ASN A 112 -10.497 -5.176 -17.221 1.00 0.00 O ATOM 1477 ND2 ASN A 112 -10.564 -3.177 -18.242 1.00 0.00 N ATOM 0 H ASN A 112 -10.967 -5.646 -15.465 1.00 0.00 H new ATOM 0 HA ASN A 112 -10.399 -3.280 -13.791 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -10.069 -2.174 -16.027 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -8.921 -3.453 -15.685 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -10.833 -3.592 -19.134 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -10.446 -2.167 -18.164 1.00 0.00 H new ATOM 1484 N ARG A 113 -12.683 -2.371 -13.896 1.00 0.00 N ATOM 1485 CA ARG A 113 -14.027 -1.805 -13.925 1.00 0.00 C ATOM 1486 C ARG A 113 -14.043 -0.476 -14.672 1.00 0.00 C ATOM 1487 O ARG A 113 -14.962 -0.194 -15.440 1.00 0.00 O ATOM 1488 CB ARG A 113 -14.551 -1.609 -12.501 1.00 0.00 C ATOM 1489 CG ARG A 113 -13.636 -0.767 -11.626 1.00 0.00 C ATOM 1490 CD ARG A 113 -14.205 -0.599 -10.226 1.00 0.00 C ATOM 1491 NE ARG A 113 -13.676 0.588 -9.560 1.00 0.00 N ATOM 1492 CZ ARG A 113 -13.908 1.829 -9.973 1.00 0.00 C ATOM 1493 NH1 ARG A 113 -14.658 2.044 -11.044 1.00 0.00 N ATOM 1494 NH2 ARG A 113 -13.390 2.857 -9.312 1.00 0.00 N ATOM 0 H ARG A 113 -12.127 -2.096 -13.087 1.00 0.00 H new ATOM 0 HA ARG A 113 -14.677 -2.504 -14.451 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -15.532 -1.137 -12.546 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -14.688 -2.585 -12.036 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.654 -1.236 -11.567 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -13.494 0.213 -12.082 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -15.291 -0.530 -10.282 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -13.972 -1.482 -9.631 1.00 0.00 H new ATOM 0 HE ARG A 113 -13.096 0.457 -8.731 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -15.058 1.256 -11.553 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -14.835 2.998 -11.360 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -12.813 2.694 -8.486 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -13.568 3.810 -9.630 1.00 0.00 H new ATOM 1508 N SER A 114 -13.018 0.339 -14.441 1.00 0.00 N ATOM 1509 CA SER A 114 -12.915 1.642 -15.089 1.00 0.00 C ATOM 1510 C SER A 114 -13.192 1.527 -16.585 1.00 0.00 C ATOM 1511 O SER A 114 -13.126 0.439 -17.159 1.00 0.00 O ATOM 1512 CB SER A 114 -11.526 2.240 -14.859 1.00 0.00 C ATOM 1513 OG SER A 114 -11.442 2.862 -13.589 1.00 0.00 O ATOM 0 H SER A 114 -12.247 0.120 -13.810 1.00 0.00 H new ATOM 0 HA SER A 114 -13.663 2.301 -14.649 1.00 0.00 H new ATOM 0 HB2 SER A 114 -10.772 1.456 -14.934 1.00 0.00 H new ATOM 0 HB3 SER A 114 -11.307 2.969 -15.639 1.00 0.00 H new ATOM 0 HG SER A 114 -10.544 3.235 -13.466 1.00 0.00 H new ATOM 1519 N LEU A 115 -13.501 2.657 -17.210 1.00 0.00 N ATOM 1520 CA LEU A 115 -13.789 2.686 -18.640 1.00 0.00 C ATOM 1521 C LEU A 115 -12.546 2.336 -19.452 1.00 0.00 C ATOM 1522 O LEU A 115 -12.531 1.347 -20.186 1.00 0.00 O ATOM 1523 CB LEU A 115 -14.306 4.067 -19.048 1.00 0.00 C ATOM 1524 CG LEU A 115 -15.790 4.330 -18.791 1.00 0.00 C ATOM 1525 CD1 LEU A 115 -16.072 5.825 -18.774 1.00 0.00 C ATOM 1526 CD2 LEU A 115 -16.644 3.637 -19.843 1.00 0.00 C ATOM 0 H LEU A 115 -13.559 3.565 -16.750 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.558 1.941 -18.846 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.726 4.822 -18.516 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -14.112 4.206 -20.111 1.00 0.00 H new ATOM 0 HG LEU A 115 -16.048 3.921 -17.814 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -17.133 5.993 -18.590 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -15.487 6.297 -17.984 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -15.798 6.258 -19.736 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -17.697 3.835 -19.645 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -16.383 4.016 -20.831 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -16.464 2.563 -19.808 1.00 0.00 H new ATOM 1538 N ASP A 116 -11.508 3.151 -19.315 1.00 0.00 N ATOM 1539 CA ASP A 116 -10.258 2.925 -20.034 1.00 0.00 C ATOM 1540 C ASP A 116 -9.594 1.630 -19.577 1.00 0.00 C ATOM 1541 O ASP A 116 -9.817 1.169 -18.458 1.00 0.00 O ATOM 1542 CB ASP A 116 -9.304 4.104 -19.825 1.00 0.00 C ATOM 1543 CG ASP A 116 -9.819 5.383 -20.452 1.00 0.00 C ATOM 1544 OD1 ASP A 116 -10.087 5.380 -21.672 1.00 0.00 O ATOM 1545 OD2 ASP A 116 -9.953 6.390 -19.724 1.00 0.00 O ATOM 0 H ASP A 116 -11.506 3.975 -18.713 1.00 0.00 H new ATOM 0 HA ASP A 116 -10.489 2.838 -21.096 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -9.154 4.261 -18.757 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -8.331 3.860 -20.251 1.00 0.00 H new ATOM 1550 N ARG A 117 -8.780 1.048 -20.451 1.00 0.00 N ATOM 1551 CA ARG A 117 -8.086 -0.195 -20.138 1.00 0.00 C ATOM 1552 C ARG A 117 -6.981 0.041 -19.114 1.00 0.00 C ATOM 1553 O ARG A 117 -6.158 0.943 -19.271 1.00 0.00 O ATOM 1554 CB ARG A 117 -7.495 -0.808 -21.409 1.00 0.00 C ATOM 1555 CG ARG A 117 -7.063 -2.256 -21.244 1.00 0.00 C ATOM 1556 CD ARG A 117 -6.597 -2.853 -22.562 1.00 0.00 C ATOM 1557 NE ARG A 117 -6.693 -4.310 -22.568 1.00 0.00 N ATOM 1558 CZ ARG A 117 -5.751 -5.111 -22.085 1.00 0.00 C ATOM 1559 NH1 ARG A 117 -4.646 -4.599 -21.559 1.00 0.00 N ATOM 1560 NH2 ARG A 117 -5.912 -6.428 -22.126 1.00 0.00 N ATOM 0 H ARG A 117 -8.585 1.417 -21.382 1.00 0.00 H new ATOM 0 HA ARG A 117 -8.811 -0.888 -19.711 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -8.233 -0.747 -22.209 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -6.636 -0.215 -21.722 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -6.258 -2.315 -20.512 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -7.894 -2.842 -20.852 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -7.197 -2.447 -23.376 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -5.565 -2.557 -22.749 1.00 0.00 H new ATOM 0 HE ARG A 117 -7.530 -4.736 -22.965 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -4.519 -3.588 -21.525 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -3.924 -5.217 -21.189 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -6.760 -6.826 -22.529 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -5.187 -7.042 -21.755 1.00 0.00 H new ATOM 1574 N ALA A 118 -6.970 -0.773 -18.064 1.00 0.00 N ATOM 1575 CA ALA A 118 -5.966 -0.653 -17.014 1.00 0.00 C ATOM 1576 C ALA A 118 -5.872 -1.936 -16.194 1.00 0.00 C ATOM 1577 O ALA A 118 -6.822 -2.319 -15.510 1.00 0.00 O ATOM 1578 CB ALA A 118 -6.283 0.530 -16.112 1.00 0.00 C ATOM 0 H ALA A 118 -7.645 -1.523 -17.918 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.999 -0.485 -17.489 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.525 0.607 -15.333 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.291 1.446 -16.703 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.261 0.386 -15.653 1.00 0.00 H new ATOM 1584 N LYS A 119 -4.722 -2.598 -16.268 1.00 0.00 N ATOM 1585 CA LYS A 119 -4.504 -3.837 -15.533 1.00 0.00 C ATOM 1586 C LYS A 119 -4.479 -3.580 -14.029 1.00 0.00 C ATOM 1587 O LYS A 119 -3.413 -3.457 -13.429 1.00 0.00 O ATOM 1588 CB LYS A 119 -3.190 -4.489 -15.970 1.00 0.00 C ATOM 1589 CG LYS A 119 -2.876 -5.779 -15.232 1.00 0.00 C ATOM 1590 CD LYS A 119 -1.550 -6.370 -15.682 1.00 0.00 C ATOM 1591 CE LYS A 119 -1.715 -7.222 -16.931 1.00 0.00 C ATOM 1592 NZ LYS A 119 -0.431 -7.376 -17.671 1.00 0.00 N ATOM 0 H LYS A 119 -3.926 -2.296 -16.830 1.00 0.00 H new ATOM 0 HA LYS A 119 -5.330 -4.512 -15.756 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.234 -4.694 -17.040 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.374 -3.783 -15.814 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.845 -5.587 -14.159 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.674 -6.501 -15.404 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -0.841 -5.566 -15.880 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -1.130 -6.976 -14.880 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -2.094 -8.205 -16.652 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -2.459 -6.767 -17.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -0.585 -7.963 -18.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -0.082 -6.440 -17.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 0.272 -7.833 -17.055 1.00 0.00 H new ATOM 1606 N MET A 120 -5.662 -3.503 -13.428 1.00 0.00 N ATOM 1607 CA MET A 120 -5.775 -3.265 -11.994 1.00 0.00 C ATOM 1608 C MET A 120 -5.361 -4.500 -11.202 1.00 0.00 C ATOM 1609 O MET A 120 -5.528 -5.630 -11.664 1.00 0.00 O ATOM 1610 CB MET A 120 -7.209 -2.870 -11.632 1.00 0.00 C ATOM 1611 CG MET A 120 -7.558 -1.438 -12.006 1.00 0.00 C ATOM 1612 SD MET A 120 -7.253 -0.276 -10.662 1.00 0.00 S ATOM 1613 CE MET A 120 -5.484 -0.463 -10.447 1.00 0.00 C ATOM 0 H MET A 120 -6.555 -3.602 -13.911 1.00 0.00 H new ATOM 0 HA MET A 120 -5.103 -2.447 -11.734 1.00 0.00 H new ATOM 0 HB2 MET A 120 -7.901 -3.547 -12.133 1.00 0.00 H new ATOM 0 HB3 MET A 120 -7.354 -3.002 -10.560 1.00 0.00 H new ATOM 0 HG2 MET A 120 -6.974 -1.141 -12.877 1.00 0.00 H new ATOM 0 HG3 MET A 120 -8.608 -1.387 -12.294 1.00 0.00 H new ATOM 0 HE1 MET A 120 -5.109 0.335 -9.806 1.00 0.00 H new ATOM 0 HE2 MET A 120 -5.273 -1.428 -9.986 1.00 0.00 H new ATOM 0 HE3 MET A 120 -4.992 -0.409 -11.418 1.00 0.00 H new ATOM 1623 N ALA A 121 -4.819 -4.281 -10.009 1.00 0.00 N ATOM 1624 CA ALA A 121 -4.383 -5.377 -9.153 1.00 0.00 C ATOM 1625 C ALA A 121 -4.535 -5.016 -7.679 1.00 0.00 C ATOM 1626 O ALA A 121 -4.627 -3.842 -7.323 1.00 0.00 O ATOM 1627 CB ALA A 121 -2.940 -5.745 -9.463 1.00 0.00 C ATOM 0 H ALA A 121 -4.671 -3.353 -9.613 1.00 0.00 H new ATOM 0 HA ALA A 121 -5.018 -6.239 -9.355 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -2.627 -6.565 -8.817 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -2.859 -6.053 -10.505 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -2.299 -4.881 -9.289 1.00 0.00 H new ATOM 1633 N VAL A 122 -4.561 -6.036 -6.825 1.00 0.00 N ATOM 1634 CA VAL A 122 -4.701 -5.826 -5.389 1.00 0.00 C ATOM 1635 C VAL A 122 -3.497 -6.378 -4.634 1.00 0.00 C ATOM 1636 O VAL A 122 -3.161 -7.557 -4.756 1.00 0.00 O ATOM 1637 CB VAL A 122 -5.981 -6.489 -4.848 1.00 0.00 C ATOM 1638 CG1 VAL A 122 -6.034 -6.388 -3.332 1.00 0.00 C ATOM 1639 CG2 VAL A 122 -7.214 -5.857 -5.476 1.00 0.00 C ATOM 0 H VAL A 122 -4.487 -7.015 -7.103 1.00 0.00 H new ATOM 0 HA VAL A 122 -4.764 -4.749 -5.230 1.00 0.00 H new ATOM 0 HB VAL A 122 -5.965 -7.545 -5.118 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -6.945 -6.862 -2.967 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -5.167 -6.891 -2.903 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.028 -5.339 -3.037 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -8.110 -6.338 -5.082 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -7.239 -4.793 -5.239 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -7.178 -5.986 -6.558 1.00 0.00 H new ATOM 1649 N ILE A 123 -2.851 -5.519 -3.853 1.00 0.00 N ATOM 1650 CA ILE A 123 -1.685 -5.921 -3.075 1.00 0.00 C ATOM 1651 C ILE A 123 -1.972 -5.850 -1.579 1.00 0.00 C ATOM 1652 O ILE A 123 -2.541 -4.875 -1.091 1.00 0.00 O ATOM 1653 CB ILE A 123 -0.465 -5.039 -3.395 1.00 0.00 C ATOM 1654 CG1 ILE A 123 0.768 -5.542 -2.639 1.00 0.00 C ATOM 1655 CG2 ILE A 123 -0.752 -3.587 -3.043 1.00 0.00 C ATOM 1656 CD1 ILE A 123 2.075 -5.071 -3.233 1.00 0.00 C ATOM 0 H ILE A 123 -3.115 -4.540 -3.742 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.460 -6.951 -3.351 1.00 0.00 H new ATOM 0 HB ILE A 123 -0.263 -5.100 -4.464 1.00 0.00 H new ATOM 0 HG12 ILE A 123 0.709 -5.210 -1.602 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.756 -6.632 -2.626 1.00 0.00 H new ATOM 0 HG21 ILE A 123 0.121 -2.977 -3.275 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -1.606 -3.234 -3.622 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -0.977 -3.508 -1.979 1.00 0.00 H new ATOM 0 HD11 ILE A 123 2.904 -5.466 -2.646 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.156 -5.425 -4.261 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.108 -3.982 -3.221 1.00 0.00 H new ATOM 1668 N GLU A 124 -1.571 -6.892 -0.856 1.00 0.00 N ATOM 1669 CA GLU A 124 -1.785 -6.947 0.586 1.00 0.00 C ATOM 1670 C GLU A 124 -0.684 -7.755 1.267 1.00 0.00 C ATOM 1671 O GLU A 124 -0.143 -8.699 0.690 1.00 0.00 O ATOM 1672 CB GLU A 124 -3.151 -7.559 0.899 1.00 0.00 C ATOM 1673 CG GLU A 124 -3.307 -8.987 0.401 1.00 0.00 C ATOM 1674 CD GLU A 124 -2.854 -10.013 1.422 1.00 0.00 C ATOM 1675 OE1 GLU A 124 -3.393 -10.006 2.549 1.00 0.00 O ATOM 1676 OE2 GLU A 124 -1.962 -10.823 1.094 1.00 0.00 O ATOM 0 H GLU A 124 -1.097 -7.708 -1.244 1.00 0.00 H new ATOM 0 HA GLU A 124 -1.756 -5.928 0.972 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -3.310 -7.540 1.977 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -3.928 -6.940 0.451 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -4.352 -9.168 0.149 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -2.731 -9.113 -0.516 1.00 0.00 H new ATOM 1683 N TYR A 125 -0.358 -7.380 2.498 1.00 0.00 N ATOM 1684 CA TYR A 125 0.678 -8.068 3.259 1.00 0.00 C ATOM 1685 C TYR A 125 0.228 -9.471 3.650 1.00 0.00 C ATOM 1686 O TYR A 125 -0.967 -9.747 3.749 1.00 0.00 O ATOM 1687 CB TYR A 125 1.036 -7.267 4.513 1.00 0.00 C ATOM 1688 CG TYR A 125 2.018 -6.147 4.256 1.00 0.00 C ATOM 1689 CD1 TYR A 125 3.298 -6.413 3.786 1.00 0.00 C ATOM 1690 CD2 TYR A 125 1.668 -4.822 4.488 1.00 0.00 C ATOM 1691 CE1 TYR A 125 4.200 -5.393 3.551 1.00 0.00 C ATOM 1692 CE2 TYR A 125 2.561 -3.796 4.254 1.00 0.00 C ATOM 1693 CZ TYR A 125 3.827 -4.085 3.786 1.00 0.00 C ATOM 1694 OH TYR A 125 4.720 -3.066 3.554 1.00 0.00 O ATOM 0 H TYR A 125 -0.797 -6.602 2.991 1.00 0.00 H new ATOM 0 HA TYR A 125 1.561 -8.154 2.625 1.00 0.00 H new ATOM 0 HB2 TYR A 125 0.124 -6.849 4.939 1.00 0.00 H new ATOM 0 HB3 TYR A 125 1.455 -7.943 5.258 1.00 0.00 H new ATOM 0 HD1 TYR A 125 3.593 -7.435 3.601 1.00 0.00 H new ATOM 0 HD2 TYR A 125 0.680 -4.591 4.858 1.00 0.00 H new ATOM 0 HE1 TYR A 125 5.191 -5.618 3.186 1.00 0.00 H new ATOM 0 HE2 TYR A 125 2.271 -2.772 4.436 1.00 0.00 H new ATOM 0 HH TYR A 125 4.232 -2.255 3.299 1.00 0.00 H new ATOM 1704 N LYS A 126 1.194 -10.356 3.870 1.00 0.00 N ATOM 1705 CA LYS A 126 0.900 -11.732 4.251 1.00 0.00 C ATOM 1706 C LYS A 126 0.127 -11.779 5.566 1.00 0.00 C ATOM 1707 O LYS A 126 0.684 -12.108 6.613 1.00 0.00 O ATOM 1708 CB LYS A 126 2.197 -12.535 4.380 1.00 0.00 C ATOM 1709 CG LYS A 126 1.972 -14.023 4.588 1.00 0.00 C ATOM 1710 CD LYS A 126 1.615 -14.720 3.286 1.00 0.00 C ATOM 1711 CE LYS A 126 2.859 -15.115 2.505 1.00 0.00 C ATOM 1712 NZ LYS A 126 3.688 -16.105 3.246 1.00 0.00 N ATOM 0 H LYS A 126 2.189 -10.144 3.791 1.00 0.00 H new ATOM 0 HA LYS A 126 0.282 -12.175 3.470 1.00 0.00 H new ATOM 0 HB2 LYS A 126 2.796 -12.389 3.481 1.00 0.00 H new ATOM 0 HB3 LYS A 126 2.776 -12.143 5.216 1.00 0.00 H new ATOM 0 HG2 LYS A 126 2.872 -14.473 5.008 1.00 0.00 H new ATOM 0 HG3 LYS A 126 1.172 -14.173 5.313 1.00 0.00 H new ATOM 0 HD2 LYS A 126 1.021 -15.609 3.499 1.00 0.00 H new ATOM 0 HD3 LYS A 126 0.996 -14.061 2.677 1.00 0.00 H new ATOM 0 HE2 LYS A 126 2.566 -15.535 1.543 1.00 0.00 H new ATOM 0 HE3 LYS A 126 3.455 -14.226 2.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 4.230 -16.679 2.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 4.344 -15.604 3.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.070 -16.724 3.808 1.00 0.00 H new ATOM 1726 N GLY A 127 -1.160 -11.450 5.503 1.00 0.00 N ATOM 1727 CA GLY A 127 -1.988 -11.462 6.695 1.00 0.00 C ATOM 1728 C GLY A 127 -1.265 -10.913 7.909 1.00 0.00 C ATOM 1729 O GLY A 127 -0.557 -11.644 8.600 1.00 0.00 O ATOM 0 H GLY A 127 -1.644 -11.175 4.648 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -2.887 -10.873 6.515 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -2.311 -12.483 6.899 1.00 0.00 H new ATOM 1733 N ASN A 128 -1.441 -9.621 8.167 1.00 0.00 N ATOM 1734 CA ASN A 128 -0.798 -8.975 9.306 1.00 0.00 C ATOM 1735 C ASN A 128 -1.830 -8.554 10.346 1.00 0.00 C ATOM 1736 O ASN A 128 -1.734 -8.927 11.516 1.00 0.00 O ATOM 1737 CB ASN A 128 0.001 -7.755 8.840 1.00 0.00 C ATOM 1738 CG ASN A 128 1.366 -8.131 8.296 1.00 0.00 C ATOM 1739 OD1 ASN A 128 2.395 -7.694 8.812 1.00 0.00 O ATOM 1740 ND2 ASN A 128 1.381 -8.946 7.248 1.00 0.00 N ATOM 0 H ASN A 128 -2.023 -9.001 7.603 1.00 0.00 H new ATOM 0 HA ASN A 128 -0.119 -9.693 9.765 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -0.562 -7.228 8.069 1.00 0.00 H new ATOM 0 HB3 ASN A 128 0.123 -7.064 9.674 1.00 0.00 H new ATOM 0 HD21 ASN A 128 2.270 -9.234 6.839 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.504 -9.284 6.852 1.00 0.00 H new ATOM 1747 N CYS A 129 -2.816 -7.776 9.913 1.00 0.00 N ATOM 1748 CA CYS A 129 -3.867 -7.304 10.808 1.00 0.00 C ATOM 1749 C CYS A 129 -5.242 -7.737 10.308 1.00 0.00 C ATOM 1750 O CYS A 129 -6.088 -8.177 11.088 1.00 0.00 O ATOM 1751 CB CYS A 129 -3.812 -5.781 10.934 1.00 0.00 C ATOM 1752 SG CYS A 129 -4.728 -5.123 12.347 1.00 0.00 S ATOM 0 H CYS A 129 -2.910 -7.459 8.948 1.00 0.00 H new ATOM 0 HA CYS A 129 -3.702 -7.748 11.790 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -2.770 -5.471 11.014 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -4.207 -5.337 10.020 1.00 0.00 H new ATOM 0 HG CYS A 129 -4.618 -3.828 12.371 1.00 0.00 H new ATOM 1758 N LEU A 130 -5.458 -7.608 9.004 1.00 0.00 N ATOM 1759 CA LEU A 130 -6.731 -7.983 8.399 1.00 0.00 C ATOM 1760 C LEU A 130 -6.913 -9.499 8.408 1.00 0.00 C ATOM 1761 O LEU A 130 -5.948 -10.264 8.385 1.00 0.00 O ATOM 1762 CB LEU A 130 -6.812 -7.458 6.965 1.00 0.00 C ATOM 1763 CG LEU A 130 -6.610 -5.953 6.790 1.00 0.00 C ATOM 1764 CD1 LEU A 130 -6.311 -5.620 5.336 1.00 0.00 C ATOM 1765 CD2 LEU A 130 -7.835 -5.190 7.272 1.00 0.00 C ATOM 0 H LEU A 130 -4.768 -7.247 8.345 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.531 -7.535 8.989 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -6.063 -7.977 6.366 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -7.787 -7.724 6.556 1.00 0.00 H new ATOM 0 HG LEU A 130 -5.756 -5.648 7.395 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -6.170 -4.544 5.231 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -5.404 -6.137 5.023 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -7.145 -5.940 4.711 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -7.673 -4.120 7.140 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -8.706 -5.499 6.695 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -8.005 -5.403 8.327 1.00 0.00 H new ATOM 1777 N PRO A 131 -8.177 -9.943 8.442 1.00 0.00 N ATOM 1778 CA PRO A 131 -8.514 -11.370 8.453 1.00 0.00 C ATOM 1779 C PRO A 131 -8.208 -12.048 7.122 1.00 0.00 C ATOM 1780 O PRO A 131 -8.352 -11.459 6.049 1.00 0.00 O ATOM 1781 CB PRO A 131 -10.022 -11.376 8.721 1.00 0.00 C ATOM 1782 CG PRO A 131 -10.500 -10.055 8.225 1.00 0.00 C ATOM 1783 CD PRO A 131 -9.376 -9.087 8.472 1.00 0.00 C ATOM 0 HA PRO A 131 -7.933 -11.920 9.193 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -10.514 -12.197 8.199 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -10.235 -11.501 9.783 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -10.747 -10.103 7.165 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -11.404 -9.745 8.750 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -9.337 -8.313 7.706 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -9.485 -8.581 9.431 1.00 0.00 H new ATOM 1791 N PRO A 132 -7.776 -13.316 7.188 1.00 0.00 N ATOM 1792 CA PRO A 132 -7.441 -14.102 5.997 1.00 0.00 C ATOM 1793 C PRO A 132 -8.674 -14.462 5.174 1.00 0.00 C ATOM 1794 O PRO A 132 -9.769 -14.619 5.716 1.00 0.00 O ATOM 1795 CB PRO A 132 -6.796 -15.363 6.574 1.00 0.00 C ATOM 1796 CG PRO A 132 -7.364 -15.487 7.946 1.00 0.00 C ATOM 1797 CD PRO A 132 -7.581 -14.080 8.432 1.00 0.00 C ATOM 0 HA PRO A 132 -6.795 -13.551 5.314 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -7.029 -16.239 5.969 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -5.710 -15.275 6.602 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -8.301 -16.044 7.932 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -6.682 -16.026 8.604 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -8.450 -14.010 9.087 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -6.725 -13.714 8.998 1.00 0.00 H new ATOM 1805 N LEU A 133 -8.489 -14.592 3.866 1.00 0.00 N ATOM 1806 CA LEU A 133 -9.586 -14.934 2.968 1.00 0.00 C ATOM 1807 C LEU A 133 -9.223 -16.132 2.096 1.00 0.00 C ATOM 1808 O LEU A 133 -8.105 -16.250 1.595 1.00 0.00 O ATOM 1809 CB LEU A 133 -9.943 -13.737 2.086 1.00 0.00 C ATOM 1810 CG LEU A 133 -10.374 -12.467 2.821 1.00 0.00 C ATOM 1811 CD1 LEU A 133 -10.154 -11.243 1.945 1.00 0.00 C ATOM 1812 CD2 LEU A 133 -11.831 -12.566 3.247 1.00 0.00 C ATOM 0 H LEU A 133 -7.589 -14.466 3.403 1.00 0.00 H new ATOM 0 HA LEU A 133 -10.451 -15.199 3.577 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -9.080 -13.498 1.465 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -10.747 -14.034 1.413 1.00 0.00 H new ATOM 0 HG LEU A 133 -9.761 -12.362 3.716 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -10.466 -10.349 2.484 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -9.097 -11.163 1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -10.741 -11.339 1.031 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -12.120 -11.654 3.768 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -12.460 -12.695 2.366 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -11.958 -13.420 3.912 1.00 0.00 H new ATOM 1824 N PRO A 134 -10.190 -17.042 1.908 1.00 0.00 N ATOM 1825 CA PRO A 134 -9.997 -18.247 1.094 1.00 0.00 C ATOM 1826 C PRO A 134 -9.873 -17.927 -0.392 1.00 0.00 C ATOM 1827 O PRO A 134 -10.801 -17.396 -1.002 1.00 0.00 O ATOM 1828 CB PRO A 134 -11.264 -19.063 1.362 1.00 0.00 C ATOM 1829 CG PRO A 134 -12.289 -18.055 1.750 1.00 0.00 C ATOM 1830 CD PRO A 134 -11.547 -16.967 2.476 1.00 0.00 C ATOM 0 HA PRO A 134 -9.076 -18.770 1.350 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -11.571 -19.619 0.476 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -11.105 -19.792 2.157 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -12.800 -17.660 0.872 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -13.052 -18.500 2.389 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -12.000 -15.990 2.307 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -11.542 -17.134 3.553 1.00 0.00 H new ATOM 1838 N LEU A 135 -8.722 -18.255 -0.968 1.00 0.00 N ATOM 1839 CA LEU A 135 -8.477 -18.003 -2.384 1.00 0.00 C ATOM 1840 C LEU A 135 -9.091 -19.102 -3.246 1.00 0.00 C ATOM 1841 O LEU A 135 -9.080 -20.281 -2.893 1.00 0.00 O ATOM 1842 CB LEU A 135 -6.974 -17.909 -2.653 1.00 0.00 C ATOM 1843 CG LEU A 135 -6.174 -19.196 -2.451 1.00 0.00 C ATOM 1844 CD1 LEU A 135 -6.117 -19.998 -3.742 1.00 0.00 C ATOM 1845 CD2 LEU A 135 -4.770 -18.880 -1.956 1.00 0.00 C ATOM 0 H LEU A 135 -7.944 -18.696 -0.477 1.00 0.00 H new ATOM 0 HA LEU A 135 -8.947 -17.055 -2.646 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -6.829 -17.572 -3.680 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.556 -17.140 -2.003 1.00 0.00 H new ATOM 0 HG LEU A 135 -6.678 -19.798 -1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -5.544 -20.910 -3.579 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -7.129 -20.256 -4.055 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.638 -19.403 -4.519 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.215 -19.808 -1.818 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.258 -18.257 -2.689 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -4.830 -18.349 -1.006 1.00 0.00 H new ATOM 1857 N PRO A 136 -9.638 -18.708 -4.407 1.00 0.00 N ATOM 1858 CA PRO A 136 -10.264 -19.644 -5.344 1.00 0.00 C ATOM 1859 C PRO A 136 -9.246 -20.556 -6.021 1.00 0.00 C ATOM 1860 O PRO A 136 -9.416 -21.774 -6.056 1.00 0.00 O ATOM 1861 CB PRO A 136 -10.927 -18.725 -6.373 1.00 0.00 C ATOM 1862 CG PRO A 136 -10.136 -17.464 -6.319 1.00 0.00 C ATOM 1863 CD PRO A 136 -9.687 -17.319 -4.891 1.00 0.00 C ATOM 0 HA PRO A 136 -10.959 -20.318 -4.843 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -10.903 -19.165 -7.370 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -11.974 -18.546 -6.128 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -9.282 -17.510 -6.994 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -10.740 -16.611 -6.627 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -8.713 -16.835 -4.823 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -10.384 -16.715 -4.310 1.00 0.00 H new ATOM 1871 N SER A 137 -8.187 -19.957 -6.557 1.00 0.00 N ATOM 1872 CA SER A 137 -7.143 -20.714 -7.235 1.00 0.00 C ATOM 1873 C SER A 137 -5.953 -19.820 -7.571 1.00 0.00 C ATOM 1874 O SER A 137 -6.121 -18.658 -7.939 1.00 0.00 O ATOM 1875 CB SER A 137 -7.693 -21.351 -8.513 1.00 0.00 C ATOM 1876 OG SER A 137 -7.914 -20.374 -9.516 1.00 0.00 O ATOM 0 H SER A 137 -8.030 -18.949 -6.534 1.00 0.00 H new ATOM 0 HA SER A 137 -6.805 -21.501 -6.561 1.00 0.00 H new ATOM 0 HB2 SER A 137 -6.992 -22.101 -8.880 1.00 0.00 H new ATOM 0 HB3 SER A 137 -8.627 -21.868 -8.293 1.00 0.00 H new ATOM 0 HG SER A 137 -8.264 -20.807 -10.323 1.00 0.00 H new ATOM 1882 N GLY A 138 -4.750 -20.372 -7.442 1.00 0.00 N ATOM 1883 CA GLY A 138 -3.550 -19.611 -7.735 1.00 0.00 C ATOM 1884 C GLY A 138 -2.378 -20.019 -6.865 1.00 0.00 C ATOM 1885 O GLY A 138 -2.217 -19.546 -5.739 1.00 0.00 O ATOM 0 H GLY A 138 -4.586 -21.332 -7.140 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -3.285 -19.746 -8.784 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -3.753 -18.550 -7.592 1.00 0.00 H new ATOM 1889 N PRO A 139 -1.533 -20.922 -7.388 1.00 0.00 N ATOM 1890 CA PRO A 139 -0.356 -21.415 -6.667 1.00 0.00 C ATOM 1891 C PRO A 139 0.722 -20.346 -6.519 1.00 0.00 C ATOM 1892 O PRO A 139 1.232 -19.824 -7.509 1.00 0.00 O ATOM 1893 CB PRO A 139 0.144 -22.560 -7.549 1.00 0.00 C ATOM 1894 CG PRO A 139 -0.348 -22.231 -8.917 1.00 0.00 C ATOM 1895 CD PRO A 139 -1.663 -21.528 -8.723 1.00 0.00 C ATOM 0 HA PRO A 139 -0.598 -21.718 -5.648 1.00 0.00 H new ATOM 0 HB2 PRO A 139 1.231 -22.631 -7.526 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -0.245 -23.520 -7.209 1.00 0.00 H new ATOM 0 HG2 PRO A 139 0.362 -21.594 -9.445 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -0.472 -23.134 -9.515 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -1.833 -20.774 -9.492 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -2.501 -22.224 -8.769 1.00 0.00 H new ATOM 1903 N SER A 140 1.065 -20.027 -5.274 1.00 0.00 N ATOM 1904 CA SER A 140 2.081 -19.019 -4.996 1.00 0.00 C ATOM 1905 C SER A 140 3.421 -19.672 -4.676 1.00 0.00 C ATOM 1906 O SER A 140 4.457 -19.288 -5.220 1.00 0.00 O ATOM 1907 CB SER A 140 1.641 -18.131 -3.830 1.00 0.00 C ATOM 1908 OG SER A 140 2.192 -16.830 -3.944 1.00 0.00 O ATOM 0 H SER A 140 0.654 -20.452 -4.443 1.00 0.00 H new ATOM 0 HA SER A 140 2.201 -18.403 -5.887 1.00 0.00 H new ATOM 0 HB2 SER A 140 0.553 -18.068 -3.807 1.00 0.00 H new ATOM 0 HB3 SER A 140 1.954 -18.581 -2.888 1.00 0.00 H new ATOM 0 HG SER A 140 1.895 -16.281 -3.188 1.00 0.00 H new ATOM 1914 N SER A 141 3.393 -20.661 -3.789 1.00 0.00 N ATOM 1915 CA SER A 141 4.607 -21.367 -3.392 1.00 0.00 C ATOM 1916 C SER A 141 4.268 -22.638 -2.619 1.00 0.00 C ATOM 1917 O SER A 141 3.125 -22.844 -2.212 1.00 0.00 O ATOM 1918 CB SER A 141 5.493 -20.459 -2.538 1.00 0.00 C ATOM 1919 OG SER A 141 6.727 -21.087 -2.237 1.00 0.00 O ATOM 0 H SER A 141 2.544 -20.992 -3.331 1.00 0.00 H new ATOM 0 HA SER A 141 5.148 -21.646 -4.296 1.00 0.00 H new ATOM 0 HB2 SER A 141 5.677 -19.524 -3.067 1.00 0.00 H new ATOM 0 HB3 SER A 141 4.975 -20.206 -1.613 1.00 0.00 H new ATOM 0 HG SER A 141 7.276 -20.485 -1.692 1.00 0.00 H new ATOM 1925 N GLY A 142 5.271 -23.488 -2.422 1.00 0.00 N ATOM 1926 CA GLY A 142 5.060 -24.729 -1.700 1.00 0.00 C ATOM 1927 C GLY A 142 4.488 -25.823 -2.581 1.00 0.00 C ATOM 1928 O GLY A 142 5.145 -26.283 -3.515 1.00 0.00 O ATOM 0 H GLY A 142 6.226 -23.339 -2.749 1.00 0.00 H new ATOM 0 HA2 GLY A 142 6.007 -25.065 -1.277 1.00 0.00 H new ATOM 0 HA3 GLY A 142 4.384 -24.549 -0.864 1.00 0.00 H new TER 1932 GLY A 142