USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 956 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 85 MET CE :methyl 165:sc= -0.522 (180deg=-0.824) USER MOD Set 1.2: A 91 MET CE :methyl 179:sc= -5.33! (180deg=-5.32!) USER MOD Set 2.1: A 51 THR OG1 : rot -79:sc= 1.3 USER MOD Set 2.2: A 60 HIS :FLIP no HD1:sc= 1.04 F(o=-3!,f=2.3) USER MOD Single : A 4 SER OG : rot 30:sc= 0.807 USER MOD Single : A 6 LYS NZ :NH3+ 172:sc= 1.21 (180deg=1.16) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -1.41! C(o=-1.4!,f=-3.8!) USER MOD Single : A 10 GLN : amide:sc= -1.08 X(o=-1.1,f=-0.72) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -1.3 X(o=-1.3,f=-1.6!) USER MOD Single : A 14 ASN : amide:sc= -0.393 K(o=-0.39,f=-1.3!) USER MOD Single : A 19 MET CE :methyl -177:sc= 0 (180deg=-0.0238) USER MOD Single : A 20 LYS NZ :NH3+ -162:sc= -0.0431 (180deg=-0.334) USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= -0.177 K(o=-0.18,f=-1.2) USER MOD Single : A 31 LYS NZ :NH3+ 165:sc= 1.19 (180deg=0.592) USER MOD Single : A 33 LYS NZ :NH3+ 149:sc= -0.103 (180deg=-0.608) USER MOD Single : A 36 LYS NZ :NH3+ -145:sc= 0.184 (180deg=-1.81!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -2.35! C(o=-2.3!,f=-6.4!) USER MOD Single : A 46 LYS NZ :NH3+ -166:sc= -0.0479 (180deg=-0.284) USER MOD Single : A 47 LYS NZ :NH3+ 170:sc= 1.18 (180deg=1.01) USER MOD Single : A 49 LYS NZ :NH3+ 171:sc= 1.17 (180deg=1) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 100:sc= 0.471 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.0038 X(o=-0.0038,f=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -57:sc= -1.11! USER MOD Single : A 78 LYS NZ :NH3+ 174:sc= 1.11 (180deg=1) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -145:sc= -0.0558 (180deg=-0.354) USER MOD Single : A 89 ASN : amide:sc= -0.782 K(o=-0.78,f=-1.7!) USER MOD Single : A 90 LYS NZ :NH3+ -156:sc= 1.41 (180deg=1.22) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 158:sc= -0.0992 (180deg=-0.482) USER MOD Single : A 100 SER OG : rot 180:sc= -0.0263 USER MOD Single : A 102 THR OG1 : rot 66:sc= 1.2 USER MOD Single : A 105 ASN : amide:sc= 0.929 K(o=0.93,f=0) USER MOD Single : A 108 THR OG1 : rot 36:sc= 1.24 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN :FLIP amide:sc= 0 F(o=-0.57,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -156:sc= -0.94 (180deg=-2.62!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= -0.0242 USER MOD Single : A 121 LYS NZ :NH3+ -149:sc= 1.29 (180deg=0.828) USER MOD Single : A 124 SER OG : rot 180:sc= -0.557 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 54 N SER A 4 7.505 -10.592 9.543 1.00 0.00 N ATOM 55 CA SER A 4 6.757 -9.504 10.126 1.00 0.00 C ATOM 56 C SER A 4 7.669 -8.455 10.769 1.00 0.00 C ATOM 57 O SER A 4 8.712 -8.782 11.342 1.00 0.00 O ATOM 58 CB SER A 4 5.810 -10.097 11.157 1.00 0.00 C ATOM 59 OG SER A 4 5.182 -11.258 10.629 1.00 0.00 O ATOM 0 HA SER A 4 6.203 -8.986 9.343 1.00 0.00 H new ATOM 0 HB2 SER A 4 6.359 -10.351 12.064 1.00 0.00 H new ATOM 0 HB3 SER A 4 5.056 -9.361 11.436 1.00 0.00 H new ATOM 0 HG SER A 4 5.781 -11.690 9.985 1.00 0.00 H new ATOM 65 N GLY A 5 7.256 -7.200 10.667 1.00 0.00 N ATOM 66 CA GLY A 5 8.023 -6.092 11.194 1.00 0.00 C ATOM 67 C GLY A 5 7.474 -4.776 10.686 1.00 0.00 C ATOM 68 O GLY A 5 6.432 -4.755 10.031 1.00 0.00 O ATOM 0 H GLY A 5 6.382 -6.927 10.217 1.00 0.00 H new ATOM 0 HA2 GLY A 5 7.994 -6.108 12.284 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.068 -6.194 10.901 1.00 0.00 H new ATOM 72 N LYS A 6 8.157 -3.682 10.967 1.00 0.00 N ATOM 73 CA LYS A 6 7.702 -2.377 10.514 1.00 0.00 C ATOM 74 C LYS A 6 8.543 -1.918 9.318 1.00 0.00 C ATOM 75 O LYS A 6 9.765 -2.108 9.290 1.00 0.00 O ATOM 76 CB LYS A 6 7.812 -1.355 11.644 1.00 0.00 C ATOM 77 CG LYS A 6 6.966 -0.119 11.459 1.00 0.00 C ATOM 78 CD LYS A 6 5.526 -0.391 11.797 1.00 0.00 C ATOM 79 CE LYS A 6 5.042 0.546 12.866 1.00 0.00 C ATOM 80 NZ LYS A 6 3.582 0.407 13.111 1.00 0.00 N ATOM 0 H LYS A 6 9.024 -3.668 11.504 1.00 0.00 H new ATOM 0 HA LYS A 6 6.658 -2.457 10.211 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.529 -1.836 12.580 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.855 -1.054 11.743 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.346 0.683 12.092 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.042 0.226 10.428 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.911 -0.280 10.904 1.00 0.00 H new ATOM 0 HD3 LYS A 6 5.415 -1.422 12.134 1.00 0.00 H new ATOM 0 HE2 LYS A 6 5.585 0.352 13.791 1.00 0.00 H new ATOM 0 HE3 LYS A 6 5.265 1.573 12.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 3.315 0.970 13.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 3.057 0.747 12.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 3.352 -0.593 13.281 1.00 0.00 H new ATOM 94 N TYR A 7 7.891 -1.310 8.336 1.00 0.00 N ATOM 95 CA TYR A 7 8.561 -0.857 7.124 1.00 0.00 C ATOM 96 C TYR A 7 8.177 0.587 6.816 1.00 0.00 C ATOM 97 O TYR A 7 7.029 0.897 6.527 1.00 0.00 O ATOM 98 CB TYR A 7 8.205 -1.775 5.950 1.00 0.00 C ATOM 99 CG TYR A 7 8.625 -3.210 6.176 1.00 0.00 C ATOM 100 CD1 TYR A 7 7.906 -4.032 7.030 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.748 -3.736 5.556 1.00 0.00 C ATOM 102 CE1 TYR A 7 8.294 -5.335 7.269 1.00 0.00 C ATOM 103 CE2 TYR A 7 10.139 -5.039 5.781 1.00 0.00 C ATOM 104 CZ TYR A 7 9.411 -5.833 6.641 1.00 0.00 C ATOM 105 OH TYR A 7 9.816 -7.126 6.882 1.00 0.00 O ATOM 0 H TYR A 7 6.889 -1.118 8.356 1.00 0.00 H new ATOM 0 HA TYR A 7 9.639 -0.899 7.280 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.129 -1.739 5.781 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.683 -1.400 5.045 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.024 -3.645 7.518 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.325 -3.116 4.887 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.725 -5.958 7.943 1.00 0.00 H new ATOM 0 HE2 TYR A 7 11.012 -5.436 5.285 1.00 0.00 H new ATOM 0 HH TYR A 7 10.621 -7.320 6.358 1.00 0.00 H new ATOM 115 N GLN A 8 9.155 1.464 6.885 1.00 0.00 N ATOM 116 CA GLN A 8 8.941 2.892 6.719 1.00 0.00 C ATOM 117 C GLN A 8 9.136 3.313 5.266 1.00 0.00 C ATOM 118 O GLN A 8 10.240 3.234 4.729 1.00 0.00 O ATOM 119 CB GLN A 8 9.910 3.603 7.655 1.00 0.00 C ATOM 120 CG GLN A 8 10.073 5.094 7.456 1.00 0.00 C ATOM 121 CD GLN A 8 8.816 5.891 7.748 1.00 0.00 C ATOM 122 OE1 GLN A 8 8.560 6.262 8.891 1.00 0.00 O ATOM 123 NE2 GLN A 8 8.053 6.202 6.716 1.00 0.00 N ATOM 0 H GLN A 8 10.127 1.209 7.059 1.00 0.00 H new ATOM 0 HA GLN A 8 7.915 3.162 6.971 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.582 3.430 8.680 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.889 3.136 7.550 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.877 5.451 8.100 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.381 5.282 6.428 1.00 0.00 H new ATOM 0 HE21 GLN A 8 8.300 5.874 5.782 1.00 0.00 H new ATOM 0 HE22 GLN A 8 7.217 6.770 6.853 1.00 0.00 H new ATOM 132 N VAL A 9 8.048 3.735 4.625 1.00 0.00 N ATOM 133 CA VAL A 9 8.113 4.211 3.250 1.00 0.00 C ATOM 134 C VAL A 9 9.025 5.422 3.170 1.00 0.00 C ATOM 135 O VAL A 9 8.953 6.314 4.014 1.00 0.00 O ATOM 136 CB VAL A 9 6.731 4.619 2.700 1.00 0.00 C ATOM 137 CG1 VAL A 9 6.800 4.839 1.196 1.00 0.00 C ATOM 138 CG2 VAL A 9 5.679 3.588 3.035 1.00 0.00 C ATOM 0 H VAL A 9 7.115 3.756 5.036 1.00 0.00 H new ATOM 0 HA VAL A 9 8.495 3.385 2.650 1.00 0.00 H new ATOM 0 HB VAL A 9 6.445 5.556 3.179 1.00 0.00 H new ATOM 0 HG11 VAL A 9 5.816 5.126 0.825 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.516 5.631 0.977 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.117 3.918 0.708 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.717 3.906 2.633 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.956 2.629 2.597 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.603 3.484 4.117 1.00 0.00 H new ATOM 148 N GLN A 10 9.883 5.450 2.170 1.00 0.00 N ATOM 149 CA GLN A 10 10.751 6.591 1.962 1.00 0.00 C ATOM 150 C GLN A 10 10.501 7.208 0.607 1.00 0.00 C ATOM 151 O GLN A 10 10.211 8.392 0.486 1.00 0.00 O ATOM 152 CB GLN A 10 12.223 6.210 2.102 1.00 0.00 C ATOM 153 CG GLN A 10 12.538 4.759 1.845 1.00 0.00 C ATOM 154 CD GLN A 10 13.988 4.541 1.465 1.00 0.00 C ATOM 155 OE1 GLN A 10 14.869 5.288 1.890 1.00 0.00 O ATOM 156 NE2 GLN A 10 14.244 3.520 0.663 1.00 0.00 N ATOM 0 H GLN A 10 9.998 4.698 1.491 1.00 0.00 H new ATOM 0 HA GLN A 10 10.519 7.324 2.734 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.807 6.820 1.412 1.00 0.00 H new ATOM 0 HB3 GLN A 10 12.553 6.464 3.109 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.308 4.177 2.737 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.896 4.387 1.047 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.483 2.926 0.334 1.00 0.00 H new ATOM 0 HE22 GLN A 10 15.203 3.327 0.373 1.00 0.00 H new ATOM 165 N SER A 11 10.601 6.399 -0.410 1.00 0.00 N ATOM 166 CA SER A 11 10.349 6.870 -1.747 1.00 0.00 C ATOM 167 C SER A 11 8.926 6.581 -2.139 1.00 0.00 C ATOM 168 O SER A 11 8.335 5.619 -1.679 1.00 0.00 O ATOM 169 CB SER A 11 11.271 6.217 -2.745 1.00 0.00 C ATOM 170 OG SER A 11 11.471 7.044 -3.879 1.00 0.00 O ATOM 0 H SER A 11 10.854 5.413 -0.342 1.00 0.00 H new ATOM 0 HA SER A 11 10.529 7.945 -1.754 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.230 6.005 -2.273 1.00 0.00 H new ATOM 0 HB3 SER A 11 10.852 5.261 -3.059 1.00 0.00 H new ATOM 0 HG SER A 11 12.074 6.596 -4.508 1.00 0.00 H new ATOM 176 N GLN A 12 8.380 7.453 -2.935 1.00 0.00 N ATOM 177 CA GLN A 12 7.121 7.224 -3.614 1.00 0.00 C ATOM 178 C GLN A 12 7.136 8.019 -4.908 1.00 0.00 C ATOM 179 O GLN A 12 7.909 8.970 -5.046 1.00 0.00 O ATOM 180 CB GLN A 12 5.903 7.648 -2.790 1.00 0.00 C ATOM 181 CG GLN A 12 5.759 6.977 -1.430 1.00 0.00 C ATOM 182 CD GLN A 12 4.814 7.735 -0.527 1.00 0.00 C ATOM 183 OE1 GLN A 12 4.681 8.947 -0.642 1.00 0.00 O ATOM 184 NE2 GLN A 12 4.161 7.031 0.385 1.00 0.00 N ATOM 0 H GLN A 12 8.797 8.361 -3.140 1.00 0.00 H new ATOM 0 HA GLN A 12 7.028 6.152 -3.787 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.947 8.727 -2.640 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.005 7.444 -3.372 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.395 5.958 -1.564 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.737 6.906 -0.955 1.00 0.00 H new ATOM 0 HE21 GLN A 12 4.301 6.023 0.447 1.00 0.00 H new ATOM 0 HE22 GLN A 12 3.518 7.497 1.025 1.00 0.00 H new ATOM 193 N GLU A 13 6.309 7.640 -5.854 1.00 0.00 N ATOM 194 CA GLU A 13 6.230 8.382 -7.103 1.00 0.00 C ATOM 195 C GLU A 13 4.806 8.540 -7.557 1.00 0.00 C ATOM 196 O GLU A 13 3.917 7.795 -7.138 1.00 0.00 O ATOM 197 CB GLU A 13 7.034 7.753 -8.234 1.00 0.00 C ATOM 198 CG GLU A 13 6.376 6.575 -8.887 1.00 0.00 C ATOM 199 CD GLU A 13 7.300 5.872 -9.859 1.00 0.00 C ATOM 200 OE1 GLU A 13 7.533 6.404 -10.963 1.00 0.00 O ATOM 201 OE2 GLU A 13 7.819 4.789 -9.516 1.00 0.00 O ATOM 0 H GLU A 13 5.687 6.834 -5.791 1.00 0.00 H new ATOM 0 HA GLU A 13 6.665 9.356 -6.881 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.225 8.512 -8.992 1.00 0.00 H new ATOM 0 HB3 GLU A 13 8.003 7.441 -7.844 1.00 0.00 H new ATOM 0 HG2 GLU A 13 6.053 5.870 -8.121 1.00 0.00 H new ATOM 0 HG3 GLU A 13 5.481 6.906 -9.414 1.00 0.00 H new ATOM 208 N ASN A 14 4.624 9.510 -8.435 1.00 0.00 N ATOM 209 CA ASN A 14 3.337 9.812 -9.022 1.00 0.00 C ATOM 210 C ASN A 14 2.301 10.099 -7.950 1.00 0.00 C ATOM 211 O ASN A 14 1.119 9.792 -8.106 1.00 0.00 O ATOM 212 CB ASN A 14 2.856 8.684 -9.931 1.00 0.00 C ATOM 213 CG ASN A 14 3.576 8.653 -11.263 1.00 0.00 C ATOM 214 OD1 ASN A 14 3.978 9.691 -11.793 1.00 0.00 O ATOM 215 ND2 ASN A 14 3.734 7.465 -11.818 1.00 0.00 N ATOM 0 H ASN A 14 5.377 10.116 -8.762 1.00 0.00 H new ATOM 0 HA ASN A 14 3.464 10.707 -9.631 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.999 7.730 -9.424 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.786 8.795 -10.105 1.00 0.00 H new ATOM 0 HD21 ASN A 14 4.204 7.382 -12.719 1.00 0.00 H new ATOM 0 HD22 ASN A 14 3.386 6.631 -11.345 1.00 0.00 H new ATOM 222 N PHE A 15 2.751 10.707 -6.867 1.00 0.00 N ATOM 223 CA PHE A 15 1.868 11.065 -5.773 1.00 0.00 C ATOM 224 C PHE A 15 0.987 12.225 -6.201 1.00 0.00 C ATOM 225 O PHE A 15 -0.216 12.249 -5.935 1.00 0.00 O ATOM 226 CB PHE A 15 2.686 11.436 -4.529 1.00 0.00 C ATOM 227 CG PHE A 15 1.863 11.990 -3.396 1.00 0.00 C ATOM 228 CD1 PHE A 15 1.530 13.337 -3.360 1.00 0.00 C ATOM 229 CD2 PHE A 15 1.422 11.168 -2.372 1.00 0.00 C ATOM 230 CE1 PHE A 15 0.773 13.850 -2.329 1.00 0.00 C ATOM 231 CE2 PHE A 15 0.664 11.677 -1.335 1.00 0.00 C ATOM 232 CZ PHE A 15 0.338 13.021 -1.314 1.00 0.00 C ATOM 0 H PHE A 15 3.727 10.964 -6.722 1.00 0.00 H new ATOM 0 HA PHE A 15 1.237 10.213 -5.520 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.217 10.551 -4.179 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.441 12.171 -4.809 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.868 13.991 -4.150 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.673 10.118 -2.384 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.520 14.900 -2.315 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.327 11.026 -0.542 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.256 13.421 -0.505 1.00 0.00 H new ATOM 242 N GLU A 16 1.606 13.172 -6.891 1.00 0.00 N ATOM 243 CA GLU A 16 0.918 14.355 -7.373 1.00 0.00 C ATOM 244 C GLU A 16 -0.214 13.967 -8.290 1.00 0.00 C ATOM 245 O GLU A 16 -1.350 14.239 -7.992 1.00 0.00 O ATOM 246 CB GLU A 16 1.878 15.274 -8.122 1.00 0.00 C ATOM 247 CG GLU A 16 3.325 14.978 -7.823 1.00 0.00 C ATOM 248 CD GLU A 16 4.288 15.946 -8.477 1.00 0.00 C ATOM 249 OE1 GLU A 16 3.827 16.936 -9.084 1.00 0.00 O ATOM 250 OE2 GLU A 16 5.510 15.709 -8.396 1.00 0.00 O ATOM 0 H GLU A 16 2.597 13.140 -7.131 1.00 0.00 H new ATOM 0 HA GLU A 16 0.520 14.885 -6.508 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.706 15.175 -9.194 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.662 16.309 -7.859 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.477 15.001 -6.744 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.557 13.966 -8.156 1.00 0.00 H new ATOM 257 N PRO A 17 0.073 13.290 -9.404 1.00 0.00 N ATOM 258 CA PRO A 17 -0.948 12.976 -10.395 1.00 0.00 C ATOM 259 C PRO A 17 -2.091 12.159 -9.802 1.00 0.00 C ATOM 260 O PRO A 17 -3.230 12.248 -10.258 1.00 0.00 O ATOM 261 CB PRO A 17 -0.211 12.184 -11.459 1.00 0.00 C ATOM 262 CG PRO A 17 1.046 11.723 -10.811 1.00 0.00 C ATOM 263 CD PRO A 17 1.385 12.743 -9.765 1.00 0.00 C ATOM 0 HA PRO A 17 -1.416 13.878 -10.789 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -0.808 11.339 -11.803 1.00 0.00 H new ATOM 0 HB3 PRO A 17 0.001 12.802 -12.332 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.913 10.738 -10.364 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.850 11.635 -11.542 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.884 12.292 -8.908 1.00 0.00 H new ATOM 0 HD3 PRO A 17 2.051 13.514 -10.153 1.00 0.00 H new ATOM 271 N PHE A 18 -1.785 11.387 -8.766 1.00 0.00 N ATOM 272 CA PHE A 18 -2.798 10.601 -8.088 1.00 0.00 C ATOM 273 C PHE A 18 -3.716 11.514 -7.278 1.00 0.00 C ATOM 274 O PHE A 18 -4.934 11.463 -7.428 1.00 0.00 O ATOM 275 CB PHE A 18 -2.138 9.566 -7.174 1.00 0.00 C ATOM 276 CG PHE A 18 -3.112 8.608 -6.558 1.00 0.00 C ATOM 277 CD1 PHE A 18 -3.814 7.726 -7.356 1.00 0.00 C ATOM 278 CD2 PHE A 18 -3.334 8.592 -5.191 1.00 0.00 C ATOM 279 CE1 PHE A 18 -4.720 6.843 -6.811 1.00 0.00 C ATOM 280 CE2 PHE A 18 -4.241 7.708 -4.635 1.00 0.00 C ATOM 281 CZ PHE A 18 -4.936 6.833 -5.449 1.00 0.00 C ATOM 0 H PHE A 18 -0.845 11.291 -8.381 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.395 10.077 -8.834 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.400 9.004 -7.747 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -1.599 10.084 -6.381 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -3.650 7.729 -8.423 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.794 9.276 -4.553 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.260 6.160 -7.449 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -4.406 7.701 -3.568 1.00 0.00 H new ATOM 0 HZ PHE A 18 -5.647 6.143 -5.019 1.00 0.00 H new ATOM 291 N MET A 19 -3.123 12.370 -6.449 1.00 0.00 N ATOM 292 CA MET A 19 -3.881 13.355 -5.672 1.00 0.00 C ATOM 293 C MET A 19 -4.471 14.416 -6.580 1.00 0.00 C ATOM 294 O MET A 19 -5.539 14.943 -6.309 1.00 0.00 O ATOM 295 CB MET A 19 -2.989 14.011 -4.615 1.00 0.00 C ATOM 296 CG MET A 19 -3.014 13.303 -3.269 1.00 0.00 C ATOM 297 SD MET A 19 -2.566 11.560 -3.384 1.00 0.00 S ATOM 298 CE MET A 19 -2.833 11.029 -1.696 1.00 0.00 C ATOM 0 H MET A 19 -2.115 12.403 -6.296 1.00 0.00 H new ATOM 0 HA MET A 19 -4.695 12.832 -5.170 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.963 14.037 -4.983 1.00 0.00 H new ATOM 0 HB3 MET A 19 -3.304 15.045 -4.477 1.00 0.00 H new ATOM 0 HG2 MET A 19 -2.327 13.805 -2.587 1.00 0.00 H new ATOM 0 HG3 MET A 19 -4.011 13.389 -2.838 1.00 0.00 H new ATOM 0 HE1 MET A 19 -2.547 9.982 -1.594 1.00 0.00 H new ATOM 0 HE2 MET A 19 -2.228 11.637 -1.023 1.00 0.00 H new ATOM 0 HE3 MET A 19 -3.886 11.144 -1.441 1.00 0.00 H new ATOM 308 N LYS A 20 -3.770 14.719 -7.652 1.00 0.00 N ATOM 309 CA LYS A 20 -4.232 15.686 -8.627 1.00 0.00 C ATOM 310 C LYS A 20 -5.544 15.223 -9.208 1.00 0.00 C ATOM 311 O LYS A 20 -6.533 15.957 -9.192 1.00 0.00 O ATOM 312 CB LYS A 20 -3.205 15.821 -9.731 1.00 0.00 C ATOM 313 CG LYS A 20 -2.307 17.015 -9.566 1.00 0.00 C ATOM 314 CD LYS A 20 -0.957 16.744 -10.161 1.00 0.00 C ATOM 315 CE LYS A 20 -0.145 18.001 -10.217 1.00 0.00 C ATOM 316 NZ LYS A 20 -0.677 18.963 -11.215 1.00 0.00 N ATOM 0 H LYS A 20 -2.865 14.303 -7.873 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.371 16.653 -8.144 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.595 14.918 -9.763 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.719 15.892 -10.689 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.755 17.884 -10.048 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.203 17.256 -8.508 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.435 15.994 -9.567 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.071 16.333 -11.164 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.133 18.469 -9.233 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.887 17.755 -10.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.055 19.664 -11.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.951 18.452 -12.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.509 19.448 -10.821 1.00 0.00 H new ATOM 330 N ALA A 21 -5.561 13.950 -9.608 1.00 0.00 N ATOM 331 CA ALA A 21 -6.753 13.322 -10.144 1.00 0.00 C ATOM 332 C ALA A 21 -7.768 13.104 -9.039 1.00 0.00 C ATOM 333 O ALA A 21 -8.963 12.931 -9.277 1.00 0.00 O ATOM 334 CB ALA A 21 -6.408 12.019 -10.826 1.00 0.00 C ATOM 0 H ALA A 21 -4.749 13.334 -9.567 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.193 13.983 -10.891 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.316 11.564 -11.221 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.712 12.209 -11.643 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.947 11.343 -10.106 1.00 0.00 H new ATOM 340 N MET A 22 -7.255 13.126 -7.826 1.00 0.00 N ATOM 341 CA MET A 22 -8.057 13.032 -6.617 1.00 0.00 C ATOM 342 C MET A 22 -8.705 14.379 -6.313 1.00 0.00 C ATOM 343 O MET A 22 -9.597 14.486 -5.469 1.00 0.00 O ATOM 344 CB MET A 22 -7.168 12.564 -5.460 1.00 0.00 C ATOM 345 CG MET A 22 -7.098 11.057 -5.329 1.00 0.00 C ATOM 346 SD MET A 22 -8.707 10.303 -5.027 1.00 0.00 S ATOM 347 CE MET A 22 -8.253 8.574 -4.918 1.00 0.00 C ATOM 0 H MET A 22 -6.255 13.211 -7.647 1.00 0.00 H new ATOM 0 HA MET A 22 -8.857 12.305 -6.756 1.00 0.00 H new ATOM 0 HB2 MET A 22 -6.161 12.956 -5.603 1.00 0.00 H new ATOM 0 HB3 MET A 22 -7.545 12.985 -4.528 1.00 0.00 H new ATOM 0 HG2 MET A 22 -6.671 10.638 -6.240 1.00 0.00 H new ATOM 0 HG3 MET A 22 -6.423 10.799 -4.513 1.00 0.00 H new ATOM 0 HE1 MET A 22 -9.144 7.975 -4.733 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.792 8.259 -5.854 1.00 0.00 H new ATOM 0 HE3 MET A 22 -7.545 8.434 -4.101 1.00 0.00 H new ATOM 357 N GLY A 23 -8.245 15.401 -7.022 1.00 0.00 N ATOM 358 CA GLY A 23 -8.835 16.722 -6.923 1.00 0.00 C ATOM 359 C GLY A 23 -7.902 17.727 -6.281 1.00 0.00 C ATOM 360 O GLY A 23 -8.294 18.862 -6.004 1.00 0.00 O ATOM 0 H GLY A 23 -7.462 15.336 -7.673 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.109 17.070 -7.919 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.755 16.663 -6.342 1.00 0.00 H new ATOM 364 N LEU A 24 -6.665 17.317 -6.053 1.00 0.00 N ATOM 365 CA LEU A 24 -5.714 18.140 -5.310 1.00 0.00 C ATOM 366 C LEU A 24 -4.988 19.098 -6.237 1.00 0.00 C ATOM 367 O LEU A 24 -4.467 18.711 -7.283 1.00 0.00 O ATOM 368 CB LEU A 24 -4.711 17.269 -4.538 1.00 0.00 C ATOM 369 CG LEU A 24 -4.086 17.934 -3.313 1.00 0.00 C ATOM 370 CD1 LEU A 24 -5.160 18.237 -2.289 1.00 0.00 C ATOM 371 CD2 LEU A 24 -3.002 17.058 -2.690 1.00 0.00 C ATOM 0 H LEU A 24 -6.293 16.422 -6.369 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.278 18.727 -4.585 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.215 16.357 -4.220 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.913 16.971 -5.218 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.617 18.863 -3.637 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.708 18.711 -1.418 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.899 18.909 -2.725 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.646 17.310 -1.986 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.580 17.564 -1.821 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.436 16.107 -2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.215 16.877 -3.422 1.00 0.00 H new ATOM 383 N PRO A 25 -4.973 20.368 -5.845 1.00 0.00 N ATOM 384 CA PRO A 25 -4.255 21.415 -6.555 1.00 0.00 C ATOM 385 C PRO A 25 -2.758 21.244 -6.391 1.00 0.00 C ATOM 386 O PRO A 25 -2.297 20.827 -5.335 1.00 0.00 O ATOM 387 CB PRO A 25 -4.693 22.707 -5.871 1.00 0.00 C ATOM 388 CG PRO A 25 -5.428 22.322 -4.637 1.00 0.00 C ATOM 389 CD PRO A 25 -5.655 20.851 -4.647 1.00 0.00 C ATOM 0 HA PRO A 25 -4.467 21.401 -7.624 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -3.829 23.326 -5.627 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.330 23.295 -6.531 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -4.857 22.609 -3.754 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -6.380 22.850 -4.586 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -5.252 20.384 -3.749 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -6.719 20.617 -4.678 1.00 0.00 H new ATOM 397 N GLU A 26 -2.006 21.582 -7.439 1.00 0.00 N ATOM 398 CA GLU A 26 -0.554 21.416 -7.441 1.00 0.00 C ATOM 399 C GLU A 26 0.113 22.068 -6.238 1.00 0.00 C ATOM 400 O GLU A 26 1.156 21.608 -5.796 1.00 0.00 O ATOM 401 CB GLU A 26 0.069 21.950 -8.715 1.00 0.00 C ATOM 402 CG GLU A 26 -0.241 23.392 -8.959 1.00 0.00 C ATOM 403 CD GLU A 26 0.553 23.957 -10.113 1.00 0.00 C ATOM 404 OE1 GLU A 26 0.196 23.677 -11.274 1.00 0.00 O ATOM 405 OE2 GLU A 26 1.545 24.675 -9.870 1.00 0.00 O ATOM 0 H GLU A 26 -2.382 21.975 -8.302 1.00 0.00 H new ATOM 0 HA GLU A 26 -0.381 20.341 -7.382 1.00 0.00 H new ATOM 0 HB2 GLU A 26 1.150 21.820 -8.666 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.285 21.360 -9.561 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.306 23.504 -9.163 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -0.027 23.966 -8.057 1.00 0.00 H new ATOM 412 N ASP A 27 -0.476 23.132 -5.712 1.00 0.00 N ATOM 413 CA ASP A 27 0.075 23.764 -4.524 1.00 0.00 C ATOM 414 C ASP A 27 -0.002 22.813 -3.340 1.00 0.00 C ATOM 415 O ASP A 27 0.993 22.575 -2.660 1.00 0.00 O ATOM 416 CB ASP A 27 -0.659 25.064 -4.198 1.00 0.00 C ATOM 417 CG ASP A 27 -0.294 25.597 -2.824 1.00 0.00 C ATOM 418 OD1 ASP A 27 0.717 26.316 -2.707 1.00 0.00 O ATOM 419 OD2 ASP A 27 -1.019 25.292 -1.855 1.00 0.00 O ATOM 0 H ASP A 27 -1.320 23.569 -6.081 1.00 0.00 H new ATOM 0 HA ASP A 27 1.119 24.004 -4.725 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -0.420 25.814 -4.952 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -1.735 24.894 -4.247 1.00 0.00 H new ATOM 424 N LEU A 28 -1.172 22.217 -3.141 1.00 0.00 N ATOM 425 CA LEU A 28 -1.360 21.256 -2.065 1.00 0.00 C ATOM 426 C LEU A 28 -0.645 19.965 -2.406 1.00 0.00 C ATOM 427 O LEU A 28 -0.162 19.257 -1.528 1.00 0.00 O ATOM 428 CB LEU A 28 -2.837 20.985 -1.828 1.00 0.00 C ATOM 429 CG LEU A 28 -3.564 22.069 -1.057 1.00 0.00 C ATOM 430 CD1 LEU A 28 -5.037 21.743 -0.956 1.00 0.00 C ATOM 431 CD2 LEU A 28 -2.954 22.230 0.321 1.00 0.00 C ATOM 0 H LEU A 28 -2.002 22.383 -3.710 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.941 21.675 -1.150 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.328 20.853 -2.792 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.938 20.044 -1.287 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.459 23.013 -1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.547 22.530 -0.400 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.463 21.672 -1.957 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.165 20.792 -0.439 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.485 23.011 0.865 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.034 21.290 0.866 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.904 22.505 0.224 1.00 0.00 H new ATOM 443 N ILE A 29 -0.585 19.680 -3.692 1.00 0.00 N ATOM 444 CA ILE A 29 0.155 18.561 -4.211 1.00 0.00 C ATOM 445 C ILE A 29 1.625 18.652 -3.835 1.00 0.00 C ATOM 446 O ILE A 29 2.196 17.688 -3.355 1.00 0.00 O ATOM 447 CB ILE A 29 0.011 18.539 -5.738 1.00 0.00 C ATOM 448 CG1 ILE A 29 -1.290 17.858 -6.119 1.00 0.00 C ATOM 449 CG2 ILE A 29 1.172 17.856 -6.386 1.00 0.00 C ATOM 450 CD1 ILE A 29 -1.257 16.363 -5.983 1.00 0.00 C ATOM 0 H ILE A 29 -1.057 20.230 -4.410 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.245 17.643 -3.779 1.00 0.00 H new ATOM 0 HB ILE A 29 -0.004 19.568 -6.097 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -2.092 18.252 -5.494 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.534 18.114 -7.150 1.00 0.00 H new ATOM 0 HG21 ILE A 29 1.038 17.858 -7.468 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.092 18.384 -6.133 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.234 16.828 -6.030 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.223 15.950 -6.274 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.479 15.956 -6.629 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.045 16.096 -4.948 1.00 0.00 H new ATOM 462 N GLN A 30 2.220 19.821 -4.032 1.00 0.00 N ATOM 463 CA GLN A 30 3.623 20.031 -3.698 1.00 0.00 C ATOM 464 C GLN A 30 3.851 19.907 -2.193 1.00 0.00 C ATOM 465 O GLN A 30 4.912 19.477 -1.740 1.00 0.00 O ATOM 466 CB GLN A 30 4.083 21.418 -4.166 1.00 0.00 C ATOM 467 CG GLN A 30 4.154 21.594 -5.667 1.00 0.00 C ATOM 468 CD GLN A 30 5.022 20.562 -6.352 1.00 0.00 C ATOM 469 OE1 GLN A 30 4.542 19.516 -6.781 1.00 0.00 O ATOM 470 NE2 GLN A 30 6.310 20.847 -6.450 1.00 0.00 N ATOM 0 H GLN A 30 1.753 20.639 -4.422 1.00 0.00 H new ATOM 0 HA GLN A 30 4.204 19.263 -4.209 1.00 0.00 H new ATOM 0 HB2 GLN A 30 3.403 22.166 -3.759 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.068 21.619 -3.744 1.00 0.00 H new ATOM 0 HG2 GLN A 30 3.146 21.542 -6.080 1.00 0.00 H new ATOM 0 HG3 GLN A 30 4.539 22.589 -5.891 1.00 0.00 H new ATOM 0 HE21 GLN A 30 6.667 21.728 -6.080 1.00 0.00 H new ATOM 0 HE22 GLN A 30 6.946 20.186 -6.896 1.00 0.00 H new ATOM 479 N LYS A 31 2.841 20.288 -1.427 1.00 0.00 N ATOM 480 CA LYS A 31 2.928 20.311 0.026 1.00 0.00 C ATOM 481 C LYS A 31 2.713 18.925 0.597 1.00 0.00 C ATOM 482 O LYS A 31 3.338 18.527 1.580 1.00 0.00 O ATOM 483 CB LYS A 31 1.920 21.310 0.585 1.00 0.00 C ATOM 484 CG LYS A 31 2.421 22.726 0.416 1.00 0.00 C ATOM 485 CD LYS A 31 1.338 23.705 0.040 1.00 0.00 C ATOM 486 CE LYS A 31 0.287 23.825 1.112 1.00 0.00 C ATOM 487 NZ LYS A 31 -0.733 24.854 0.768 1.00 0.00 N ATOM 0 H LYS A 31 1.938 20.590 -1.794 1.00 0.00 H new ATOM 0 HA LYS A 31 3.927 20.631 0.321 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.964 21.194 0.074 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.744 21.105 1.641 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.888 23.052 1.346 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.195 22.740 -0.351 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.782 24.684 -0.143 1.00 0.00 H new ATOM 0 HD3 LYS A 31 0.870 23.388 -0.892 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -0.201 22.861 1.253 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.761 24.084 2.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -1.564 24.738 1.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -0.329 25.803 0.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -1.019 24.741 -0.225 1.00 0.00 H new ATOM 501 N GLY A 32 1.827 18.198 -0.045 1.00 0.00 N ATOM 502 CA GLY A 32 1.584 16.819 0.315 1.00 0.00 C ATOM 503 C GLY A 32 2.582 15.886 -0.340 1.00 0.00 C ATOM 504 O GLY A 32 2.670 14.713 0.010 1.00 0.00 O ATOM 0 H GLY A 32 1.261 18.540 -0.822 1.00 0.00 H new ATOM 0 HA2 GLY A 32 1.640 16.710 1.398 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.574 16.538 0.018 1.00 0.00 H new ATOM 508 N LYS A 33 3.352 16.419 -1.281 1.00 0.00 N ATOM 509 CA LYS A 33 4.294 15.638 -2.067 1.00 0.00 C ATOM 510 C LYS A 33 5.381 14.984 -1.198 1.00 0.00 C ATOM 511 O LYS A 33 6.055 14.042 -1.622 1.00 0.00 O ATOM 512 CB LYS A 33 4.888 16.558 -3.138 1.00 0.00 C ATOM 513 CG LYS A 33 6.383 16.567 -3.208 1.00 0.00 C ATOM 514 CD LYS A 33 6.836 17.055 -4.562 1.00 0.00 C ATOM 515 CE LYS A 33 7.662 18.319 -4.449 1.00 0.00 C ATOM 516 NZ LYS A 33 8.842 18.133 -3.565 1.00 0.00 N ATOM 0 H LYS A 33 3.339 17.411 -1.520 1.00 0.00 H new ATOM 0 HA LYS A 33 3.772 14.807 -2.541 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.496 16.259 -4.110 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.542 17.575 -2.954 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.787 17.211 -2.427 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.769 15.564 -3.026 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.423 16.278 -5.052 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.966 17.243 -5.192 1.00 0.00 H new ATOM 0 HE2 LYS A 33 7.996 18.624 -5.441 1.00 0.00 H new ATOM 0 HE3 LYS A 33 7.040 19.125 -4.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 9.619 18.744 -3.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 8.588 18.386 -2.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 9.146 17.139 -3.597 1.00 0.00 H new ATOM 530 N ASP A 34 5.513 15.454 0.035 1.00 0.00 N ATOM 531 CA ASP A 34 6.556 14.969 0.928 1.00 0.00 C ATOM 532 C ASP A 34 5.999 13.881 1.825 1.00 0.00 C ATOM 533 O ASP A 34 6.731 13.214 2.553 1.00 0.00 O ATOM 534 CB ASP A 34 7.125 16.111 1.780 1.00 0.00 C ATOM 535 CG ASP A 34 8.170 15.639 2.779 1.00 0.00 C ATOM 536 OD1 ASP A 34 9.211 15.095 2.353 1.00 0.00 O ATOM 537 OD2 ASP A 34 7.957 15.814 3.998 1.00 0.00 O ATOM 0 H ASP A 34 4.911 16.171 0.440 1.00 0.00 H new ATOM 0 HA ASP A 34 7.365 14.561 0.322 1.00 0.00 H new ATOM 0 HB2 ASP A 34 7.568 16.861 1.125 1.00 0.00 H new ATOM 0 HB3 ASP A 34 6.311 16.598 2.316 1.00 0.00 H new ATOM 542 N ILE A 35 4.705 13.662 1.716 1.00 0.00 N ATOM 543 CA ILE A 35 4.011 12.777 2.606 1.00 0.00 C ATOM 544 C ILE A 35 4.287 11.320 2.291 1.00 0.00 C ATOM 545 O ILE A 35 3.906 10.798 1.248 1.00 0.00 O ATOM 546 CB ILE A 35 2.504 13.038 2.524 1.00 0.00 C ATOM 547 CG1 ILE A 35 2.152 14.402 3.094 1.00 0.00 C ATOM 548 CG2 ILE A 35 1.724 11.982 3.226 1.00 0.00 C ATOM 549 CD1 ILE A 35 2.672 14.617 4.479 1.00 0.00 C ATOM 0 H ILE A 35 4.113 14.095 1.007 1.00 0.00 H new ATOM 0 HA ILE A 35 4.375 12.975 3.614 1.00 0.00 H new ATOM 0 HB ILE A 35 2.236 13.017 1.468 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.552 15.176 2.439 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.068 14.517 3.098 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.659 12.202 3.146 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.930 11.014 2.770 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.011 11.956 4.277 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.385 15.610 4.825 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.252 13.865 5.146 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.759 14.533 4.477 1.00 0.00 H new ATOM 561 N LYS A 36 4.979 10.703 3.216 1.00 0.00 N ATOM 562 CA LYS A 36 5.168 9.265 3.248 1.00 0.00 C ATOM 563 C LYS A 36 4.301 8.694 4.362 1.00 0.00 C ATOM 564 O LYS A 36 3.425 9.383 4.891 1.00 0.00 O ATOM 565 CB LYS A 36 6.642 8.902 3.492 1.00 0.00 C ATOM 566 CG LYS A 36 7.497 8.793 2.232 1.00 0.00 C ATOM 567 CD LYS A 36 7.896 10.153 1.673 1.00 0.00 C ATOM 568 CE LYS A 36 7.089 10.514 0.441 1.00 0.00 C ATOM 569 NZ LYS A 36 7.489 11.830 -0.121 1.00 0.00 N ATOM 0 H LYS A 36 5.438 11.191 3.985 1.00 0.00 H new ATOM 0 HA LYS A 36 4.881 8.843 2.285 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.082 9.654 4.147 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.683 7.952 4.024 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.396 8.219 2.456 1.00 0.00 H new ATOM 0 HG3 LYS A 36 6.947 8.239 1.471 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.753 10.916 2.438 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.957 10.146 1.423 1.00 0.00 H new ATOM 0 HE2 LYS A 36 7.219 9.742 -0.317 1.00 0.00 H new ATOM 0 HE3 LYS A 36 6.029 10.535 0.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 6.652 12.311 -0.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 7.908 12.415 0.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.187 11.686 -0.878 1.00 0.00 H new ATOM 583 N GLY A 37 4.536 7.448 4.719 1.00 0.00 N ATOM 584 CA GLY A 37 3.809 6.854 5.809 1.00 0.00 C ATOM 585 C GLY A 37 4.570 5.715 6.425 1.00 0.00 C ATOM 586 O GLY A 37 5.539 5.228 5.842 1.00 0.00 O ATOM 0 H GLY A 37 5.219 6.836 4.272 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.607 7.610 6.568 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.844 6.496 5.451 1.00 0.00 H new ATOM 590 N VAL A 38 4.131 5.271 7.588 1.00 0.00 N ATOM 591 CA VAL A 38 4.789 4.174 8.262 1.00 0.00 C ATOM 592 C VAL A 38 3.991 2.902 8.068 1.00 0.00 C ATOM 593 O VAL A 38 2.824 2.821 8.459 1.00 0.00 O ATOM 594 CB VAL A 38 4.958 4.445 9.766 1.00 0.00 C ATOM 595 CG1 VAL A 38 5.763 3.337 10.428 1.00 0.00 C ATOM 596 CG2 VAL A 38 5.627 5.783 9.953 1.00 0.00 C ATOM 0 H VAL A 38 3.324 5.653 8.082 1.00 0.00 H new ATOM 0 HA VAL A 38 5.782 4.066 7.825 1.00 0.00 H new ATOM 0 HB VAL A 38 3.978 4.464 10.242 1.00 0.00 H new ATOM 0 HG11 VAL A 38 5.870 3.550 11.492 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.247 2.385 10.299 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.750 3.280 9.969 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.750 5.982 11.017 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.604 5.772 9.470 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.011 6.563 9.507 1.00 0.00 H new ATOM 606 N SER A 39 4.614 1.920 7.449 1.00 0.00 N ATOM 607 CA SER A 39 3.947 0.670 7.157 1.00 0.00 C ATOM 608 C SER A 39 4.403 -0.405 8.127 1.00 0.00 C ATOM 609 O SER A 39 5.523 -0.368 8.615 1.00 0.00 O ATOM 610 CB SER A 39 4.229 0.247 5.715 1.00 0.00 C ATOM 611 OG SER A 39 3.772 1.232 4.806 1.00 0.00 O ATOM 0 H SER A 39 5.584 1.965 7.138 1.00 0.00 H new ATOM 0 HA SER A 39 2.872 0.807 7.273 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.299 0.089 5.580 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.737 -0.703 5.507 1.00 0.00 H new ATOM 0 HG SER A 39 3.963 0.944 3.889 1.00 0.00 H new ATOM 617 N GLU A 40 3.521 -1.324 8.443 1.00 0.00 N ATOM 618 CA GLU A 40 3.860 -2.445 9.299 1.00 0.00 C ATOM 619 C GLU A 40 3.352 -3.721 8.654 1.00 0.00 C ATOM 620 O GLU A 40 2.158 -3.839 8.374 1.00 0.00 O ATOM 621 CB GLU A 40 3.221 -2.274 10.669 1.00 0.00 C ATOM 622 CG GLU A 40 3.752 -3.237 11.710 1.00 0.00 C ATOM 623 CD GLU A 40 2.911 -3.218 12.967 1.00 0.00 C ATOM 624 OE1 GLU A 40 3.089 -2.286 13.782 1.00 0.00 O ATOM 625 OE2 GLU A 40 2.059 -4.113 13.134 1.00 0.00 O ATOM 0 H GLU A 40 2.554 -1.320 8.119 1.00 0.00 H new ATOM 0 HA GLU A 40 4.942 -2.493 9.424 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.386 -1.253 11.013 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.143 -2.409 10.577 1.00 0.00 H new ATOM 0 HG2 GLU A 40 3.769 -4.246 11.298 1.00 0.00 H new ATOM 0 HG3 GLU A 40 4.781 -2.976 11.956 1.00 0.00 H new ATOM 632 N ILE A 41 4.242 -4.664 8.409 1.00 0.00 N ATOM 633 CA ILE A 41 3.865 -5.884 7.721 1.00 0.00 C ATOM 634 C ILE A 41 4.059 -7.079 8.643 1.00 0.00 C ATOM 635 O ILE A 41 5.182 -7.396 9.005 1.00 0.00 O ATOM 636 CB ILE A 41 4.721 -6.102 6.449 1.00 0.00 C ATOM 637 CG1 ILE A 41 4.900 -4.806 5.650 1.00 0.00 C ATOM 638 CG2 ILE A 41 4.111 -7.177 5.571 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.610 -4.114 5.287 1.00 0.00 C ATOM 0 H ILE A 41 5.225 -4.610 8.674 1.00 0.00 H new ATOM 0 HA ILE A 41 2.818 -5.789 7.433 1.00 0.00 H new ATOM 0 HB ILE A 41 5.708 -6.428 6.777 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.516 -4.119 6.230 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.448 -5.031 4.735 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.728 -7.315 4.683 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.059 -8.114 6.126 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.107 -6.876 5.272 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.830 -3.207 4.724 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.999 -4.780 4.678 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.068 -3.854 6.196 1.00 0.00 H new ATOM 651 N VAL A 42 2.972 -7.740 9.013 1.00 0.00 N ATOM 652 CA VAL A 42 3.044 -8.940 9.837 1.00 0.00 C ATOM 653 C VAL A 42 2.393 -10.092 9.090 1.00 0.00 C ATOM 654 O VAL A 42 1.183 -10.119 8.903 1.00 0.00 O ATOM 655 CB VAL A 42 2.319 -8.742 11.188 1.00 0.00 C ATOM 656 CG1 VAL A 42 2.564 -9.923 12.106 1.00 0.00 C ATOM 657 CG2 VAL A 42 2.741 -7.444 11.857 1.00 0.00 C ATOM 0 H VAL A 42 2.024 -7.465 8.755 1.00 0.00 H new ATOM 0 HA VAL A 42 4.093 -9.154 10.040 1.00 0.00 H new ATOM 0 HB VAL A 42 1.250 -8.679 10.986 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.045 -9.763 13.051 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.190 -10.833 11.636 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.633 -10.024 12.292 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.213 -7.335 12.804 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.815 -7.462 12.040 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.497 -6.604 11.207 1.00 0.00 H new ATOM 667 N HIS A 43 3.188 -11.048 8.674 1.00 0.00 N ATOM 668 CA HIS A 43 2.694 -12.108 7.816 1.00 0.00 C ATOM 669 C HIS A 43 2.551 -13.411 8.589 1.00 0.00 C ATOM 670 O HIS A 43 3.510 -13.929 9.150 1.00 0.00 O ATOM 671 CB HIS A 43 3.595 -12.242 6.577 1.00 0.00 C ATOM 672 CG HIS A 43 3.513 -13.556 5.858 1.00 0.00 C ATOM 673 ND1 HIS A 43 4.624 -14.217 5.389 1.00 0.00 N ATOM 674 CD2 HIS A 43 2.453 -14.319 5.507 1.00 0.00 C ATOM 675 CE1 HIS A 43 4.254 -15.326 4.785 1.00 0.00 C ATOM 676 NE2 HIS A 43 2.940 -15.413 4.840 1.00 0.00 N ATOM 0 H HIS A 43 4.177 -11.118 8.912 1.00 0.00 H new ATOM 0 HA HIS A 43 1.695 -11.853 7.463 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.340 -11.447 5.876 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.629 -12.078 6.882 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.415 -14.106 5.714 1.00 0.00 H new ATOM 0 HE1 HIS A 43 4.915 -16.044 4.322 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.378 -16.170 4.450 1.00 0.00 H new ATOM 685 N GLU A 44 1.324 -13.905 8.609 1.00 0.00 N ATOM 686 CA GLU A 44 0.965 -15.118 9.318 1.00 0.00 C ATOM 687 C GLU A 44 0.358 -16.147 8.352 1.00 0.00 C ATOM 688 O GLU A 44 -0.770 -15.982 7.887 1.00 0.00 O ATOM 689 CB GLU A 44 -0.035 -14.758 10.412 1.00 0.00 C ATOM 690 CG GLU A 44 -0.642 -15.947 11.125 1.00 0.00 C ATOM 691 CD GLU A 44 0.374 -16.735 11.918 1.00 0.00 C ATOM 692 OE1 GLU A 44 0.719 -16.309 13.040 1.00 0.00 O ATOM 693 OE2 GLU A 44 0.818 -17.793 11.436 1.00 0.00 O ATOM 0 H GLU A 44 0.540 -13.467 8.126 1.00 0.00 H new ATOM 0 HA GLU A 44 1.855 -15.564 9.762 1.00 0.00 H new ATOM 0 HB2 GLU A 44 0.462 -14.125 11.147 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.838 -14.166 9.972 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.429 -15.600 11.795 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -1.112 -16.603 10.392 1.00 0.00 H new ATOM 700 N GLY A 45 1.117 -17.198 8.047 1.00 0.00 N ATOM 701 CA GLY A 45 0.637 -18.235 7.139 1.00 0.00 C ATOM 702 C GLY A 45 0.529 -17.745 5.705 1.00 0.00 C ATOM 703 O GLY A 45 1.537 -17.579 5.022 1.00 0.00 O ATOM 0 H GLY A 45 2.057 -17.352 8.411 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.313 -19.089 7.178 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.339 -18.585 7.475 1.00 0.00 H new ATOM 707 N LYS A 46 -0.695 -17.533 5.243 1.00 0.00 N ATOM 708 CA LYS A 46 -0.936 -16.898 3.950 1.00 0.00 C ATOM 709 C LYS A 46 -1.223 -15.438 4.154 1.00 0.00 C ATOM 710 O LYS A 46 -0.879 -14.596 3.334 1.00 0.00 O ATOM 711 CB LYS A 46 -2.111 -17.512 3.221 1.00 0.00 C ATOM 712 CG LYS A 46 -1.777 -18.766 2.465 1.00 0.00 C ATOM 713 CD LYS A 46 -1.302 -19.863 3.382 1.00 0.00 C ATOM 714 CE LYS A 46 -1.009 -21.147 2.625 1.00 0.00 C ATOM 715 NZ LYS A 46 -2.223 -21.681 1.948 1.00 0.00 N ATOM 0 H LYS A 46 -1.543 -17.793 5.746 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.039 -17.045 3.348 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.897 -17.734 3.943 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.516 -16.778 2.525 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.656 -19.105 1.918 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.005 -18.550 1.726 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.403 -19.536 3.904 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.060 -20.054 4.142 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.231 -20.962 1.884 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.620 -21.895 3.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.050 -22.661 1.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -3.027 -21.658 2.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.442 -21.097 1.116 1.00 0.00 H new ATOM 729 N LYS A 47 -1.846 -15.149 5.270 1.00 0.00 N ATOM 730 CA LYS A 47 -2.321 -13.820 5.542 1.00 0.00 C ATOM 731 C LYS A 47 -1.182 -12.910 5.919 1.00 0.00 C ATOM 732 O LYS A 47 -0.316 -13.262 6.709 1.00 0.00 O ATOM 733 CB LYS A 47 -3.328 -13.863 6.669 1.00 0.00 C ATOM 734 CG LYS A 47 -4.221 -15.079 6.621 1.00 0.00 C ATOM 735 CD LYS A 47 -5.407 -14.887 7.518 1.00 0.00 C ATOM 736 CE LYS A 47 -4.985 -14.731 8.970 1.00 0.00 C ATOM 737 NZ LYS A 47 -6.048 -14.107 9.795 1.00 0.00 N ATOM 0 H LYS A 47 -2.036 -15.825 6.009 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.792 -13.430 4.640 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.799 -13.846 7.622 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.945 -12.965 6.631 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.554 -15.254 5.598 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.662 -15.962 6.930 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.964 -14.005 7.203 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.079 -15.740 7.423 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.734 -15.709 9.381 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.082 -14.122 9.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -5.791 -14.173 10.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.152 -13.107 9.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.948 -14.603 9.635 1.00 0.00 H new ATOM 751 N VAL A 48 -1.181 -11.747 5.330 1.00 0.00 N ATOM 752 CA VAL A 48 -0.177 -10.764 5.608 1.00 0.00 C ATOM 753 C VAL A 48 -0.858 -9.487 6.077 1.00 0.00 C ATOM 754 O VAL A 48 -1.794 -9.007 5.438 1.00 0.00 O ATOM 755 CB VAL A 48 0.681 -10.475 4.365 1.00 0.00 C ATOM 756 CG1 VAL A 48 1.792 -9.497 4.697 1.00 0.00 C ATOM 757 CG2 VAL A 48 1.253 -11.757 3.777 1.00 0.00 C ATOM 0 H VAL A 48 -1.877 -11.456 4.644 1.00 0.00 H new ATOM 0 HA VAL A 48 0.485 -11.146 6.385 1.00 0.00 H new ATOM 0 HB VAL A 48 0.035 -10.022 3.613 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.387 -9.306 3.804 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.359 -8.562 5.052 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.429 -9.920 5.474 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.854 -11.518 2.900 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.877 -12.252 4.521 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.438 -12.420 3.488 1.00 0.00 H new ATOM 767 N LYS A 49 -0.408 -8.958 7.194 1.00 0.00 N ATOM 768 CA LYS A 49 -0.988 -7.742 7.747 1.00 0.00 C ATOM 769 C LYS A 49 -0.296 -6.516 7.171 1.00 0.00 C ATOM 770 O LYS A 49 0.927 -6.503 7.029 1.00 0.00 O ATOM 771 CB LYS A 49 -0.829 -7.697 9.256 1.00 0.00 C ATOM 772 CG LYS A 49 -1.587 -8.763 10.017 1.00 0.00 C ATOM 773 CD LYS A 49 -1.174 -8.762 11.475 1.00 0.00 C ATOM 774 CE LYS A 49 -2.016 -9.719 12.305 1.00 0.00 C ATOM 775 NZ LYS A 49 -1.941 -11.117 11.807 1.00 0.00 N ATOM 0 H LYS A 49 0.359 -9.348 7.742 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.046 -7.743 7.487 1.00 0.00 H new ATOM 0 HB2 LYS A 49 0.230 -7.786 9.496 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.155 -6.719 9.610 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.659 -8.585 9.936 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.392 -9.741 9.577 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.123 -9.041 11.555 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.268 -7.754 11.878 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.682 -9.687 13.342 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.054 -9.388 12.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.403 -11.753 12.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.423 -11.184 10.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.944 -11.393 11.697 1.00 0.00 H new ATOM 789 N LEU A 50 -1.073 -5.494 6.848 1.00 0.00 N ATOM 790 CA LEU A 50 -0.529 -4.229 6.380 1.00 0.00 C ATOM 791 C LEU A 50 -1.111 -3.085 7.191 1.00 0.00 C ATOM 792 O LEU A 50 -2.321 -2.852 7.190 1.00 0.00 O ATOM 793 CB LEU A 50 -0.829 -4.011 4.894 1.00 0.00 C ATOM 794 CG LEU A 50 0.348 -4.213 3.932 1.00 0.00 C ATOM 795 CD1 LEU A 50 0.904 -5.621 4.027 1.00 0.00 C ATOM 796 CD2 LEU A 50 -0.078 -3.899 2.507 1.00 0.00 C ATOM 0 H LEU A 50 -2.091 -5.517 6.902 1.00 0.00 H new ATOM 0 HA LEU A 50 0.553 -4.259 6.510 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.631 -4.690 4.603 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.207 -2.997 4.765 1.00 0.00 H new ATOM 0 HG LEU A 50 1.143 -3.525 4.221 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.737 -5.731 3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.252 -5.807 5.043 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.123 -6.338 3.774 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.767 -4.046 1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.893 -4.562 2.217 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.413 -2.864 2.447 1.00 0.00 H new ATOM 808 N THR A 51 -0.252 -2.402 7.917 1.00 0.00 N ATOM 809 CA THR A 51 -0.638 -1.186 8.594 1.00 0.00 C ATOM 810 C THR A 51 0.009 -0.016 7.879 1.00 0.00 C ATOM 811 O THR A 51 1.229 0.085 7.853 1.00 0.00 O ATOM 812 CB THR A 51 -0.181 -1.184 10.060 1.00 0.00 C ATOM 813 OG1 THR A 51 -0.423 -2.463 10.659 1.00 0.00 O ATOM 814 CG2 THR A 51 -0.913 -0.106 10.835 1.00 0.00 C ATOM 0 H THR A 51 0.722 -2.671 8.053 1.00 0.00 H new ATOM 0 HA THR A 51 -1.725 -1.110 8.578 1.00 0.00 H new ATOM 0 HB THR A 51 0.889 -0.978 10.089 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.369 -2.536 10.905 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.580 -0.115 11.873 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.700 0.868 10.394 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.986 -0.295 10.796 1.00 0.00 H new ATOM 822 N ILE A 52 -0.785 0.861 7.293 1.00 0.00 N ATOM 823 CA ILE A 52 -0.218 1.927 6.487 1.00 0.00 C ATOM 824 C ILE A 52 -0.753 3.283 6.913 1.00 0.00 C ATOM 825 O ILE A 52 -1.960 3.524 6.888 1.00 0.00 O ATOM 826 CB ILE A 52 -0.495 1.750 4.971 1.00 0.00 C ATOM 827 CG1 ILE A 52 -0.318 0.293 4.521 1.00 0.00 C ATOM 828 CG2 ILE A 52 0.422 2.656 4.164 1.00 0.00 C ATOM 829 CD1 ILE A 52 -1.572 -0.540 4.671 1.00 0.00 C ATOM 0 H ILE A 52 -1.803 0.859 7.357 1.00 0.00 H new ATOM 0 HA ILE A 52 0.858 1.875 6.652 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.534 2.027 4.793 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.004 0.279 3.477 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.484 -0.164 5.101 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.220 2.524 3.101 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.243 3.695 4.442 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.461 2.399 4.370 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.375 -1.558 4.335 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.875 -0.556 5.718 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.371 -0.107 4.069 1.00 0.00 H new ATOM 841 N THR A 53 0.152 4.161 7.304 1.00 0.00 N ATOM 842 CA THR A 53 -0.197 5.535 7.601 1.00 0.00 C ATOM 843 C THR A 53 -0.033 6.382 6.347 1.00 0.00 C ATOM 844 O THR A 53 0.984 6.294 5.666 1.00 0.00 O ATOM 845 CB THR A 53 0.709 6.102 8.711 1.00 0.00 C ATOM 846 OG1 THR A 53 0.799 5.161 9.790 1.00 0.00 O ATOM 847 CG2 THR A 53 0.174 7.427 9.235 1.00 0.00 C ATOM 0 H THR A 53 1.141 3.943 7.423 1.00 0.00 H new ATOM 0 HA THR A 53 -1.232 5.562 7.942 1.00 0.00 H new ATOM 0 HB THR A 53 1.698 6.275 8.287 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.377 5.524 10.493 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.834 7.802 10.017 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.130 8.149 8.420 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.826 7.280 9.644 1.00 0.00 H new ATOM 855 N TYR A 54 -1.041 7.168 6.014 1.00 0.00 N ATOM 856 CA TYR A 54 -0.921 8.100 4.909 1.00 0.00 C ATOM 857 C TYR A 54 -0.903 9.516 5.451 1.00 0.00 C ATOM 858 O TYR A 54 -1.960 10.112 5.672 1.00 0.00 O ATOM 859 CB TYR A 54 -2.091 7.931 3.934 1.00 0.00 C ATOM 860 CG TYR A 54 -2.172 6.562 3.294 1.00 0.00 C ATOM 861 CD1 TYR A 54 -2.809 5.505 3.937 1.00 0.00 C ATOM 862 CD2 TYR A 54 -1.619 6.328 2.043 1.00 0.00 C ATOM 863 CE1 TYR A 54 -2.886 4.256 3.353 1.00 0.00 C ATOM 864 CE2 TYR A 54 -1.694 5.082 1.452 1.00 0.00 C ATOM 865 CZ TYR A 54 -2.326 4.050 2.110 1.00 0.00 C ATOM 866 OH TYR A 54 -2.400 2.803 1.521 1.00 0.00 O ATOM 0 H TYR A 54 -1.944 7.180 6.488 1.00 0.00 H new ATOM 0 HA TYR A 54 0.006 7.899 4.372 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -3.023 8.127 4.464 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.007 8.682 3.149 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -3.251 5.664 4.910 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -1.122 7.133 1.523 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -3.382 3.446 3.867 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -1.259 4.917 0.477 1.00 0.00 H new ATOM 0 HH TYR A 54 -3.125 2.795 0.862 1.00 0.00 H new ATOM 876 N GLY A 55 0.300 10.055 5.633 1.00 0.00 N ATOM 877 CA GLY A 55 0.462 11.408 6.146 1.00 0.00 C ATOM 878 C GLY A 55 0.026 11.563 7.596 1.00 0.00 C ATOM 879 O GLY A 55 0.814 11.973 8.445 1.00 0.00 O ATOM 0 H GLY A 55 1.176 9.573 5.432 1.00 0.00 H new ATOM 0 HA2 GLY A 55 1.509 11.699 6.056 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.114 12.095 5.526 1.00 0.00 H new ATOM 883 N SER A 56 -1.220 11.222 7.882 1.00 0.00 N ATOM 884 CA SER A 56 -1.775 11.374 9.218 1.00 0.00 C ATOM 885 C SER A 56 -2.649 10.177 9.608 1.00 0.00 C ATOM 886 O SER A 56 -2.510 9.635 10.705 1.00 0.00 O ATOM 887 CB SER A 56 -2.588 12.665 9.286 1.00 0.00 C ATOM 888 OG SER A 56 -3.466 12.762 8.175 1.00 0.00 O ATOM 0 H SER A 56 -1.872 10.834 7.200 1.00 0.00 H new ATOM 0 HA SER A 56 -0.949 11.420 9.928 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.161 12.692 10.213 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.917 13.523 9.302 1.00 0.00 H new ATOM 0 HG SER A 56 -3.980 13.594 8.236 1.00 0.00 H new ATOM 894 N LYS A 57 -3.537 9.760 8.709 1.00 0.00 N ATOM 895 CA LYS A 57 -4.464 8.681 8.991 1.00 0.00 C ATOM 896 C LYS A 57 -3.814 7.330 8.740 1.00 0.00 C ATOM 897 O LYS A 57 -2.922 7.206 7.905 1.00 0.00 O ATOM 898 CB LYS A 57 -5.673 8.825 8.091 1.00 0.00 C ATOM 899 CG LYS A 57 -6.934 8.222 8.658 1.00 0.00 C ATOM 900 CD LYS A 57 -7.301 8.828 9.996 1.00 0.00 C ATOM 901 CE LYS A 57 -7.599 10.313 9.881 1.00 0.00 C ATOM 902 NZ LYS A 57 -8.061 10.884 11.170 1.00 0.00 N ATOM 0 H LYS A 57 -3.630 10.159 7.775 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.759 8.736 10.039 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.844 9.884 7.896 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -5.457 8.355 7.131 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.754 8.370 7.956 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.802 7.146 8.771 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.172 8.313 10.401 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -6.484 8.675 10.701 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -6.703 10.839 9.551 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -8.362 10.473 9.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -8.254 11.899 11.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.930 10.399 11.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -7.323 10.754 11.891 1.00 0.00 H new ATOM 916 N VAL A 58 -4.276 6.320 9.454 1.00 0.00 N ATOM 917 CA VAL A 58 -3.691 4.986 9.379 1.00 0.00 C ATOM 918 C VAL A 58 -4.745 3.941 9.020 1.00 0.00 C ATOM 919 O VAL A 58 -5.709 3.750 9.758 1.00 0.00 O ATOM 920 CB VAL A 58 -3.046 4.582 10.724 1.00 0.00 C ATOM 921 CG1 VAL A 58 -2.100 3.411 10.537 1.00 0.00 C ATOM 922 CG2 VAL A 58 -2.344 5.767 11.366 1.00 0.00 C ATOM 0 H VAL A 58 -5.062 6.396 10.099 1.00 0.00 H new ATOM 0 HA VAL A 58 -2.928 5.021 8.601 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.838 4.263 11.401 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.658 3.144 11.497 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -2.651 2.558 10.141 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.311 3.689 9.838 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.898 5.457 12.311 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -1.563 6.132 10.699 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.066 6.562 11.549 1.00 0.00 H new ATOM 932 N ILE A 59 -4.564 3.267 7.893 1.00 0.00 N ATOM 933 CA ILE A 59 -5.441 2.166 7.513 1.00 0.00 C ATOM 934 C ILE A 59 -4.795 0.839 7.902 1.00 0.00 C ATOM 935 O ILE A 59 -3.611 0.615 7.638 1.00 0.00 O ATOM 936 CB ILE A 59 -5.753 2.159 5.996 1.00 0.00 C ATOM 937 CG1 ILE A 59 -6.386 3.483 5.578 1.00 0.00 C ATOM 938 CG2 ILE A 59 -6.689 1.021 5.654 1.00 0.00 C ATOM 939 CD1 ILE A 59 -6.581 3.628 4.081 1.00 0.00 C ATOM 0 H ILE A 59 -3.818 3.462 7.225 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.383 2.302 8.044 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.816 2.024 5.456 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.353 3.584 6.071 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.760 4.301 5.933 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.898 1.031 4.584 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.223 0.073 5.924 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.621 1.138 6.207 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.036 4.595 3.865 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.615 3.561 3.580 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -7.233 2.832 3.720 1.00 0.00 H new ATOM 951 N HIS A 60 -5.562 -0.018 8.555 1.00 0.00 N ATOM 952 CA HIS A 60 -5.071 -1.318 8.976 1.00 0.00 C ATOM 953 C HIS A 60 -5.873 -2.417 8.300 1.00 0.00 C ATOM 954 O HIS A 60 -7.089 -2.502 8.477 1.00 0.00 O ATOM 955 CB HIS A 60 -5.180 -1.451 10.496 1.00 0.00 C ATOM 956 CG HIS A 60 -4.533 -2.684 11.042 1.00 0.00 C ATOM 957 ND1 HIS A 60 -3.230 -3.009 11.165 1.00 0.00 N flip ATOM 958 CD2 HIS A 60 -5.240 -3.744 11.564 1.00 0.00 C flip ATOM 959 CE1 HIS A 60 -3.166 -4.244 11.754 1.00 0.00 C flip ATOM 960 NE2 HIS A 60 -4.394 -4.668 11.983 1.00 0.00 N flip ATOM 0 H HIS A 60 -6.533 0.166 8.806 1.00 0.00 H new ATOM 0 HA HIS A 60 -4.024 -1.413 8.687 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -4.725 -0.577 10.961 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -6.233 -1.450 10.777 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -6.316 -3.810 11.622 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -2.260 -4.782 11.992 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -4.647 -5.558 12.411 1.00 0.00 H new ATOM 969 N ASN A 61 -5.196 -3.257 7.532 1.00 0.00 N ATOM 970 CA ASN A 61 -5.868 -4.326 6.815 1.00 0.00 C ATOM 971 C ASN A 61 -5.003 -5.573 6.779 1.00 0.00 C ATOM 972 O ASN A 61 -3.777 -5.491 6.725 1.00 0.00 O ATOM 973 CB ASN A 61 -6.220 -3.887 5.384 1.00 0.00 C ATOM 974 CG ASN A 61 -5.006 -3.466 4.567 1.00 0.00 C ATOM 975 OD1 ASN A 61 -4.613 -2.302 4.577 1.00 0.00 O ATOM 976 ND2 ASN A 61 -4.416 -4.404 3.839 1.00 0.00 N ATOM 0 H ASN A 61 -4.187 -3.219 7.391 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.792 -4.556 7.345 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -6.726 -4.707 4.874 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.925 -3.057 5.429 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -3.608 -4.169 3.262 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.770 -5.360 3.856 1.00 0.00 H new ATOM 983 N GLU A 62 -5.643 -6.724 6.836 1.00 0.00 N ATOM 984 CA GLU A 62 -4.945 -7.984 6.695 1.00 0.00 C ATOM 985 C GLU A 62 -5.549 -8.758 5.542 1.00 0.00 C ATOM 986 O GLU A 62 -6.752 -8.676 5.289 1.00 0.00 O ATOM 987 CB GLU A 62 -5.019 -8.813 7.970 1.00 0.00 C ATOM 988 CG GLU A 62 -4.007 -9.940 8.006 1.00 0.00 C ATOM 989 CD GLU A 62 -4.428 -11.073 8.919 1.00 0.00 C ATOM 990 OE1 GLU A 62 -5.503 -11.662 8.682 1.00 0.00 O ATOM 991 OE2 GLU A 62 -3.690 -11.375 9.879 1.00 0.00 O ATOM 0 H GLU A 62 -6.649 -6.812 6.980 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.893 -7.775 6.499 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.859 -8.162 8.829 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.021 -9.230 8.068 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.863 -10.326 6.997 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.045 -9.549 8.338 1.00 0.00 H new ATOM 998 N PHE A 63 -4.723 -9.493 4.836 1.00 0.00 N ATOM 999 CA PHE A 63 -5.174 -10.188 3.645 1.00 0.00 C ATOM 1000 C PHE A 63 -4.556 -11.573 3.560 1.00 0.00 C ATOM 1001 O PHE A 63 -3.423 -11.770 3.968 1.00 0.00 O ATOM 1002 CB PHE A 63 -4.846 -9.365 2.399 1.00 0.00 C ATOM 1003 CG PHE A 63 -3.413 -8.916 2.309 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -2.408 -9.770 1.876 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -3.084 -7.627 2.655 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -1.101 -9.336 1.791 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -1.778 -7.182 2.575 1.00 0.00 C ATOM 1008 CZ PHE A 63 -0.786 -8.039 2.141 1.00 0.00 C ATOM 0 H PHE A 63 -3.737 -9.628 5.061 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.256 -10.310 3.703 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.085 -9.956 1.515 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.491 -8.487 2.379 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.652 -10.786 1.602 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.857 -6.953 2.994 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.327 -10.009 1.452 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.534 -6.167 2.851 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.235 -7.694 2.076 1.00 0.00 H new ATOM 1018 N THR A 64 -5.303 -12.518 3.014 1.00 0.00 N ATOM 1019 CA THR A 64 -4.873 -13.907 2.963 1.00 0.00 C ATOM 1020 C THR A 64 -4.397 -14.264 1.552 1.00 0.00 C ATOM 1021 O THR A 64 -5.062 -13.948 0.567 1.00 0.00 O ATOM 1022 CB THR A 64 -6.032 -14.837 3.332 1.00 0.00 C ATOM 1023 OG1 THR A 64 -6.733 -14.313 4.467 1.00 0.00 O ATOM 1024 CG2 THR A 64 -5.527 -16.234 3.643 1.00 0.00 C ATOM 0 H THR A 64 -6.218 -12.347 2.596 1.00 0.00 H new ATOM 0 HA THR A 64 -4.056 -14.033 3.674 1.00 0.00 H new ATOM 0 HB THR A 64 -6.709 -14.896 2.480 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.475 -14.911 4.698 1.00 0.00 H new ATOM 0 HG21 THR A 64 -6.369 -16.876 3.902 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.017 -16.640 2.769 1.00 0.00 H new ATOM 0 HG23 THR A 64 -4.832 -16.191 4.481 1.00 0.00 H new ATOM 1032 N LEU A 65 -3.250 -14.920 1.462 1.00 0.00 N ATOM 1033 CA LEU A 65 -2.662 -15.297 0.187 1.00 0.00 C ATOM 1034 C LEU A 65 -3.469 -16.370 -0.529 1.00 0.00 C ATOM 1035 O LEU A 65 -3.659 -17.472 -0.009 1.00 0.00 O ATOM 1036 CB LEU A 65 -1.262 -15.803 0.437 1.00 0.00 C ATOM 1037 CG LEU A 65 -0.153 -14.772 0.359 1.00 0.00 C ATOM 1038 CD1 LEU A 65 0.697 -15.078 -0.841 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -0.702 -13.354 0.262 1.00 0.00 C ATOM 0 H LEU A 65 -2.701 -15.206 2.272 1.00 0.00 H new ATOM 0 HA LEU A 65 -2.654 -14.418 -0.457 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.235 -16.261 1.426 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.049 -16.591 -0.285 1.00 0.00 H new ATOM 0 HG LEU A 65 0.439 -14.825 1.273 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.501 -14.346 -0.914 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.123 -16.076 -0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.084 -15.034 -1.741 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.125 -12.646 0.208 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.317 -13.262 -0.633 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.308 -13.137 1.142 1.00 0.00 H new ATOM 1051 N GLY A 66 -3.940 -16.041 -1.724 1.00 0.00 N ATOM 1052 CA GLY A 66 -4.669 -16.998 -2.532 1.00 0.00 C ATOM 1053 C GLY A 66 -6.060 -17.204 -2.013 1.00 0.00 C ATOM 1054 O GLY A 66 -6.778 -18.100 -2.455 1.00 0.00 O ATOM 0 H GLY A 66 -3.829 -15.121 -2.151 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.712 -16.648 -3.563 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.137 -17.950 -2.540 1.00 0.00 H new ATOM 1058 N GLU A 67 -6.431 -16.379 -1.062 1.00 0.00 N ATOM 1059 CA GLU A 67 -7.710 -16.496 -0.426 1.00 0.00 C ATOM 1060 C GLU A 67 -8.418 -15.148 -0.449 1.00 0.00 C ATOM 1061 O GLU A 67 -7.778 -14.102 -0.323 1.00 0.00 O ATOM 1062 CB GLU A 67 -7.538 -17.021 1.003 1.00 0.00 C ATOM 1063 CG GLU A 67 -8.839 -17.152 1.771 1.00 0.00 C ATOM 1064 CD GLU A 67 -8.670 -17.811 3.123 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -8.233 -18.980 3.176 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -8.980 -17.162 4.143 1.00 0.00 O ATOM 0 H GLU A 67 -5.854 -15.614 -0.713 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.328 -17.211 -0.969 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.050 -17.995 0.965 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -6.872 -16.352 1.548 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.273 -16.162 1.909 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.547 -17.731 1.178 1.00 0.00 H new ATOM 1073 N GLU A 68 -9.729 -15.166 -0.634 1.00 0.00 N ATOM 1074 CA GLU A 68 -10.495 -13.935 -0.717 1.00 0.00 C ATOM 1075 C GLU A 68 -10.557 -13.272 0.651 1.00 0.00 C ATOM 1076 O GLU A 68 -11.129 -13.816 1.597 1.00 0.00 O ATOM 1077 CB GLU A 68 -11.903 -14.201 -1.230 1.00 0.00 C ATOM 1078 CG GLU A 68 -12.641 -12.937 -1.617 1.00 0.00 C ATOM 1079 CD GLU A 68 -14.026 -13.216 -2.166 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -14.931 -13.556 -1.375 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -14.217 -13.110 -3.396 1.00 0.00 O ATOM 0 H GLU A 68 -10.282 -16.018 -0.729 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.997 -13.268 -1.421 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.850 -14.863 -2.094 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.471 -14.726 -0.461 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.724 -12.288 -0.745 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.060 -12.396 -2.364 1.00 0.00 H new ATOM 1088 N CYS A 69 -9.936 -12.112 0.743 1.00 0.00 N ATOM 1089 CA CYS A 69 -9.856 -11.362 1.975 1.00 0.00 C ATOM 1090 C CYS A 69 -10.545 -10.030 1.816 1.00 0.00 C ATOM 1091 O CYS A 69 -10.520 -9.430 0.752 1.00 0.00 O ATOM 1092 CB CYS A 69 -8.405 -11.143 2.358 1.00 0.00 C ATOM 1093 SG CYS A 69 -7.250 -11.389 0.988 1.00 0.00 S ATOM 0 H CYS A 69 -9.469 -11.662 -0.045 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.352 -11.929 2.763 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.288 -10.130 2.743 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.145 -11.824 3.168 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.403 -12.584 0.501 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.149 -9.561 2.870 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.912 -8.341 2.793 1.00 0.00 C ATOM 1101 C GLU A 70 -11.083 -7.138 3.235 1.00 0.00 C ATOM 1102 O GLU A 70 -10.478 -7.134 4.307 1.00 0.00 O ATOM 1103 CB GLU A 70 -13.182 -8.479 3.618 1.00 0.00 C ATOM 1104 CG GLU A 70 -14.319 -9.109 2.852 1.00 0.00 C ATOM 1105 CD GLU A 70 -15.541 -9.365 3.705 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -15.387 -9.589 4.923 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -16.663 -9.297 3.168 1.00 0.00 O ATOM 0 H GLU A 70 -11.131 -10.000 3.791 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.191 -8.166 1.754 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.970 -9.080 4.502 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.490 -7.494 3.968 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.593 -8.459 2.021 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.980 -10.051 2.421 1.00 0.00 H new ATOM 1114 N LEU A 71 -11.085 -6.119 2.391 1.00 0.00 N ATOM 1115 CA LEU A 71 -10.251 -4.947 2.562 1.00 0.00 C ATOM 1116 C LEU A 71 -11.065 -3.785 3.106 1.00 0.00 C ATOM 1117 O LEU A 71 -12.104 -3.445 2.548 1.00 0.00 O ATOM 1118 CB LEU A 71 -9.701 -4.563 1.200 1.00 0.00 C ATOM 1119 CG LEU A 71 -8.183 -4.399 1.104 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.713 -3.268 2.002 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.478 -5.697 1.469 1.00 0.00 C ATOM 0 H LEU A 71 -11.674 -6.085 1.559 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.449 -5.170 3.266 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.009 -5.321 0.480 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.166 -3.626 0.895 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.930 -4.150 0.073 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.631 -3.165 1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.190 -2.337 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.981 -3.489 3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.399 -5.559 1.394 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.738 -5.978 2.490 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.791 -6.486 0.785 1.00 0.00 H new ATOM 1133 N GLU A 72 -10.572 -3.156 4.159 1.00 0.00 N ATOM 1134 CA GLU A 72 -11.301 -2.073 4.805 1.00 0.00 C ATOM 1135 C GLU A 72 -10.675 -0.729 4.469 1.00 0.00 C ATOM 1136 O GLU A 72 -9.460 -0.560 4.549 1.00 0.00 O ATOM 1137 CB GLU A 72 -11.314 -2.254 6.322 1.00 0.00 C ATOM 1138 CG GLU A 72 -12.268 -1.308 7.035 1.00 0.00 C ATOM 1139 CD GLU A 72 -12.330 -1.558 8.525 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -13.092 -2.453 8.945 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -11.623 -0.857 9.280 1.00 0.00 O ATOM 0 H GLU A 72 -9.672 -3.374 4.586 1.00 0.00 H new ATOM 0 HA GLU A 72 -12.325 -2.098 4.433 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.591 -3.282 6.555 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -10.306 -2.100 6.707 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.955 -0.279 6.856 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -13.266 -1.416 6.610 1.00 0.00 H new ATOM 1215 N LYS A 78 -15.829 -1.990 3.628 1.00 0.00 N ATOM 1216 CA LYS A 78 -14.896 -2.996 3.214 1.00 0.00 C ATOM 1217 C LYS A 78 -15.409 -3.780 2.013 1.00 0.00 C ATOM 1218 O LYS A 78 -16.604 -4.047 1.885 1.00 0.00 O ATOM 1219 CB LYS A 78 -14.613 -3.911 4.396 1.00 0.00 C ATOM 1220 CG LYS A 78 -14.302 -5.345 4.033 1.00 0.00 C ATOM 1221 CD LYS A 78 -15.567 -6.190 4.051 1.00 0.00 C ATOM 1222 CE LYS A 78 -16.118 -6.366 5.456 1.00 0.00 C ATOM 1223 NZ LYS A 78 -15.276 -7.277 6.277 1.00 0.00 N ATOM 0 HA LYS A 78 -13.970 -2.518 2.894 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -13.773 -3.504 4.958 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.477 -3.899 5.060 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.846 -5.384 3.044 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -13.575 -5.754 4.735 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -16.324 -5.722 3.421 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -15.355 -7.169 3.620 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -16.182 -5.394 5.944 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -17.132 -6.762 5.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -15.629 -7.289 7.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -15.317 -8.238 5.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -14.292 -6.941 6.269 1.00 0.00 H new ATOM 1237 N VAL A 79 -14.491 -4.120 1.131 1.00 0.00 N ATOM 1238 CA VAL A 79 -14.784 -4.933 -0.032 1.00 0.00 C ATOM 1239 C VAL A 79 -13.861 -6.151 -0.053 1.00 0.00 C ATOM 1240 O VAL A 79 -12.677 -6.038 0.257 1.00 0.00 O ATOM 1241 CB VAL A 79 -14.618 -4.127 -1.333 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -13.196 -3.637 -1.497 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -15.032 -4.965 -2.509 1.00 0.00 C ATOM 0 H VAL A 79 -13.513 -3.838 1.202 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.822 -5.260 0.032 1.00 0.00 H new ATOM 0 HB VAL A 79 -15.262 -3.250 -1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.111 -3.071 -2.425 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.933 -2.996 -0.656 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.519 -4.490 -1.529 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.912 -4.389 -3.426 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.409 -5.858 -2.557 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -16.076 -5.257 -2.398 1.00 0.00 H new ATOM 1253 N LYS A 80 -14.404 -7.316 -0.378 1.00 0.00 N ATOM 1254 CA LYS A 80 -13.597 -8.530 -0.444 1.00 0.00 C ATOM 1255 C LYS A 80 -12.796 -8.581 -1.731 1.00 0.00 C ATOM 1256 O LYS A 80 -13.296 -8.286 -2.816 1.00 0.00 O ATOM 1257 CB LYS A 80 -14.465 -9.772 -0.307 1.00 0.00 C ATOM 1258 CG LYS A 80 -15.528 -9.880 -1.354 1.00 0.00 C ATOM 1259 CD LYS A 80 -16.619 -10.840 -0.924 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.328 -10.351 0.330 1.00 0.00 C ATOM 1261 NZ LYS A 80 -18.136 -11.422 0.970 1.00 0.00 N ATOM 0 H LYS A 80 -15.391 -7.448 -0.599 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.899 -8.509 0.393 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -13.829 -10.656 -0.355 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.935 -9.770 0.677 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.958 -8.896 -1.543 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.087 -10.221 -2.291 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.343 -10.955 -1.731 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.188 -11.824 -0.739 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.590 -9.980 1.042 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.976 -9.512 0.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.601 -11.045 1.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.858 -11.759 0.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.515 -12.213 1.237 1.00 0.00 H new ATOM 1275 N ALA A 81 -11.547 -8.943 -1.577 1.00 0.00 N ATOM 1276 CA ALA A 81 -10.600 -8.990 -2.675 1.00 0.00 C ATOM 1277 C ALA A 81 -9.647 -10.177 -2.523 1.00 0.00 C ATOM 1278 O ALA A 81 -9.358 -10.610 -1.414 1.00 0.00 O ATOM 1279 CB ALA A 81 -9.823 -7.695 -2.684 1.00 0.00 C ATOM 0 H ALA A 81 -11.150 -9.217 -0.678 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.136 -9.116 -3.616 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.104 -7.708 -3.503 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.510 -6.859 -2.818 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.294 -7.582 -1.738 1.00 0.00 H new ATOM 1285 N VAL A 82 -9.160 -10.708 -3.636 1.00 0.00 N ATOM 1286 CA VAL A 82 -8.252 -11.849 -3.595 1.00 0.00 C ATOM 1287 C VAL A 82 -6.816 -11.421 -3.904 1.00 0.00 C ATOM 1288 O VAL A 82 -6.519 -10.959 -5.008 1.00 0.00 O ATOM 1289 CB VAL A 82 -8.680 -12.944 -4.585 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -7.771 -14.146 -4.475 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -10.089 -13.376 -4.289 1.00 0.00 C ATOM 0 H VAL A 82 -9.376 -10.370 -4.574 1.00 0.00 H new ATOM 0 HA VAL A 82 -8.296 -12.253 -2.584 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.617 -12.535 -5.593 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.091 -14.910 -5.184 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.746 -13.849 -4.699 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.819 -14.547 -3.463 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.387 -14.152 -4.994 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.144 -13.768 -3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.759 -12.522 -4.385 1.00 0.00 H new ATOM 1301 N VAL A 83 -5.933 -11.561 -2.923 1.00 0.00 N ATOM 1302 CA VAL A 83 -4.536 -11.185 -3.091 1.00 0.00 C ATOM 1303 C VAL A 83 -3.619 -12.404 -3.072 1.00 0.00 C ATOM 1304 O VAL A 83 -3.745 -13.285 -2.218 1.00 0.00 O ATOM 1305 CB VAL A 83 -4.082 -10.200 -2.001 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -4.191 -10.835 -0.644 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -2.666 -9.723 -2.264 1.00 0.00 C ATOM 0 H VAL A 83 -6.161 -11.933 -2.001 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.463 -10.700 -4.065 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.739 -9.330 -2.026 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -3.866 -10.125 0.117 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.227 -11.119 -0.457 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.559 -11.722 -0.606 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.365 -9.027 -1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.989 -10.578 -2.270 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.625 -9.221 -3.231 1.00 0.00 H new ATOM 1317 N LYS A 84 -2.742 -12.490 -4.052 1.00 0.00 N ATOM 1318 CA LYS A 84 -1.649 -13.446 -4.009 1.00 0.00 C ATOM 1319 C LYS A 84 -0.426 -12.848 -4.680 1.00 0.00 C ATOM 1320 O LYS A 84 -0.536 -11.833 -5.369 1.00 0.00 O ATOM 1321 CB LYS A 84 -2.000 -14.800 -4.606 1.00 0.00 C ATOM 1322 CG LYS A 84 -1.236 -15.910 -3.911 1.00 0.00 C ATOM 1323 CD LYS A 84 -0.503 -16.808 -4.896 1.00 0.00 C ATOM 1324 CE LYS A 84 -1.433 -17.825 -5.539 1.00 0.00 C ATOM 1325 NZ LYS A 84 -1.932 -18.824 -4.555 1.00 0.00 N ATOM 0 H LYS A 84 -2.763 -11.909 -4.890 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.433 -13.643 -2.959 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.072 -14.977 -4.513 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -1.768 -14.804 -5.671 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.518 -15.474 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -1.928 -16.510 -3.320 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -0.043 -16.196 -5.672 1.00 0.00 H new ATOM 0 HD3 LYS A 84 0.304 -17.329 -4.381 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.279 -17.308 -5.991 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -0.907 -18.340 -6.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.029 -19.750 -5.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.258 -18.901 -3.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -2.858 -18.520 -4.191 1.00 0.00 H new ATOM 1339 N MET A 85 0.736 -13.466 -4.489 1.00 0.00 N ATOM 1340 CA MET A 85 1.985 -12.849 -4.887 1.00 0.00 C ATOM 1341 C MET A 85 2.181 -13.030 -6.378 1.00 0.00 C ATOM 1342 O MET A 85 1.955 -14.109 -6.923 1.00 0.00 O ATOM 1343 CB MET A 85 3.186 -13.465 -4.143 1.00 0.00 C ATOM 1344 CG MET A 85 2.903 -13.932 -2.730 1.00 0.00 C ATOM 1345 SD MET A 85 4.350 -14.658 -1.931 1.00 0.00 S ATOM 1346 CE MET A 85 5.542 -13.328 -2.085 1.00 0.00 C ATOM 0 H MET A 85 0.833 -14.388 -4.063 1.00 0.00 H new ATOM 0 HA MET A 85 1.933 -11.790 -4.633 1.00 0.00 H new ATOM 0 HB2 MET A 85 3.554 -14.313 -4.721 1.00 0.00 H new ATOM 0 HB3 MET A 85 3.989 -12.728 -4.111 1.00 0.00 H new ATOM 0 HG2 MET A 85 2.551 -13.088 -2.137 1.00 0.00 H new ATOM 0 HG3 MET A 85 2.097 -14.666 -2.749 1.00 0.00 H new ATOM 0 HE1 MET A 85 6.383 -13.514 -1.417 1.00 0.00 H new ATOM 0 HE2 MET A 85 5.899 -13.277 -3.113 1.00 0.00 H new ATOM 0 HE3 MET A 85 5.069 -12.383 -1.818 1.00 0.00 H new ATOM 1390 N ASN A 89 8.147 -10.599 -6.552 1.00 0.00 N ATOM 1391 CA ASN A 89 8.616 -10.417 -5.173 1.00 0.00 C ATOM 1392 C ASN A 89 7.492 -10.372 -4.128 1.00 0.00 C ATOM 1393 O ASN A 89 7.691 -10.757 -2.984 1.00 0.00 O ATOM 1394 CB ASN A 89 9.455 -9.153 -5.077 1.00 0.00 C ATOM 1395 CG ASN A 89 10.920 -9.373 -5.425 1.00 0.00 C ATOM 1396 OD1 ASN A 89 11.475 -10.450 -5.204 1.00 0.00 O ATOM 1397 ND2 ASN A 89 11.555 -8.350 -5.970 1.00 0.00 N ATOM 0 HA ASN A 89 9.213 -11.298 -4.939 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.040 -8.398 -5.745 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.385 -8.755 -4.064 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.539 -8.437 -6.223 1.00 0.00 H new ATOM 0 HD22 ASN A 89 11.061 -7.474 -6.138 1.00 0.00 H new ATOM 1404 N LYS A 90 6.362 -9.787 -4.486 1.00 0.00 N ATOM 1405 CA LYS A 90 5.234 -9.632 -3.562 1.00 0.00 C ATOM 1406 C LYS A 90 3.895 -9.666 -4.311 1.00 0.00 C ATOM 1407 O LYS A 90 3.861 -9.911 -5.515 1.00 0.00 O ATOM 1408 CB LYS A 90 5.352 -8.443 -2.606 1.00 0.00 C ATOM 1409 CG LYS A 90 4.555 -8.635 -1.339 1.00 0.00 C ATOM 1410 CD LYS A 90 4.938 -7.626 -0.275 1.00 0.00 C ATOM 1411 CE LYS A 90 4.333 -7.988 1.067 1.00 0.00 C ATOM 1412 NZ LYS A 90 2.844 -8.072 1.011 1.00 0.00 N ATOM 0 H LYS A 90 6.193 -9.406 -5.417 1.00 0.00 H new ATOM 0 HA LYS A 90 5.269 -10.499 -2.903 1.00 0.00 H new ATOM 0 HB2 LYS A 90 6.401 -8.289 -2.351 1.00 0.00 H new ATOM 0 HB3 LYS A 90 5.011 -7.540 -3.112 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.492 -8.543 -1.561 1.00 0.00 H new ATOM 0 HG3 LYS A 90 4.715 -9.644 -0.958 1.00 0.00 H new ATOM 0 HD2 LYS A 90 6.024 -7.581 -0.187 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.601 -6.633 -0.573 1.00 0.00 H new ATOM 0 HE2 LYS A 90 4.737 -8.944 1.399 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.625 -7.244 1.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 2.451 -7.915 1.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.480 -7.346 0.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.562 -9.014 0.671 1.00 0.00 H new ATOM 1426 N MET A 91 2.798 -9.441 -3.589 1.00 0.00 N ATOM 1427 CA MET A 91 1.463 -9.856 -4.014 1.00 0.00 C ATOM 1428 C MET A 91 0.687 -8.676 -4.569 1.00 0.00 C ATOM 1429 O MET A 91 0.914 -7.528 -4.189 1.00 0.00 O ATOM 1430 CB MET A 91 0.624 -10.369 -2.832 1.00 0.00 C ATOM 1431 CG MET A 91 1.269 -11.426 -1.969 1.00 0.00 C ATOM 1432 SD MET A 91 2.176 -10.715 -0.574 1.00 0.00 S ATOM 1433 CE MET A 91 2.729 -12.188 0.281 1.00 0.00 C ATOM 0 H MET A 91 2.811 -8.963 -2.688 1.00 0.00 H new ATOM 0 HA MET A 91 1.617 -10.637 -4.758 1.00 0.00 H new ATOM 0 HB2 MET A 91 0.367 -9.519 -2.199 1.00 0.00 H new ATOM 0 HB3 MET A 91 -0.311 -10.769 -3.223 1.00 0.00 H new ATOM 0 HG2 MET A 91 0.502 -12.103 -1.593 1.00 0.00 H new ATOM 0 HG3 MET A 91 1.950 -12.022 -2.576 1.00 0.00 H new ATOM 0 HE1 MET A 91 3.317 -11.903 1.153 1.00 0.00 H new ATOM 0 HE2 MET A 91 1.864 -12.769 0.601 1.00 0.00 H new ATOM 0 HE3 MET A 91 3.343 -12.789 -0.390 1.00 0.00 H new ATOM 1443 N VAL A 92 -0.224 -8.982 -5.472 1.00 0.00 N ATOM 1444 CA VAL A 92 -1.096 -7.989 -6.070 1.00 0.00 C ATOM 1445 C VAL A 92 -2.536 -8.262 -5.653 1.00 0.00 C ATOM 1446 O VAL A 92 -2.970 -9.421 -5.612 1.00 0.00 O ATOM 1447 CB VAL A 92 -0.977 -8.009 -7.611 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -2.027 -7.123 -8.267 1.00 0.00 C ATOM 1449 CG2 VAL A 92 0.413 -7.576 -8.034 1.00 0.00 C ATOM 0 H VAL A 92 -0.381 -9.930 -5.813 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.795 -7.002 -5.720 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.151 -9.032 -7.944 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.912 -7.163 -9.350 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.022 -7.475 -7.995 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.900 -6.095 -7.926 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.485 -7.594 -9.121 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.604 -6.565 -7.675 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.151 -8.257 -7.610 1.00 0.00 H new ATOM 1459 N THR A 93 -3.261 -7.205 -5.315 1.00 0.00 N ATOM 1460 CA THR A 93 -4.645 -7.337 -4.898 1.00 0.00 C ATOM 1461 C THR A 93 -5.514 -6.284 -5.582 1.00 0.00 C ATOM 1462 O THR A 93 -5.093 -5.140 -5.778 1.00 0.00 O ATOM 1463 CB THR A 93 -4.784 -7.233 -3.361 1.00 0.00 C ATOM 1464 OG1 THR A 93 -6.158 -7.344 -2.977 1.00 0.00 O ATOM 1465 CG2 THR A 93 -4.208 -5.924 -2.834 1.00 0.00 C ATOM 0 H THR A 93 -2.911 -6.247 -5.322 1.00 0.00 H new ATOM 0 HA THR A 93 -4.989 -8.326 -5.200 1.00 0.00 H new ATOM 0 HB THR A 93 -4.217 -8.055 -2.924 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.231 -7.278 -2.002 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.323 -5.886 -1.751 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.150 -5.863 -3.089 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.738 -5.085 -3.285 1.00 0.00 H new ATOM 1473 N THR A 94 -6.707 -6.691 -5.982 1.00 0.00 N ATOM 1474 CA THR A 94 -7.656 -5.794 -6.615 1.00 0.00 C ATOM 1475 C THR A 94 -8.887 -5.603 -5.745 1.00 0.00 C ATOM 1476 O THR A 94 -9.566 -6.569 -5.408 1.00 0.00 O ATOM 1477 CB THR A 94 -8.080 -6.334 -7.990 1.00 0.00 C ATOM 1478 OG1 THR A 94 -7.960 -7.764 -8.013 1.00 0.00 O ATOM 1479 CG2 THR A 94 -7.235 -5.726 -9.088 1.00 0.00 C ATOM 0 H THR A 94 -7.043 -7.648 -5.877 1.00 0.00 H new ATOM 0 HA THR A 94 -7.163 -4.831 -6.745 1.00 0.00 H new ATOM 0 HB THR A 94 -9.120 -6.058 -8.163 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.233 -8.101 -8.892 1.00 0.00 H new ATOM 0 HG21 THR A 94 -7.552 -6.122 -10.053 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.356 -4.643 -9.083 1.00 0.00 H new ATOM 0 HG23 THR A 94 -6.187 -5.975 -8.920 1.00 0.00 H new ATOM 1487 N PHE A 95 -9.201 -4.358 -5.427 1.00 0.00 N ATOM 1488 CA PHE A 95 -10.304 -4.059 -4.518 1.00 0.00 C ATOM 1489 C PHE A 95 -10.885 -2.687 -4.831 1.00 0.00 C ATOM 1490 O PHE A 95 -10.166 -1.800 -5.275 1.00 0.00 O ATOM 1491 CB PHE A 95 -9.847 -4.134 -3.054 1.00 0.00 C ATOM 1492 CG PHE A 95 -8.760 -3.165 -2.679 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -7.424 -3.504 -2.828 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -9.078 -1.921 -2.161 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -6.427 -2.617 -2.471 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -8.086 -1.030 -1.801 1.00 0.00 C ATOM 1497 CZ PHE A 95 -6.758 -1.378 -1.957 1.00 0.00 C ATOM 0 H PHE A 95 -8.711 -3.537 -5.782 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.082 -4.809 -4.663 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.709 -3.958 -2.410 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.498 -5.146 -2.849 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.160 -4.472 -3.227 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.114 -1.644 -2.037 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.390 -2.892 -2.594 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.348 -0.063 -1.398 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.980 -0.683 -1.678 1.00 0.00 H new ATOM 1507 N LYS A 96 -12.190 -2.525 -4.608 1.00 0.00 N ATOM 1508 CA LYS A 96 -12.921 -1.321 -5.007 1.00 0.00 C ATOM 1509 C LYS A 96 -12.672 -0.958 -6.470 1.00 0.00 C ATOM 1510 O LYS A 96 -12.774 0.205 -6.862 1.00 0.00 O ATOM 1511 CB LYS A 96 -12.591 -0.154 -4.096 1.00 0.00 C ATOM 1512 CG LYS A 96 -13.274 -0.277 -2.753 1.00 0.00 C ATOM 1513 CD LYS A 96 -13.213 1.013 -1.987 1.00 0.00 C ATOM 1514 CE LYS A 96 -14.050 2.092 -2.654 1.00 0.00 C ATOM 1515 NZ LYS A 96 -13.998 3.386 -1.918 1.00 0.00 N ATOM 0 H LYS A 96 -12.770 -3.225 -4.146 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.983 -1.544 -4.905 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.512 -0.100 -3.951 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.895 0.777 -4.574 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.315 -0.567 -2.898 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -12.800 -1.069 -2.173 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.569 0.851 -0.969 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.178 1.346 -1.914 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.697 2.243 -3.674 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.085 1.756 -2.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.584 4.090 -2.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.359 3.251 -0.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.015 3.722 -1.876 1.00 0.00 H new ATOM 1529 N GLY A 97 -12.341 -1.965 -7.267 1.00 0.00 N ATOM 1530 CA GLY A 97 -12.112 -1.760 -8.684 1.00 0.00 C ATOM 1531 C GLY A 97 -10.715 -1.252 -8.992 1.00 0.00 C ATOM 1532 O GLY A 97 -10.375 -1.024 -10.153 1.00 0.00 O ATOM 0 H GLY A 97 -12.226 -2.929 -6.954 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.276 -2.699 -9.212 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -12.844 -1.048 -9.065 1.00 0.00 H new ATOM 1536 N ILE A 98 -9.905 -1.063 -7.958 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.554 -0.569 -8.136 1.00 0.00 C ATOM 1538 C ILE A 98 -7.554 -1.700 -7.945 1.00 0.00 C ATOM 1539 O ILE A 98 -7.794 -2.634 -7.179 1.00 0.00 O ATOM 1540 CB ILE A 98 -8.232 0.632 -7.210 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -8.073 0.223 -5.740 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -9.322 1.681 -7.330 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -6.657 -0.137 -5.348 1.00 0.00 C ATOM 0 H ILE A 98 -10.164 -1.246 -6.989 1.00 0.00 H new ATOM 0 HA ILE A 98 -8.473 -0.196 -9.157 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.276 1.039 -7.538 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.417 1.041 -5.107 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.722 -0.629 -5.539 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -9.091 2.523 -6.677 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.381 2.028 -8.362 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -10.278 1.247 -7.037 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -6.631 -0.414 -4.294 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.314 -0.977 -5.953 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -6.004 0.720 -5.514 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.449 -1.622 -8.655 1.00 0.00 N ATOM 1556 CA LYS A 99 -5.487 -2.704 -8.679 1.00 0.00 C ATOM 1557 C LYS A 99 -4.197 -2.267 -7.998 1.00 0.00 C ATOM 1558 O LYS A 99 -3.664 -1.215 -8.312 1.00 0.00 O ATOM 1559 CB LYS A 99 -5.198 -3.108 -10.132 1.00 0.00 C ATOM 1560 CG LYS A 99 -6.422 -3.108 -11.040 1.00 0.00 C ATOM 1561 CD LYS A 99 -6.664 -1.743 -11.666 1.00 0.00 C ATOM 1562 CE LYS A 99 -5.682 -1.461 -12.792 1.00 0.00 C ATOM 1563 NZ LYS A 99 -5.849 -2.409 -13.925 1.00 0.00 N ATOM 0 H LYS A 99 -6.193 -0.816 -9.226 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.899 -3.560 -8.144 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -4.454 -2.426 -10.545 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.756 -4.104 -10.138 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.290 -3.850 -11.827 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -7.300 -3.405 -10.466 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -7.683 -1.694 -12.050 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -6.574 -0.971 -10.902 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.822 -0.441 -13.149 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.663 -1.528 -12.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -5.457 -1.987 -14.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.347 -3.295 -13.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.860 -2.609 -14.064 1.00 0.00 H new ATOM 1577 N SER A 100 -3.700 -3.046 -7.051 1.00 0.00 N ATOM 1578 CA SER A 100 -2.480 -2.675 -6.361 1.00 0.00 C ATOM 1579 C SER A 100 -1.475 -3.826 -6.297 1.00 0.00 C ATOM 1580 O SER A 100 -1.826 -4.953 -5.958 1.00 0.00 O ATOM 1581 CB SER A 100 -2.814 -2.201 -4.961 1.00 0.00 C ATOM 1582 OG SER A 100 -3.773 -1.160 -4.992 1.00 0.00 O ATOM 0 H SER A 100 -4.117 -3.926 -6.747 1.00 0.00 H new ATOM 0 HA SER A 100 -2.012 -1.870 -6.928 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.197 -3.035 -4.373 1.00 0.00 H new ATOM 0 HB3 SER A 100 -1.908 -1.851 -4.466 1.00 0.00 H new ATOM 0 HG SER A 100 -3.973 -0.872 -4.077 1.00 0.00 H new ATOM 1588 N VAL A 101 -0.225 -3.515 -6.616 1.00 0.00 N ATOM 1589 CA VAL A 101 0.873 -4.474 -6.575 1.00 0.00 C ATOM 1590 C VAL A 101 1.837 -4.142 -5.428 1.00 0.00 C ATOM 1591 O VAL A 101 2.110 -2.979 -5.140 1.00 0.00 O ATOM 1592 CB VAL A 101 1.640 -4.550 -7.926 1.00 0.00 C ATOM 1593 CG1 VAL A 101 1.082 -3.560 -8.922 1.00 0.00 C ATOM 1594 CG2 VAL A 101 3.132 -4.369 -7.736 1.00 0.00 C ATOM 0 H VAL A 101 0.058 -2.581 -6.913 1.00 0.00 H new ATOM 0 HA VAL A 101 0.435 -5.456 -6.397 1.00 0.00 H new ATOM 0 HB VAL A 101 1.491 -5.550 -8.333 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.636 -3.634 -9.858 1.00 0.00 H new ATOM 0 HG12 VAL A 101 0.030 -3.781 -9.105 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.177 -2.550 -8.523 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.632 -4.429 -8.703 1.00 0.00 H new ATOM 0 HG22 VAL A 101 3.326 -3.395 -7.287 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.513 -5.153 -7.082 1.00 0.00 H new ATOM 1604 N THR A 102 2.315 -5.170 -4.761 1.00 0.00 N ATOM 1605 CA THR A 102 3.325 -5.028 -3.735 1.00 0.00 C ATOM 1606 C THR A 102 4.475 -5.905 -4.129 1.00 0.00 C ATOM 1607 O THR A 102 4.237 -7.001 -4.617 1.00 0.00 O ATOM 1608 CB THR A 102 2.857 -5.482 -2.341 1.00 0.00 C ATOM 1609 OG1 THR A 102 1.431 -5.618 -2.303 1.00 0.00 O ATOM 1610 CG2 THR A 102 3.296 -4.485 -1.278 1.00 0.00 C ATOM 0 H THR A 102 2.013 -6.132 -4.916 1.00 0.00 H new ATOM 0 HA THR A 102 3.579 -3.970 -3.663 1.00 0.00 H new ATOM 0 HB THR A 102 3.313 -6.451 -2.136 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.156 -6.346 -2.899 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.956 -4.823 -0.299 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.383 -4.409 -1.278 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.864 -3.508 -1.495 1.00 0.00 H new ATOM 1618 N GLU A 103 5.691 -5.422 -3.987 1.00 0.00 N ATOM 1619 CA GLU A 103 6.869 -6.206 -4.285 1.00 0.00 C ATOM 1620 C GLU A 103 7.853 -6.156 -3.118 1.00 0.00 C ATOM 1621 O GLU A 103 8.106 -5.090 -2.563 1.00 0.00 O ATOM 1622 CB GLU A 103 7.510 -5.669 -5.557 1.00 0.00 C ATOM 1623 CG GLU A 103 8.829 -6.294 -5.873 1.00 0.00 C ATOM 1624 CD GLU A 103 9.609 -5.556 -6.938 1.00 0.00 C ATOM 1625 OE1 GLU A 103 9.007 -5.120 -7.936 1.00 0.00 O ATOM 1626 OE2 GLU A 103 10.837 -5.389 -6.764 1.00 0.00 O ATOM 0 H GLU A 103 5.890 -4.476 -3.662 1.00 0.00 H new ATOM 0 HA GLU A 103 6.587 -7.248 -4.436 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.830 -5.833 -6.393 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.642 -4.591 -5.460 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.427 -6.340 -4.963 1.00 0.00 H new ATOM 0 HG3 GLU A 103 8.666 -7.321 -6.200 1.00 0.00 H new ATOM 1633 N PHE A 104 8.391 -7.311 -2.729 1.00 0.00 N ATOM 1634 CA PHE A 104 9.365 -7.350 -1.646 1.00 0.00 C ATOM 1635 C PHE A 104 10.779 -7.383 -2.217 1.00 0.00 C ATOM 1636 O PHE A 104 11.235 -8.414 -2.702 1.00 0.00 O ATOM 1637 CB PHE A 104 9.133 -8.579 -0.774 1.00 0.00 C ATOM 1638 CG PHE A 104 9.391 -8.327 0.681 1.00 0.00 C ATOM 1639 CD1 PHE A 104 10.669 -8.063 1.145 1.00 0.00 C ATOM 1640 CD2 PHE A 104 8.345 -8.344 1.576 1.00 0.00 C ATOM 1641 CE1 PHE A 104 10.893 -7.824 2.487 1.00 0.00 C ATOM 1642 CE2 PHE A 104 8.559 -8.106 2.920 1.00 0.00 C ATOM 1643 CZ PHE A 104 9.837 -7.846 3.376 1.00 0.00 C ATOM 0 H PHE A 104 8.172 -8.218 -3.142 1.00 0.00 H new ATOM 0 HA PHE A 104 9.246 -6.455 -1.036 1.00 0.00 H new ATOM 0 HB2 PHE A 104 8.105 -8.918 -0.901 1.00 0.00 H new ATOM 0 HB3 PHE A 104 9.779 -9.387 -1.117 1.00 0.00 H new ATOM 0 HD1 PHE A 104 11.497 -8.044 0.452 1.00 0.00 H new ATOM 0 HD2 PHE A 104 7.344 -8.546 1.223 1.00 0.00 H new ATOM 0 HE1 PHE A 104 11.893 -7.620 2.840 1.00 0.00 H new ATOM 0 HE2 PHE A 104 7.730 -8.123 3.612 1.00 0.00 H new ATOM 0 HZ PHE A 104 10.010 -7.660 4.426 1.00 0.00 H new ATOM 1653 N ASN A 105 11.485 -6.271 -2.115 1.00 0.00 N ATOM 1654 CA ASN A 105 12.782 -6.133 -2.759 1.00 0.00 C ATOM 1655 C ASN A 105 13.886 -6.045 -1.711 1.00 0.00 C ATOM 1656 O ASN A 105 14.132 -4.979 -1.152 1.00 0.00 O ATOM 1657 CB ASN A 105 12.791 -4.865 -3.617 1.00 0.00 C ATOM 1658 CG ASN A 105 13.895 -4.858 -4.655 1.00 0.00 C ATOM 1659 OD1 ASN A 105 15.045 -4.530 -4.357 1.00 0.00 O ATOM 1660 ND2 ASN A 105 13.545 -5.183 -5.890 1.00 0.00 N ATOM 0 H ASN A 105 11.183 -5.449 -1.592 1.00 0.00 H new ATOM 0 HA ASN A 105 12.960 -7.006 -3.387 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.828 -4.766 -4.118 1.00 0.00 H new ATOM 0 HB3 ASN A 105 12.904 -3.996 -2.969 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.239 -5.168 -6.637 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.582 -5.449 -6.094 1.00 0.00 H new ATOM 1667 N GLY A 106 14.555 -7.161 -1.457 1.00 0.00 N ATOM 1668 CA GLY A 106 15.615 -7.179 -0.465 1.00 0.00 C ATOM 1669 C GLY A 106 15.109 -6.880 0.933 1.00 0.00 C ATOM 1670 O GLY A 106 14.444 -7.712 1.554 1.00 0.00 O ATOM 0 H GLY A 106 14.384 -8.054 -1.919 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.098 -8.156 -0.472 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.375 -6.446 -0.737 1.00 0.00 H new ATOM 1674 N ASP A 107 15.435 -5.696 1.433 1.00 0.00 N ATOM 1675 CA ASP A 107 14.973 -5.255 2.748 1.00 0.00 C ATOM 1676 C ASP A 107 13.964 -4.131 2.584 1.00 0.00 C ATOM 1677 O ASP A 107 13.444 -3.588 3.560 1.00 0.00 O ATOM 1678 CB ASP A 107 16.134 -4.759 3.599 1.00 0.00 C ATOM 1679 CG ASP A 107 17.365 -5.642 3.527 1.00 0.00 C ATOM 1680 OD1 ASP A 107 17.362 -6.736 4.131 1.00 0.00 O ATOM 1681 OD2 ASP A 107 18.352 -5.231 2.877 1.00 0.00 O ATOM 0 H ASP A 107 16.021 -5.018 0.947 1.00 0.00 H new ATOM 0 HA ASP A 107 14.511 -6.106 3.248 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.402 -3.751 3.281 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.808 -4.689 4.637 1.00 0.00 H new ATOM 1686 N THR A 108 13.706 -3.783 1.337 1.00 0.00 N ATOM 1687 CA THR A 108 12.783 -2.725 1.004 1.00 0.00 C ATOM 1688 C THR A 108 11.527 -3.290 0.344 1.00 0.00 C ATOM 1689 O THR A 108 11.538 -4.393 -0.195 1.00 0.00 O ATOM 1690 CB THR A 108 13.442 -1.709 0.055 1.00 0.00 C ATOM 1691 OG1 THR A 108 14.332 -2.369 -0.855 1.00 0.00 O ATOM 1692 CG2 THR A 108 14.196 -0.658 0.836 1.00 0.00 C ATOM 0 H THR A 108 14.135 -4.231 0.527 1.00 0.00 H new ATOM 0 HA THR A 108 12.505 -2.223 1.931 1.00 0.00 H new ATOM 0 HB THR A 108 12.651 -1.223 -0.516 1.00 0.00 H new ATOM 0 HG1 THR A 108 13.958 -3.239 -1.105 1.00 0.00 H new ATOM 0 HG21 THR A 108 14.654 0.050 0.145 1.00 0.00 H new ATOM 0 HG22 THR A 108 13.506 -0.129 1.494 1.00 0.00 H new ATOM 0 HG23 THR A 108 14.972 -1.136 1.433 1.00 0.00 H new ATOM 1700 N ILE A 109 10.444 -2.543 0.404 1.00 0.00 N ATOM 1701 CA ILE A 109 9.196 -2.963 -0.211 1.00 0.00 C ATOM 1702 C ILE A 109 8.767 -1.962 -1.273 1.00 0.00 C ATOM 1703 O ILE A 109 8.597 -0.782 -0.987 1.00 0.00 O ATOM 1704 CB ILE A 109 8.057 -3.096 0.824 1.00 0.00 C ATOM 1705 CG1 ILE A 109 8.546 -3.841 2.066 1.00 0.00 C ATOM 1706 CG2 ILE A 109 6.864 -3.818 0.208 1.00 0.00 C ATOM 1707 CD1 ILE A 109 7.464 -4.104 3.088 1.00 0.00 C ATOM 0 H ILE A 109 10.400 -1.638 0.873 1.00 0.00 H new ATOM 0 HA ILE A 109 9.378 -3.940 -0.659 1.00 0.00 H new ATOM 0 HB ILE A 109 7.743 -2.096 1.123 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.981 -4.792 1.759 1.00 0.00 H new ATOM 0 HG13 ILE A 109 9.342 -3.262 2.535 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.069 -3.905 0.949 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.500 -3.253 -0.650 1.00 0.00 H new ATOM 0 HG23 ILE A 109 7.168 -4.813 -0.115 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.889 -4.636 3.939 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.044 -3.156 3.425 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.678 -4.710 2.638 1.00 0.00 H new ATOM 1719 N THR A 110 8.568 -2.435 -2.482 1.00 0.00 N ATOM 1720 CA THR A 110 8.142 -1.579 -3.569 1.00 0.00 C ATOM 1721 C THR A 110 6.636 -1.743 -3.783 1.00 0.00 C ATOM 1722 O THR A 110 6.156 -2.817 -4.134 1.00 0.00 O ATOM 1723 CB THR A 110 8.884 -1.930 -4.871 1.00 0.00 C ATOM 1724 OG1 THR A 110 10.294 -2.053 -4.631 1.00 0.00 O ATOM 1725 CG2 THR A 110 8.647 -0.857 -5.895 1.00 0.00 C ATOM 0 H THR A 110 8.695 -3.414 -2.740 1.00 0.00 H new ATOM 0 HA THR A 110 8.374 -0.547 -3.307 1.00 0.00 H new ATOM 0 HB THR A 110 8.503 -2.883 -5.239 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.750 -2.278 -5.469 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.174 -1.109 -6.815 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.579 -0.778 -6.099 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.016 0.096 -5.515 1.00 0.00 H new ATOM 1733 N ASN A 111 5.905 -0.677 -3.546 1.00 0.00 N ATOM 1734 CA ASN A 111 4.458 -0.677 -3.663 1.00 0.00 C ATOM 1735 C ASN A 111 4.070 -0.033 -4.979 1.00 0.00 C ATOM 1736 O ASN A 111 4.435 1.108 -5.225 1.00 0.00 O ATOM 1737 CB ASN A 111 3.837 0.143 -2.525 1.00 0.00 C ATOM 1738 CG ASN A 111 2.342 -0.083 -2.387 1.00 0.00 C ATOM 1739 OD1 ASN A 111 1.960 -1.072 -1.595 1.00 0.00 O flip ATOM 1740 ND2 ASN A 111 1.538 0.632 -2.982 1.00 0.00 N flip ATOM 0 H ASN A 111 6.297 0.222 -3.265 1.00 0.00 H new ATOM 0 HA ASN A 111 4.098 -1.705 -3.614 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.327 -0.116 -1.587 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.025 1.202 -2.701 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.873 1.385 -3.584 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.536 0.473 -2.874 1.00 0.00 H new ATOM 1747 N THR A 112 3.369 -0.746 -5.835 1.00 0.00 N ATOM 1748 CA THR A 112 2.908 -0.147 -7.067 1.00 0.00 C ATOM 1749 C THR A 112 1.383 -0.146 -7.080 1.00 0.00 C ATOM 1750 O THR A 112 0.762 -1.194 -7.094 1.00 0.00 O ATOM 1751 CB THR A 112 3.430 -0.914 -8.294 1.00 0.00 C ATOM 1752 OG1 THR A 112 4.823 -1.210 -8.129 1.00 0.00 O ATOM 1753 CG2 THR A 112 3.232 -0.103 -9.561 1.00 0.00 C ATOM 0 H THR A 112 3.110 -1.724 -5.704 1.00 0.00 H new ATOM 0 HA THR A 112 3.290 0.873 -7.119 1.00 0.00 H new ATOM 0 HB THR A 112 2.866 -1.843 -8.381 1.00 0.00 H new ATOM 0 HG1 THR A 112 5.148 -1.700 -8.913 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.609 -0.665 -10.415 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.170 0.101 -9.700 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.775 0.839 -9.479 1.00 0.00 H new ATOM 1761 N MET A 113 0.779 1.013 -7.062 1.00 0.00 N ATOM 1762 CA MET A 113 -0.663 1.096 -7.092 1.00 0.00 C ATOM 1763 C MET A 113 -1.120 1.467 -8.477 1.00 0.00 C ATOM 1764 O MET A 113 -0.504 2.290 -9.141 1.00 0.00 O ATOM 1765 CB MET A 113 -1.192 2.138 -6.120 1.00 0.00 C ATOM 1766 CG MET A 113 -2.705 2.114 -6.032 1.00 0.00 C ATOM 1767 SD MET A 113 -3.375 3.493 -5.082 1.00 0.00 S ATOM 1768 CE MET A 113 -5.131 3.184 -5.253 1.00 0.00 C ATOM 0 H MET A 113 1.259 1.912 -7.027 1.00 0.00 H new ATOM 0 HA MET A 113 -1.050 0.119 -6.802 1.00 0.00 H new ATOM 0 HB2 MET A 113 -0.768 1.960 -5.132 1.00 0.00 H new ATOM 0 HB3 MET A 113 -0.863 3.128 -6.435 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.123 2.136 -7.039 1.00 0.00 H new ATOM 0 HG3 MET A 113 -3.022 1.177 -5.575 1.00 0.00 H new ATOM 0 HE1 MET A 113 -5.680 4.116 -5.114 1.00 0.00 H new ATOM 0 HE2 MET A 113 -5.335 2.787 -6.247 1.00 0.00 H new ATOM 0 HE3 MET A 113 -5.448 2.461 -4.502 1.00 0.00 H new ATOM 1778 N THR A 114 -2.182 0.850 -8.921 1.00 0.00 N ATOM 1779 CA THR A 114 -2.706 1.157 -10.228 1.00 0.00 C ATOM 1780 C THR A 114 -4.190 1.527 -10.171 1.00 0.00 C ATOM 1781 O THR A 114 -5.044 0.687 -9.870 1.00 0.00 O ATOM 1782 CB THR A 114 -2.530 -0.039 -11.164 1.00 0.00 C ATOM 1783 OG1 THR A 114 -1.357 -0.792 -10.811 1.00 0.00 O ATOM 1784 CG2 THR A 114 -2.403 0.439 -12.589 1.00 0.00 C ATOM 0 H THR A 114 -2.698 0.138 -8.404 1.00 0.00 H new ATOM 0 HA THR A 114 -2.148 2.014 -10.605 1.00 0.00 H new ATOM 0 HB THR A 114 -3.406 -0.681 -11.067 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.262 -1.554 -11.420 1.00 0.00 H new ATOM 0 HG21 THR A 114 -2.278 -0.418 -13.251 1.00 0.00 H new ATOM 0 HG22 THR A 114 -3.302 0.986 -12.871 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.537 1.095 -12.677 1.00 0.00 H new ATOM 1792 N LEU A 115 -4.503 2.778 -10.467 1.00 0.00 N ATOM 1793 CA LEU A 115 -5.891 3.188 -10.610 1.00 0.00 C ATOM 1794 C LEU A 115 -6.139 3.554 -12.060 1.00 0.00 C ATOM 1795 O LEU A 115 -5.723 4.610 -12.507 1.00 0.00 O ATOM 1796 CB LEU A 115 -6.202 4.392 -9.721 1.00 0.00 C ATOM 1797 CG LEU A 115 -7.600 4.394 -9.092 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -7.991 5.797 -8.688 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -8.627 3.819 -10.043 1.00 0.00 C ATOM 0 H LEU A 115 -3.821 3.522 -10.612 1.00 0.00 H new ATOM 0 HA LEU A 115 -6.538 2.365 -10.305 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -5.461 4.435 -8.922 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.086 5.300 -10.313 1.00 0.00 H new ATOM 0 HG LEU A 115 -7.571 3.764 -8.203 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -8.986 5.784 -8.243 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.274 6.180 -7.962 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -7.996 6.441 -9.567 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -9.609 3.833 -9.570 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.654 4.417 -10.954 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.358 2.792 -10.291 1.00 0.00 H new ATOM 1811 N GLY A 116 -6.855 2.693 -12.769 1.00 0.00 N ATOM 1812 CA GLY A 116 -7.135 2.920 -14.176 1.00 0.00 C ATOM 1813 C GLY A 116 -5.899 3.294 -14.988 1.00 0.00 C ATOM 1814 O GLY A 116 -5.179 2.420 -15.472 1.00 0.00 O ATOM 0 H GLY A 116 -7.251 1.832 -12.392 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.580 2.020 -14.600 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.875 3.715 -14.268 1.00 0.00 H new ATOM 1818 N ASP A 117 -5.659 4.593 -15.143 1.00 0.00 N ATOM 1819 CA ASP A 117 -4.514 5.082 -15.903 1.00 0.00 C ATOM 1820 C ASP A 117 -3.410 5.613 -14.997 1.00 0.00 C ATOM 1821 O ASP A 117 -2.244 5.660 -15.396 1.00 0.00 O ATOM 1822 CB ASP A 117 -4.936 6.172 -16.883 1.00 0.00 C ATOM 1823 CG ASP A 117 -5.706 5.622 -18.060 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -5.113 4.865 -18.860 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -6.904 5.941 -18.197 1.00 0.00 O ATOM 0 H ASP A 117 -6.246 5.329 -14.750 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.119 4.230 -16.457 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.550 6.907 -16.362 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.050 6.695 -17.244 1.00 0.00 H new ATOM 1830 N ILE A 118 -3.761 6.018 -13.784 1.00 0.00 N ATOM 1831 CA ILE A 118 -2.766 6.544 -12.859 1.00 0.00 C ATOM 1832 C ILE A 118 -2.048 5.417 -12.137 1.00 0.00 C ATOM 1833 O ILE A 118 -2.675 4.525 -11.566 1.00 0.00 O ATOM 1834 CB ILE A 118 -3.357 7.510 -11.824 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -4.598 6.919 -11.213 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -3.684 8.818 -12.470 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -5.278 7.816 -10.247 1.00 0.00 C ATOM 0 H ILE A 118 -4.714 5.993 -13.421 1.00 0.00 H new ATOM 0 HA ILE A 118 -2.059 7.106 -13.470 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.619 7.675 -11.039 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -5.297 6.663 -12.009 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -4.335 5.990 -10.708 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.103 9.496 -11.727 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -2.777 9.254 -12.889 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.411 8.659 -13.266 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.163 7.319 -9.850 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -4.597 8.053 -9.429 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -5.574 8.736 -10.751 1.00 0.00 H new ATOM 1849 N VAL A 119 -0.733 5.445 -12.177 1.00 0.00 N ATOM 1850 CA VAL A 119 0.053 4.475 -11.450 1.00 0.00 C ATOM 1851 C VAL A 119 0.757 5.186 -10.294 1.00 0.00 C ATOM 1852 O VAL A 119 1.171 6.333 -10.422 1.00 0.00 O ATOM 1853 CB VAL A 119 1.070 3.750 -12.367 1.00 0.00 C ATOM 1854 CG1 VAL A 119 2.316 4.580 -12.582 1.00 0.00 C ATOM 1855 CG2 VAL A 119 1.410 2.375 -11.814 1.00 0.00 C ATOM 0 H VAL A 119 -0.188 6.127 -12.704 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.609 3.703 -11.058 1.00 0.00 H new ATOM 0 HB VAL A 119 0.601 3.615 -13.342 1.00 0.00 H new ATOM 0 HG11 VAL A 119 3.006 4.039 -13.230 1.00 0.00 H new ATOM 0 HG12 VAL A 119 2.046 5.527 -13.049 1.00 0.00 H new ATOM 0 HG13 VAL A 119 2.795 4.772 -11.622 1.00 0.00 H new ATOM 0 HG21 VAL A 119 2.125 1.884 -12.474 1.00 0.00 H new ATOM 0 HG22 VAL A 119 1.846 2.480 -10.820 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.503 1.774 -11.751 1.00 0.00 H new ATOM 1865 N TYR A 120 0.844 4.515 -9.169 1.00 0.00 N ATOM 1866 CA TYR A 120 1.384 5.089 -7.946 1.00 0.00 C ATOM 1867 C TYR A 120 2.447 4.152 -7.393 1.00 0.00 C ATOM 1868 O TYR A 120 2.294 2.950 -7.468 1.00 0.00 O ATOM 1869 CB TYR A 120 0.252 5.285 -6.925 1.00 0.00 C ATOM 1870 CG TYR A 120 0.681 5.955 -5.640 1.00 0.00 C ATOM 1871 CD1 TYR A 120 1.233 7.224 -5.653 1.00 0.00 C ATOM 1872 CD2 TYR A 120 0.527 5.317 -4.417 1.00 0.00 C ATOM 1873 CE1 TYR A 120 1.628 7.844 -4.488 1.00 0.00 C ATOM 1874 CE2 TYR A 120 0.917 5.932 -3.243 1.00 0.00 C ATOM 1875 CZ TYR A 120 1.468 7.193 -3.282 1.00 0.00 C ATOM 1876 OH TYR A 120 1.862 7.796 -2.111 1.00 0.00 O ATOM 0 H TYR A 120 0.541 3.546 -9.070 1.00 0.00 H new ATOM 0 HA TYR A 120 1.834 6.060 -8.152 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -0.537 5.880 -7.385 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.179 4.313 -6.687 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.356 7.738 -6.595 1.00 0.00 H new ATOM 0 HD2 TYR A 120 0.097 4.327 -4.383 1.00 0.00 H new ATOM 0 HE1 TYR A 120 2.060 8.833 -4.518 1.00 0.00 H new ATOM 0 HE2 TYR A 120 0.790 5.425 -2.298 1.00 0.00 H new ATOM 0 HH TYR A 120 1.677 7.198 -1.357 1.00 0.00 H new ATOM 1886 N LYS A 121 3.547 4.672 -6.898 1.00 0.00 N ATOM 1887 CA LYS A 121 4.573 3.794 -6.360 1.00 0.00 C ATOM 1888 C LYS A 121 5.029 4.270 -4.994 1.00 0.00 C ATOM 1889 O LYS A 121 5.029 5.463 -4.720 1.00 0.00 O ATOM 1890 CB LYS A 121 5.769 3.737 -7.301 1.00 0.00 C ATOM 1891 CG LYS A 121 6.632 2.505 -7.147 1.00 0.00 C ATOM 1892 CD LYS A 121 7.800 2.785 -6.226 1.00 0.00 C ATOM 1893 CE LYS A 121 9.120 2.435 -6.889 1.00 0.00 C ATOM 1894 NZ LYS A 121 9.507 3.431 -7.925 1.00 0.00 N ATOM 0 H LYS A 121 3.756 5.669 -6.854 1.00 0.00 H new ATOM 0 HA LYS A 121 4.143 2.797 -6.261 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.409 3.786 -8.329 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.386 4.620 -7.137 1.00 0.00 H new ATOM 0 HG2 LYS A 121 6.036 1.684 -6.748 1.00 0.00 H new ATOM 0 HG3 LYS A 121 6.999 2.187 -8.123 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.800 3.838 -5.944 1.00 0.00 H new ATOM 0 HD3 LYS A 121 7.688 2.209 -5.307 1.00 0.00 H new ATOM 0 HE2 LYS A 121 9.902 2.378 -6.132 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.046 1.448 -7.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 10.050 2.958 -8.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.651 3.857 -8.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.091 4.174 -7.491 1.00 0.00 H new ATOM 1908 N ARG A 122 5.389 3.325 -4.139 1.00 0.00 N ATOM 1909 CA ARG A 122 6.009 3.626 -2.865 1.00 0.00 C ATOM 1910 C ARG A 122 7.161 2.666 -2.631 1.00 0.00 C ATOM 1911 O ARG A 122 7.085 1.508 -3.007 1.00 0.00 O ATOM 1912 CB ARG A 122 5.014 3.492 -1.705 1.00 0.00 C ATOM 1913 CG ARG A 122 3.582 3.835 -2.059 1.00 0.00 C ATOM 1914 CD ARG A 122 2.625 3.413 -0.956 1.00 0.00 C ATOM 1915 NE ARG A 122 1.237 3.392 -1.417 1.00 0.00 N ATOM 1916 CZ ARG A 122 0.201 3.021 -0.666 1.00 0.00 C ATOM 1917 NH1 ARG A 122 0.389 2.641 0.594 1.00 0.00 N ATOM 1918 NH2 ARG A 122 -1.028 3.026 -1.174 1.00 0.00 N ATOM 0 H ARG A 122 5.258 2.328 -4.312 1.00 0.00 H new ATOM 0 HA ARG A 122 6.362 4.657 -2.899 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.047 2.468 -1.332 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.338 4.139 -0.890 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.494 4.908 -2.229 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.307 3.341 -2.991 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.902 2.423 -0.594 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.717 4.098 -0.113 1.00 0.00 H new ATOM 0 HE ARG A 122 1.050 3.681 -2.377 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.329 2.633 0.989 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -0.407 2.358 1.165 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -1.179 3.314 -2.141 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.820 2.741 -0.597 1.00 0.00 H new ATOM 1932 N VAL A 123 8.231 3.142 -2.045 1.00 0.00 N ATOM 1933 CA VAL A 123 9.312 2.275 -1.643 1.00 0.00 C ATOM 1934 C VAL A 123 9.465 2.343 -0.135 1.00 0.00 C ATOM 1935 O VAL A 123 9.798 3.393 0.414 1.00 0.00 O ATOM 1936 CB VAL A 123 10.631 2.675 -2.319 1.00 0.00 C ATOM 1937 CG1 VAL A 123 11.776 1.776 -1.868 1.00 0.00 C ATOM 1938 CG2 VAL A 123 10.460 2.612 -3.822 1.00 0.00 C ATOM 0 H VAL A 123 8.378 4.129 -1.835 1.00 0.00 H new ATOM 0 HA VAL A 123 9.075 1.257 -1.952 1.00 0.00 H new ATOM 0 HB VAL A 123 10.883 3.694 -2.026 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.697 2.083 -2.364 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.900 1.859 -0.788 1.00 0.00 H new ATOM 0 HG13 VAL A 123 11.551 0.742 -2.129 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.394 2.895 -4.307 1.00 0.00 H new ATOM 0 HG22 VAL A 123 10.192 1.597 -4.115 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.670 3.298 -4.127 1.00 0.00 H new ATOM 1948 N SER A 124 9.230 1.233 0.524 1.00 0.00 N ATOM 1949 CA SER A 124 9.304 1.182 1.968 1.00 0.00 C ATOM 1950 C SER A 124 10.618 0.561 2.381 1.00 0.00 C ATOM 1951 O SER A 124 11.002 -0.479 1.869 1.00 0.00 O ATOM 1952 CB SER A 124 8.136 0.376 2.532 1.00 0.00 C ATOM 1953 OG SER A 124 6.937 0.674 1.835 1.00 0.00 O ATOM 0 H SER A 124 8.984 0.347 0.082 1.00 0.00 H new ATOM 0 HA SER A 124 9.244 2.195 2.366 1.00 0.00 H new ATOM 0 HB2 SER A 124 8.352 -0.690 2.454 1.00 0.00 H new ATOM 0 HB3 SER A 124 8.012 0.600 3.592 1.00 0.00 H new ATOM 0 HG SER A 124 6.201 0.147 2.210 1.00 0.00 H new ATOM 1959 N LYS A 125 11.306 1.198 3.290 1.00 0.00 N ATOM 1960 CA LYS A 125 12.591 0.719 3.732 1.00 0.00 C ATOM 1961 C LYS A 125 12.499 0.332 5.197 1.00 0.00 C ATOM 1962 O LYS A 125 11.781 0.952 5.982 1.00 0.00 O ATOM 1963 CB LYS A 125 13.648 1.794 3.458 1.00 0.00 C ATOM 1964 CG LYS A 125 15.018 1.468 3.957 1.00 0.00 C ATOM 1965 CD LYS A 125 15.237 2.074 5.321 1.00 0.00 C ATOM 1966 CE LYS A 125 15.512 3.566 5.226 1.00 0.00 C ATOM 1967 NZ LYS A 125 15.744 4.176 6.559 1.00 0.00 N ATOM 0 H LYS A 125 10.996 2.058 3.743 1.00 0.00 H new ATOM 0 HA LYS A 125 12.892 -0.173 3.183 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.700 1.967 2.383 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.323 2.728 3.916 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.146 0.387 4.007 1.00 0.00 H new ATOM 0 HG3 LYS A 125 15.766 1.846 3.260 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.358 1.903 5.942 1.00 0.00 H new ATOM 0 HD3 LYS A 125 16.075 1.578 5.811 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.384 3.734 4.594 1.00 0.00 H new ATOM 0 HE3 LYS A 125 14.669 4.060 4.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 15.928 5.194 6.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 14.903 4.039 7.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.565 3.723 7.010 1.00 0.00 H new ATOM 1981 N ARG A 126 13.217 -0.717 5.534 1.00 0.00 N ATOM 1982 CA ARG A 126 13.093 -1.364 6.824 1.00 0.00 C ATOM 1983 C ARG A 126 13.568 -0.453 7.948 1.00 0.00 C ATOM 1984 O ARG A 126 14.592 0.221 7.824 1.00 0.00 O ATOM 1985 CB ARG A 126 13.892 -2.658 6.830 1.00 0.00 C ATOM 1986 CG ARG A 126 15.361 -2.401 6.717 1.00 0.00 C ATOM 1987 CD ARG A 126 16.144 -3.688 6.608 1.00 0.00 C ATOM 1988 NE ARG A 126 17.583 -3.450 6.504 1.00 0.00 N ATOM 1989 CZ ARG A 126 18.512 -4.369 6.766 1.00 0.00 C ATOM 1990 NH1 ARG A 126 18.153 -5.587 7.155 1.00 0.00 N ATOM 1991 NH2 ARG A 126 19.798 -4.072 6.643 1.00 0.00 N ATOM 0 H ARG A 126 13.907 -1.148 4.919 1.00 0.00 H new ATOM 0 HA ARG A 126 12.039 -1.586 6.994 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.688 -3.207 7.749 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.568 -3.290 6.003 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.556 -1.781 5.842 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.701 -1.840 7.588 1.00 0.00 H new ATOM 0 HD2 ARG A 126 15.942 -4.310 7.480 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.805 -4.245 5.734 1.00 0.00 H new ATOM 0 HE ARG A 126 17.895 -2.524 6.213 1.00 0.00 H new ATOM 0 HH11 ARG A 126 17.165 -5.820 7.254 1.00 0.00 H new ATOM 0 HH12 ARG A 126 18.865 -6.289 7.355 1.00 0.00 H new ATOM 0 HH21 ARG A 126 20.080 -3.137 6.347 1.00 0.00 H new ATOM 0 HH22 ARG A 126 20.506 -4.778 6.844 1.00 0.00 H new ATOM 2005 N ILE A 127 12.823 -0.422 9.035 1.00 0.00 N ATOM 2006 CA ILE A 127 13.258 0.305 10.204 1.00 0.00 C ATOM 2007 C ILE A 127 13.801 -0.667 11.242 1.00 0.00 C ATOM 2008 O ILE A 127 15.033 -0.706 11.432 1.00 0.00 O ATOM 2009 CB ILE A 127 12.141 1.165 10.818 1.00 0.00 C ATOM 2010 CG1 ILE A 127 10.801 0.443 10.714 1.00 0.00 C ATOM 2011 CG2 ILE A 127 12.109 2.544 10.182 1.00 0.00 C ATOM 2012 CD1 ILE A 127 9.769 1.204 9.957 1.00 0.00 C ATOM 2013 OXT ILE A 127 13.000 -1.440 11.814 1.00 0.00 O ATOM 0 H ILE A 127 11.921 -0.889 9.130 1.00 0.00 H new ATOM 0 HA ILE A 127 14.045 0.989 9.886 1.00 0.00 H new ATOM 0 HB ILE A 127 12.348 1.314 11.878 1.00 0.00 H new ATOM 0 HG12 ILE A 127 10.955 -0.522 10.232 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.428 0.242 11.718 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.311 3.134 10.633 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.065 3.042 10.345 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.928 2.447 9.111 1.00 0.00 H new ATOM 0 HD11 ILE A 127 8.844 0.629 9.925 1.00 0.00 H new ATOM 0 HD12 ILE A 127 9.586 2.158 10.451 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.121 1.383 8.941 1.00 0.00 H new