USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1017 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 74 MET CE :methyl 168:sc= 0 (180deg=-0.0666) USER MOD Set 1.2: A 100 SER OG : rot 180:sc= 0.336 USER MOD Set 1.3: A 102 THR OG1 : rot 180:sc= 0 USER MOD Set 1.4: A 111 ASN : amide:sc= 0.298 X(o=0.63,f=0.15) USER MOD Set 1.5: A 113 MET CE :methyl 163:sc= 0 (180deg=-0.0166) USER MOD Set 2.1: A 81 THR OG1 : rot -104:sc= 0.628 USER MOD Set 2.2: A 93 THR OG1 : rot 70:sc= 0.605 USER MOD Set 3.1: A 73 THR OG1 : rot 84:sc= 0.379 USER MOD Set 3.2: A 75 THR OG1 : rot 180:sc= 0.356 USER MOD Set 4.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=0.0085) USER MOD Set 4.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 5.2: A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 31:sc= 0.00507 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.0155 X(o=-0.015,f=-0.015) USER MOD Single : A 10 GLN : amide:sc= -0.0274 X(o=-0.027,f=-0.027) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 19 MET CE :methyl -118:sc=-0.00646 (180deg=-0.604) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 151:sc= 0.00866 (180deg=0) USER MOD Single : A 39 SER OG : rot -160:sc= 0 USER MOD Single : A 43 GLN : amide:sc=-0.00528 X(o=-0.0053,f=0.28) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 136:sc= 1.03 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= -0.375 K(o=-0.37,f=-0.89) USER MOD Single : A 69 CYS SG : rot 73:sc= 0.826 USER MOD Single : A 78 LYS NZ :NH3+ -117:sc= 0 (180deg=-1.37!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc=-0.00388 K(o=-0.0039,f=-1.1) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 90 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.498) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.234) USER MOD Single : A 97 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0.048) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 9.312 -10.540 12.946 1.00 0.00 N ATOM 2 CA SER A 2 8.965 -10.778 14.354 1.00 0.00 C ATOM 3 C SER A 2 8.490 -9.449 14.988 1.00 0.00 C ATOM 4 O SER A 2 9.282 -8.522 15.199 1.00 0.00 O ATOM 5 CB SER A 2 10.150 -11.403 15.123 1.00 0.00 C ATOM 6 OG SER A 2 10.455 -12.701 14.627 1.00 0.00 O ATOM 0 HA SER A 2 8.150 -11.499 14.413 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.026 -10.761 15.032 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.908 -11.463 16.184 1.00 0.00 H new ATOM 0 HG SER A 2 10.243 -12.744 13.671 1.00 0.00 H new ATOM 12 N PHE A 3 7.183 -9.374 15.292 1.00 0.00 N ATOM 13 CA PHE A 3 6.524 -8.125 15.773 1.00 0.00 C ATOM 14 C PHE A 3 6.722 -7.723 17.269 1.00 0.00 C ATOM 15 O PHE A 3 6.293 -6.623 17.626 1.00 0.00 O ATOM 16 CB PHE A 3 5.008 -8.186 15.417 1.00 0.00 C ATOM 17 CG PHE A 3 4.668 -8.056 13.918 1.00 0.00 C ATOM 18 CD1 PHE A 3 4.649 -6.793 13.319 1.00 0.00 C ATOM 19 CD2 PHE A 3 4.364 -9.184 13.148 1.00 0.00 C ATOM 20 CE1 PHE A 3 4.330 -6.657 11.970 1.00 0.00 C ATOM 21 CE2 PHE A 3 4.036 -9.045 11.803 1.00 0.00 C ATOM 22 CZ PHE A 3 4.022 -7.783 11.215 1.00 0.00 C ATOM 0 H PHE A 3 6.547 -10.168 15.215 1.00 0.00 H new ATOM 0 HA PHE A 3 7.046 -7.326 15.247 1.00 0.00 H new ATOM 0 HB2 PHE A 3 4.606 -9.131 15.781 1.00 0.00 H new ATOM 0 HB3 PHE A 3 4.494 -7.391 15.958 1.00 0.00 H new ATOM 0 HD1 PHE A 3 4.883 -5.917 13.906 1.00 0.00 H new ATOM 0 HD2 PHE A 3 4.384 -10.165 13.599 1.00 0.00 H new ATOM 0 HE1 PHE A 3 4.322 -5.679 11.512 1.00 0.00 H new ATOM 0 HE2 PHE A 3 3.792 -9.917 11.214 1.00 0.00 H new ATOM 0 HZ PHE A 3 3.771 -7.679 10.170 1.00 0.00 H new ATOM 32 N SER A 4 7.371 -8.529 18.138 1.00 0.00 N ATOM 33 CA SER A 4 7.553 -8.176 19.572 1.00 0.00 C ATOM 34 C SER A 4 8.621 -7.056 19.757 1.00 0.00 C ATOM 35 O SER A 4 9.797 -7.245 19.429 1.00 0.00 O ATOM 36 CB SER A 4 7.926 -9.426 20.401 1.00 0.00 C ATOM 37 OG SER A 4 6.863 -10.373 20.423 1.00 0.00 O ATOM 0 H SER A 4 7.778 -9.427 17.877 1.00 0.00 H new ATOM 0 HA SER A 4 6.602 -7.789 19.937 1.00 0.00 H new ATOM 0 HB2 SER A 4 8.819 -9.889 19.981 1.00 0.00 H new ATOM 0 HB3 SER A 4 8.171 -9.128 21.421 1.00 0.00 H new ATOM 0 HG SER A 4 7.130 -11.152 20.954 1.00 0.00 H new ATOM 43 N GLY A 5 8.181 -5.893 20.264 1.00 0.00 N ATOM 44 CA GLY A 5 9.054 -4.712 20.427 1.00 0.00 C ATOM 45 C GLY A 5 8.265 -3.397 20.599 1.00 0.00 C ATOM 46 O GLY A 5 7.177 -3.218 20.039 1.00 0.00 O ATOM 0 H GLY A 5 7.220 -5.742 20.571 1.00 0.00 H new ATOM 0 HA2 GLY A 5 9.697 -4.859 21.295 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.706 -4.627 19.558 1.00 0.00 H new ATOM 50 N LYS A 6 8.874 -2.447 21.333 1.00 0.00 N ATOM 51 CA LYS A 6 8.365 -1.056 21.446 1.00 0.00 C ATOM 52 C LYS A 6 8.886 -0.221 20.241 1.00 0.00 C ATOM 53 O LYS A 6 10.097 -0.081 20.040 1.00 0.00 O ATOM 54 CB LYS A 6 8.779 -0.461 22.819 1.00 0.00 C ATOM 55 CG LYS A 6 8.175 0.934 23.107 1.00 0.00 C ATOM 56 CD LYS A 6 8.532 1.548 24.479 1.00 0.00 C ATOM 57 CE LYS A 6 7.890 0.900 25.723 1.00 0.00 C ATOM 58 NZ LYS A 6 6.424 1.067 25.777 1.00 0.00 N ATOM 0 H LYS A 6 9.729 -2.615 21.864 1.00 0.00 H new ATOM 0 HA LYS A 6 7.276 -1.037 21.407 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.474 -1.148 23.608 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.866 -0.391 22.860 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.503 1.620 22.326 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.090 0.862 23.033 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.615 1.508 24.597 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.252 2.601 24.462 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.128 -0.164 25.734 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.332 1.335 26.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.054 0.610 26.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 6.190 2.080 25.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.993 0.628 24.938 1.00 0.00 H new ATOM 72 N TYR A 7 7.939 0.317 19.454 1.00 0.00 N ATOM 73 CA TYR A 7 8.241 1.059 18.204 1.00 0.00 C ATOM 74 C TYR A 7 7.626 2.471 18.360 1.00 0.00 C ATOM 75 O TYR A 7 6.406 2.646 18.269 1.00 0.00 O ATOM 76 CB TYR A 7 7.716 0.327 16.934 1.00 0.00 C ATOM 77 CG TYR A 7 8.147 -1.141 16.740 1.00 0.00 C ATOM 78 CD1 TYR A 7 9.464 -1.471 16.408 1.00 0.00 C ATOM 79 CD2 TYR A 7 7.205 -2.166 16.907 1.00 0.00 C ATOM 80 CE1 TYR A 7 9.842 -2.805 16.262 1.00 0.00 C ATOM 81 CE2 TYR A 7 7.580 -3.496 16.747 1.00 0.00 C ATOM 82 CZ TYR A 7 8.898 -3.818 16.436 1.00 0.00 C ATOM 83 OH TYR A 7 9.269 -5.133 16.324 1.00 0.00 O ATOM 0 H TYR A 7 6.942 0.254 19.660 1.00 0.00 H new ATOM 0 HA TYR A 7 9.319 1.125 18.058 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.627 0.360 16.951 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.039 0.893 16.060 1.00 0.00 H new ATOM 0 HD1 TYR A 7 10.193 -0.688 16.264 1.00 0.00 H new ATOM 0 HD2 TYR A 7 6.184 -1.922 17.161 1.00 0.00 H new ATOM 0 HE1 TYR A 7 10.863 -3.054 16.015 1.00 0.00 H new ATOM 0 HE2 TYR A 7 6.847 -4.280 16.864 1.00 0.00 H new ATOM 0 HH TYR A 7 8.489 -5.707 16.476 1.00 0.00 H new ATOM 93 N GLN A 8 8.482 3.473 18.616 1.00 0.00 N ATOM 94 CA GLN A 8 8.048 4.864 18.910 1.00 0.00 C ATOM 95 C GLN A 8 7.754 5.612 17.582 1.00 0.00 C ATOM 96 O GLN A 8 8.608 5.656 16.692 1.00 0.00 O ATOM 97 CB GLN A 8 9.168 5.556 19.742 1.00 0.00 C ATOM 98 CG GLN A 8 8.756 6.792 20.576 1.00 0.00 C ATOM 99 CD GLN A 8 8.391 8.066 19.791 1.00 0.00 C ATOM 100 OE1 GLN A 8 9.149 8.538 18.943 1.00 0.00 O ATOM 101 NE2 GLN A 8 7.230 8.647 20.060 1.00 0.00 N ATOM 0 H GLN A 8 9.495 3.351 18.627 1.00 0.00 H new ATOM 0 HA GLN A 8 7.127 4.875 19.492 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.594 4.816 20.419 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.962 5.857 19.058 1.00 0.00 H new ATOM 0 HG2 GLN A 8 7.901 6.516 21.193 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.575 7.033 21.254 1.00 0.00 H new ATOM 0 HE21 GLN A 8 6.611 8.247 20.765 1.00 0.00 H new ATOM 0 HE22 GLN A 8 6.956 9.494 19.562 1.00 0.00 H new ATOM 110 N LEU A 9 6.557 6.222 17.467 1.00 0.00 N ATOM 111 CA LEU A 9 6.132 6.941 16.233 1.00 0.00 C ATOM 112 C LEU A 9 7.048 8.159 15.911 1.00 0.00 C ATOM 113 O LEU A 9 7.225 9.061 16.735 1.00 0.00 O ATOM 114 CB LEU A 9 4.616 7.274 16.309 1.00 0.00 C ATOM 115 CG LEU A 9 3.952 7.933 15.063 1.00 0.00 C ATOM 116 CD1 LEU A 9 4.195 7.176 13.743 1.00 0.00 C ATOM 117 CD2 LEU A 9 2.435 8.095 15.289 1.00 0.00 C ATOM 0 H LEU A 9 5.861 6.235 18.212 1.00 0.00 H new ATOM 0 HA LEU A 9 6.263 6.283 15.374 1.00 0.00 H new ATOM 0 HB2 LEU A 9 4.081 6.349 16.524 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.461 7.937 17.160 1.00 0.00 H new ATOM 0 HG LEU A 9 4.432 8.905 14.955 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.699 7.701 12.926 1.00 0.00 H new ATOM 0 HD12 LEU A 9 5.266 7.125 13.545 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.792 6.166 13.823 1.00 0.00 H new ATOM 0 HD21 LEU A 9 1.984 8.557 14.411 1.00 0.00 H new ATOM 0 HD22 LEU A 9 1.985 7.116 15.456 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.262 8.727 16.160 1.00 0.00 H new ATOM 129 N GLN A 10 7.664 8.121 14.719 1.00 0.00 N ATOM 130 CA GLN A 10 8.632 9.144 14.254 1.00 0.00 C ATOM 131 C GLN A 10 7.970 10.113 13.234 1.00 0.00 C ATOM 132 O GLN A 10 8.009 11.326 13.458 1.00 0.00 O ATOM 133 CB GLN A 10 9.890 8.409 13.704 1.00 0.00 C ATOM 134 CG GLN A 10 11.160 9.278 13.534 1.00 0.00 C ATOM 135 CD GLN A 10 11.743 9.814 14.854 1.00 0.00 C ATOM 136 OE1 GLN A 10 11.635 10.999 15.166 1.00 0.00 O ATOM 137 NE2 GLN A 10 12.342 8.954 15.664 1.00 0.00 N ATOM 0 H GLN A 10 7.507 7.376 14.040 1.00 0.00 H new ATOM 0 HA GLN A 10 8.952 9.782 15.078 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.126 7.582 14.374 1.00 0.00 H new ATOM 0 HB3 GLN A 10 9.639 7.974 12.737 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.924 8.689 13.026 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.924 10.122 12.885 1.00 0.00 H new ATOM 0 HE21 GLN A 10 12.426 7.974 15.395 1.00 0.00 H new ATOM 0 HE22 GLN A 10 12.719 9.272 16.557 1.00 0.00 H new ATOM 146 N SER A 11 7.382 9.586 12.139 1.00 0.00 N ATOM 147 CA SER A 11 6.682 10.395 11.116 1.00 0.00 C ATOM 148 C SER A 11 5.179 10.016 11.101 1.00 0.00 C ATOM 149 O SER A 11 4.785 8.964 10.585 1.00 0.00 O ATOM 150 CB SER A 11 7.342 10.160 9.742 1.00 0.00 C ATOM 151 OG SER A 11 8.638 10.744 9.687 1.00 0.00 O ATOM 0 H SER A 11 7.379 8.586 11.938 1.00 0.00 H new ATOM 0 HA SER A 11 6.759 11.456 11.352 1.00 0.00 H new ATOM 0 HB2 SER A 11 7.414 9.090 9.549 1.00 0.00 H new ATOM 0 HB3 SER A 11 6.716 10.584 8.957 1.00 0.00 H new ATOM 0 HG SER A 11 9.034 10.579 8.806 1.00 0.00 H new ATOM 157 N GLN A 12 4.346 10.916 11.651 1.00 0.00 N ATOM 158 CA GLN A 12 2.866 10.809 11.596 1.00 0.00 C ATOM 159 C GLN A 12 2.370 11.626 10.368 1.00 0.00 C ATOM 160 O GLN A 12 2.316 12.861 10.418 1.00 0.00 O ATOM 161 CB GLN A 12 2.321 11.320 12.958 1.00 0.00 C ATOM 162 CG GLN A 12 0.792 11.232 13.128 1.00 0.00 C ATOM 163 CD GLN A 12 0.302 11.806 14.470 1.00 0.00 C ATOM 164 OE1 GLN A 12 0.241 13.020 14.667 1.00 0.00 O ATOM 165 NE2 GLN A 12 -0.070 10.954 15.414 1.00 0.00 N ATOM 0 H GLN A 12 4.675 11.743 12.149 1.00 0.00 H new ATOM 0 HA GLN A 12 2.506 9.789 11.459 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.793 10.748 13.757 1.00 0.00 H new ATOM 0 HB3 GLN A 12 2.626 12.359 13.086 1.00 0.00 H new ATOM 0 HG2 GLN A 12 0.310 11.769 12.311 1.00 0.00 H new ATOM 0 HG3 GLN A 12 0.483 10.190 13.050 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -0.017 9.950 15.244 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -0.409 11.302 16.311 1.00 0.00 H new ATOM 174 N GLU A 13 2.032 10.926 9.268 1.00 0.00 N ATOM 175 CA GLU A 13 1.668 11.574 7.976 1.00 0.00 C ATOM 176 C GLU A 13 0.132 11.494 7.799 1.00 0.00 C ATOM 177 O GLU A 13 -0.419 10.398 7.686 1.00 0.00 O ATOM 178 CB GLU A 13 2.393 10.909 6.773 1.00 0.00 C ATOM 179 CG GLU A 13 3.936 10.982 6.812 1.00 0.00 C ATOM 180 CD GLU A 13 4.617 10.418 5.559 1.00 0.00 C ATOM 181 OE1 GLU A 13 4.295 9.283 5.147 1.00 0.00 O ATOM 182 OE2 GLU A 13 5.489 11.107 4.986 1.00 0.00 O ATOM 0 H GLU A 13 2.001 9.907 9.240 1.00 0.00 H new ATOM 0 HA GLU A 13 1.989 12.616 8.001 1.00 0.00 H new ATOM 0 HB2 GLU A 13 2.096 9.861 6.725 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.046 11.382 5.854 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.238 12.022 6.941 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.294 10.436 7.685 1.00 0.00 H new ATOM 189 N ASN A 14 -0.544 12.659 7.780 1.00 0.00 N ATOM 190 CA ASN A 14 -2.033 12.776 7.677 1.00 0.00 C ATOM 191 C ASN A 14 -2.794 12.238 8.927 1.00 0.00 C ATOM 192 O ASN A 14 -3.507 11.234 8.848 1.00 0.00 O ATOM 193 CB ASN A 14 -2.641 12.242 6.338 1.00 0.00 C ATOM 194 CG ASN A 14 -2.220 12.956 5.038 1.00 0.00 C ATOM 195 OD1 ASN A 14 -1.871 14.136 5.018 1.00 0.00 O ATOM 196 ND2 ASN A 14 -2.281 12.259 3.914 1.00 0.00 N ATOM 0 H ASN A 14 -0.076 13.564 7.836 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.199 13.853 7.656 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -2.379 11.188 6.245 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -3.727 12.294 6.416 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -2.038 12.700 3.027 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.571 11.281 3.935 1.00 0.00 H new ATOM 203 N PHE A 15 -2.678 12.947 10.067 1.00 0.00 N ATOM 204 CA PHE A 15 -3.558 12.733 11.250 1.00 0.00 C ATOM 205 C PHE A 15 -4.821 13.642 11.176 1.00 0.00 C ATOM 206 O PHE A 15 -5.929 13.111 11.260 1.00 0.00 O ATOM 207 CB PHE A 15 -2.731 12.867 12.561 1.00 0.00 C ATOM 208 CG PHE A 15 -3.492 12.597 13.876 1.00 0.00 C ATOM 209 CD1 PHE A 15 -4.195 13.629 14.509 1.00 0.00 C ATOM 210 CD2 PHE A 15 -3.485 11.322 14.452 1.00 0.00 C ATOM 211 CE1 PHE A 15 -4.886 13.387 15.694 1.00 0.00 C ATOM 212 CE2 PHE A 15 -4.158 11.088 15.650 1.00 0.00 C ATOM 213 CZ PHE A 15 -4.859 12.120 16.269 1.00 0.00 C ATOM 0 H PHE A 15 -1.981 13.679 10.201 1.00 0.00 H new ATOM 0 HA PHE A 15 -3.948 11.715 11.249 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -1.887 12.179 12.506 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -2.318 13.875 12.604 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -4.202 14.618 14.076 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.956 10.516 13.966 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -5.443 14.183 16.167 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -4.136 10.106 16.098 1.00 0.00 H new ATOM 0 HZ PHE A 15 -5.382 11.937 17.196 1.00 0.00 H new ATOM 223 N GLU A 16 -4.685 14.978 11.035 1.00 0.00 N ATOM 224 CA GLU A 16 -5.851 15.913 11.003 1.00 0.00 C ATOM 225 C GLU A 16 -6.851 15.705 9.820 1.00 0.00 C ATOM 226 O GLU A 16 -8.064 15.739 10.054 1.00 0.00 O ATOM 227 CB GLU A 16 -5.384 17.391 11.095 1.00 0.00 C ATOM 228 CG GLU A 16 -4.715 17.781 12.434 1.00 0.00 C ATOM 229 CD GLU A 16 -4.360 19.268 12.512 1.00 0.00 C ATOM 230 OE1 GLU A 16 -5.243 20.081 12.864 1.00 0.00 O ATOM 231 OE2 GLU A 16 -3.196 19.628 12.232 1.00 0.00 O ATOM 0 H GLU A 16 -3.782 15.442 10.941 1.00 0.00 H new ATOM 0 HA GLU A 16 -6.430 15.659 11.891 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -4.682 17.586 10.285 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.245 18.039 10.933 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.385 17.529 13.256 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.810 17.189 12.568 1.00 0.00 H new ATOM 238 N ALA A 17 -6.363 15.450 8.586 1.00 0.00 N ATOM 239 CA ALA A 17 -7.218 15.026 7.444 1.00 0.00 C ATOM 240 C ALA A 17 -7.893 13.628 7.587 1.00 0.00 C ATOM 241 O ALA A 17 -9.096 13.514 7.334 1.00 0.00 O ATOM 242 CB ALA A 17 -6.389 15.112 6.143 1.00 0.00 C ATOM 0 H ALA A 17 -5.374 15.530 8.350 1.00 0.00 H new ATOM 0 HA ALA A 17 -8.061 15.717 7.423 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -7.005 14.804 5.298 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.054 16.138 5.992 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.523 14.455 6.219 1.00 0.00 H new ATOM 248 N PHE A 18 -7.138 12.583 7.985 1.00 0.00 N ATOM 249 CA PHE A 18 -7.662 11.197 8.129 1.00 0.00 C ATOM 250 C PHE A 18 -8.669 11.001 9.298 1.00 0.00 C ATOM 251 O PHE A 18 -9.716 10.394 9.075 1.00 0.00 O ATOM 252 CB PHE A 18 -6.458 10.224 8.238 1.00 0.00 C ATOM 253 CG PHE A 18 -6.810 8.730 8.167 1.00 0.00 C ATOM 254 CD1 PHE A 18 -7.063 8.119 6.934 1.00 0.00 C ATOM 255 CD2 PHE A 18 -6.838 7.957 9.336 1.00 0.00 C ATOM 256 CE1 PHE A 18 -7.340 6.759 6.873 1.00 0.00 C ATOM 257 CE2 PHE A 18 -7.117 6.596 9.268 1.00 0.00 C ATOM 258 CZ PHE A 18 -7.376 6.002 8.038 1.00 0.00 C ATOM 0 H PHE A 18 -6.148 12.670 8.217 1.00 0.00 H new ATOM 0 HA PHE A 18 -8.252 10.978 7.239 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -5.754 10.453 7.438 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -5.943 10.414 9.180 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -7.043 8.706 6.028 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -6.642 8.419 10.292 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -7.528 6.289 5.919 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -7.132 6.001 10.170 1.00 0.00 H new ATOM 0 HZ PHE A 18 -7.606 4.948 7.988 1.00 0.00 H new ATOM 268 N MET A 19 -8.344 11.479 10.516 1.00 0.00 N ATOM 269 CA MET A 19 -9.214 11.327 11.716 1.00 0.00 C ATOM 270 C MET A 19 -10.614 12.012 11.623 1.00 0.00 C ATOM 271 O MET A 19 -11.594 11.427 12.092 1.00 0.00 O ATOM 272 CB MET A 19 -8.455 11.749 13.002 1.00 0.00 C ATOM 273 CG MET A 19 -7.213 10.911 13.365 1.00 0.00 C ATOM 274 SD MET A 19 -7.576 9.143 13.367 1.00 0.00 S ATOM 275 CE MET A 19 -5.903 8.475 13.274 1.00 0.00 C ATOM 0 H MET A 19 -7.476 11.981 10.703 1.00 0.00 H new ATOM 0 HA MET A 19 -9.445 10.263 11.763 1.00 0.00 H new ATOM 0 HB2 MET A 19 -8.147 12.789 12.892 1.00 0.00 H new ATOM 0 HB3 MET A 19 -9.152 11.710 13.839 1.00 0.00 H new ATOM 0 HG2 MET A 19 -6.414 11.117 12.653 1.00 0.00 H new ATOM 0 HG3 MET A 19 -6.848 11.208 14.348 1.00 0.00 H new ATOM 0 HE1 MET A 19 -5.791 7.901 12.354 1.00 0.00 H new ATOM 0 HE2 MET A 19 -5.183 9.294 13.281 1.00 0.00 H new ATOM 0 HE3 MET A 19 -5.722 7.826 14.131 1.00 0.00 H new ATOM 285 N LYS A 20 -10.724 13.192 10.977 1.00 0.00 N ATOM 286 CA LYS A 20 -12.038 13.799 10.616 1.00 0.00 C ATOM 287 C LYS A 20 -12.865 13.009 9.548 1.00 0.00 C ATOM 288 O LYS A 20 -14.085 12.895 9.694 1.00 0.00 O ATOM 289 CB LYS A 20 -11.794 15.275 10.191 1.00 0.00 C ATOM 290 CG LYS A 20 -13.046 16.176 10.298 1.00 0.00 C ATOM 291 CD LYS A 20 -12.785 17.678 10.065 1.00 0.00 C ATOM 292 CE LYS A 20 -12.068 18.385 11.237 1.00 0.00 C ATOM 293 NZ LYS A 20 -11.925 19.829 10.990 1.00 0.00 N ATOM 0 H LYS A 20 -9.920 13.751 10.691 1.00 0.00 H new ATOM 0 HA LYS A 20 -12.670 13.753 11.503 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.003 15.695 10.812 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.434 15.291 9.162 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.785 15.834 9.574 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.485 16.047 11.287 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -12.185 17.795 9.163 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.737 18.177 9.882 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.630 18.226 12.157 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.084 17.941 11.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.440 20.273 11.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.368 19.980 10.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -12.866 20.256 10.875 1.00 0.00 H new ATOM 307 N ALA A 21 -12.208 12.475 8.499 1.00 0.00 N ATOM 308 CA ALA A 21 -12.868 11.679 7.432 1.00 0.00 C ATOM 309 C ALA A 21 -13.355 10.247 7.819 1.00 0.00 C ATOM 310 O ALA A 21 -14.416 9.832 7.341 1.00 0.00 O ATOM 311 CB ALA A 21 -11.908 11.645 6.230 1.00 0.00 C ATOM 0 H ALA A 21 -11.203 12.581 8.363 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.808 12.181 7.202 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -12.357 11.068 5.422 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -11.718 12.662 5.887 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.968 11.181 6.528 1.00 0.00 H new ATOM 317 N ILE A 22 -12.615 9.502 8.666 1.00 0.00 N ATOM 318 CA ILE A 22 -13.037 8.161 9.182 1.00 0.00 C ATOM 319 C ILE A 22 -14.252 8.177 10.174 1.00 0.00 C ATOM 320 O ILE A 22 -15.059 7.244 10.138 1.00 0.00 O ATOM 321 CB ILE A 22 -11.824 7.347 9.768 1.00 0.00 C ATOM 322 CG1 ILE A 22 -11.204 7.958 11.064 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.762 7.020 8.692 1.00 0.00 C ATOM 324 CD1 ILE A 22 -10.046 7.199 11.731 1.00 0.00 C ATOM 0 H ILE A 22 -11.706 9.803 9.018 1.00 0.00 H new ATOM 0 HA ILE A 22 -13.409 7.641 8.299 1.00 0.00 H new ATOM 0 HB ILE A 22 -12.250 6.398 10.092 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -10.853 8.962 10.826 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -12.002 8.065 11.799 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.946 6.458 9.146 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.217 6.424 7.901 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -10.374 7.947 8.270 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -9.719 7.741 12.618 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -10.382 6.203 12.018 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -9.215 7.114 11.030 1.00 0.00 H new ATOM 336 N GLY A 23 -14.346 9.189 11.063 1.00 0.00 N ATOM 337 CA GLY A 23 -15.364 9.250 12.136 1.00 0.00 C ATOM 338 C GLY A 23 -14.737 9.421 13.535 1.00 0.00 C ATOM 339 O GLY A 23 -14.814 8.506 14.359 1.00 0.00 O ATOM 0 H GLY A 23 -13.715 9.991 11.057 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -16.043 10.080 11.942 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.962 8.339 12.118 1.00 0.00 H new ATOM 343 N LEU A 24 -14.166 10.611 13.803 1.00 0.00 N ATOM 344 CA LEU A 24 -13.762 11.040 15.170 1.00 0.00 C ATOM 345 C LEU A 24 -14.126 12.554 15.359 1.00 0.00 C ATOM 346 O LEU A 24 -13.914 13.338 14.423 1.00 0.00 O ATOM 347 CB LEU A 24 -12.244 10.855 15.465 1.00 0.00 C ATOM 348 CG LEU A 24 -11.735 9.419 15.762 1.00 0.00 C ATOM 349 CD1 LEU A 24 -10.198 9.419 15.855 1.00 0.00 C ATOM 350 CD2 LEU A 24 -12.315 8.839 17.069 1.00 0.00 C ATOM 0 H LEU A 24 -13.969 11.307 13.084 1.00 0.00 H new ATOM 0 HA LEU A 24 -14.302 10.400 15.868 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -11.687 11.238 14.609 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.989 11.484 16.318 1.00 0.00 H new ATOM 0 HG LEU A 24 -12.073 8.788 14.940 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.846 8.409 16.064 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -9.776 9.762 14.910 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.882 10.086 16.657 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -11.925 7.833 17.226 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -12.029 9.474 17.907 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -13.402 8.799 16.999 1.00 0.00 H new ATOM 362 N PRO A 25 -14.603 13.035 16.550 1.00 0.00 N ATOM 363 CA PRO A 25 -14.886 14.475 16.790 1.00 0.00 C ATOM 364 C PRO A 25 -13.613 15.373 16.880 1.00 0.00 C ATOM 365 O PRO A 25 -12.503 14.899 17.148 1.00 0.00 O ATOM 366 CB PRO A 25 -15.676 14.429 18.116 1.00 0.00 C ATOM 367 CG PRO A 25 -15.164 13.189 18.849 1.00 0.00 C ATOM 368 CD PRO A 25 -14.896 12.188 17.726 1.00 0.00 C ATOM 0 HA PRO A 25 -15.427 14.937 15.964 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -15.509 15.331 18.705 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -16.748 14.363 17.933 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -14.259 13.405 19.417 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -15.901 12.809 19.556 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -14.057 11.535 17.966 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -15.759 11.546 17.550 1.00 0.00 H new ATOM 376 N GLU A 26 -13.818 16.688 16.684 1.00 0.00 N ATOM 377 CA GLU A 26 -12.735 17.713 16.783 1.00 0.00 C ATOM 378 C GLU A 26 -12.044 17.881 18.178 1.00 0.00 C ATOM 379 O GLU A 26 -10.893 18.324 18.211 1.00 0.00 O ATOM 380 CB GLU A 26 -13.283 19.051 16.210 1.00 0.00 C ATOM 381 CG GLU A 26 -12.203 20.098 15.857 1.00 0.00 C ATOM 382 CD GLU A 26 -12.766 21.343 15.167 1.00 0.00 C ATOM 383 OE1 GLU A 26 -13.077 21.276 13.956 1.00 0.00 O ATOM 384 OE2 GLU A 26 -12.894 22.398 15.829 1.00 0.00 O ATOM 0 H GLU A 26 -14.731 17.080 16.453 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.902 17.344 16.185 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -13.865 18.835 15.314 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -13.968 19.488 16.937 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.687 20.399 16.769 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.459 19.637 15.208 1.00 0.00 H new ATOM 391 N GLU A 27 -12.683 17.488 19.302 1.00 0.00 N ATOM 392 CA GLU A 27 -12.013 17.356 20.623 1.00 0.00 C ATOM 393 C GLU A 27 -10.809 16.358 20.619 1.00 0.00 C ATOM 394 O GLU A 27 -9.703 16.784 20.959 1.00 0.00 O ATOM 395 CB GLU A 27 -13.099 17.028 21.684 1.00 0.00 C ATOM 396 CG GLU A 27 -12.601 17.114 23.140 1.00 0.00 C ATOM 397 CD GLU A 27 -13.701 16.840 24.167 1.00 0.00 C ATOM 398 OE1 GLU A 27 -13.916 15.660 24.525 1.00 0.00 O ATOM 399 OE2 GLU A 27 -14.357 17.803 24.624 1.00 0.00 O ATOM 0 H GLU A 27 -13.675 17.253 19.323 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.540 18.303 20.882 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.936 17.715 21.556 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.480 16.023 21.500 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.791 16.398 23.284 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.185 18.106 23.318 1.00 0.00 H new ATOM 406 N LEU A 28 -10.989 15.087 20.198 1.00 0.00 N ATOM 407 CA LEU A 28 -9.864 14.118 20.031 1.00 0.00 C ATOM 408 C LEU A 28 -8.817 14.462 18.920 1.00 0.00 C ATOM 409 O LEU A 28 -7.639 14.138 19.096 1.00 0.00 O ATOM 410 CB LEU A 28 -10.428 12.683 19.824 1.00 0.00 C ATOM 411 CG LEU A 28 -11.135 12.030 21.049 1.00 0.00 C ATOM 412 CD1 LEU A 28 -11.926 10.784 20.611 1.00 0.00 C ATOM 413 CD2 LEU A 28 -10.153 11.661 22.184 1.00 0.00 C ATOM 0 H LEU A 28 -11.903 14.699 19.965 1.00 0.00 H new ATOM 0 HA LEU A 28 -9.297 14.187 20.959 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.137 12.711 18.996 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.607 12.035 19.519 1.00 0.00 H new ATOM 0 HG LEU A 28 -11.819 12.778 21.449 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -12.414 10.339 21.478 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.680 11.071 19.878 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -11.245 10.058 20.166 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -10.704 11.210 23.010 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.415 10.952 21.810 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.647 12.561 22.534 1.00 0.00 H new ATOM 425 N ILE A 29 -9.206 15.132 17.812 1.00 0.00 N ATOM 426 CA ILE A 29 -8.251 15.629 16.772 1.00 0.00 C ATOM 427 C ILE A 29 -7.295 16.718 17.366 1.00 0.00 C ATOM 428 O ILE A 29 -6.080 16.509 17.357 1.00 0.00 O ATOM 429 CB ILE A 29 -8.981 16.074 15.453 1.00 0.00 C ATOM 430 CG1 ILE A 29 -9.878 14.956 14.836 1.00 0.00 C ATOM 431 CG2 ILE A 29 -7.971 16.574 14.383 1.00 0.00 C ATOM 432 CD1 ILE A 29 -10.924 15.438 13.824 1.00 0.00 C ATOM 0 H ILE A 29 -10.182 15.347 17.606 1.00 0.00 H new ATOM 0 HA ILE A 29 -7.617 14.796 16.469 1.00 0.00 H new ATOM 0 HB ILE A 29 -9.634 16.895 15.749 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -9.234 14.225 14.347 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -10.392 14.438 15.645 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.511 16.873 13.485 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.418 17.427 14.775 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -7.274 15.772 14.137 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.494 14.585 13.455 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.599 16.144 14.307 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -10.423 15.928 12.989 1.00 0.00 H new ATOM 444 N GLN A 30 -7.834 17.838 17.893 1.00 0.00 N ATOM 445 CA GLN A 30 -7.026 18.913 18.543 1.00 0.00 C ATOM 446 C GLN A 30 -6.248 18.533 19.845 1.00 0.00 C ATOM 447 O GLN A 30 -5.243 19.189 20.139 1.00 0.00 O ATOM 448 CB GLN A 30 -7.905 20.174 18.786 1.00 0.00 C ATOM 449 CG GLN A 30 -8.585 20.827 17.555 1.00 0.00 C ATOM 450 CD GLN A 30 -7.623 21.362 16.480 1.00 0.00 C ATOM 451 OE1 GLN A 30 -6.999 22.410 16.644 1.00 0.00 O ATOM 452 NE2 GLN A 30 -7.485 20.661 15.364 1.00 0.00 N ATOM 0 H GLN A 30 -8.836 18.030 17.884 1.00 0.00 H new ATOM 0 HA GLN A 30 -6.233 19.112 17.822 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -8.686 19.906 19.498 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -7.282 20.930 19.265 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -9.247 20.094 17.094 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -9.212 21.649 17.900 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -8.007 19.794 15.239 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -6.857 20.989 14.630 1.00 0.00 H new ATOM 461 N LYS A 31 -6.654 17.480 20.589 1.00 0.00 N ATOM 462 CA LYS A 31 -5.829 16.866 21.669 1.00 0.00 C ATOM 463 C LYS A 31 -4.455 16.321 21.169 1.00 0.00 C ATOM 464 O LYS A 31 -3.429 16.761 21.692 1.00 0.00 O ATOM 465 CB LYS A 31 -6.638 15.757 22.406 1.00 0.00 C ATOM 466 CG LYS A 31 -7.747 16.231 23.374 1.00 0.00 C ATOM 467 CD LYS A 31 -7.259 16.530 24.807 1.00 0.00 C ATOM 468 CE LYS A 31 -8.352 17.060 25.759 1.00 0.00 C ATOM 469 NZ LYS A 31 -9.367 16.047 26.112 1.00 0.00 N ATOM 0 H LYS A 31 -7.560 17.028 20.463 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.593 17.665 22.372 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.095 15.113 21.654 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -5.936 15.141 22.969 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -8.209 17.130 22.966 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -8.523 15.467 23.420 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -6.837 15.619 25.231 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.453 17.262 24.757 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.882 17.425 26.672 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -8.847 17.912 25.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -10.070 16.468 26.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -9.841 15.715 25.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -8.906 15.243 26.584 1.00 0.00 H new ATOM 483 N GLY A 32 -4.433 15.400 20.181 1.00 0.00 N ATOM 484 CA GLY A 32 -3.172 14.845 19.628 1.00 0.00 C ATOM 485 C GLY A 32 -2.880 15.182 18.152 1.00 0.00 C ATOM 486 O GLY A 32 -2.462 14.295 17.405 1.00 0.00 O ATOM 0 H GLY A 32 -5.275 15.022 19.747 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.342 15.206 20.235 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -3.197 13.761 19.735 1.00 0.00 H new ATOM 490 N LYS A 33 -3.039 16.460 17.757 1.00 0.00 N ATOM 491 CA LYS A 33 -2.836 16.936 16.360 1.00 0.00 C ATOM 492 C LYS A 33 -1.393 16.751 15.805 1.00 0.00 C ATOM 493 O LYS A 33 -1.230 16.049 14.802 1.00 0.00 O ATOM 494 CB LYS A 33 -3.420 18.364 16.160 1.00 0.00 C ATOM 495 CG LYS A 33 -2.994 19.474 17.156 1.00 0.00 C ATOM 496 CD LYS A 33 -3.638 20.847 16.887 1.00 0.00 C ATOM 497 CE LYS A 33 -3.060 21.585 15.664 1.00 0.00 C ATOM 498 NZ LYS A 33 -3.688 22.906 15.484 1.00 0.00 N ATOM 0 H LYS A 33 -3.314 17.204 18.399 1.00 0.00 H new ATOM 0 HA LYS A 33 -3.417 16.265 15.727 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.153 18.696 15.157 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -4.507 18.287 16.191 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.251 19.157 18.167 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -1.910 19.581 17.121 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.710 20.711 16.743 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.512 21.474 17.769 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.984 21.706 15.786 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -3.213 20.983 14.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -3.276 23.376 14.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.712 22.787 15.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.520 23.488 16.329 1.00 0.00 H new ATOM 512 N ASP A 34 -0.369 17.321 16.474 1.00 0.00 N ATOM 513 CA ASP A 34 1.052 16.938 16.244 1.00 0.00 C ATOM 514 C ASP A 34 1.662 16.390 17.571 1.00 0.00 C ATOM 515 O ASP A 34 2.575 16.979 18.157 1.00 0.00 O ATOM 516 CB ASP A 34 1.784 18.153 15.615 1.00 0.00 C ATOM 517 CG ASP A 34 3.184 17.850 15.064 1.00 0.00 C ATOM 518 OD1 ASP A 34 3.292 17.421 13.894 1.00 0.00 O ATOM 519 OD2 ASP A 34 4.179 18.043 15.797 1.00 0.00 O ATOM 0 H ASP A 34 -0.493 18.048 17.179 1.00 0.00 H new ATOM 0 HA ASP A 34 1.160 16.120 15.532 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.170 18.550 14.807 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.867 18.937 16.367 1.00 0.00 H new ATOM 524 N ILE A 35 1.147 15.224 18.010 1.00 0.00 N ATOM 525 CA ILE A 35 1.685 14.460 19.169 1.00 0.00 C ATOM 526 C ILE A 35 1.803 12.998 18.646 1.00 0.00 C ATOM 527 O ILE A 35 0.798 12.338 18.353 1.00 0.00 O ATOM 528 CB ILE A 35 0.843 14.572 20.494 1.00 0.00 C ATOM 529 CG1 ILE A 35 0.568 16.051 20.912 1.00 0.00 C ATOM 530 CG2 ILE A 35 1.524 13.785 21.648 1.00 0.00 C ATOM 531 CD1 ILE A 35 -0.240 16.275 22.202 1.00 0.00 C ATOM 0 H ILE A 35 0.341 14.778 17.572 1.00 0.00 H new ATOM 0 HA ILE A 35 2.642 14.874 19.487 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.128 14.122 20.289 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.528 16.556 21.022 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.042 16.542 20.093 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.925 13.876 22.554 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.607 12.734 21.372 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.519 14.192 21.829 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.359 17.344 22.376 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.222 15.813 22.101 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.287 15.827 23.044 1.00 0.00 H new ATOM 543 N LYS A 36 3.050 12.507 18.571 1.00 0.00 N ATOM 544 CA LYS A 36 3.361 11.134 18.101 1.00 0.00 C ATOM 545 C LYS A 36 3.211 10.115 19.269 1.00 0.00 C ATOM 546 O LYS A 36 3.796 10.291 20.344 1.00 0.00 O ATOM 547 CB LYS A 36 4.801 11.092 17.521 1.00 0.00 C ATOM 548 CG LYS A 36 5.012 11.647 16.092 1.00 0.00 C ATOM 549 CD LYS A 36 5.113 13.181 15.972 1.00 0.00 C ATOM 550 CE LYS A 36 5.426 13.633 14.534 1.00 0.00 C ATOM 551 NZ LYS A 36 5.554 15.096 14.443 1.00 0.00 N ATOM 0 H LYS A 36 3.876 13.045 18.833 1.00 0.00 H new ATOM 0 HA LYS A 36 2.657 10.858 17.316 1.00 0.00 H new ATOM 0 HB2 LYS A 36 5.452 11.647 18.197 1.00 0.00 H new ATOM 0 HB3 LYS A 36 5.138 10.056 17.533 1.00 0.00 H new ATOM 0 HG2 LYS A 36 5.923 11.210 15.684 1.00 0.00 H new ATOM 0 HG3 LYS A 36 4.187 11.307 15.466 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.175 13.632 16.296 1.00 0.00 H new ATOM 0 HD3 LYS A 36 5.891 13.546 16.643 1.00 0.00 H new ATOM 0 HE2 LYS A 36 6.351 13.164 14.198 1.00 0.00 H new ATOM 0 HE3 LYS A 36 4.635 13.294 13.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 6.207 15.340 13.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 4.621 15.515 14.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 5.924 15.469 15.341 1.00 0.00 H new ATOM 565 N GLY A 37 2.443 9.037 19.027 1.00 0.00 N ATOM 566 CA GLY A 37 2.226 7.964 20.025 1.00 0.00 C ATOM 567 C GLY A 37 3.346 6.904 20.128 1.00 0.00 C ATOM 568 O GLY A 37 4.481 7.120 19.693 1.00 0.00 O ATOM 0 H GLY A 37 1.958 8.882 18.143 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.097 8.425 21.004 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.292 7.456 19.787 1.00 0.00 H new ATOM 572 N VAL A 38 3.014 5.768 20.766 1.00 0.00 N ATOM 573 CA VAL A 38 3.995 4.679 21.049 1.00 0.00 C ATOM 574 C VAL A 38 3.267 3.345 20.713 1.00 0.00 C ATOM 575 O VAL A 38 2.370 2.920 21.447 1.00 0.00 O ATOM 576 CB VAL A 38 4.545 4.703 22.521 1.00 0.00 C ATOM 577 CG1 VAL A 38 5.626 3.619 22.752 1.00 0.00 C ATOM 578 CG2 VAL A 38 5.131 6.063 22.972 1.00 0.00 C ATOM 0 H VAL A 38 2.071 5.570 21.101 1.00 0.00 H new ATOM 0 HA VAL A 38 4.888 4.808 20.437 1.00 0.00 H new ATOM 0 HB VAL A 38 3.660 4.504 23.125 1.00 0.00 H new ATOM 0 HG11 VAL A 38 5.979 3.671 23.782 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.199 2.634 22.564 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.462 3.788 22.073 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.485 5.984 24.000 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.962 6.335 22.321 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.358 6.830 22.913 1.00 0.00 H new ATOM 588 N SER A 39 3.693 2.681 19.623 1.00 0.00 N ATOM 589 CA SER A 39 3.122 1.381 19.185 1.00 0.00 C ATOM 590 C SER A 39 3.972 0.204 19.729 1.00 0.00 C ATOM 591 O SER A 39 5.006 -0.142 19.150 1.00 0.00 O ATOM 592 CB SER A 39 3.053 1.371 17.643 1.00 0.00 C ATOM 593 OG SER A 39 2.409 0.190 17.178 1.00 0.00 O ATOM 0 H SER A 39 4.440 3.024 19.019 1.00 0.00 H new ATOM 0 HA SER A 39 2.116 1.257 19.585 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.511 2.249 17.292 1.00 0.00 H new ATOM 0 HB3 SER A 39 4.059 1.430 17.228 1.00 0.00 H new ATOM 0 HG SER A 39 2.645 0.037 16.239 1.00 0.00 H new ATOM 599 N GLU A 40 3.504 -0.418 20.826 1.00 0.00 N ATOM 600 CA GLU A 40 4.163 -1.615 21.410 1.00 0.00 C ATOM 601 C GLU A 40 3.287 -2.856 21.099 1.00 0.00 C ATOM 602 O GLU A 40 2.315 -3.132 21.807 1.00 0.00 O ATOM 603 CB GLU A 40 4.437 -1.401 22.923 1.00 0.00 C ATOM 604 CG GLU A 40 5.220 -2.563 23.583 1.00 0.00 C ATOM 605 CD GLU A 40 5.571 -2.341 25.055 1.00 0.00 C ATOM 606 OE1 GLU A 40 4.656 -2.093 25.872 1.00 0.00 O ATOM 607 OE2 GLU A 40 6.768 -2.434 25.408 1.00 0.00 O ATOM 0 H GLU A 40 2.671 -0.116 21.331 1.00 0.00 H new ATOM 0 HA GLU A 40 5.142 -1.783 20.962 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.998 -0.476 23.055 1.00 0.00 H new ATOM 0 HB3 GLU A 40 3.486 -1.274 23.441 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.630 -3.476 23.498 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.142 -2.726 23.024 1.00 0.00 H new ATOM 614 N ILE A 41 3.687 -3.616 20.063 1.00 0.00 N ATOM 615 CA ILE A 41 3.086 -4.940 19.738 1.00 0.00 C ATOM 616 C ILE A 41 3.861 -6.012 20.567 1.00 0.00 C ATOM 617 O ILE A 41 5.095 -5.999 20.625 1.00 0.00 O ATOM 618 CB ILE A 41 3.119 -5.269 18.201 1.00 0.00 C ATOM 619 CG1 ILE A 41 2.613 -4.143 17.250 1.00 0.00 C ATOM 620 CG2 ILE A 41 2.360 -6.587 17.882 1.00 0.00 C ATOM 621 CD1 ILE A 41 3.113 -4.287 15.806 1.00 0.00 C ATOM 0 H ILE A 41 4.433 -3.338 19.425 1.00 0.00 H new ATOM 0 HA ILE A 41 2.028 -4.932 20.000 1.00 0.00 H new ATOM 0 HB ILE A 41 4.184 -5.376 17.994 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.523 -4.142 17.250 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.933 -3.177 17.642 1.00 0.00 H new ATOM 0 HG21 ILE A 41 2.404 -6.782 16.810 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.824 -7.413 18.421 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.319 -6.491 18.191 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.721 -3.469 15.202 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.203 -4.258 15.794 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.771 -5.237 15.396 1.00 0.00 H new ATOM 633 N VAL A 42 3.115 -6.947 21.175 1.00 0.00 N ATOM 634 CA VAL A 42 3.692 -8.128 21.874 1.00 0.00 C ATOM 635 C VAL A 42 2.955 -9.354 21.260 1.00 0.00 C ATOM 636 O VAL A 42 1.817 -9.657 21.637 1.00 0.00 O ATOM 637 CB VAL A 42 3.560 -8.020 23.435 1.00 0.00 C ATOM 638 CG1 VAL A 42 4.123 -9.262 24.168 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.246 -6.766 24.034 1.00 0.00 C ATOM 0 H VAL A 42 2.096 -6.915 21.202 1.00 0.00 H new ATOM 0 HA VAL A 42 4.769 -8.213 21.726 1.00 0.00 H new ATOM 0 HB VAL A 42 2.485 -7.945 23.597 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.006 -9.134 25.244 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.580 -10.151 23.847 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.180 -9.377 23.929 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.113 -6.760 25.116 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.310 -6.787 23.800 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.798 -5.868 23.608 1.00 0.00 H new ATOM 649 N GLN A 43 3.628 -10.066 20.332 1.00 0.00 N ATOM 650 CA GLN A 43 3.137 -11.364 19.799 1.00 0.00 C ATOM 651 C GLN A 43 3.591 -12.550 20.700 1.00 0.00 C ATOM 652 O GLN A 43 4.711 -12.577 21.223 1.00 0.00 O ATOM 653 CB GLN A 43 3.526 -11.569 18.307 1.00 0.00 C ATOM 654 CG GLN A 43 5.029 -11.716 17.965 1.00 0.00 C ATOM 655 CD GLN A 43 5.317 -12.158 16.518 1.00 0.00 C ATOM 656 OE1 GLN A 43 4.623 -11.801 15.567 1.00 0.00 O ATOM 657 NE2 GLN A 43 6.373 -12.931 16.315 1.00 0.00 N ATOM 0 H GLN A 43 4.517 -9.766 19.932 1.00 0.00 H new ATOM 0 HA GLN A 43 2.048 -11.339 19.827 1.00 0.00 H new ATOM 0 HB2 GLN A 43 3.012 -12.460 17.947 1.00 0.00 H new ATOM 0 HB3 GLN A 43 3.135 -10.724 17.740 1.00 0.00 H new ATOM 0 HG2 GLN A 43 5.524 -10.762 18.145 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.474 -12.440 18.648 1.00 0.00 H new ATOM 0 HE21 GLN A 43 6.948 -13.227 17.104 1.00 0.00 H new ATOM 0 HE22 GLN A 43 6.611 -13.231 15.370 1.00 0.00 H new ATOM 666 N ASN A 44 2.697 -13.539 20.837 1.00 0.00 N ATOM 667 CA ASN A 44 2.998 -14.835 21.494 1.00 0.00 C ATOM 668 C ASN A 44 2.439 -15.951 20.568 1.00 0.00 C ATOM 669 O ASN A 44 1.332 -16.461 20.781 1.00 0.00 O ATOM 670 CB ASN A 44 2.416 -14.895 22.937 1.00 0.00 C ATOM 671 CG ASN A 44 3.087 -13.959 23.962 1.00 0.00 C ATOM 672 OD1 ASN A 44 4.235 -14.157 24.355 1.00 0.00 O ATOM 673 ND2 ASN A 44 2.391 -12.924 24.411 1.00 0.00 N ATOM 0 H ASN A 44 1.738 -13.470 20.496 1.00 0.00 H new ATOM 0 HA ASN A 44 4.072 -14.969 21.622 1.00 0.00 H new ATOM 0 HB2 ASN A 44 1.354 -14.654 22.892 1.00 0.00 H new ATOM 0 HB3 ASN A 44 2.496 -15.920 23.300 1.00 0.00 H new ATOM 0 HD21 ASN A 44 2.807 -12.284 25.088 1.00 0.00 H new ATOM 0 HD22 ASN A 44 1.439 -12.767 24.080 1.00 0.00 H new ATOM 680 N GLY A 45 3.201 -16.290 19.506 1.00 0.00 N ATOM 681 CA GLY A 45 2.739 -17.214 18.445 1.00 0.00 C ATOM 682 C GLY A 45 1.657 -16.588 17.539 1.00 0.00 C ATOM 683 O GLY A 45 1.933 -15.636 16.801 1.00 0.00 O ATOM 0 H GLY A 45 4.146 -15.935 19.359 1.00 0.00 H new ATOM 0 HA2 GLY A 45 3.590 -17.513 17.834 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.343 -18.119 18.905 1.00 0.00 H new ATOM 687 N LYS A 46 0.427 -17.118 17.648 1.00 0.00 N ATOM 688 CA LYS A 46 -0.775 -16.525 16.995 1.00 0.00 C ATOM 689 C LYS A 46 -1.551 -15.443 17.817 1.00 0.00 C ATOM 690 O LYS A 46 -2.262 -14.656 17.189 1.00 0.00 O ATOM 691 CB LYS A 46 -1.710 -17.640 16.445 1.00 0.00 C ATOM 692 CG LYS A 46 -2.393 -18.583 17.461 1.00 0.00 C ATOM 693 CD LYS A 46 -3.332 -19.602 16.781 1.00 0.00 C ATOM 694 CE LYS A 46 -4.058 -20.560 17.744 1.00 0.00 C ATOM 695 NZ LYS A 46 -5.125 -19.903 18.523 1.00 0.00 N ATOM 0 H LYS A 46 0.228 -17.962 18.184 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.377 -15.946 16.161 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.492 -17.159 15.858 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.128 -18.255 15.758 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -1.630 -19.118 18.026 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -2.962 -17.990 18.177 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -4.078 -19.057 16.203 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.751 -20.193 16.073 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -4.488 -21.382 17.172 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.331 -20.995 18.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -5.575 -20.599 19.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -4.716 -19.135 19.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -5.837 -19.511 17.874 1.00 0.00 H new ATOM 709 N HIS A 47 -1.447 -15.382 19.165 1.00 0.00 N ATOM 710 CA HIS A 47 -2.161 -14.370 19.995 1.00 0.00 C ATOM 711 C HIS A 47 -1.333 -13.055 20.085 1.00 0.00 C ATOM 712 O HIS A 47 -0.277 -12.996 20.722 1.00 0.00 O ATOM 713 CB HIS A 47 -2.476 -14.930 21.413 1.00 0.00 C ATOM 714 CG HIS A 47 -3.779 -15.730 21.517 1.00 0.00 C ATOM 715 ND1 HIS A 47 -4.913 -15.286 22.175 1.00 0.00 N ATOM 716 CD2 HIS A 47 -4.024 -17.000 20.965 1.00 0.00 C ATOM 717 CE1 HIS A 47 -5.747 -16.348 21.956 1.00 0.00 C ATOM 718 NE2 HIS A 47 -5.314 -17.433 21.237 1.00 0.00 N ATOM 0 H HIS A 47 -0.872 -16.025 19.709 1.00 0.00 H new ATOM 0 HA HIS A 47 -3.111 -14.142 19.511 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -1.650 -15.567 21.728 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.521 -14.097 22.115 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.299 -17.567 20.400 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -6.752 -16.332 22.351 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.794 -18.296 20.980 1.00 0.00 H new ATOM 726 N PHE A 48 -1.871 -12.008 19.448 1.00 0.00 N ATOM 727 CA PHE A 48 -1.280 -10.640 19.425 1.00 0.00 C ATOM 728 C PHE A 48 -2.031 -9.692 20.404 1.00 0.00 C ATOM 729 O PHE A 48 -3.248 -9.792 20.603 1.00 0.00 O ATOM 730 CB PHE A 48 -1.349 -10.063 17.980 1.00 0.00 C ATOM 731 CG PHE A 48 -0.289 -10.546 16.966 1.00 0.00 C ATOM 732 CD1 PHE A 48 -0.302 -11.858 16.479 1.00 0.00 C ATOM 733 CD2 PHE A 48 0.621 -9.631 16.425 1.00 0.00 C ATOM 734 CE1 PHE A 48 0.585 -12.252 15.481 1.00 0.00 C ATOM 735 CE2 PHE A 48 1.493 -10.019 15.411 1.00 0.00 C ATOM 736 CZ PHE A 48 1.474 -11.329 14.940 1.00 0.00 C ATOM 0 H PHE A 48 -2.742 -12.075 18.922 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.240 -10.710 19.744 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -2.333 -10.294 17.573 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -1.279 -8.977 18.048 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -1.006 -12.571 16.881 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.647 -8.617 16.796 1.00 0.00 H new ATOM 0 HE1 PHE A 48 0.583 -13.272 15.127 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.184 -9.304 14.990 1.00 0.00 H new ATOM 0 HZ PHE A 48 2.151 -11.629 14.153 1.00 0.00 H new ATOM 746 N LYS A 49 -1.282 -8.723 20.963 1.00 0.00 N ATOM 747 CA LYS A 49 -1.861 -7.575 21.710 1.00 0.00 C ATOM 748 C LYS A 49 -0.959 -6.335 21.463 1.00 0.00 C ATOM 749 O LYS A 49 0.251 -6.382 21.702 1.00 0.00 O ATOM 750 CB LYS A 49 -2.025 -7.899 23.221 1.00 0.00 C ATOM 751 CG LYS A 49 -2.731 -6.781 24.026 1.00 0.00 C ATOM 752 CD LYS A 49 -3.093 -7.139 25.480 1.00 0.00 C ATOM 753 CE LYS A 49 -1.917 -7.358 26.456 1.00 0.00 C ATOM 754 NZ LYS A 49 -1.142 -6.131 26.721 1.00 0.00 N ATOM 0 H LYS A 49 -0.263 -8.707 20.914 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.867 -7.363 21.348 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.593 -8.823 23.325 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.041 -8.079 23.653 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.086 -5.902 24.036 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.644 -6.500 23.501 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.722 -6.344 25.879 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.697 -8.046 25.466 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.304 -7.746 27.398 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.252 -8.118 26.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.368 -6.345 27.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.746 -5.771 25.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.765 -5.410 27.138 1.00 0.00 H new ATOM 768 N PHE A 50 -1.578 -5.221 21.029 1.00 0.00 N ATOM 769 CA PHE A 50 -0.877 -3.926 20.818 1.00 0.00 C ATOM 770 C PHE A 50 -1.659 -2.738 21.440 1.00 0.00 C ATOM 771 O PHE A 50 -2.889 -2.773 21.542 1.00 0.00 O ATOM 772 CB PHE A 50 -0.505 -3.724 19.320 1.00 0.00 C ATOM 773 CG PHE A 50 -1.573 -3.250 18.313 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.364 -4.176 17.626 1.00 0.00 C ATOM 775 CD2 PHE A 50 -1.715 -1.885 18.031 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.272 -3.745 16.661 1.00 0.00 C ATOM 777 CE2 PHE A 50 -2.624 -1.457 17.067 1.00 0.00 C ATOM 778 CZ PHE A 50 -3.398 -2.388 16.378 1.00 0.00 C ATOM 0 H PHE A 50 -2.574 -5.186 20.813 1.00 0.00 H new ATOM 0 HA PHE A 50 0.069 -3.958 21.358 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.314 -3.006 19.284 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.113 -4.673 18.953 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.271 -5.230 17.844 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.116 -1.161 18.564 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.879 -4.465 16.132 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -2.729 -0.404 16.854 1.00 0.00 H new ATOM 0 HZ PHE A 50 -4.096 -2.057 15.624 1.00 0.00 H new ATOM 788 N THR A 51 -0.936 -1.669 21.826 1.00 0.00 N ATOM 789 CA THR A 51 -1.558 -0.441 22.395 1.00 0.00 C ATOM 790 C THR A 51 -0.828 0.794 21.796 1.00 0.00 C ATOM 791 O THR A 51 0.399 0.910 21.890 1.00 0.00 O ATOM 792 CB THR A 51 -1.554 -0.466 23.954 1.00 0.00 C ATOM 793 OG1 THR A 51 -2.234 -1.628 24.425 1.00 0.00 O ATOM 794 CG2 THR A 51 -2.243 0.745 24.603 1.00 0.00 C ATOM 0 H THR A 51 0.081 -1.624 21.757 1.00 0.00 H new ATOM 0 HA THR A 51 -2.611 -0.386 22.120 1.00 0.00 H new ATOM 0 HB THR A 51 -0.501 -0.454 24.235 1.00 0.00 H new ATOM 0 HG1 THR A 51 -2.226 -1.637 25.405 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.197 0.651 25.688 1.00 0.00 H new ATOM 0 HG22 THR A 51 -1.736 1.660 24.296 1.00 0.00 H new ATOM 0 HG23 THR A 51 -3.285 0.784 24.286 1.00 0.00 H new ATOM 802 N ILE A 52 -1.615 1.731 21.229 1.00 0.00 N ATOM 803 CA ILE A 52 -1.101 3.024 20.695 1.00 0.00 C ATOM 804 C ILE A 52 -1.290 4.074 21.830 1.00 0.00 C ATOM 805 O ILE A 52 -2.389 4.608 22.011 1.00 0.00 O ATOM 806 CB ILE A 52 -1.804 3.437 19.348 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.892 2.335 18.249 1.00 0.00 C ATOM 808 CG2 ILE A 52 -1.198 4.734 18.749 1.00 0.00 C ATOM 809 CD1 ILE A 52 -0.561 1.715 17.801 1.00 0.00 C ATOM 0 H ILE A 52 -2.624 1.620 21.125 1.00 0.00 H new ATOM 0 HA ILE A 52 -0.047 2.945 20.428 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.834 3.613 19.659 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.536 1.536 18.616 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.382 2.762 17.374 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -1.713 4.981 17.821 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -1.316 5.553 19.459 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -0.138 4.580 18.546 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.750 0.963 17.035 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.084 2.493 17.394 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -0.071 1.248 18.655 1.00 0.00 H new ATOM 821 N THR A 53 -0.211 4.359 22.584 1.00 0.00 N ATOM 822 CA THR A 53 -0.263 5.276 23.757 1.00 0.00 C ATOM 823 C THR A 53 0.078 6.714 23.265 1.00 0.00 C ATOM 824 O THR A 53 1.250 7.094 23.176 1.00 0.00 O ATOM 825 CB THR A 53 0.671 4.742 24.886 1.00 0.00 C ATOM 826 OG1 THR A 53 0.325 3.400 25.225 1.00 0.00 O ATOM 827 CG2 THR A 53 0.613 5.559 26.189 1.00 0.00 C ATOM 0 H THR A 53 0.715 3.969 22.407 1.00 0.00 H new ATOM 0 HA THR A 53 -1.258 5.317 24.200 1.00 0.00 H new ATOM 0 HB THR A 53 1.677 4.819 24.474 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.921 3.078 25.933 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.291 5.123 26.923 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.911 6.588 25.987 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.404 5.546 26.582 1.00 0.00 H new ATOM 835 N ALA A 54 -0.976 7.482 22.939 1.00 0.00 N ATOM 836 CA ALA A 54 -0.862 8.862 22.393 1.00 0.00 C ATOM 837 C ALA A 54 -1.482 9.915 23.358 1.00 0.00 C ATOM 838 O ALA A 54 -2.197 9.576 24.311 1.00 0.00 O ATOM 839 CB ALA A 54 -1.553 8.859 21.012 1.00 0.00 C ATOM 0 H ALA A 54 -1.941 7.168 23.045 1.00 0.00 H new ATOM 0 HA ALA A 54 0.184 9.149 22.288 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -1.493 9.855 20.573 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -1.055 8.144 20.358 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -2.599 8.576 21.129 1.00 0.00 H new ATOM 845 N GLY A 55 -1.224 11.211 23.082 1.00 0.00 N ATOM 846 CA GLY A 55 -1.860 12.328 23.830 1.00 0.00 C ATOM 847 C GLY A 55 -3.277 12.716 23.342 1.00 0.00 C ATOM 848 O GLY A 55 -3.487 13.833 22.872 1.00 0.00 O ATOM 0 H GLY A 55 -0.582 11.514 22.350 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.917 12.055 24.884 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.216 13.205 23.762 1.00 0.00 H new ATOM 852 N SER A 56 -4.225 11.771 23.473 1.00 0.00 N ATOM 853 CA SER A 56 -5.614 11.869 22.949 1.00 0.00 C ATOM 854 C SER A 56 -6.400 10.628 23.455 1.00 0.00 C ATOM 855 O SER A 56 -7.333 10.783 24.248 1.00 0.00 O ATOM 856 CB SER A 56 -5.701 12.027 21.407 1.00 0.00 C ATOM 857 OG SER A 56 -7.053 12.160 20.990 1.00 0.00 O ATOM 0 H SER A 56 -4.049 10.891 23.958 1.00 0.00 H new ATOM 0 HA SER A 56 -6.062 12.788 23.329 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.131 12.902 21.094 1.00 0.00 H new ATOM 0 HB3 SER A 56 -5.249 11.162 20.922 1.00 0.00 H new ATOM 0 HG SER A 56 -7.123 12.883 20.332 1.00 0.00 H new ATOM 863 N LYS A 57 -6.029 9.416 22.987 1.00 0.00 N ATOM 864 CA LYS A 57 -6.653 8.145 23.411 1.00 0.00 C ATOM 865 C LYS A 57 -5.535 7.065 23.477 1.00 0.00 C ATOM 866 O LYS A 57 -4.702 6.938 22.570 1.00 0.00 O ATOM 867 CB LYS A 57 -7.802 7.771 22.431 1.00 0.00 C ATOM 868 CG LYS A 57 -8.702 6.612 22.919 1.00 0.00 C ATOM 869 CD LYS A 57 -9.862 6.232 21.970 1.00 0.00 C ATOM 870 CE LYS A 57 -10.998 7.264 21.812 1.00 0.00 C ATOM 871 NZ LYS A 57 -11.789 7.462 23.042 1.00 0.00 N ATOM 0 H LYS A 57 -5.284 9.292 22.301 1.00 0.00 H new ATOM 0 HA LYS A 57 -7.107 8.229 24.398 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -8.422 8.652 22.264 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -7.369 7.499 21.469 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -8.079 5.731 23.076 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -9.121 6.882 23.888 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.443 6.034 20.983 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -10.298 5.298 22.324 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -10.571 8.219 21.507 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -11.662 6.941 21.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.534 8.166 22.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -12.225 6.561 23.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -11.167 7.799 23.804 1.00 0.00 H new ATOM 885 N VAL A 58 -5.568 6.253 24.550 1.00 0.00 N ATOM 886 CA VAL A 58 -4.707 5.044 24.686 1.00 0.00 C ATOM 887 C VAL A 58 -5.525 3.872 24.056 1.00 0.00 C ATOM 888 O VAL A 58 -6.454 3.344 24.678 1.00 0.00 O ATOM 889 CB VAL A 58 -4.274 4.828 26.178 1.00 0.00 C ATOM 890 CG1 VAL A 58 -3.412 3.561 26.373 1.00 0.00 C ATOM 891 CG2 VAL A 58 -3.489 6.029 26.764 1.00 0.00 C ATOM 0 H VAL A 58 -6.185 6.408 25.347 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.756 5.133 24.160 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.217 4.717 26.713 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -3.142 3.463 27.424 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.979 2.684 26.060 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -2.506 3.641 25.772 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -3.219 5.817 27.798 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -2.584 6.193 26.179 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.111 6.923 26.728 1.00 0.00 H new ATOM 901 N ILE A 59 -5.203 3.527 22.794 1.00 0.00 N ATOM 902 CA ILE A 59 -6.096 2.713 21.919 1.00 0.00 C ATOM 903 C ILE A 59 -5.668 1.227 22.092 1.00 0.00 C ATOM 904 O ILE A 59 -4.683 0.785 21.494 1.00 0.00 O ATOM 905 CB ILE A 59 -6.063 3.204 20.422 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.399 4.719 20.251 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.009 2.358 19.530 1.00 0.00 C ATOM 908 CD1 ILE A 59 -6.153 5.322 18.860 1.00 0.00 C ATOM 0 H ILE A 59 -4.327 3.797 22.347 1.00 0.00 H new ATOM 0 HA ILE A 59 -7.139 2.827 22.213 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.031 3.066 20.098 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.448 4.867 20.506 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.812 5.283 20.976 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.963 2.722 18.504 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.699 1.313 19.559 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -8.031 2.443 19.900 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.424 6.378 18.868 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.099 5.220 18.600 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.761 4.797 18.123 1.00 0.00 H new ATOM 920 N GLN A 60 -6.431 0.474 22.905 1.00 0.00 N ATOM 921 CA GLN A 60 -6.089 -0.926 23.267 1.00 0.00 C ATOM 922 C GLN A 60 -6.751 -1.921 22.274 1.00 0.00 C ATOM 923 O GLN A 60 -7.970 -1.927 22.066 1.00 0.00 O ATOM 924 CB GLN A 60 -6.497 -1.210 24.737 1.00 0.00 C ATOM 925 CG GLN A 60 -5.537 -0.594 25.783 1.00 0.00 C ATOM 926 CD GLN A 60 -6.075 -0.645 27.219 1.00 0.00 C ATOM 927 OE1 GLN A 60 -6.823 0.232 27.650 1.00 0.00 O ATOM 928 NE2 GLN A 60 -5.706 -1.656 27.991 1.00 0.00 N ATOM 0 H GLN A 60 -7.296 0.809 23.330 1.00 0.00 H new ATOM 0 HA GLN A 60 -5.011 -1.065 23.191 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -7.501 -0.822 24.907 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -6.542 -2.288 24.890 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -4.584 -1.121 25.743 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -5.339 0.444 25.515 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -5.086 -2.378 27.624 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -6.042 -1.713 28.952 1.00 0.00 H new ATOM 937 N ASN A 61 -5.886 -2.745 21.667 1.00 0.00 N ATOM 938 CA ASN A 61 -6.242 -3.673 20.562 1.00 0.00 C ATOM 939 C ASN A 61 -5.711 -5.092 20.919 1.00 0.00 C ATOM 940 O ASN A 61 -4.589 -5.240 21.416 1.00 0.00 O ATOM 941 CB ASN A 61 -5.573 -3.177 19.248 1.00 0.00 C ATOM 942 CG ASN A 61 -6.028 -1.805 18.713 1.00 0.00 C ATOM 943 OD1 ASN A 61 -5.387 -0.786 18.962 1.00 0.00 O ATOM 944 ND2 ASN A 61 -7.122 -1.748 17.974 1.00 0.00 N ATOM 0 H ASN A 61 -4.901 -2.793 21.927 1.00 0.00 H new ATOM 0 HA ASN A 61 -7.323 -3.707 20.425 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -4.496 -3.139 19.408 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -5.754 -3.921 18.472 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.442 -0.853 17.604 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -7.647 -2.599 17.773 1.00 0.00 H new ATOM 951 N GLU A 62 -6.508 -6.140 20.642 1.00 0.00 N ATOM 952 CA GLU A 62 -6.102 -7.553 20.877 1.00 0.00 C ATOM 953 C GLU A 62 -6.757 -8.464 19.803 1.00 0.00 C ATOM 954 O GLU A 62 -7.984 -8.604 19.759 1.00 0.00 O ATOM 955 CB GLU A 62 -6.350 -8.032 22.337 1.00 0.00 C ATOM 956 CG GLU A 62 -7.782 -7.905 22.908 1.00 0.00 C ATOM 957 CD GLU A 62 -7.872 -8.359 24.368 1.00 0.00 C ATOM 958 OE1 GLU A 62 -7.591 -7.542 25.273 1.00 0.00 O ATOM 959 OE2 GLU A 62 -8.220 -9.534 24.616 1.00 0.00 O ATOM 0 H GLU A 62 -7.445 -6.042 20.252 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.020 -7.622 20.765 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.057 -9.080 22.399 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.679 -7.474 22.990 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.110 -6.868 22.832 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.466 -8.500 22.303 1.00 0.00 H new ATOM 966 N PHE A 63 -5.919 -9.068 18.938 1.00 0.00 N ATOM 967 CA PHE A 63 -6.377 -9.982 17.853 1.00 0.00 C ATOM 968 C PHE A 63 -5.669 -11.364 17.934 1.00 0.00 C ATOM 969 O PHE A 63 -4.612 -11.516 18.551 1.00 0.00 O ATOM 970 CB PHE A 63 -6.251 -9.312 16.449 1.00 0.00 C ATOM 971 CG PHE A 63 -4.842 -8.971 15.922 1.00 0.00 C ATOM 972 CD1 PHE A 63 -4.104 -9.927 15.210 1.00 0.00 C ATOM 973 CD2 PHE A 63 -4.301 -7.695 16.118 1.00 0.00 C ATOM 974 CE1 PHE A 63 -2.847 -9.607 14.705 1.00 0.00 C ATOM 975 CE2 PHE A 63 -3.041 -7.383 15.610 1.00 0.00 C ATOM 976 CZ PHE A 63 -2.318 -8.338 14.905 1.00 0.00 C ATOM 0 H PHE A 63 -4.907 -8.942 18.965 1.00 0.00 H new ATOM 0 HA PHE A 63 -7.439 -10.175 18.004 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -6.726 -9.971 15.723 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -6.830 -8.389 16.469 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -4.512 -10.915 15.053 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.861 -6.950 16.664 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -2.282 -10.346 14.157 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -2.626 -6.398 15.764 1.00 0.00 H new ATOM 0 HZ PHE A 63 -1.342 -8.093 14.512 1.00 0.00 H new ATOM 986 N THR A 64 -6.251 -12.364 17.250 1.00 0.00 N ATOM 987 CA THR A 64 -5.576 -13.662 16.980 1.00 0.00 C ATOM 988 C THR A 64 -5.606 -13.867 15.437 1.00 0.00 C ATOM 989 O THR A 64 -6.656 -13.727 14.796 1.00 0.00 O ATOM 990 CB THR A 64 -6.229 -14.826 17.781 1.00 0.00 C ATOM 991 OG1 THR A 64 -6.309 -14.494 19.164 1.00 0.00 O ATOM 992 CG2 THR A 64 -5.443 -16.142 17.690 1.00 0.00 C ATOM 0 H THR A 64 -7.195 -12.305 16.868 1.00 0.00 H new ATOM 0 HA THR A 64 -4.541 -13.654 17.322 1.00 0.00 H new ATOM 0 HB THR A 64 -7.214 -14.965 17.334 1.00 0.00 H new ATOM 0 HG1 THR A 64 -6.723 -15.234 19.655 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.953 -16.911 18.270 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.379 -16.456 16.648 1.00 0.00 H new ATOM 0 HG23 THR A 64 -4.439 -15.994 18.087 1.00 0.00 H new ATOM 1000 N VAL A 65 -4.440 -14.206 14.847 1.00 0.00 N ATOM 1001 CA VAL A 65 -4.275 -14.314 13.367 1.00 0.00 C ATOM 1002 C VAL A 65 -5.075 -15.512 12.765 1.00 0.00 C ATOM 1003 O VAL A 65 -5.029 -16.635 13.279 1.00 0.00 O ATOM 1004 CB VAL A 65 -2.780 -14.309 12.891 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -2.105 -12.935 13.076 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -1.886 -15.412 13.490 1.00 0.00 C ATOM 0 H VAL A 65 -3.589 -14.412 15.370 1.00 0.00 H new ATOM 0 HA VAL A 65 -4.712 -13.399 12.967 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.865 -14.534 11.828 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -1.072 -12.987 12.731 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -2.643 -12.184 12.497 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.122 -12.661 14.131 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.875 -15.316 13.094 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.862 -15.311 14.575 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.288 -16.390 13.225 1.00 0.00 H new ATOM 1016 N GLY A 66 -5.843 -15.220 11.702 1.00 0.00 N ATOM 1017 CA GLY A 66 -6.870 -16.152 11.176 1.00 0.00 C ATOM 1018 C GLY A 66 -8.211 -16.304 11.946 1.00 0.00 C ATOM 1019 O GLY A 66 -8.910 -17.294 11.716 1.00 0.00 O ATOM 0 H GLY A 66 -5.776 -14.344 11.184 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -7.108 -15.841 10.159 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.415 -17.140 11.109 1.00 0.00 H new ATOM 1023 N GLU A 67 -8.578 -15.343 12.817 1.00 0.00 N ATOM 1024 CA GLU A 67 -9.849 -15.359 13.592 1.00 0.00 C ATOM 1025 C GLU A 67 -10.421 -13.915 13.617 1.00 0.00 C ATOM 1026 O GLU A 67 -9.681 -12.939 13.800 1.00 0.00 O ATOM 1027 CB GLU A 67 -9.622 -15.863 15.046 1.00 0.00 C ATOM 1028 CG GLU A 67 -9.313 -17.372 15.170 1.00 0.00 C ATOM 1029 CD GLU A 67 -9.104 -17.832 16.615 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -10.090 -17.886 17.383 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -7.954 -18.152 16.986 1.00 0.00 O ATOM 0 H GLU A 67 -8.001 -14.524 13.009 1.00 0.00 H new ATOM 0 HA GLU A 67 -10.550 -16.043 13.114 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.798 -15.301 15.486 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -10.511 -15.639 15.636 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.132 -17.941 14.730 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.419 -17.601 14.590 1.00 0.00 H new ATOM 1038 N GLU A 68 -11.760 -13.788 13.480 1.00 0.00 N ATOM 1039 CA GLU A 68 -12.455 -12.471 13.542 1.00 0.00 C ATOM 1040 C GLU A 68 -12.568 -11.980 15.016 1.00 0.00 C ATOM 1041 O GLU A 68 -13.379 -12.485 15.799 1.00 0.00 O ATOM 1042 CB GLU A 68 -13.804 -12.470 12.768 1.00 0.00 C ATOM 1043 CG GLU A 68 -14.930 -13.421 13.240 1.00 0.00 C ATOM 1044 CD GLU A 68 -16.110 -13.461 12.265 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -16.911 -12.500 12.242 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -16.238 -14.450 11.510 1.00 0.00 O ATOM 0 H GLU A 68 -12.386 -14.578 13.326 1.00 0.00 H new ATOM 0 HA GLU A 68 -11.843 -11.738 13.016 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -14.198 -11.454 12.791 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -13.588 -12.705 11.726 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -14.526 -14.427 13.358 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -15.284 -13.102 14.221 1.00 0.00 H new ATOM 1053 N CYS A 69 -11.688 -11.033 15.384 1.00 0.00 N ATOM 1054 CA CYS A 69 -11.486 -10.604 16.789 1.00 0.00 C ATOM 1055 C CYS A 69 -11.854 -9.108 16.934 1.00 0.00 C ATOM 1056 O CYS A 69 -11.396 -8.260 16.158 1.00 0.00 O ATOM 1057 CB CYS A 69 -10.015 -10.844 17.178 1.00 0.00 C ATOM 1058 SG CYS A 69 -9.599 -12.619 17.085 1.00 0.00 S ATOM 0 H CYS A 69 -11.093 -10.539 14.718 1.00 0.00 H new ATOM 0 HA CYS A 69 -12.129 -11.181 17.454 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -9.362 -10.278 16.514 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -9.837 -10.477 18.189 1.00 0.00 H new ATOM 0 HG CYS A 69 -9.510 -12.979 15.839 1.00 0.00 H new ATOM 1064 N GLU A 70 -12.687 -8.800 17.945 1.00 0.00 N ATOM 1065 CA GLU A 70 -13.242 -7.437 18.154 1.00 0.00 C ATOM 1066 C GLU A 70 -12.180 -6.435 18.693 1.00 0.00 C ATOM 1067 O GLU A 70 -11.569 -6.660 19.744 1.00 0.00 O ATOM 1068 CB GLU A 70 -14.561 -7.476 18.978 1.00 0.00 C ATOM 1069 CG GLU A 70 -14.529 -7.905 20.467 1.00 0.00 C ATOM 1070 CD GLU A 70 -14.300 -9.401 20.712 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -15.257 -10.193 20.561 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -13.161 -9.791 21.051 1.00 0.00 O ATOM 0 H GLU A 70 -12.997 -9.480 18.640 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.518 -7.041 17.177 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -14.999 -6.479 18.937 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -15.247 -8.147 18.461 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.742 -7.346 20.972 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -15.472 -7.618 20.931 1.00 0.00 H new ATOM 1079 N LEU A 71 -11.953 -5.355 17.923 1.00 0.00 N ATOM 1080 CA LEU A 71 -10.863 -4.381 18.182 1.00 0.00 C ATOM 1081 C LEU A 71 -11.475 -2.993 18.475 1.00 0.00 C ATOM 1082 O LEU A 71 -12.216 -2.465 17.640 1.00 0.00 O ATOM 1083 CB LEU A 71 -9.930 -4.271 16.935 1.00 0.00 C ATOM 1084 CG LEU A 71 -9.028 -5.482 16.576 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -8.171 -5.176 15.330 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -8.117 -5.877 17.746 1.00 0.00 C ATOM 0 H LEU A 71 -12.516 -5.128 17.103 1.00 0.00 H new ATOM 0 HA LEU A 71 -10.281 -4.723 19.038 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.557 -4.057 16.070 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.282 -3.407 17.081 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.689 -6.321 16.359 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.547 -6.039 15.097 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.823 -4.961 14.484 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.537 -4.312 15.528 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.501 -6.728 17.456 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.474 -5.036 18.007 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.728 -6.148 18.607 1.00 0.00 H new ATOM 1098 N GLU A 72 -11.092 -2.353 19.602 1.00 0.00 N ATOM 1099 CA GLU A 72 -11.390 -0.910 19.831 1.00 0.00 C ATOM 1100 C GLU A 72 -10.378 -0.078 18.995 1.00 0.00 C ATOM 1101 O GLU A 72 -9.237 0.143 19.410 1.00 0.00 O ATOM 1102 CB GLU A 72 -11.378 -0.557 21.343 1.00 0.00 C ATOM 1103 CG GLU A 72 -11.962 0.826 21.720 1.00 0.00 C ATOM 1104 CD GLU A 72 -11.081 2.043 21.398 1.00 0.00 C ATOM 1105 OE1 GLU A 72 -9.988 2.177 21.993 1.00 0.00 O ATOM 1106 OE2 GLU A 72 -11.476 2.867 20.544 1.00 0.00 O ATOM 0 H GLU A 72 -10.581 -2.801 20.363 1.00 0.00 H new ATOM 0 HA GLU A 72 -12.400 -0.669 19.499 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.937 -1.324 21.880 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -10.349 -0.604 21.699 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -12.916 0.947 21.206 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.174 0.829 22.789 1.00 0.00 H new ATOM 1113 N THR A 73 -10.826 0.330 17.799 1.00 0.00 N ATOM 1114 CA THR A 73 -9.951 0.955 16.768 1.00 0.00 C ATOM 1115 C THR A 73 -9.934 2.506 16.858 1.00 0.00 C ATOM 1116 O THR A 73 -10.711 3.137 17.583 1.00 0.00 O ATOM 1117 CB THR A 73 -10.345 0.427 15.347 1.00 0.00 C ATOM 1118 OG1 THR A 73 -11.718 0.685 15.057 1.00 0.00 O ATOM 1119 CG2 THR A 73 -10.055 -1.064 15.110 1.00 0.00 C ATOM 0 H THR A 73 -11.800 0.241 17.509 1.00 0.00 H new ATOM 0 HA THR A 73 -8.922 0.655 16.963 1.00 0.00 H new ATOM 0 HB THR A 73 -9.700 0.985 14.668 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.813 1.596 14.709 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.361 -1.338 14.100 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.988 -1.251 15.229 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.611 -1.662 15.832 1.00 0.00 H new ATOM 1127 N MET A 74 -9.037 3.111 16.053 1.00 0.00 N ATOM 1128 CA MET A 74 -9.102 4.549 15.682 1.00 0.00 C ATOM 1129 C MET A 74 -10.350 4.818 14.785 1.00 0.00 C ATOM 1130 O MET A 74 -10.349 4.543 13.585 1.00 0.00 O ATOM 1131 CB MET A 74 -7.760 5.032 15.066 1.00 0.00 C ATOM 1132 CG MET A 74 -7.158 4.243 13.881 1.00 0.00 C ATOM 1133 SD MET A 74 -5.437 4.730 13.631 1.00 0.00 S ATOM 1134 CE MET A 74 -4.570 3.833 14.945 1.00 0.00 C ATOM 0 H MET A 74 -8.244 2.620 15.639 1.00 0.00 H new ATOM 0 HA MET A 74 -9.236 5.152 16.580 1.00 0.00 H new ATOM 0 HB2 MET A 74 -7.899 6.063 14.740 1.00 0.00 H new ATOM 0 HB3 MET A 74 -7.017 5.047 15.864 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.217 3.173 14.078 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.734 4.433 12.976 1.00 0.00 H new ATOM 0 HE1 MET A 74 -3.495 3.878 14.769 1.00 0.00 H new ATOM 0 HE2 MET A 74 -4.799 4.288 15.909 1.00 0.00 H new ATOM 0 HE3 MET A 74 -4.893 2.792 14.950 1.00 0.00 H new ATOM 1144 N THR A 75 -11.409 5.267 15.474 1.00 0.00 N ATOM 1145 CA THR A 75 -12.817 5.414 14.990 1.00 0.00 C ATOM 1146 C THR A 75 -13.737 5.385 16.252 1.00 0.00 C ATOM 1147 O THR A 75 -14.410 6.384 16.526 1.00 0.00 O ATOM 1148 CB THR A 75 -13.414 4.493 13.867 1.00 0.00 C ATOM 1149 OG1 THR A 75 -12.894 3.170 13.928 1.00 0.00 O ATOM 1150 CG2 THR A 75 -13.254 5.051 12.445 1.00 0.00 C ATOM 0 H THR A 75 -11.315 5.559 16.447 1.00 0.00 H new ATOM 0 HA THR A 75 -12.780 6.351 14.435 1.00 0.00 H new ATOM 0 HB THR A 75 -14.483 4.468 14.078 1.00 0.00 H new ATOM 0 HG1 THR A 75 -13.291 2.629 13.214 1.00 0.00 H new ATOM 0 HG21 THR A 75 -13.692 4.355 11.730 1.00 0.00 H new ATOM 0 HG22 THR A 75 -13.761 6.013 12.373 1.00 0.00 H new ATOM 0 HG23 THR A 75 -12.195 5.181 12.222 1.00 0.00 H new ATOM 1158 N GLY A 76 -13.801 4.253 16.986 1.00 0.00 N ATOM 1159 CA GLY A 76 -14.738 4.086 18.123 1.00 0.00 C ATOM 1160 C GLY A 76 -15.154 2.622 18.360 1.00 0.00 C ATOM 1161 O GLY A 76 -14.908 2.076 19.439 1.00 0.00 O ATOM 0 H GLY A 76 -13.213 3.438 16.812 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.273 4.475 19.028 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -15.630 4.685 17.940 1.00 0.00 H new ATOM 1165 N GLU A 77 -15.816 2.016 17.354 1.00 0.00 N ATOM 1166 CA GLU A 77 -16.471 0.685 17.458 1.00 0.00 C ATOM 1167 C GLU A 77 -15.507 -0.484 17.826 1.00 0.00 C ATOM 1168 O GLU A 77 -14.363 -0.534 17.359 1.00 0.00 O ATOM 1169 CB GLU A 77 -17.166 0.433 16.085 1.00 0.00 C ATOM 1170 CG GLU A 77 -18.168 -0.742 16.038 1.00 0.00 C ATOM 1171 CD GLU A 77 -18.761 -0.963 14.644 1.00 0.00 C ATOM 1172 OE1 GLU A 77 -19.684 -0.214 14.252 1.00 0.00 O ATOM 1173 OE2 GLU A 77 -18.305 -1.886 13.931 1.00 0.00 O ATOM 0 H GLU A 77 -15.915 2.439 16.431 1.00 0.00 H new ATOM 0 HA GLU A 77 -17.181 0.704 18.285 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.690 1.343 15.793 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -16.394 0.256 15.336 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -17.667 -1.654 16.363 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -18.976 -0.553 16.745 1.00 0.00 H new ATOM 1180 N LYS A 78 -16.026 -1.447 18.616 1.00 0.00 N ATOM 1181 CA LYS A 78 -15.393 -2.779 18.791 1.00 0.00 C ATOM 1182 C LYS A 78 -15.784 -3.683 17.586 1.00 0.00 C ATOM 1183 O LYS A 78 -16.882 -4.245 17.519 1.00 0.00 O ATOM 1184 CB LYS A 78 -15.755 -3.422 20.151 1.00 0.00 C ATOM 1185 CG LYS A 78 -15.100 -2.750 21.385 1.00 0.00 C ATOM 1186 CD LYS A 78 -14.727 -3.743 22.507 1.00 0.00 C ATOM 1187 CE LYS A 78 -13.470 -4.592 22.204 1.00 0.00 C ATOM 1188 NZ LYS A 78 -12.214 -3.946 22.622 1.00 0.00 N ATOM 0 H LYS A 78 -16.888 -1.329 19.148 1.00 0.00 H new ATOM 0 HA LYS A 78 -14.310 -2.661 18.807 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -16.838 -3.395 20.273 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.463 -4.472 20.129 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -14.202 -2.222 21.066 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -15.784 -2.002 21.786 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.563 -3.187 23.430 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -15.570 -4.411 22.682 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -13.560 -5.554 22.708 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.427 -4.795 21.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -11.622 -3.766 21.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -12.428 -3.045 23.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -11.705 -4.570 23.279 1.00 0.00 H new ATOM 1202 N VAL A 79 -14.861 -3.741 16.617 1.00 0.00 N ATOM 1203 CA VAL A 79 -15.132 -4.198 15.233 1.00 0.00 C ATOM 1204 C VAL A 79 -14.409 -5.555 14.992 1.00 0.00 C ATOM 1205 O VAL A 79 -13.174 -5.623 15.006 1.00 0.00 O ATOM 1206 CB VAL A 79 -14.757 -3.043 14.239 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -13.344 -2.422 14.364 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -15.003 -3.434 12.770 1.00 0.00 C ATOM 0 H VAL A 79 -13.889 -3.470 16.767 1.00 0.00 H new ATOM 0 HA VAL A 79 -16.188 -4.403 15.060 1.00 0.00 H new ATOM 0 HB VAL A 79 -15.442 -2.258 14.559 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.224 -1.638 13.616 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.221 -1.996 15.360 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.592 -3.194 14.204 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.729 -2.602 12.121 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.398 -4.305 12.519 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -16.057 -3.672 12.628 1.00 0.00 H new ATOM 1218 N LYS A 80 -15.197 -6.623 14.745 1.00 0.00 N ATOM 1219 CA LYS A 80 -14.662 -7.991 14.508 1.00 0.00 C ATOM 1220 C LYS A 80 -14.082 -8.130 13.072 1.00 0.00 C ATOM 1221 O LYS A 80 -14.802 -8.025 12.075 1.00 0.00 O ATOM 1222 CB LYS A 80 -15.674 -9.097 14.907 1.00 0.00 C ATOM 1223 CG LYS A 80 -16.997 -9.199 14.113 1.00 0.00 C ATOM 1224 CD LYS A 80 -17.924 -10.302 14.656 1.00 0.00 C ATOM 1225 CE LYS A 80 -19.219 -10.447 13.836 1.00 0.00 C ATOM 1226 NZ LYS A 80 -20.070 -11.527 14.366 1.00 0.00 N ATOM 0 H LYS A 80 -16.215 -6.568 14.703 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.817 -8.146 15.179 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.165 -10.058 14.830 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.927 -8.954 15.958 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -17.515 -8.241 14.152 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -16.774 -9.399 13.065 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.390 -11.252 14.655 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -18.178 -10.080 15.692 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -19.769 -9.506 13.852 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -18.972 -10.654 12.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -20.935 -11.600 13.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -19.552 -12.428 14.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -20.325 -11.316 15.352 1.00 0.00 H new ATOM 1240 N THR A 81 -12.752 -8.305 13.011 1.00 0.00 N ATOM 1241 CA THR A 81 -11.972 -8.234 11.747 1.00 0.00 C ATOM 1242 C THR A 81 -10.877 -9.340 11.757 1.00 0.00 C ATOM 1243 O THR A 81 -10.142 -9.507 12.738 1.00 0.00 O ATOM 1244 CB THR A 81 -11.423 -6.792 11.509 1.00 0.00 C ATOM 1245 OG1 THR A 81 -10.846 -6.720 10.211 1.00 0.00 O ATOM 1246 CG2 THR A 81 -10.392 -6.260 12.524 1.00 0.00 C ATOM 0 H THR A 81 -12.179 -8.500 13.832 1.00 0.00 H new ATOM 0 HA THR A 81 -12.617 -8.435 10.891 1.00 0.00 H new ATOM 0 HB THR A 81 -12.298 -6.153 11.632 1.00 0.00 H new ATOM 0 HG1 THR A 81 -9.869 -6.736 10.286 1.00 0.00 H new ATOM 0 HG21 THR A 81 -10.093 -5.250 12.243 1.00 0.00 H new ATOM 0 HG22 THR A 81 -10.836 -6.244 13.519 1.00 0.00 H new ATOM 0 HG23 THR A 81 -9.517 -6.910 12.528 1.00 0.00 H new ATOM 1254 N VAL A 82 -10.765 -10.073 10.633 1.00 0.00 N ATOM 1255 CA VAL A 82 -9.763 -11.164 10.466 1.00 0.00 C ATOM 1256 C VAL A 82 -8.412 -10.510 10.043 1.00 0.00 C ATOM 1257 O VAL A 82 -8.333 -9.859 8.994 1.00 0.00 O ATOM 1258 CB VAL A 82 -10.214 -12.259 9.434 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -9.254 -13.472 9.427 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -11.636 -12.824 9.647 1.00 0.00 C ATOM 0 H VAL A 82 -11.358 -9.934 9.815 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.655 -11.691 11.414 1.00 0.00 H new ATOM 0 HB VAL A 82 -10.199 -11.717 8.488 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -9.601 -14.206 8.700 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.251 -13.141 9.158 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.233 -13.925 10.418 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.849 -13.572 8.883 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.701 -13.284 10.633 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -12.363 -12.015 9.576 1.00 0.00 H new ATOM 1270 N VAL A 83 -7.362 -10.719 10.859 1.00 0.00 N ATOM 1271 CA VAL A 83 -5.995 -10.216 10.551 1.00 0.00 C ATOM 1272 C VAL A 83 -5.175 -11.441 10.056 1.00 0.00 C ATOM 1273 O VAL A 83 -4.626 -12.190 10.867 1.00 0.00 O ATOM 1274 CB VAL A 83 -5.322 -9.474 11.761 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -4.006 -8.781 11.331 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -6.205 -8.435 12.494 1.00 0.00 C ATOM 0 H VAL A 83 -7.426 -11.232 11.738 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.039 -9.449 9.778 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.137 -10.277 12.475 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -3.563 -8.276 12.190 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -3.309 -9.528 10.950 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.218 -8.051 10.550 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.638 -7.987 13.310 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -6.510 -7.658 11.793 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -7.090 -8.928 12.896 1.00 0.00 H new ATOM 1286 N GLN A 84 -5.074 -11.636 8.729 1.00 0.00 N ATOM 1287 CA GLN A 84 -4.267 -12.728 8.141 1.00 0.00 C ATOM 1288 C GLN A 84 -2.796 -12.272 7.976 1.00 0.00 C ATOM 1289 O GLN A 84 -2.510 -11.242 7.357 1.00 0.00 O ATOM 1290 CB GLN A 84 -4.853 -13.141 6.772 1.00 0.00 C ATOM 1291 CG GLN A 84 -6.202 -13.890 6.779 1.00 0.00 C ATOM 1292 CD GLN A 84 -6.253 -15.295 7.412 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -5.306 -15.800 8.018 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -7.386 -15.967 7.274 1.00 0.00 N ATOM 0 H GLN A 84 -5.543 -11.050 8.038 1.00 0.00 H new ATOM 0 HA GLN A 84 -4.295 -13.588 8.810 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -4.970 -12.240 6.169 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -4.120 -13.770 6.267 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -6.927 -13.264 7.299 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -6.539 -13.978 5.746 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -8.169 -15.548 6.772 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -7.475 -16.903 7.669 1.00 0.00 H new ATOM 1303 N LEU A 85 -1.874 -13.087 8.514 1.00 0.00 N ATOM 1304 CA LEU A 85 -0.417 -12.848 8.374 1.00 0.00 C ATOM 1305 C LEU A 85 0.088 -13.480 7.050 1.00 0.00 C ATOM 1306 O LEU A 85 0.019 -14.697 6.849 1.00 0.00 O ATOM 1307 CB LEU A 85 0.336 -13.362 9.632 1.00 0.00 C ATOM 1308 CG LEU A 85 1.886 -13.217 9.649 1.00 0.00 C ATOM 1309 CD1 LEU A 85 2.413 -11.811 9.300 1.00 0.00 C ATOM 1310 CD2 LEU A 85 2.442 -13.657 11.013 1.00 0.00 C ATOM 0 H LEU A 85 -2.107 -13.921 9.053 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.212 -11.779 8.314 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.061 -12.836 10.500 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.095 -14.417 9.761 1.00 0.00 H new ATOM 0 HG LEU A 85 2.244 -13.870 8.853 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.502 -11.811 9.339 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.085 -11.538 8.297 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.024 -11.088 10.018 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.527 -13.552 11.015 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.016 -13.033 11.798 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.178 -14.699 11.195 1.00 0.00 H new ATOM 1322 N GLU A 86 0.607 -12.604 6.176 1.00 0.00 N ATOM 1323 CA GLU A 86 1.214 -12.995 4.883 1.00 0.00 C ATOM 1324 C GLU A 86 2.759 -12.867 4.962 1.00 0.00 C ATOM 1325 O GLU A 86 3.311 -11.926 5.543 1.00 0.00 O ATOM 1326 CB GLU A 86 0.603 -12.148 3.743 1.00 0.00 C ATOM 1327 CG GLU A 86 0.908 -12.647 2.313 1.00 0.00 C ATOM 1328 CD GLU A 86 0.304 -14.008 1.946 1.00 0.00 C ATOM 1329 OE1 GLU A 86 -0.903 -14.070 1.623 1.00 0.00 O ATOM 1330 OE2 GLU A 86 1.035 -15.021 1.980 1.00 0.00 O ATOM 0 H GLU A 86 0.620 -11.598 6.342 1.00 0.00 H new ATOM 0 HA GLU A 86 0.992 -14.040 4.665 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -0.478 -12.116 3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.966 -11.125 3.838 1.00 0.00 H new ATOM 0 HG2 GLU A 86 0.545 -11.904 1.603 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.990 -12.704 2.190 1.00 0.00 H new ATOM 1337 N GLY A 87 3.434 -13.848 4.343 1.00 0.00 N ATOM 1338 CA GLY A 87 4.911 -13.889 4.264 1.00 0.00 C ATOM 1339 C GLY A 87 5.582 -14.296 5.591 1.00 0.00 C ATOM 1340 O GLY A 87 5.572 -15.471 5.966 1.00 0.00 O ATOM 0 H GLY A 87 2.977 -14.635 3.883 1.00 0.00 H new ATOM 0 HA2 GLY A 87 5.207 -14.592 3.485 1.00 0.00 H new ATOM 0 HA3 GLY A 87 5.279 -12.908 3.965 1.00 0.00 H new ATOM 1344 N ASP A 88 6.152 -13.296 6.280 1.00 0.00 N ATOM 1345 CA ASP A 88 6.775 -13.462 7.629 1.00 0.00 C ATOM 1346 C ASP A 88 6.450 -12.284 8.594 1.00 0.00 C ATOM 1347 O ASP A 88 6.151 -12.520 9.769 1.00 0.00 O ATOM 1348 CB ASP A 88 8.314 -13.689 7.552 1.00 0.00 C ATOM 1349 CG ASP A 88 8.757 -15.018 6.923 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.651 -16.069 7.593 1.00 0.00 O ATOM 1351 OD2 ASP A 88 9.202 -15.015 5.756 1.00 0.00 O ATOM 0 H ASP A 88 6.201 -12.340 5.927 1.00 0.00 H new ATOM 0 HA ASP A 88 6.322 -14.363 8.043 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.756 -12.872 6.981 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.723 -13.631 8.561 1.00 0.00 H new ATOM 1356 N ASN A 89 6.553 -11.036 8.107 1.00 0.00 N ATOM 1357 CA ASN A 89 6.332 -9.800 8.901 1.00 0.00 C ATOM 1358 C ASN A 89 5.459 -8.763 8.125 1.00 0.00 C ATOM 1359 O ASN A 89 5.845 -7.599 7.979 1.00 0.00 O ATOM 1360 CB ASN A 89 7.707 -9.270 9.400 1.00 0.00 C ATOM 1361 CG ASN A 89 8.765 -8.790 8.373 1.00 0.00 C ATOM 1362 OD1 ASN A 89 8.562 -8.774 7.158 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.927 -8.388 8.858 1.00 0.00 N ATOM 0 H ASN A 89 6.796 -10.847 7.135 1.00 0.00 H new ATOM 0 HA ASN A 89 5.739 -10.016 9.790 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.509 -8.438 10.076 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.165 -10.061 9.993 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.659 -8.063 8.226 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.092 -8.402 9.864 1.00 0.00 H new ATOM 1370 N LYS A 90 4.268 -9.184 7.647 1.00 0.00 N ATOM 1371 CA LYS A 90 3.371 -8.328 6.823 1.00 0.00 C ATOM 1372 C LYS A 90 1.898 -8.742 7.096 1.00 0.00 C ATOM 1373 O LYS A 90 1.368 -9.666 6.473 1.00 0.00 O ATOM 1374 CB LYS A 90 3.823 -8.412 5.334 1.00 0.00 C ATOM 1375 CG LYS A 90 3.195 -7.404 4.347 1.00 0.00 C ATOM 1376 CD LYS A 90 1.910 -7.889 3.646 1.00 0.00 C ATOM 1377 CE LYS A 90 1.541 -7.012 2.436 1.00 0.00 C ATOM 1378 NZ LYS A 90 0.307 -7.476 1.780 1.00 0.00 N ATOM 0 H LYS A 90 3.898 -10.119 7.817 1.00 0.00 H new ATOM 0 HA LYS A 90 3.436 -7.273 7.090 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.905 -8.286 5.302 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.608 -9.417 4.972 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.971 -6.483 4.886 1.00 0.00 H new ATOM 0 HG3 LYS A 90 3.934 -7.156 3.585 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.044 -8.920 3.318 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.086 -7.886 4.359 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.414 -5.979 2.761 1.00 0.00 H new ATOM 0 HE3 LYS A 90 2.360 -7.021 1.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.332 -7.219 0.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.232 -8.509 1.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.516 -7.028 2.232 1.00 0.00 H new ATOM 1392 N LEU A 91 1.246 -8.027 8.031 1.00 0.00 N ATOM 1393 CA LEU A 91 -0.176 -8.263 8.421 1.00 0.00 C ATOM 1394 C LEU A 91 -1.160 -7.570 7.430 1.00 0.00 C ATOM 1395 O LEU A 91 -0.832 -6.548 6.816 1.00 0.00 O ATOM 1396 CB LEU A 91 -0.411 -7.732 9.866 1.00 0.00 C ATOM 1397 CG LEU A 91 0.354 -8.452 11.016 1.00 0.00 C ATOM 1398 CD1 LEU A 91 0.459 -7.553 12.262 1.00 0.00 C ATOM 1399 CD2 LEU A 91 -0.261 -9.815 11.387 1.00 0.00 C ATOM 0 H LEU A 91 1.684 -7.263 8.546 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.369 -9.335 8.386 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.140 -6.676 9.887 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -1.478 -7.791 10.080 1.00 0.00 H new ATOM 0 HG LEU A 91 1.357 -8.649 10.636 1.00 0.00 H new ATOM 0 HD11 LEU A 91 0.998 -8.082 13.048 1.00 0.00 H new ATOM 0 HD12 LEU A 91 0.995 -6.639 12.007 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -0.541 -7.301 12.614 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.316 -10.267 12.194 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.291 -9.673 11.713 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.244 -10.471 10.517 1.00 0.00 H new ATOM 1411 N VAL A 92 -2.364 -8.154 7.271 1.00 0.00 N ATOM 1412 CA VAL A 92 -3.354 -7.716 6.244 1.00 0.00 C ATOM 1413 C VAL A 92 -4.756 -7.768 6.924 1.00 0.00 C ATOM 1414 O VAL A 92 -5.257 -8.851 7.250 1.00 0.00 O ATOM 1415 CB VAL A 92 -3.290 -8.589 4.936 1.00 0.00 C ATOM 1416 CG1 VAL A 92 -4.240 -8.058 3.836 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -1.881 -8.714 4.309 1.00 0.00 C ATOM 0 H VAL A 92 -2.684 -8.937 7.841 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.130 -6.704 5.907 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.599 -9.576 5.280 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.163 -8.691 2.952 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.266 -8.072 4.204 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.961 -7.037 3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.935 -9.333 3.413 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.511 -7.723 4.044 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.203 -9.174 5.027 1.00 0.00 H new ATOM 1427 N THR A 93 -5.388 -6.593 7.107 1.00 0.00 N ATOM 1428 CA THR A 93 -6.754 -6.473 7.701 1.00 0.00 C ATOM 1429 C THR A 93 -7.526 -5.259 7.100 1.00 0.00 C ATOM 1430 O THR A 93 -6.947 -4.372 6.466 1.00 0.00 O ATOM 1431 CB THR A 93 -6.675 -6.476 9.262 1.00 0.00 C ATOM 1432 OG1 THR A 93 -7.961 -6.734 9.812 1.00 0.00 O ATOM 1433 CG2 THR A 93 -6.099 -5.223 9.947 1.00 0.00 C ATOM 0 H THR A 93 -4.976 -5.696 6.851 1.00 0.00 H new ATOM 0 HA THR A 93 -7.344 -7.348 7.430 1.00 0.00 H new ATOM 0 HB THR A 93 -5.952 -7.265 9.470 1.00 0.00 H new ATOM 0 HG1 THR A 93 -8.212 -7.665 9.635 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.104 -5.364 11.028 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.076 -5.060 9.607 1.00 0.00 H new ATOM 0 HG23 THR A 93 -6.708 -4.356 9.691 1.00 0.00 H new ATOM 1441 N THR A 94 -8.855 -5.233 7.317 1.00 0.00 N ATOM 1442 CA THR A 94 -9.731 -4.118 6.870 1.00 0.00 C ATOM 1443 C THR A 94 -10.884 -3.925 7.899 1.00 0.00 C ATOM 1444 O THR A 94 -11.674 -4.842 8.147 1.00 0.00 O ATOM 1445 CB THR A 94 -10.192 -4.262 5.389 1.00 0.00 C ATOM 1446 OG1 THR A 94 -11.008 -3.152 5.026 1.00 0.00 O ATOM 1447 CG2 THR A 94 -10.925 -5.566 5.020 1.00 0.00 C ATOM 0 H THR A 94 -9.355 -5.977 7.804 1.00 0.00 H new ATOM 0 HA THR A 94 -9.155 -3.193 6.856 1.00 0.00 H new ATOM 0 HB THR A 94 -9.260 -4.293 4.824 1.00 0.00 H new ATOM 0 HG1 THR A 94 -11.293 -3.247 4.093 1.00 0.00 H new ATOM 0 HG21 THR A 94 -11.194 -5.546 3.964 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.272 -6.417 5.212 1.00 0.00 H new ATOM 0 HG23 THR A 94 -11.828 -5.659 5.623 1.00 0.00 H new ATOM 1455 N PHE A 95 -10.963 -2.711 8.472 1.00 0.00 N ATOM 1456 CA PHE A 95 -11.960 -2.348 9.518 1.00 0.00 C ATOM 1457 C PHE A 95 -12.685 -1.039 9.108 1.00 0.00 C ATOM 1458 O PHE A 95 -12.066 0.026 9.032 1.00 0.00 O ATOM 1459 CB PHE A 95 -11.323 -2.275 10.941 1.00 0.00 C ATOM 1460 CG PHE A 95 -10.118 -1.335 11.189 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -10.313 0.010 11.530 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -8.813 -1.837 11.115 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -9.220 0.845 11.758 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -7.725 -1.006 11.366 1.00 0.00 C ATOM 1465 CZ PHE A 95 -7.927 0.336 11.676 1.00 0.00 C ATOM 0 H PHE A 95 -10.337 -1.944 8.227 1.00 0.00 H new ATOM 0 HA PHE A 95 -12.706 -3.139 9.585 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -12.111 -1.987 11.637 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -11.012 -3.284 11.212 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -11.316 0.402 11.617 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -8.650 -2.874 10.862 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -9.376 1.886 11.998 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -6.722 -1.403 11.320 1.00 0.00 H new ATOM 0 HZ PHE A 95 -7.080 0.983 11.853 1.00 0.00 H new ATOM 1475 N LYS A 96 -14.007 -1.114 8.850 1.00 0.00 N ATOM 1476 CA LYS A 96 -14.870 0.072 8.529 1.00 0.00 C ATOM 1477 C LYS A 96 -14.383 0.931 7.311 1.00 0.00 C ATOM 1478 O LYS A 96 -14.155 2.140 7.433 1.00 0.00 O ATOM 1479 CB LYS A 96 -15.181 0.914 9.804 1.00 0.00 C ATOM 1480 CG LYS A 96 -16.072 0.172 10.822 1.00 0.00 C ATOM 1481 CD LYS A 96 -16.198 0.821 12.207 1.00 0.00 C ATOM 1482 CE LYS A 96 -17.130 2.043 12.335 1.00 0.00 C ATOM 1483 NZ LYS A 96 -16.528 3.297 11.843 1.00 0.00 N ATOM 0 H LYS A 96 -14.520 -1.996 8.855 1.00 0.00 H new ATOM 0 HA LYS A 96 -15.816 -0.339 8.178 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.243 1.191 10.286 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -15.673 1.841 9.508 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.071 0.074 10.397 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.680 -0.837 10.950 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.543 0.059 12.906 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.201 1.122 12.530 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.049 1.849 11.781 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -17.409 2.169 13.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -16.699 4.058 12.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.504 3.165 11.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.957 3.553 10.931 1.00 0.00 H new ATOM 1497 N ASN A 97 -14.178 0.277 6.146 1.00 0.00 N ATOM 1498 CA ASN A 97 -13.490 0.867 4.954 1.00 0.00 C ATOM 1499 C ASN A 97 -12.089 1.524 5.234 1.00 0.00 C ATOM 1500 O ASN A 97 -11.839 2.662 4.832 1.00 0.00 O ATOM 1501 CB ASN A 97 -14.498 1.749 4.150 1.00 0.00 C ATOM 1502 CG ASN A 97 -14.080 2.109 2.709 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -13.601 3.210 2.439 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -14.256 1.201 1.761 1.00 0.00 N ATOM 0 H ASN A 97 -14.485 -0.684 5.996 1.00 0.00 H new ATOM 0 HA ASN A 97 -13.190 0.041 4.309 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -15.455 1.228 4.111 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -14.661 2.675 4.702 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -13.994 1.412 0.798 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -14.654 0.291 1.994 1.00 0.00 H new ATOM 1511 N ILE A 98 -11.183 0.804 5.925 1.00 0.00 N ATOM 1512 CA ILE A 98 -9.809 1.291 6.242 1.00 0.00 C ATOM 1513 C ILE A 98 -8.913 0.050 5.989 1.00 0.00 C ATOM 1514 O ILE A 98 -8.851 -0.841 6.841 1.00 0.00 O ATOM 1515 CB ILE A 98 -9.653 1.871 7.699 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -10.549 3.113 7.991 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -8.176 2.205 8.030 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -10.802 3.390 9.482 1.00 0.00 C ATOM 0 H ILE A 98 -11.375 -0.132 6.283 1.00 0.00 H new ATOM 0 HA ILE A 98 -9.534 2.145 5.624 1.00 0.00 H new ATOM 0 HB ILE A 98 -10.000 1.069 8.351 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -10.083 3.992 7.547 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -11.509 2.976 7.493 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -8.111 2.602 9.043 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -7.573 1.300 7.956 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -7.804 2.948 7.324 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -11.434 4.272 9.586 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -11.300 2.531 9.932 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -9.851 3.564 9.986 1.00 0.00 H new ATOM 1530 N LYS A 99 -8.188 0.022 4.853 1.00 0.00 N ATOM 1531 CA LYS A 99 -7.256 -1.089 4.525 1.00 0.00 C ATOM 1532 C LYS A 99 -5.917 -0.887 5.290 1.00 0.00 C ATOM 1533 O LYS A 99 -5.082 -0.066 4.900 1.00 0.00 O ATOM 1534 CB LYS A 99 -7.098 -1.195 2.986 1.00 0.00 C ATOM 1535 CG LYS A 99 -6.338 -2.442 2.481 1.00 0.00 C ATOM 1536 CD LYS A 99 -7.034 -3.792 2.755 1.00 0.00 C ATOM 1537 CE LYS A 99 -6.278 -4.993 2.162 1.00 0.00 C ATOM 1538 NZ LYS A 99 -7.009 -6.249 2.407 1.00 0.00 N ATOM 0 H LYS A 99 -8.226 0.754 4.143 1.00 0.00 H new ATOM 0 HA LYS A 99 -7.654 -2.048 4.857 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -8.090 -1.188 2.535 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.579 -0.305 2.629 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.183 -2.343 1.407 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.352 -2.459 2.945 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -7.135 -3.930 3.832 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -8.042 -3.765 2.341 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.143 -4.849 1.090 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.283 -5.055 2.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -6.479 -7.045 1.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.116 -6.395 3.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -7.949 -6.195 1.965 1.00 0.00 H new ATOM 1552 N SER A 100 -5.771 -1.629 6.400 1.00 0.00 N ATOM 1553 CA SER A 100 -4.682 -1.442 7.386 1.00 0.00 C ATOM 1554 C SER A 100 -3.638 -2.574 7.206 1.00 0.00 C ATOM 1555 O SER A 100 -3.923 -3.745 7.474 1.00 0.00 O ATOM 1556 CB SER A 100 -5.329 -1.446 8.788 1.00 0.00 C ATOM 1557 OG SER A 100 -4.378 -1.151 9.801 1.00 0.00 O ATOM 0 H SER A 100 -6.410 -2.385 6.645 1.00 0.00 H new ATOM 0 HA SER A 100 -4.154 -0.499 7.248 1.00 0.00 H new ATOM 0 HB2 SER A 100 -6.135 -0.713 8.820 1.00 0.00 H new ATOM 0 HB3 SER A 100 -5.777 -2.421 8.981 1.00 0.00 H new ATOM 0 HG SER A 100 -4.819 -1.160 10.676 1.00 0.00 H new ATOM 1563 N VAL A 101 -2.442 -2.200 6.721 1.00 0.00 N ATOM 1564 CA VAL A 101 -1.382 -3.172 6.329 1.00 0.00 C ATOM 1565 C VAL A 101 -0.133 -2.808 7.171 1.00 0.00 C ATOM 1566 O VAL A 101 0.542 -1.811 6.896 1.00 0.00 O ATOM 1567 CB VAL A 101 -1.131 -3.142 4.785 1.00 0.00 C ATOM 1568 CG1 VAL A 101 0.064 -4.010 4.325 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -2.374 -3.610 3.990 1.00 0.00 C ATOM 0 H VAL A 101 -2.174 -1.225 6.587 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.672 -4.202 6.534 1.00 0.00 H new ATOM 0 HB VAL A 101 -0.905 -2.096 4.577 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.172 -3.936 3.243 1.00 0.00 H new ATOM 0 HG12 VAL A 101 0.976 -3.657 4.806 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -0.113 -5.049 4.602 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.158 -3.574 2.922 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.625 -4.632 4.275 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.216 -2.954 4.212 1.00 0.00 H new ATOM 1579 N THR A 102 0.165 -3.651 8.174 1.00 0.00 N ATOM 1580 CA THR A 102 1.277 -3.406 9.134 1.00 0.00 C ATOM 1581 C THR A 102 2.510 -4.234 8.665 1.00 0.00 C ATOM 1582 O THR A 102 2.656 -5.403 9.038 1.00 0.00 O ATOM 1583 CB THR A 102 0.816 -3.732 10.590 1.00 0.00 C ATOM 1584 OG1 THR A 102 -0.416 -3.089 10.906 1.00 0.00 O ATOM 1585 CG2 THR A 102 1.833 -3.315 11.663 1.00 0.00 C ATOM 0 H THR A 102 -0.347 -4.516 8.349 1.00 0.00 H new ATOM 0 HA THR A 102 1.567 -2.356 9.149 1.00 0.00 H new ATOM 0 HB THR A 102 0.708 -4.817 10.604 1.00 0.00 H new ATOM 0 HG1 THR A 102 -0.677 -3.315 11.823 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.447 -3.572 12.650 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.775 -3.838 11.495 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.000 -2.239 11.607 1.00 0.00 H new ATOM 1593 N GLU A 103 3.387 -3.615 7.848 1.00 0.00 N ATOM 1594 CA GLU A 103 4.629 -4.263 7.356 1.00 0.00 C ATOM 1595 C GLU A 103 5.828 -3.750 8.195 1.00 0.00 C ATOM 1596 O GLU A 103 6.114 -2.550 8.241 1.00 0.00 O ATOM 1597 CB GLU A 103 4.829 -3.991 5.842 1.00 0.00 C ATOM 1598 CG GLU A 103 5.979 -4.813 5.212 1.00 0.00 C ATOM 1599 CD GLU A 103 6.172 -4.509 3.724 1.00 0.00 C ATOM 1600 OE1 GLU A 103 6.846 -3.507 3.395 1.00 0.00 O ATOM 1601 OE2 GLU A 103 5.652 -5.268 2.877 1.00 0.00 O ATOM 0 H GLU A 103 3.260 -2.661 7.511 1.00 0.00 H new ATOM 0 HA GLU A 103 4.554 -5.344 7.475 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.902 -4.216 5.315 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.029 -2.930 5.695 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.906 -4.602 5.745 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.773 -5.876 5.338 1.00 0.00 H new ATOM 1608 N LEU A 104 6.550 -4.700 8.800 1.00 0.00 N ATOM 1609 CA LEU A 104 7.807 -4.430 9.538 1.00 0.00 C ATOM 1610 C LEU A 104 8.986 -4.463 8.527 1.00 0.00 C ATOM 1611 O LEU A 104 9.217 -5.484 7.871 1.00 0.00 O ATOM 1612 CB LEU A 104 7.929 -5.505 10.653 1.00 0.00 C ATOM 1613 CG LEU A 104 8.766 -5.169 11.911 1.00 0.00 C ATOM 1614 CD1 LEU A 104 8.600 -6.314 12.928 1.00 0.00 C ATOM 1615 CD2 LEU A 104 10.260 -4.924 11.646 1.00 0.00 C ATOM 0 H LEU A 104 6.285 -5.685 8.796 1.00 0.00 H new ATOM 0 HA LEU A 104 7.818 -3.448 10.011 1.00 0.00 H new ATOM 0 HB2 LEU A 104 6.921 -5.757 10.983 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.352 -6.403 10.203 1.00 0.00 H new ATOM 0 HG LEU A 104 8.384 -4.223 12.295 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.184 -6.094 13.822 1.00 0.00 H new ATOM 0 HD12 LEU A 104 7.548 -6.413 13.196 1.00 0.00 H new ATOM 0 HD13 LEU A 104 8.951 -7.247 12.486 1.00 0.00 H new ATOM 0 HD21 LEU A 104 10.764 -4.696 12.585 1.00 0.00 H new ATOM 0 HD22 LEU A 104 10.702 -5.817 11.205 1.00 0.00 H new ATOM 0 HD23 LEU A 104 10.375 -4.085 10.960 1.00 0.00 H new ATOM 1627 N ASN A 105 9.710 -3.337 8.398 1.00 0.00 N ATOM 1628 CA ASN A 105 10.850 -3.217 7.446 1.00 0.00 C ATOM 1629 C ASN A 105 12.184 -3.188 8.250 1.00 0.00 C ATOM 1630 O ASN A 105 12.789 -2.127 8.447 1.00 0.00 O ATOM 1631 CB ASN A 105 10.658 -1.983 6.519 1.00 0.00 C ATOM 1632 CG ASN A 105 9.512 -2.090 5.489 1.00 0.00 C ATOM 1633 OD1 ASN A 105 9.698 -2.558 4.367 1.00 0.00 O ATOM 1634 ND2 ASN A 105 8.312 -1.661 5.851 1.00 0.00 N ATOM 0 H ASN A 105 9.532 -2.490 8.938 1.00 0.00 H new ATOM 0 HA ASN A 105 10.888 -4.083 6.785 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.480 -1.107 7.143 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.590 -1.807 5.981 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.532 -1.717 5.197 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.169 -1.275 6.784 1.00 0.00 H new ATOM 1641 N GLY A 106 12.630 -4.375 8.715 1.00 0.00 N ATOM 1642 CA GLY A 106 13.881 -4.520 9.501 1.00 0.00 C ATOM 1643 C GLY A 106 13.674 -4.291 11.012 1.00 0.00 C ATOM 1644 O GLY A 106 13.451 -5.241 11.767 1.00 0.00 O ATOM 0 H GLY A 106 12.139 -5.256 8.559 1.00 0.00 H new ATOM 0 HA2 GLY A 106 14.289 -5.518 9.343 1.00 0.00 H new ATOM 0 HA3 GLY A 106 14.621 -3.811 9.130 1.00 0.00 H new ATOM 1648 N ASP A 107 13.724 -3.013 11.415 1.00 0.00 N ATOM 1649 CA ASP A 107 13.192 -2.534 12.729 1.00 0.00 C ATOM 1650 C ASP A 107 12.024 -1.504 12.573 1.00 0.00 C ATOM 1651 O ASP A 107 11.128 -1.484 13.422 1.00 0.00 O ATOM 1652 CB ASP A 107 14.316 -1.922 13.611 1.00 0.00 C ATOM 1653 CG ASP A 107 15.422 -2.878 14.083 1.00 0.00 C ATOM 1654 OD1 ASP A 107 15.114 -4.014 14.509 1.00 0.00 O ATOM 1655 OD2 ASP A 107 16.609 -2.484 14.047 1.00 0.00 O ATOM 0 H ASP A 107 14.132 -2.270 10.848 1.00 0.00 H new ATOM 0 HA ASP A 107 12.791 -3.418 13.225 1.00 0.00 H new ATOM 0 HB2 ASP A 107 14.783 -1.111 13.052 1.00 0.00 H new ATOM 0 HB3 ASP A 107 13.853 -1.477 14.492 1.00 0.00 H new ATOM 1660 N ILE A 108 12.043 -0.639 11.532 1.00 0.00 N ATOM 1661 CA ILE A 108 11.100 0.496 11.364 1.00 0.00 C ATOM 1662 C ILE A 108 9.767 -0.055 10.762 1.00 0.00 C ATOM 1663 O ILE A 108 9.752 -0.587 9.649 1.00 0.00 O ATOM 1664 CB ILE A 108 11.756 1.627 10.486 1.00 0.00 C ATOM 1665 CG1 ILE A 108 13.103 2.204 11.035 1.00 0.00 C ATOM 1666 CG2 ILE A 108 10.782 2.811 10.278 1.00 0.00 C ATOM 1667 CD1 ILE A 108 14.379 1.475 10.582 1.00 0.00 C ATOM 0 H ILE A 108 12.722 -0.709 10.774 1.00 0.00 H new ATOM 0 HA ILE A 108 10.870 0.957 12.324 1.00 0.00 H new ATOM 0 HB ILE A 108 11.981 1.122 9.547 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.178 3.249 10.734 1.00 0.00 H new ATOM 0 HG13 ILE A 108 13.066 2.188 12.124 1.00 0.00 H new ATOM 0 HG21 ILE A 108 11.264 3.575 9.668 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.883 2.458 9.774 1.00 0.00 H new ATOM 0 HG23 ILE A 108 10.513 3.235 11.245 1.00 0.00 H new ATOM 0 HD11 ILE A 108 15.251 1.960 11.022 1.00 0.00 H new ATOM 0 HD12 ILE A 108 14.339 0.435 10.907 1.00 0.00 H new ATOM 0 HD13 ILE A 108 14.453 1.513 9.495 1.00 0.00 H new ATOM 1679 N ILE A 109 8.664 0.101 11.513 1.00 0.00 N ATOM 1680 CA ILE A 109 7.349 -0.518 11.189 1.00 0.00 C ATOM 1681 C ILE A 109 6.403 0.534 10.526 1.00 0.00 C ATOM 1682 O ILE A 109 6.050 1.551 11.128 1.00 0.00 O ATOM 1683 CB ILE A 109 6.783 -1.240 12.460 1.00 0.00 C ATOM 1684 CG1 ILE A 109 5.612 -2.200 12.128 1.00 0.00 C ATOM 1685 CG2 ILE A 109 6.396 -0.289 13.617 1.00 0.00 C ATOM 1686 CD1 ILE A 109 5.230 -3.124 13.290 1.00 0.00 C ATOM 0 H ILE A 109 8.650 0.660 12.366 1.00 0.00 H new ATOM 0 HA ILE A 109 7.453 -1.300 10.437 1.00 0.00 H new ATOM 0 HB ILE A 109 7.623 -1.834 12.821 1.00 0.00 H new ATOM 0 HG12 ILE A 109 4.741 -1.612 11.841 1.00 0.00 H new ATOM 0 HG13 ILE A 109 5.885 -2.808 11.265 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.014 -0.872 14.455 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.274 0.272 13.936 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.626 0.404 13.277 1.00 0.00 H new ATOM 0 HD11 ILE A 109 4.404 -3.768 12.987 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.088 -3.739 13.563 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.926 -2.524 14.147 1.00 0.00 H new ATOM 1698 N THR A 110 5.994 0.252 9.281 1.00 0.00 N ATOM 1699 CA THR A 110 5.128 1.144 8.466 1.00 0.00 C ATOM 1700 C THR A 110 3.695 0.543 8.466 1.00 0.00 C ATOM 1701 O THR A 110 3.487 -0.542 7.910 1.00 0.00 O ATOM 1702 CB THR A 110 5.725 1.252 7.028 1.00 0.00 C ATOM 1703 OG1 THR A 110 7.056 1.762 7.085 1.00 0.00 O ATOM 1704 CG2 THR A 110 4.936 2.169 6.078 1.00 0.00 C ATOM 0 H THR A 110 6.253 -0.608 8.798 1.00 0.00 H new ATOM 0 HA THR A 110 5.081 2.153 8.876 1.00 0.00 H new ATOM 0 HB THR A 110 5.682 0.237 6.634 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.422 1.824 6.178 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.421 2.185 5.102 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.918 1.793 5.971 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.909 3.179 6.487 1.00 0.00 H new ATOM 1712 N ASN A 111 2.715 1.263 9.048 1.00 0.00 N ATOM 1713 CA ASN A 111 1.288 0.846 9.004 1.00 0.00 C ATOM 1714 C ASN A 111 0.520 1.846 8.100 1.00 0.00 C ATOM 1715 O ASN A 111 0.254 2.992 8.478 1.00 0.00 O ATOM 1716 CB ASN A 111 0.732 0.695 10.449 1.00 0.00 C ATOM 1717 CG ASN A 111 -0.651 0.044 10.694 1.00 0.00 C ATOM 1718 OD1 ASN A 111 -1.014 -0.201 11.844 1.00 0.00 O ATOM 1719 ND2 ASN A 111 -1.453 -0.269 9.687 1.00 0.00 N ATOM 0 H ASN A 111 2.879 2.134 9.554 1.00 0.00 H new ATOM 0 HA ASN A 111 1.161 -0.140 8.557 1.00 0.00 H new ATOM 0 HB2 ASN A 111 1.463 0.120 11.017 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.700 1.692 10.888 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -2.356 -0.706 9.871 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -1.167 -0.073 8.728 1.00 0.00 H new ATOM 1726 N THR A 112 0.176 1.363 6.894 1.00 0.00 N ATOM 1727 CA THR A 112 -0.482 2.169 5.839 1.00 0.00 C ATOM 1728 C THR A 112 -2.016 1.929 5.946 1.00 0.00 C ATOM 1729 O THR A 112 -2.518 0.866 5.568 1.00 0.00 O ATOM 1730 CB THR A 112 0.118 1.772 4.456 1.00 0.00 C ATOM 1731 OG1 THR A 112 1.537 1.928 4.462 1.00 0.00 O ATOM 1732 CG2 THR A 112 -0.410 2.617 3.290 1.00 0.00 C ATOM 0 H THR A 112 0.346 0.396 6.617 1.00 0.00 H new ATOM 0 HA THR A 112 -0.306 3.238 5.958 1.00 0.00 H new ATOM 0 HB THR A 112 -0.182 0.735 4.307 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.898 1.673 3.587 1.00 0.00 H new ATOM 0 HG21 THR A 112 0.052 2.283 2.361 1.00 0.00 H new ATOM 0 HG22 THR A 112 -1.492 2.503 3.219 1.00 0.00 H new ATOM 0 HG23 THR A 112 -0.166 3.665 3.461 1.00 0.00 H new ATOM 1740 N MET A 113 -2.728 2.940 6.468 1.00 0.00 N ATOM 1741 CA MET A 113 -4.204 2.916 6.651 1.00 0.00 C ATOM 1742 C MET A 113 -4.836 3.883 5.619 1.00 0.00 C ATOM 1743 O MET A 113 -4.693 5.104 5.733 1.00 0.00 O ATOM 1744 CB MET A 113 -4.549 3.325 8.108 1.00 0.00 C ATOM 1745 CG MET A 113 -4.587 2.154 9.087 1.00 0.00 C ATOM 1746 SD MET A 113 -4.971 2.784 10.730 1.00 0.00 S ATOM 1747 CE MET A 113 -3.473 2.295 11.587 1.00 0.00 C ATOM 0 H MET A 113 -2.299 3.811 6.781 1.00 0.00 H new ATOM 0 HA MET A 113 -4.605 1.916 6.486 1.00 0.00 H new ATOM 0 HB2 MET A 113 -3.814 4.052 8.455 1.00 0.00 H new ATOM 0 HB3 MET A 113 -5.518 3.823 8.115 1.00 0.00 H new ATOM 0 HG2 MET A 113 -5.337 1.427 8.777 1.00 0.00 H new ATOM 0 HG3 MET A 113 -3.627 1.638 9.095 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.390 2.851 12.521 1.00 0.00 H new ATOM 0 HE2 MET A 113 -3.509 1.227 11.803 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.608 2.509 10.959 1.00 0.00 H new ATOM 1757 N THR A 114 -5.528 3.317 4.614 1.00 0.00 N ATOM 1758 CA THR A 114 -6.090 4.092 3.475 1.00 0.00 C ATOM 1759 C THR A 114 -7.640 3.985 3.525 1.00 0.00 C ATOM 1760 O THR A 114 -8.214 2.895 3.424 1.00 0.00 O ATOM 1761 CB THR A 114 -5.490 3.588 2.128 1.00 0.00 C ATOM 1762 OG1 THR A 114 -4.069 3.701 2.157 1.00 0.00 O ATOM 1763 CG2 THR A 114 -5.978 4.366 0.889 1.00 0.00 C ATOM 0 H THR A 114 -5.717 2.316 4.561 1.00 0.00 H new ATOM 0 HA THR A 114 -5.820 5.145 3.552 1.00 0.00 H new ATOM 0 HB THR A 114 -5.826 2.555 2.035 1.00 0.00 H new ATOM 0 HG1 THR A 114 -3.698 3.381 1.308 1.00 0.00 H new ATOM 0 HG21 THR A 114 -5.514 3.953 -0.006 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.062 4.280 0.809 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.704 5.416 0.988 1.00 0.00 H new ATOM 1771 N LEU A 115 -8.295 5.154 3.613 1.00 0.00 N ATOM 1772 CA LEU A 115 -9.772 5.287 3.486 1.00 0.00 C ATOM 1773 C LEU A 115 -10.203 5.277 1.987 1.00 0.00 C ATOM 1774 O LEU A 115 -10.918 4.362 1.568 1.00 0.00 O ATOM 1775 CB LEU A 115 -10.203 6.537 4.313 1.00 0.00 C ATOM 1776 CG LEU A 115 -11.697 6.961 4.293 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -12.652 5.902 4.875 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -11.868 8.297 5.037 1.00 0.00 C ATOM 0 H LEU A 115 -7.821 6.043 3.775 1.00 0.00 H new ATOM 0 HA LEU A 115 -10.304 4.433 3.904 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -9.923 6.360 5.351 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -9.613 7.385 3.964 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.974 7.072 3.245 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -13.677 6.270 4.827 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -12.570 4.981 4.297 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -12.386 5.704 5.913 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -12.918 8.591 5.021 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -11.539 8.183 6.070 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.269 9.065 4.548 1.00 0.00 H new ATOM 1790 N GLY A 116 -9.750 6.270 1.204 1.00 0.00 N ATOM 1791 CA GLY A 116 -9.971 6.319 -0.256 1.00 0.00 C ATOM 1792 C GLY A 116 -8.847 7.135 -0.914 1.00 0.00 C ATOM 1793 O GLY A 116 -7.879 6.559 -1.420 1.00 0.00 O ATOM 0 H GLY A 116 -9.219 7.064 1.563 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.991 5.309 -0.666 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -10.939 6.771 -0.474 1.00 0.00 H new ATOM 1797 N ASP A 117 -8.971 8.473 -0.864 1.00 0.00 N ATOM 1798 CA ASP A 117 -7.874 9.404 -1.264 1.00 0.00 C ATOM 1799 C ASP A 117 -6.771 9.604 -0.176 1.00 0.00 C ATOM 1800 O ASP A 117 -5.598 9.744 -0.538 1.00 0.00 O ATOM 1801 CB ASP A 117 -8.456 10.783 -1.685 1.00 0.00 C ATOM 1802 CG ASP A 117 -9.269 10.779 -2.990 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -8.660 10.768 -4.081 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -10.518 10.784 -2.924 1.00 0.00 O ATOM 0 H ASP A 117 -9.819 8.946 -0.551 1.00 0.00 H new ATOM 0 HA ASP A 117 -7.382 8.926 -2.111 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -9.092 11.152 -0.880 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.633 11.490 -1.790 1.00 0.00 H new ATOM 1809 N ILE A 118 -7.128 9.648 1.128 1.00 0.00 N ATOM 1810 CA ILE A 118 -6.198 10.025 2.226 1.00 0.00 C ATOM 1811 C ILE A 118 -5.453 8.736 2.684 1.00 0.00 C ATOM 1812 O ILE A 118 -6.073 7.760 3.123 1.00 0.00 O ATOM 1813 CB ILE A 118 -6.968 10.739 3.395 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -7.698 12.047 2.951 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -6.026 11.059 4.588 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -8.818 12.519 3.891 1.00 0.00 C ATOM 0 H ILE A 118 -8.069 9.424 1.452 1.00 0.00 H new ATOM 0 HA ILE A 118 -5.461 10.750 1.879 1.00 0.00 H new ATOM 0 HB ILE A 118 -7.730 10.026 3.710 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.960 12.844 2.861 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -8.120 11.890 1.958 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -6.593 11.552 5.377 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -5.599 10.133 4.973 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -5.224 11.717 4.252 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -9.263 13.433 3.497 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -9.582 11.745 3.963 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -8.404 12.714 4.880 1.00 0.00 H new ATOM 1828 N VAL A 119 -4.113 8.795 2.610 1.00 0.00 N ATOM 1829 CA VAL A 119 -3.221 7.697 3.065 1.00 0.00 C ATOM 1830 C VAL A 119 -2.587 8.186 4.403 1.00 0.00 C ATOM 1831 O VAL A 119 -1.651 8.994 4.402 1.00 0.00 O ATOM 1832 CB VAL A 119 -2.171 7.322 1.960 1.00 0.00 C ATOM 1833 CG1 VAL A 119 -1.217 6.193 2.413 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -2.804 6.886 0.615 1.00 0.00 C ATOM 0 H VAL A 119 -3.611 9.600 2.235 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.764 6.768 3.239 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.619 8.249 1.806 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -0.510 5.971 1.613 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -0.671 6.512 3.301 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -1.796 5.299 2.645 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.015 6.643 -0.097 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -3.431 6.009 0.775 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.412 7.699 0.219 1.00 0.00 H new ATOM 1844 N PHE A 120 -3.082 7.644 5.531 1.00 0.00 N ATOM 1845 CA PHE A 120 -2.432 7.795 6.861 1.00 0.00 C ATOM 1846 C PHE A 120 -1.309 6.734 7.004 1.00 0.00 C ATOM 1847 O PHE A 120 -1.569 5.583 7.368 1.00 0.00 O ATOM 1848 CB PHE A 120 -3.512 7.748 7.978 1.00 0.00 C ATOM 1849 CG PHE A 120 -3.060 7.637 9.455 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -2.224 8.601 10.031 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -3.501 6.567 10.244 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -1.843 8.503 11.366 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -3.105 6.461 11.575 1.00 0.00 C ATOM 1854 CZ PHE A 120 -2.282 7.432 12.136 1.00 0.00 C ATOM 0 H PHE A 120 -3.939 7.091 5.554 1.00 0.00 H new ATOM 0 HA PHE A 120 -1.947 8.766 6.960 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -4.119 8.648 7.887 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -4.165 6.901 7.769 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.871 9.429 9.434 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -4.153 5.819 9.817 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -1.207 9.258 11.803 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -3.437 5.624 12.172 1.00 0.00 H new ATOM 0 HZ PHE A 120 -1.984 7.354 13.171 1.00 0.00 H new ATOM 1864 N LYS A 121 -0.065 7.157 6.718 1.00 0.00 N ATOM 1865 CA LYS A 121 1.125 6.277 6.798 1.00 0.00 C ATOM 1866 C LYS A 121 1.927 6.697 8.056 1.00 0.00 C ATOM 1867 O LYS A 121 2.514 7.783 8.115 1.00 0.00 O ATOM 1868 CB LYS A 121 1.918 6.362 5.469 1.00 0.00 C ATOM 1869 CG LYS A 121 3.018 5.288 5.327 1.00 0.00 C ATOM 1870 CD LYS A 121 3.631 5.166 3.916 1.00 0.00 C ATOM 1871 CE LYS A 121 4.449 6.388 3.459 1.00 0.00 C ATOM 1872 NZ LYS A 121 5.036 6.178 2.124 1.00 0.00 N ATOM 0 H LYS A 121 0.148 8.111 6.426 1.00 0.00 H new ATOM 0 HA LYS A 121 0.866 5.224 6.912 1.00 0.00 H new ATOM 0 HB2 LYS A 121 1.222 6.268 4.635 1.00 0.00 H new ATOM 0 HB3 LYS A 121 2.375 7.349 5.393 1.00 0.00 H new ATOM 0 HG2 LYS A 121 3.816 5.511 6.036 1.00 0.00 H new ATOM 0 HG3 LYS A 121 2.600 4.322 5.610 1.00 0.00 H new ATOM 0 HD2 LYS A 121 4.273 4.286 3.889 1.00 0.00 H new ATOM 0 HD3 LYS A 121 2.827 4.996 3.200 1.00 0.00 H new ATOM 0 HE2 LYS A 121 3.808 7.270 3.441 1.00 0.00 H new ATOM 0 HE3 LYS A 121 5.243 6.586 4.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 5.580 7.020 1.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 5.666 5.351 2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 4.277 6.014 1.433 1.00 0.00 H new ATOM 1886 N ARG A 122 1.907 5.815 9.063 1.00 0.00 N ATOM 1887 CA ARG A 122 2.538 6.051 10.387 1.00 0.00 C ATOM 1888 C ARG A 122 3.826 5.182 10.451 1.00 0.00 C ATOM 1889 O ARG A 122 3.761 3.956 10.594 1.00 0.00 O ATOM 1890 CB ARG A 122 1.569 5.788 11.581 1.00 0.00 C ATOM 1891 CG ARG A 122 0.452 4.728 11.428 1.00 0.00 C ATOM 1892 CD ARG A 122 -0.199 4.279 12.750 1.00 0.00 C ATOM 1893 NE ARG A 122 0.655 3.285 13.448 1.00 0.00 N ATOM 1894 CZ ARG A 122 0.202 2.192 14.090 1.00 0.00 C ATOM 1895 NH1 ARG A 122 -1.085 1.935 14.310 1.00 0.00 N ATOM 1896 NH2 ARG A 122 1.091 1.323 14.526 1.00 0.00 N ATOM 0 H ARG A 122 1.450 4.906 8.991 1.00 0.00 H new ATOM 0 HA ARG A 122 2.797 7.105 10.488 1.00 0.00 H new ATOM 0 HB2 ARG A 122 2.177 5.503 12.440 1.00 0.00 H new ATOM 0 HB3 ARG A 122 1.090 6.735 11.830 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -0.323 5.130 10.776 1.00 0.00 H new ATOM 0 HG3 ARG A 122 0.867 3.853 10.928 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -0.359 5.144 13.394 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -1.179 3.846 12.549 1.00 0.00 H new ATOM 0 HE ARG A 122 1.663 3.443 13.440 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -1.798 2.587 13.984 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -1.358 1.086 14.804 1.00 0.00 H new ATOM 0 HH21 ARG A 122 2.085 1.490 14.373 1.00 0.00 H new ATOM 0 HH22 ARG A 122 0.785 0.483 15.017 1.00 0.00 H new ATOM 1910 N ILE A 123 4.990 5.847 10.326 1.00 0.00 N ATOM 1911 CA ILE A 123 6.317 5.179 10.211 1.00 0.00 C ATOM 1912 C ILE A 123 6.966 5.251 11.627 1.00 0.00 C ATOM 1913 O ILE A 123 7.395 6.320 12.070 1.00 0.00 O ATOM 1914 CB ILE A 123 7.204 5.822 9.081 1.00 0.00 C ATOM 1915 CG1 ILE A 123 6.524 5.935 7.678 1.00 0.00 C ATOM 1916 CG2 ILE A 123 8.538 5.060 8.913 1.00 0.00 C ATOM 1917 CD1 ILE A 123 5.842 7.286 7.418 1.00 0.00 C ATOM 0 H ILE A 123 5.046 6.865 10.301 1.00 0.00 H new ATOM 0 HA ILE A 123 6.214 4.138 9.903 1.00 0.00 H new ATOM 0 HB ILE A 123 7.370 6.840 9.435 1.00 0.00 H new ATOM 0 HG12 ILE A 123 7.276 5.766 6.907 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.783 5.142 7.580 1.00 0.00 H new ATOM 0 HG21 ILE A 123 9.128 5.529 8.125 1.00 0.00 H new ATOM 0 HG22 ILE A 123 9.095 5.090 9.850 1.00 0.00 H new ATOM 0 HG23 ILE A 123 8.334 4.023 8.645 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.395 7.283 6.424 1.00 0.00 H new ATOM 0 HD12 ILE A 123 5.065 7.451 8.165 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.581 8.085 7.481 1.00 0.00 H new ATOM 1929 N SER A 124 7.010 4.101 12.320 1.00 0.00 N ATOM 1930 CA SER A 124 7.400 4.017 13.749 1.00 0.00 C ATOM 1931 C SER A 124 8.824 3.420 13.884 1.00 0.00 C ATOM 1932 O SER A 124 9.041 2.221 13.695 1.00 0.00 O ATOM 1933 CB SER A 124 6.321 3.202 14.505 1.00 0.00 C ATOM 1934 OG SER A 124 5.167 3.989 14.770 1.00 0.00 O ATOM 0 H SER A 124 6.776 3.197 11.909 1.00 0.00 H new ATOM 0 HA SER A 124 7.447 5.009 14.199 1.00 0.00 H new ATOM 0 HB2 SER A 124 6.041 2.330 13.914 1.00 0.00 H new ATOM 0 HB3 SER A 124 6.734 2.831 15.443 1.00 0.00 H new ATOM 0 HG SER A 124 4.504 3.447 15.246 1.00 0.00 H new ATOM 1940 N LYS A 125 9.790 4.292 14.228 1.00 0.00 N ATOM 1941 CA LYS A 125 11.211 3.913 14.435 1.00 0.00 C ATOM 1942 C LYS A 125 11.423 3.387 15.885 1.00 0.00 C ATOM 1943 O LYS A 125 10.931 3.977 16.852 1.00 0.00 O ATOM 1944 CB LYS A 125 12.075 5.164 14.117 1.00 0.00 C ATOM 1945 CG LYS A 125 13.601 4.931 14.086 1.00 0.00 C ATOM 1946 CD LYS A 125 14.387 6.183 13.649 1.00 0.00 C ATOM 1947 CE LYS A 125 15.902 5.930 13.569 1.00 0.00 C ATOM 1948 NZ LYS A 125 16.626 7.131 13.116 1.00 0.00 N ATOM 0 H LYS A 125 9.611 5.286 14.372 1.00 0.00 H new ATOM 0 HA LYS A 125 11.509 3.099 13.774 1.00 0.00 H new ATOM 0 HB2 LYS A 125 11.766 5.560 13.150 1.00 0.00 H new ATOM 0 HB3 LYS A 125 11.858 5.932 14.860 1.00 0.00 H new ATOM 0 HG2 LYS A 125 13.937 4.624 15.076 1.00 0.00 H new ATOM 0 HG3 LYS A 125 13.825 4.111 13.404 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.025 6.513 12.675 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.194 6.993 14.352 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.274 5.627 14.548 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.099 5.105 12.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 17.645 6.927 13.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 16.288 7.405 12.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.457 7.910 13.783 1.00 0.00 H new ATOM 1962 N ARG A 126 12.188 2.287 16.018 1.00 0.00 N ATOM 1963 CA ARG A 126 12.406 1.579 17.313 1.00 0.00 C ATOM 1964 C ARG A 126 13.015 2.478 18.439 1.00 0.00 C ATOM 1965 O ARG A 126 13.855 3.347 18.175 1.00 0.00 O ATOM 1966 CB ARG A 126 13.260 0.319 17.011 1.00 0.00 C ATOM 1967 CG ARG A 126 13.328 -0.738 18.142 1.00 0.00 C ATOM 1968 CD ARG A 126 14.195 -1.975 17.830 1.00 0.00 C ATOM 1969 NE ARG A 126 15.637 -1.637 17.705 1.00 0.00 N ATOM 1970 CZ ARG A 126 16.628 -2.541 17.592 1.00 0.00 C ATOM 1971 NH1 ARG A 126 16.443 -3.860 17.619 1.00 0.00 N ATOM 1972 NH2 ARG A 126 17.860 -2.090 17.445 1.00 0.00 N ATOM 0 H ARG A 126 12.678 1.856 15.234 1.00 0.00 H new ATOM 0 HA ARG A 126 11.441 1.290 17.730 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.863 -0.160 16.116 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.275 0.639 16.777 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.715 -0.260 19.042 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.315 -1.071 18.368 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.065 -2.715 18.619 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.850 -2.433 16.903 1.00 0.00 H new ATOM 0 HE ARG A 126 15.894 -0.650 17.705 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.503 -4.241 17.731 1.00 0.00 H new ATOM 0 HH12 ARG A 126 17.241 -4.489 17.528 1.00 0.00 H new ATOM 0 HH21 ARG A 126 18.036 -1.086 17.420 1.00 0.00 H new ATOM 0 HH22 ARG A 126 18.636 -2.746 17.356 1.00 0.00 H new ATOM 1986 N ILE A 127 12.551 2.261 19.686 1.00 0.00 N ATOM 1987 CA ILE A 127 12.868 3.119 20.863 1.00 0.00 C ATOM 1988 C ILE A 127 14.382 3.134 21.193 1.00 0.00 C ATOM 1989 O ILE A 127 15.007 4.194 21.232 1.00 0.00 O ATOM 1990 CB ILE A 127 11.974 2.703 22.089 1.00 0.00 C ATOM 1991 CG1 ILE A 127 11.967 3.730 23.260 1.00 0.00 C ATOM 1992 CG2 ILE A 127 12.298 1.291 22.651 1.00 0.00 C ATOM 1993 CD1 ILE A 127 11.257 5.061 22.968 1.00 0.00 C ATOM 0 H ILE A 127 11.938 1.478 19.915 1.00 0.00 H new ATOM 0 HA ILE A 127 12.624 4.151 20.611 1.00 0.00 H new ATOM 0 HB ILE A 127 10.974 2.683 21.656 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.491 3.266 24.124 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.999 3.942 23.540 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.641 1.075 23.494 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.145 0.545 21.871 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.336 1.261 22.983 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.310 5.702 23.848 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.744 5.556 22.128 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.213 4.870 22.721 1.00 0.00 H new