USER MOD reduce.3.24.130724 H: found=0, std=0, add=1071, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1072 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 51 THR OG1 : rot 90:sc= 0.863 USER MOD Set 1.2: A 97 MET CE :methyl -115:sc= -0.295 (180deg=-1.48) USER MOD Set 2.1: A 55 SER OG : rot -126:sc= -0.154 USER MOD Set 2.2: A 57 LYS NZ :NH3+ -134:sc= -0.108 (180deg=-1.88!) USER MOD Set 3.1: A 47 LYS NZ :NH3+ -153:sc= 0.829 (180deg=-0.943) USER MOD Set 3.2: A 49 GLN : amide:sc= -1.25 K(o=-0.43,f=-6.6!) USER MOD Set 4.1: A 2 SER OG : rot -43:sc= 0.0655 USER MOD Set 4.2: A 103 THR OG1 : rot 170:sc= -0.505! USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0253) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -1.27! K(o=-1.3!,f=-0.00042) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.621 USER MOD Single : A 31 SER OG : rot -19:sc= -0.253 USER MOD Single : A 32 THR OG1 : rot 119:sc= 0.196 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HE2:sc= -5.28! C(o=-5.3!,f=-5.4!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 150:sc= -0.011 USER MOD Single : A 44 THR OG1 : rot -26:sc= 0.0116 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl -127:sc= -2.03 (180deg=-4.36!) USER MOD Single : A 59 MET CE :methyl 142:sc= -4.84 (180deg=-15.9!) USER MOD Single : A 65 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0144) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0.0109 (180deg=0.0109) USER MOD Single : A 75 ASN : amide:sc= -1.41 X(o=-1.4,f=-1.9) USER MOD Single : A 78 ASN : amide:sc= -1.42 K(o=-1.4,f=-3.3!) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -0.174 X(o=-0.17,f=0) USER MOD Single : A 87 HIS : no HD1:sc= -8.74! C(o=-8.7!,f=-7.7!) USER MOD Single : A 88 MET CE :methyl -119:sc= -3.98! (180deg=-11.8!) USER MOD Single : A 90 SER OG : rot 180:sc= -0.42 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 ASN : amide:sc= -1.17 K(o=-1.2,f=-4.3!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -1.02 X(o=-1,f=-1.4) USER MOD Single : A 101 LYS NZ :NH3+ 156:sc= -0.398 (180deg=-1.44!) USER MOD Single : A 102 MET CE :methyl 170:sc= -0.664 (180deg=-0.893) USER MOD Single : A 105 GLN : amide:sc= -6.29 K(o=-6.3,f=-7.5!) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 SER OG : rot -131:sc= -2.35 USER MOD Single : A 111 TYR OH : rot 113:sc= -3.84! USER MOD Single : A 112 LYS NZ :NH3+ -154:sc= -0.717 (180deg=-2.44!) USER MOD Single : B 666 SER OG : rot 180:sc= 0 USER MOD Single : B 675 THR OG1 : rot 180:sc= 0 USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 677 SER OG : rot 180:sc= 0 USER MOD Single : B 678 GLN : amide:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : B 680 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -6.312 -17.706 -6.089 1.00 0.00 N ATOM 2 CA PRO A 1 -6.311 -16.250 -6.395 1.00 0.00 C ATOM 3 C PRO A 1 -5.432 -15.466 -5.422 1.00 0.00 C ATOM 4 O PRO A 1 -5.923 -14.892 -4.450 1.00 0.00 O ATOM 5 CB PRO A 1 -7.756 -15.762 -6.319 1.00 0.00 C ATOM 6 CG PRO A 1 -8.515 -16.936 -5.800 1.00 0.00 C ATOM 7 CD PRO A 1 -7.711 -18.160 -6.168 1.00 0.00 C ATOM 0 H2 PRO A 1 -5.928 -17.880 -5.160 1.00 0.00 H new ATOM 0 H3 PRO A 1 -5.729 -18.215 -6.753 1.00 0.00 H new ATOM 0 HA PRO A 1 -5.897 -16.087 -7.390 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -7.851 -14.902 -5.656 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -8.123 -15.452 -7.297 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -8.646 -16.867 -4.720 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -9.512 -16.979 -6.239 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -7.902 -18.984 -5.481 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -7.959 -18.515 -7.168 1.00 0.00 H new ATOM 17 N SER A 2 -4.130 -15.449 -5.692 1.00 0.00 N ATOM 18 CA SER A 2 -3.184 -14.737 -4.842 1.00 0.00 C ATOM 19 C SER A 2 -2.766 -13.416 -5.480 1.00 0.00 C ATOM 20 O SER A 2 -2.593 -12.409 -4.792 1.00 0.00 O ATOM 21 CB SER A 2 -1.951 -15.603 -4.580 1.00 0.00 C ATOM 22 OG SER A 2 -1.475 -15.429 -3.257 1.00 0.00 O ATOM 0 H SER A 2 -3.707 -15.920 -6.492 1.00 0.00 H new ATOM 0 HA SER A 2 -3.677 -14.521 -3.894 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.198 -16.652 -4.746 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.165 -15.345 -5.289 1.00 0.00 H new ATOM 0 HG SER A 2 -1.491 -14.477 -3.026 1.00 0.00 H new ATOM 28 N HIS A 3 -2.612 -13.425 -6.801 1.00 0.00 N ATOM 29 CA HIS A 3 -2.217 -12.228 -7.539 1.00 0.00 C ATOM 30 C HIS A 3 -3.414 -11.310 -7.803 1.00 0.00 C ATOM 31 O HIS A 3 -3.350 -10.439 -8.669 1.00 0.00 O ATOM 32 CB HIS A 3 -1.568 -12.621 -8.866 1.00 0.00 C ATOM 33 CG HIS A 3 -0.333 -13.452 -8.705 1.00 0.00 C ATOM 34 ND1 HIS A 3 -0.119 -14.627 -9.394 1.00 0.00 N ATOM 35 CD2 HIS A 3 0.762 -13.272 -7.926 1.00 0.00 C ATOM 36 CE1 HIS A 3 1.050 -15.134 -9.047 1.00 0.00 C ATOM 37 NE2 HIS A 3 1.605 -14.331 -8.158 1.00 0.00 N ATOM 0 H HIS A 3 -2.755 -14.250 -7.384 1.00 0.00 H new ATOM 0 HA HIS A 3 -1.499 -11.682 -6.927 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -2.292 -13.173 -9.466 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -1.318 -11.717 -9.421 1.00 0.00 H new ATOM 0 HD2 HIS A 3 0.938 -12.449 -7.249 1.00 0.00 H new ATOM 0 HE1 HIS A 3 1.479 -16.050 -9.426 1.00 0.00 H new ATOM 0 HE2 HIS A 3 2.513 -14.474 -7.715 1.00 0.00 H new ATOM 46 N SER A 4 -4.501 -11.500 -7.057 1.00 0.00 N ATOM 47 CA SER A 4 -5.689 -10.672 -7.224 1.00 0.00 C ATOM 48 C SER A 4 -6.490 -10.584 -5.930 1.00 0.00 C ATOM 49 O SER A 4 -6.427 -11.473 -5.081 1.00 0.00 O ATOM 50 CB SER A 4 -6.572 -11.201 -8.355 1.00 0.00 C ATOM 51 OG SER A 4 -6.653 -12.615 -8.323 1.00 0.00 O ATOM 0 H SER A 4 -4.582 -12.216 -6.335 1.00 0.00 H new ATOM 0 HA SER A 4 -5.352 -9.669 -7.486 1.00 0.00 H new ATOM 0 HB2 SER A 4 -7.572 -10.775 -8.269 1.00 0.00 H new ATOM 0 HB3 SER A 4 -6.169 -10.879 -9.315 1.00 0.00 H new ATOM 0 HG SER A 4 -7.225 -12.927 -9.055 1.00 0.00 H new ATOM 57 N GLY A 5 -7.233 -9.494 -5.793 1.00 0.00 N ATOM 58 CA GLY A 5 -8.039 -9.270 -4.609 1.00 0.00 C ATOM 59 C GLY A 5 -8.630 -7.877 -4.619 1.00 0.00 C ATOM 60 O GLY A 5 -7.960 -6.929 -5.011 1.00 0.00 O ATOM 0 H GLY A 5 -7.292 -8.752 -6.491 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -8.839 -10.009 -4.562 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -7.428 -9.405 -3.716 1.00 0.00 H new ATOM 64 N ALA A 6 -9.886 -7.749 -4.219 1.00 0.00 N ATOM 65 CA ALA A 6 -10.546 -6.449 -4.227 1.00 0.00 C ATOM 66 C ALA A 6 -10.231 -5.624 -2.983 1.00 0.00 C ATOM 67 O ALA A 6 -10.052 -6.161 -1.890 1.00 0.00 O ATOM 68 CB ALA A 6 -12.040 -6.626 -4.412 1.00 0.00 C ATOM 0 H ALA A 6 -10.465 -8.520 -3.888 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.152 -5.884 -5.071 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.524 -5.649 -4.417 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.232 -7.131 -5.359 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -12.439 -7.225 -3.594 1.00 0.00 H new ATOM 74 N ALA A 7 -10.155 -4.305 -3.173 1.00 0.00 N ATOM 75 CA ALA A 7 -9.850 -3.376 -2.089 1.00 0.00 C ATOM 76 C ALA A 7 -10.353 -1.967 -2.411 1.00 0.00 C ATOM 77 O ALA A 7 -10.794 -1.699 -3.527 1.00 0.00 O ATOM 78 CB ALA A 7 -8.352 -3.360 -1.828 1.00 0.00 C ATOM 0 H ALA A 7 -10.302 -3.856 -4.077 1.00 0.00 H new ATOM 0 HA ALA A 7 -10.365 -3.715 -1.190 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.131 -2.665 -1.018 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -8.021 -4.360 -1.548 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -7.829 -3.044 -2.730 1.00 0.00 H new ATOM 84 N ILE A 8 -10.293 -1.074 -1.423 1.00 0.00 N ATOM 85 CA ILE A 8 -10.754 0.306 -1.604 1.00 0.00 C ATOM 86 C ILE A 8 -9.596 1.274 -1.826 1.00 0.00 C ATOM 87 O ILE A 8 -8.666 1.335 -1.024 1.00 0.00 O ATOM 88 CB ILE A 8 -11.549 0.806 -0.379 1.00 0.00 C ATOM 89 CG1 ILE A 8 -12.694 -0.150 -0.014 1.00 0.00 C ATOM 90 CG2 ILE A 8 -12.083 2.214 -0.628 1.00 0.00 C ATOM 91 CD1 ILE A 8 -13.380 -0.796 -1.191 1.00 0.00 C ATOM 0 H ILE A 8 -9.931 -1.279 -0.492 1.00 0.00 H new ATOM 0 HA ILE A 8 -11.393 0.286 -2.487 1.00 0.00 H new ATOM 0 HB ILE A 8 -10.865 0.834 0.469 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -12.301 -0.933 0.634 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -13.437 0.400 0.564 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -12.641 2.551 0.245 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.249 2.892 -0.810 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -12.740 2.205 -1.497 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -14.173 -1.453 -0.834 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.808 -0.024 -1.831 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -12.655 -1.378 -1.760 1.00 0.00 H new ATOM 103 N PHE A 9 -9.677 2.058 -2.897 1.00 0.00 N ATOM 104 CA PHE A 9 -8.649 3.050 -3.185 1.00 0.00 C ATOM 105 C PHE A 9 -9.256 4.443 -3.326 1.00 0.00 C ATOM 106 O PHE A 9 -9.925 4.746 -4.314 1.00 0.00 O ATOM 107 CB PHE A 9 -7.873 2.699 -4.456 1.00 0.00 C ATOM 108 CG PHE A 9 -6.659 3.565 -4.660 1.00 0.00 C ATOM 109 CD1 PHE A 9 -6.792 4.921 -4.918 1.00 0.00 C ATOM 110 CD2 PHE A 9 -5.386 3.025 -4.590 1.00 0.00 C ATOM 111 CE1 PHE A 9 -5.679 5.719 -5.101 1.00 0.00 C ATOM 112 CE2 PHE A 9 -4.268 3.818 -4.773 1.00 0.00 C ATOM 113 CZ PHE A 9 -4.415 5.166 -5.028 1.00 0.00 C ATOM 0 H PHE A 9 -10.439 2.026 -3.575 1.00 0.00 H new ATOM 0 HA PHE A 9 -7.957 3.047 -2.343 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -7.564 1.655 -4.410 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -8.533 2.799 -5.318 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -7.778 5.359 -4.977 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.265 1.971 -4.390 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -5.797 6.774 -5.301 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -3.281 3.383 -4.716 1.00 0.00 H new ATOM 0 HZ PHE A 9 -3.543 5.788 -5.170 1.00 0.00 H new ATOM 123 N GLU A 10 -9.001 5.285 -2.330 1.00 0.00 N ATOM 124 CA GLU A 10 -9.493 6.663 -2.319 1.00 0.00 C ATOM 125 C GLU A 10 -11.009 6.723 -2.154 1.00 0.00 C ATOM 126 O GLU A 10 -11.698 7.422 -2.897 1.00 0.00 O ATOM 127 CB GLU A 10 -9.076 7.398 -3.597 1.00 0.00 C ATOM 128 CG GLU A 10 -7.678 7.991 -3.527 1.00 0.00 C ATOM 129 CD GLU A 10 -7.581 9.140 -2.541 1.00 0.00 C ATOM 130 OE1 GLU A 10 -7.415 8.872 -1.333 1.00 0.00 O ATOM 131 OE2 GLU A 10 -7.673 10.306 -2.978 1.00 0.00 O ATOM 0 H GLU A 10 -8.450 5.035 -1.509 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.042 7.158 -1.459 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.127 6.706 -4.438 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.791 8.196 -3.797 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.971 7.212 -3.242 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.386 8.341 -4.517 1.00 0.00 H new ATOM 138 N LYS A 11 -11.521 5.995 -1.165 1.00 0.00 N ATOM 139 CA LYS A 11 -12.956 5.969 -0.884 1.00 0.00 C ATOM 140 C LYS A 11 -13.735 5.178 -1.936 1.00 0.00 C ATOM 141 O LYS A 11 -14.936 4.959 -1.782 1.00 0.00 O ATOM 142 CB LYS A 11 -13.510 7.395 -0.793 1.00 0.00 C ATOM 143 CG LYS A 11 -12.656 8.329 0.049 1.00 0.00 C ATOM 144 CD LYS A 11 -13.174 8.425 1.474 1.00 0.00 C ATOM 145 CE LYS A 11 -12.140 9.040 2.403 1.00 0.00 C ATOM 146 NZ LYS A 11 -11.764 10.417 1.981 1.00 0.00 N ATOM 0 H LYS A 11 -10.962 5.413 -0.542 1.00 0.00 H new ATOM 0 HA LYS A 11 -13.085 5.466 0.074 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -13.599 7.806 -1.799 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -14.515 7.359 -0.373 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -11.626 7.972 0.059 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -12.646 9.321 -0.403 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -14.083 9.026 1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -13.441 7.431 1.833 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -12.535 9.067 3.419 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -11.250 8.411 2.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -11.149 10.845 2.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.257 10.376 1.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -12.623 10.993 1.872 1.00 0.00 H new ATOM 160 N VAL A 12 -13.059 4.745 -2.998 1.00 0.00 N ATOM 161 CA VAL A 12 -13.714 3.982 -4.045 1.00 0.00 C ATOM 162 C VAL A 12 -13.419 2.507 -3.891 1.00 0.00 C ATOM 163 O VAL A 12 -12.326 2.114 -3.482 1.00 0.00 O ATOM 164 CB VAL A 12 -13.285 4.452 -5.447 1.00 0.00 C ATOM 165 CG1 VAL A 12 -13.593 3.401 -6.510 1.00 0.00 C ATOM 166 CG2 VAL A 12 -13.985 5.751 -5.770 1.00 0.00 C ATOM 0 H VAL A 12 -12.064 4.911 -3.151 1.00 0.00 H new ATOM 0 HA VAL A 12 -14.786 4.150 -3.944 1.00 0.00 H new ATOM 0 HB VAL A 12 -12.206 4.605 -5.447 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -13.277 3.768 -7.487 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -13.058 2.480 -6.277 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -14.665 3.203 -6.527 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -13.685 6.089 -6.762 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -15.064 5.598 -5.750 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -13.712 6.505 -5.032 1.00 0.00 H new ATOM 176 N SER A 13 -14.402 1.696 -4.224 1.00 0.00 N ATOM 177 CA SER A 13 -14.250 0.257 -4.123 1.00 0.00 C ATOM 178 C SER A 13 -13.924 -0.351 -5.477 1.00 0.00 C ATOM 179 O SER A 13 -14.744 -0.328 -6.396 1.00 0.00 O ATOM 180 CB SER A 13 -15.514 -0.384 -3.558 1.00 0.00 C ATOM 181 OG SER A 13 -16.208 0.512 -2.707 1.00 0.00 O ATOM 0 H SER A 13 -15.312 2.006 -4.566 1.00 0.00 H new ATOM 0 HA SER A 13 -13.422 0.059 -3.443 1.00 0.00 H new ATOM 0 HB2 SER A 13 -16.166 -0.691 -4.376 1.00 0.00 H new ATOM 0 HB3 SER A 13 -15.251 -1.285 -3.004 1.00 0.00 H new ATOM 0 HG SER A 13 -17.014 0.076 -2.361 1.00 0.00 H new ATOM 187 N GLY A 14 -12.726 -0.899 -5.590 1.00 0.00 N ATOM 188 CA GLY A 14 -12.306 -1.516 -6.828 1.00 0.00 C ATOM 189 C GLY A 14 -11.604 -2.834 -6.590 1.00 0.00 C ATOM 190 O GLY A 14 -11.597 -3.345 -5.470 1.00 0.00 O ATOM 0 H GLY A 14 -12.033 -0.927 -4.842 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.175 -1.677 -7.467 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.638 -0.840 -7.363 1.00 0.00 H new ATOM 194 N ILE A 15 -11.010 -3.382 -7.636 1.00 0.00 N ATOM 195 CA ILE A 15 -10.301 -4.641 -7.526 1.00 0.00 C ATOM 196 C ILE A 15 -8.805 -4.430 -7.559 1.00 0.00 C ATOM 197 O ILE A 15 -8.291 -3.704 -8.406 1.00 0.00 O ATOM 198 CB ILE A 15 -10.661 -5.615 -8.666 1.00 0.00 C ATOM 199 CG1 ILE A 15 -12.181 -5.699 -8.859 1.00 0.00 C ATOM 200 CG2 ILE A 15 -10.064 -6.995 -8.391 1.00 0.00 C ATOM 201 CD1 ILE A 15 -12.964 -5.910 -7.578 1.00 0.00 C ATOM 0 H ILE A 15 -11.006 -2.973 -8.571 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.606 -5.071 -6.572 1.00 0.00 H new ATOM 0 HB ILE A 15 -10.233 -5.234 -9.593 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -12.526 -4.781 -9.334 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -12.403 -6.516 -9.545 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -10.326 -7.673 -9.203 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.979 -6.915 -8.320 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -10.461 -7.383 -7.453 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -14.029 -5.958 -7.806 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -12.651 -6.843 -7.110 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.776 -5.081 -6.896 1.00 0.00 H new ATOM 213 N ILE A 16 -8.103 -5.117 -6.675 1.00 0.00 N ATOM 214 CA ILE A 16 -6.660 -5.048 -6.653 1.00 0.00 C ATOM 215 C ILE A 16 -6.157 -6.291 -7.347 1.00 0.00 C ATOM 216 O ILE A 16 -6.734 -7.368 -7.189 1.00 0.00 O ATOM 217 CB ILE A 16 -6.074 -4.975 -5.215 1.00 0.00 C ATOM 218 CG1 ILE A 16 -5.515 -3.579 -4.934 1.00 0.00 C ATOM 219 CG2 ILE A 16 -4.985 -6.024 -5.012 1.00 0.00 C ATOM 220 CD1 ILE A 16 -4.797 -3.467 -3.604 1.00 0.00 C ATOM 0 H ILE A 16 -8.511 -5.726 -5.966 1.00 0.00 H new ATOM 0 HA ILE A 16 -6.340 -4.134 -7.152 1.00 0.00 H new ATOM 0 HB ILE A 16 -6.883 -5.180 -4.514 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.826 -3.306 -5.733 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -6.332 -2.858 -4.957 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -4.593 -5.950 -3.998 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -5.404 -7.018 -5.167 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -4.179 -5.854 -5.726 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -4.428 -2.450 -3.474 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -5.488 -3.708 -2.796 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.958 -4.162 -3.584 1.00 0.00 H new ATOM 232 N ALA A 17 -5.114 -6.155 -8.131 1.00 0.00 N ATOM 233 CA ALA A 17 -4.602 -7.300 -8.846 1.00 0.00 C ATOM 234 C ALA A 17 -3.113 -7.176 -9.103 1.00 0.00 C ATOM 235 O ALA A 17 -2.646 -6.253 -9.768 1.00 0.00 O ATOM 236 CB ALA A 17 -5.397 -7.500 -10.124 1.00 0.00 C ATOM 0 H ALA A 17 -4.611 -5.282 -8.289 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.726 -8.189 -8.228 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.009 -8.365 -10.662 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.446 -7.666 -9.878 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.308 -6.613 -10.751 1.00 0.00 H new ATOM 242 N ILE A 18 -2.379 -8.117 -8.534 1.00 0.00 N ATOM 243 CA ILE A 18 -0.933 -8.151 -8.642 1.00 0.00 C ATOM 244 C ILE A 18 -0.469 -8.781 -9.947 1.00 0.00 C ATOM 245 O ILE A 18 -1.057 -9.746 -10.433 1.00 0.00 O ATOM 246 CB ILE A 18 -0.320 -8.932 -7.468 1.00 0.00 C ATOM 247 CG1 ILE A 18 -0.865 -8.399 -6.141 1.00 0.00 C ATOM 248 CG2 ILE A 18 1.197 -8.849 -7.507 1.00 0.00 C ATOM 249 CD1 ILE A 18 -0.234 -9.039 -4.928 1.00 0.00 C ATOM 0 H ILE A 18 -2.771 -8.880 -7.983 1.00 0.00 H new ATOM 0 HA ILE A 18 -0.595 -7.115 -8.619 1.00 0.00 H new ATOM 0 HB ILE A 18 -0.600 -9.981 -7.558 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -0.704 -7.322 -6.098 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -1.942 -8.562 -6.108 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.614 -9.407 -6.669 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.561 -9.274 -8.443 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.506 -7.806 -7.438 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -0.669 -8.613 -4.024 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.417 -10.113 -4.947 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.840 -8.854 -4.936 1.00 0.00 H new ATOM 261 N ASN A 19 0.605 -8.230 -10.497 1.00 0.00 N ATOM 262 CA ASN A 19 1.179 -8.731 -11.733 1.00 0.00 C ATOM 263 C ASN A 19 2.603 -9.215 -11.487 1.00 0.00 C ATOM 264 O ASN A 19 3.552 -8.438 -11.544 1.00 0.00 O ATOM 265 CB ASN A 19 1.170 -7.641 -12.808 1.00 0.00 C ATOM 266 CG ASN A 19 0.664 -8.151 -14.143 1.00 0.00 C ATOM 267 OD1 ASN A 19 -0.503 -8.519 -14.278 1.00 0.00 O ATOM 268 ND2 ASN A 19 1.542 -8.176 -15.139 1.00 0.00 N ATOM 0 H ASN A 19 1.098 -7.430 -10.101 1.00 0.00 H new ATOM 0 HA ASN A 19 0.576 -9.568 -12.084 1.00 0.00 H new ATOM 0 HB2 ASN A 19 0.543 -6.813 -12.477 1.00 0.00 H new ATOM 0 HB3 ASN A 19 2.179 -7.247 -12.931 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.259 -8.510 -16.060 1.00 0.00 H new ATOM 0 HD22 ASN A 19 2.500 -7.861 -14.983 1.00 0.00 H new ATOM 275 N GLU A 20 2.742 -10.503 -11.200 1.00 0.00 N ATOM 276 CA GLU A 20 4.051 -11.091 -10.937 1.00 0.00 C ATOM 277 C GLU A 20 4.787 -11.412 -12.237 1.00 0.00 C ATOM 278 O GLU A 20 5.918 -11.899 -12.213 1.00 0.00 O ATOM 279 CB GLU A 20 3.901 -12.360 -10.093 1.00 0.00 C ATOM 280 CG GLU A 20 4.909 -12.459 -8.960 1.00 0.00 C ATOM 281 CD GLU A 20 5.543 -13.833 -8.862 1.00 0.00 C ATOM 282 OE1 GLU A 20 4.804 -14.813 -8.631 1.00 0.00 O ATOM 283 OE2 GLU A 20 6.779 -13.928 -9.015 1.00 0.00 O ATOM 0 H GLU A 20 1.965 -11.161 -11.143 1.00 0.00 H new ATOM 0 HA GLU A 20 4.642 -10.360 -10.385 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.894 -12.393 -9.676 1.00 0.00 H new ATOM 0 HB3 GLU A 20 4.007 -13.231 -10.740 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.689 -11.712 -9.107 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.415 -12.223 -8.017 1.00 0.00 H new ATOM 290 N ASP A 21 4.146 -11.136 -13.369 1.00 0.00 N ATOM 291 CA ASP A 21 4.749 -11.394 -14.671 1.00 0.00 C ATOM 292 C ASP A 21 5.688 -10.260 -15.079 1.00 0.00 C ATOM 293 O ASP A 21 6.282 -10.294 -16.156 1.00 0.00 O ATOM 294 CB ASP A 21 3.662 -11.571 -15.729 1.00 0.00 C ATOM 295 CG ASP A 21 2.876 -12.854 -15.543 1.00 0.00 C ATOM 296 OD1 ASP A 21 2.065 -12.921 -14.595 1.00 0.00 O ATOM 297 OD2 ASP A 21 3.070 -13.791 -16.346 1.00 0.00 O ATOM 0 H ASP A 21 3.210 -10.734 -13.410 1.00 0.00 H new ATOM 0 HA ASP A 21 5.332 -12.312 -14.595 1.00 0.00 H new ATOM 0 HB2 ASP A 21 2.980 -10.722 -15.690 1.00 0.00 H new ATOM 0 HB3 ASP A 21 4.119 -11.568 -16.719 1.00 0.00 H new ATOM 302 N VAL A 22 5.819 -9.255 -14.214 1.00 0.00 N ATOM 303 CA VAL A 22 6.688 -8.118 -14.496 1.00 0.00 C ATOM 304 C VAL A 22 7.986 -8.223 -13.702 1.00 0.00 C ATOM 305 O VAL A 22 8.336 -9.293 -13.204 1.00 0.00 O ATOM 306 CB VAL A 22 6.012 -6.759 -14.192 1.00 0.00 C ATOM 307 CG1 VAL A 22 5.847 -5.940 -15.463 1.00 0.00 C ATOM 308 CG2 VAL A 22 4.681 -6.961 -13.521 1.00 0.00 C ATOM 0 H VAL A 22 5.336 -9.207 -13.317 1.00 0.00 H new ATOM 0 HA VAL A 22 6.901 -8.153 -15.564 1.00 0.00 H new ATOM 0 HB VAL A 22 6.660 -6.208 -13.510 1.00 0.00 H new ATOM 0 HG11 VAL A 22 5.370 -4.990 -15.224 1.00 0.00 H new ATOM 0 HG12 VAL A 22 6.826 -5.754 -15.905 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.227 -6.489 -16.172 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.225 -5.992 -13.317 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.028 -7.539 -14.175 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.824 -7.499 -12.584 1.00 0.00 H new ATOM 318 N SER A 23 8.690 -7.106 -13.583 1.00 0.00 N ATOM 319 CA SER A 23 9.944 -7.064 -12.846 1.00 0.00 C ATOM 320 C SER A 23 10.485 -5.637 -12.797 1.00 0.00 C ATOM 321 O SER A 23 11.054 -5.150 -13.772 1.00 0.00 O ATOM 322 CB SER A 23 10.970 -7.998 -13.490 1.00 0.00 C ATOM 323 OG SER A 23 12.296 -7.586 -13.202 1.00 0.00 O ATOM 0 H SER A 23 8.412 -6.213 -13.990 1.00 0.00 H new ATOM 0 HA SER A 23 9.758 -7.400 -11.826 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.816 -9.015 -13.128 1.00 0.00 H new ATOM 0 HB3 SER A 23 10.820 -8.018 -14.569 1.00 0.00 H new ATOM 0 HG SER A 23 12.929 -8.203 -13.625 1.00 0.00 H new ATOM 329 N PRO A 24 10.307 -4.938 -11.659 1.00 0.00 N ATOM 330 CA PRO A 24 9.633 -5.476 -10.469 1.00 0.00 C ATOM 331 C PRO A 24 8.128 -5.641 -10.669 1.00 0.00 C ATOM 332 O PRO A 24 7.540 -5.040 -11.567 1.00 0.00 O ATOM 333 CB PRO A 24 9.907 -4.428 -9.381 1.00 0.00 C ATOM 334 CG PRO A 24 10.921 -3.493 -9.957 1.00 0.00 C ATOM 335 CD PRO A 24 10.761 -3.561 -11.445 1.00 0.00 C ATOM 0 HA PRO A 24 10.002 -6.472 -10.223 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.994 -3.896 -9.112 1.00 0.00 H new ATOM 0 HB3 PRO A 24 10.282 -4.898 -8.472 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.762 -2.477 -9.595 1.00 0.00 H new ATOM 0 HG3 PRO A 24 11.929 -3.783 -9.661 1.00 0.00 H new ATOM 0 HD2 PRO A 24 10.034 -2.834 -11.807 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.699 -3.359 -11.963 1.00 0.00 H new ATOM 343 N ALA A 25 7.514 -6.458 -9.817 1.00 0.00 N ATOM 344 CA ALA A 25 6.075 -6.705 -9.888 1.00 0.00 C ATOM 345 C ALA A 25 5.285 -5.409 -9.842 1.00 0.00 C ATOM 346 O ALA A 25 5.853 -4.325 -9.706 1.00 0.00 O ATOM 347 CB ALA A 25 5.627 -7.599 -8.744 1.00 0.00 C ATOM 0 H ALA A 25 7.990 -6.961 -9.068 1.00 0.00 H new ATOM 0 HA ALA A 25 5.881 -7.201 -10.839 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.553 -7.770 -8.815 1.00 0.00 H new ATOM 0 HB2 ALA A 25 6.151 -8.553 -8.801 1.00 0.00 H new ATOM 0 HB3 ALA A 25 5.855 -7.116 -7.794 1.00 0.00 H new ATOM 353 N GLU A 26 3.967 -5.532 -9.938 1.00 0.00 N ATOM 354 CA GLU A 26 3.096 -4.370 -9.886 1.00 0.00 C ATOM 355 C GLU A 26 1.652 -4.777 -9.613 1.00 0.00 C ATOM 356 O GLU A 26 1.136 -5.713 -10.222 1.00 0.00 O ATOM 357 CB GLU A 26 3.182 -3.578 -11.193 1.00 0.00 C ATOM 358 CG GLU A 26 2.618 -4.319 -12.396 1.00 0.00 C ATOM 359 CD GLU A 26 3.135 -3.772 -13.711 1.00 0.00 C ATOM 360 OE1 GLU A 26 4.365 -3.598 -13.841 1.00 0.00 O ATOM 361 OE2 GLU A 26 2.309 -3.516 -14.613 1.00 0.00 O ATOM 0 H GLU A 26 3.482 -6.422 -10.052 1.00 0.00 H new ATOM 0 HA GLU A 26 3.432 -3.736 -9.066 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.645 -2.637 -11.073 1.00 0.00 H new ATOM 0 HB3 GLU A 26 4.225 -3.328 -11.388 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.874 -5.376 -12.320 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.530 -4.253 -12.382 1.00 0.00 H new ATOM 368 N LEU A 27 0.997 -4.057 -8.708 1.00 0.00 N ATOM 369 CA LEU A 27 -0.393 -4.338 -8.376 1.00 0.00 C ATOM 370 C LEU A 27 -1.284 -3.239 -8.952 1.00 0.00 C ATOM 371 O LEU A 27 -1.005 -2.053 -8.786 1.00 0.00 O ATOM 372 CB LEU A 27 -0.579 -4.483 -6.850 1.00 0.00 C ATOM 373 CG LEU A 27 -0.919 -3.205 -6.071 1.00 0.00 C ATOM 374 CD1 LEU A 27 -2.295 -2.661 -6.431 1.00 0.00 C ATOM 375 CD2 LEU A 27 -0.848 -3.481 -4.584 1.00 0.00 C ATOM 0 H LEU A 27 1.406 -3.277 -8.193 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.684 -5.289 -8.821 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.371 -5.211 -6.672 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.338 -4.901 -6.434 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.186 -2.446 -6.346 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.491 -1.757 -5.855 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.327 -2.427 -7.495 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -3.054 -3.409 -6.201 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.090 -2.572 -4.033 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.562 -4.263 -4.325 1.00 0.00 H new ATOM 0 HD23 LEU A 27 0.159 -3.807 -4.322 1.00 0.00 H new ATOM 387 N THR A 28 -2.340 -3.637 -9.654 1.00 0.00 N ATOM 388 CA THR A 28 -3.245 -2.679 -10.282 1.00 0.00 C ATOM 389 C THR A 28 -4.636 -2.700 -9.658 1.00 0.00 C ATOM 390 O THR A 28 -5.377 -3.673 -9.802 1.00 0.00 O ATOM 391 CB THR A 28 -3.355 -2.982 -11.776 1.00 0.00 C ATOM 392 OG1 THR A 28 -2.073 -3.186 -12.343 1.00 0.00 O ATOM 393 CG2 THR A 28 -4.035 -1.882 -12.562 1.00 0.00 C ATOM 0 H THR A 28 -2.591 -4.615 -9.803 1.00 0.00 H new ATOM 0 HA THR A 28 -2.828 -1.685 -10.124 1.00 0.00 H new ATOM 0 HB THR A 28 -3.964 -3.884 -11.843 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.165 -3.380 -13.299 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.080 -2.161 -13.615 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.046 -1.735 -12.182 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.469 -0.956 -12.456 1.00 0.00 H new ATOM 401 N TRP A 29 -4.999 -1.606 -8.992 1.00 0.00 N ATOM 402 CA TRP A 29 -6.303 -1.484 -8.382 1.00 0.00 C ATOM 403 C TRP A 29 -7.265 -0.829 -9.365 1.00 0.00 C ATOM 404 O TRP A 29 -7.140 0.356 -9.664 1.00 0.00 O ATOM 405 CB TRP A 29 -6.221 -0.637 -7.115 1.00 0.00 C ATOM 406 CG TRP A 29 -7.566 -0.312 -6.549 1.00 0.00 C ATOM 407 CD1 TRP A 29 -8.265 -1.064 -5.668 1.00 0.00 C ATOM 408 CD2 TRP A 29 -8.375 0.834 -6.839 1.00 0.00 C ATOM 409 NE1 TRP A 29 -9.468 -0.463 -5.375 1.00 0.00 N ATOM 410 CE2 TRP A 29 -9.557 0.708 -6.084 1.00 0.00 C ATOM 411 CE3 TRP A 29 -8.216 1.955 -7.659 1.00 0.00 C ATOM 412 CZ2 TRP A 29 -10.573 1.659 -6.126 1.00 0.00 C ATOM 413 CZ3 TRP A 29 -9.225 2.899 -7.700 1.00 0.00 C ATOM 414 CH2 TRP A 29 -10.390 2.745 -6.938 1.00 0.00 C ATOM 0 H TRP A 29 -4.398 -0.792 -8.866 1.00 0.00 H new ATOM 0 HA TRP A 29 -6.662 -2.479 -8.120 1.00 0.00 H new ATOM 0 HB2 TRP A 29 -5.635 -1.168 -6.365 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -5.691 0.289 -7.336 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -7.927 -2.002 -5.254 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -10.175 -0.828 -4.737 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -7.321 2.081 -8.250 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -11.472 1.544 -5.539 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -9.113 3.769 -8.330 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -11.161 3.500 -6.993 1.00 0.00 H new ATOM 425 N ARG A 30 -8.219 -1.600 -9.862 1.00 0.00 N ATOM 426 CA ARG A 30 -9.195 -1.080 -10.813 1.00 0.00 C ATOM 427 C ARG A 30 -10.553 -0.895 -10.149 1.00 0.00 C ATOM 428 O ARG A 30 -11.052 -1.795 -9.485 1.00 0.00 O ATOM 429 CB ARG A 30 -9.325 -2.022 -12.011 1.00 0.00 C ATOM 430 CG ARG A 30 -10.219 -1.484 -13.115 1.00 0.00 C ATOM 431 CD ARG A 30 -10.415 -2.506 -14.222 1.00 0.00 C ATOM 432 NE ARG A 30 -10.424 -1.886 -15.546 1.00 0.00 N ATOM 433 CZ ARG A 30 -10.564 -2.566 -16.682 1.00 0.00 C ATOM 434 NH1 ARG A 30 -10.708 -3.886 -16.661 1.00 0.00 N ATOM 435 NH2 ARG A 30 -10.560 -1.925 -17.842 1.00 0.00 N ATOM 0 H ARG A 30 -8.340 -2.585 -9.625 1.00 0.00 H new ATOM 0 HA ARG A 30 -8.844 -0.109 -11.161 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -8.333 -2.215 -12.420 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -9.720 -2.979 -11.669 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -11.187 -1.208 -12.698 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -9.780 -0.577 -13.530 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -9.618 -3.248 -14.175 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -11.354 -3.036 -14.064 1.00 0.00 H new ATOM 0 HE ARG A 30 -10.317 -0.873 -15.603 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -10.712 -4.385 -15.771 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -10.815 -4.401 -17.535 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -10.450 -0.911 -17.864 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -10.667 -2.445 -18.713 1.00 0.00 H new ATOM 449 N SER A 31 -11.154 0.277 -10.335 1.00 0.00 N ATOM 450 CA SER A 31 -12.459 0.559 -9.745 1.00 0.00 C ATOM 451 C SER A 31 -13.440 -0.570 -10.049 1.00 0.00 C ATOM 452 O SER A 31 -13.298 -1.274 -11.049 1.00 0.00 O ATOM 453 CB SER A 31 -13.007 1.883 -10.277 1.00 0.00 C ATOM 454 OG SER A 31 -12.278 2.983 -9.759 1.00 0.00 O ATOM 0 H SER A 31 -10.762 1.041 -10.885 1.00 0.00 H new ATOM 0 HA SER A 31 -12.337 0.635 -8.664 1.00 0.00 H new ATOM 0 HB2 SER A 31 -12.956 1.890 -11.366 1.00 0.00 H new ATOM 0 HB3 SER A 31 -14.058 1.980 -10.006 1.00 0.00 H new ATOM 0 HG SER A 31 -11.792 2.704 -8.955 1.00 0.00 H new ATOM 460 N THR A 32 -14.437 -0.736 -9.187 1.00 0.00 N ATOM 461 CA THR A 32 -15.435 -1.777 -9.374 1.00 0.00 C ATOM 462 C THR A 32 -16.364 -1.397 -10.515 1.00 0.00 C ATOM 463 O THR A 32 -16.845 -2.252 -11.260 1.00 0.00 O ATOM 464 CB THR A 32 -16.231 -1.990 -8.082 1.00 0.00 C ATOM 465 OG1 THR A 32 -15.424 -2.606 -7.095 1.00 0.00 O ATOM 466 CG2 THR A 32 -17.463 -2.850 -8.268 1.00 0.00 C ATOM 0 H THR A 32 -14.574 -0.163 -8.354 1.00 0.00 H new ATOM 0 HA THR A 32 -14.933 -2.712 -9.624 1.00 0.00 H new ATOM 0 HB THR A 32 -16.549 -0.994 -7.772 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.348 -2.014 -6.318 1.00 0.00 H new ATOM 0 HG21 THR A 32 -17.978 -2.959 -7.314 1.00 0.00 H new ATOM 0 HG22 THR A 32 -18.131 -2.378 -8.989 1.00 0.00 H new ATOM 0 HG23 THR A 32 -17.168 -3.833 -8.636 1.00 0.00 H new ATOM 474 N ASP A 33 -16.602 -0.102 -10.640 1.00 0.00 N ATOM 475 CA ASP A 33 -17.464 0.420 -11.686 1.00 0.00 C ATOM 476 C ASP A 33 -16.671 0.693 -12.964 1.00 0.00 C ATOM 477 O ASP A 33 -17.249 0.837 -14.041 1.00 0.00 O ATOM 478 CB ASP A 33 -18.157 1.699 -11.216 1.00 0.00 C ATOM 479 CG ASP A 33 -19.458 1.419 -10.489 1.00 0.00 C ATOM 480 OD1 ASP A 33 -19.406 0.861 -9.373 1.00 0.00 O ATOM 481 OD2 ASP A 33 -20.528 1.756 -11.037 1.00 0.00 O ATOM 0 H ASP A 33 -16.207 0.610 -10.026 1.00 0.00 H new ATOM 0 HA ASP A 33 -18.221 -0.333 -11.906 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -17.487 2.250 -10.556 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -18.355 2.339 -12.076 1.00 0.00 H new ATOM 486 N GLY A 34 -15.349 0.766 -12.836 1.00 0.00 N ATOM 487 CA GLY A 34 -14.505 1.023 -13.988 1.00 0.00 C ATOM 488 C GLY A 34 -14.311 2.505 -14.240 1.00 0.00 C ATOM 489 O GLY A 34 -14.201 2.938 -15.388 1.00 0.00 O ATOM 0 H GLY A 34 -14.848 0.652 -11.955 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -13.534 0.552 -13.836 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.948 0.562 -14.870 1.00 0.00 H new ATOM 493 N ASP A 35 -14.275 3.285 -13.166 1.00 0.00 N ATOM 494 CA ASP A 35 -14.100 4.729 -13.274 1.00 0.00 C ATOM 495 C ASP A 35 -12.624 5.114 -13.280 1.00 0.00 C ATOM 496 O ASP A 35 -12.253 6.172 -13.791 1.00 0.00 O ATOM 497 CB ASP A 35 -14.819 5.438 -12.125 1.00 0.00 C ATOM 498 CG ASP A 35 -16.252 5.793 -12.472 1.00 0.00 C ATOM 499 OD1 ASP A 35 -17.088 4.869 -12.559 1.00 0.00 O ATOM 500 OD2 ASP A 35 -16.538 6.995 -12.655 1.00 0.00 O ATOM 0 H ASP A 35 -14.365 2.942 -12.210 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.536 5.045 -14.222 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.809 4.797 -11.243 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -14.275 6.346 -11.865 1.00 0.00 H new ATOM 505 N LYS A 36 -11.785 4.258 -12.709 1.00 0.00 N ATOM 506 CA LYS A 36 -10.351 4.524 -12.652 1.00 0.00 C ATOM 507 C LYS A 36 -9.593 3.358 -12.039 1.00 0.00 C ATOM 508 O LYS A 36 -10.181 2.445 -11.459 1.00 0.00 O ATOM 509 CB LYS A 36 -10.080 5.798 -11.852 1.00 0.00 C ATOM 510 CG LYS A 36 -10.430 5.679 -10.375 1.00 0.00 C ATOM 511 CD LYS A 36 -11.575 6.603 -9.992 1.00 0.00 C ATOM 512 CE LYS A 36 -11.065 7.938 -9.476 1.00 0.00 C ATOM 513 NZ LYS A 36 -11.969 9.061 -9.851 1.00 0.00 N ATOM 0 H LYS A 36 -12.070 3.377 -12.280 1.00 0.00 H new ATOM 0 HA LYS A 36 -9.998 4.658 -13.675 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -9.026 6.059 -11.947 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -10.651 6.618 -12.287 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -10.702 4.648 -10.148 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -9.553 5.917 -9.773 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.216 6.767 -10.858 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -12.188 6.126 -9.227 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -10.970 7.895 -8.391 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -10.069 8.125 -9.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -11.586 9.954 -9.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -12.040 9.118 -10.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.913 8.896 -9.448 1.00 0.00 H new ATOM 527 N VAL A 37 -8.278 3.394 -12.200 1.00 0.00 N ATOM 528 CA VAL A 37 -7.410 2.349 -11.699 1.00 0.00 C ATOM 529 C VAL A 37 -6.091 2.931 -11.194 1.00 0.00 C ATOM 530 O VAL A 37 -5.670 4.006 -11.621 1.00 0.00 O ATOM 531 CB VAL A 37 -7.138 1.315 -12.811 1.00 0.00 C ATOM 532 CG1 VAL A 37 -7.010 2.013 -14.160 1.00 0.00 C ATOM 533 CG2 VAL A 37 -5.898 0.473 -12.508 1.00 0.00 C ATOM 0 H VAL A 37 -7.788 4.148 -12.681 1.00 0.00 H new ATOM 0 HA VAL A 37 -7.910 1.858 -10.864 1.00 0.00 H new ATOM 0 HB VAL A 37 -7.987 0.633 -12.851 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.818 1.272 -14.936 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.936 2.543 -14.385 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.184 2.724 -14.125 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -5.739 -0.244 -13.314 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -5.028 1.124 -12.424 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -6.042 -0.062 -11.570 1.00 0.00 H new ATOM 543 N HIS A 38 -5.444 2.210 -10.284 1.00 0.00 N ATOM 544 CA HIS A 38 -4.174 2.650 -9.722 1.00 0.00 C ATOM 545 C HIS A 38 -3.140 1.532 -9.787 1.00 0.00 C ATOM 546 O HIS A 38 -3.328 0.464 -9.206 1.00 0.00 O ATOM 547 CB HIS A 38 -4.362 3.105 -8.274 1.00 0.00 C ATOM 548 CG HIS A 38 -4.870 4.507 -8.148 1.00 0.00 C ATOM 549 ND1 HIS A 38 -6.212 4.826 -8.166 1.00 0.00 N ATOM 550 CD2 HIS A 38 -4.209 5.680 -8.000 1.00 0.00 C ATOM 551 CE1 HIS A 38 -6.353 6.134 -8.036 1.00 0.00 C ATOM 552 NE2 HIS A 38 -5.154 6.674 -7.933 1.00 0.00 N ATOM 0 H HIS A 38 -5.779 1.318 -9.920 1.00 0.00 H new ATOM 0 HA HIS A 38 -3.813 3.492 -10.313 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -5.058 2.429 -7.777 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -3.410 3.024 -7.750 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -6.976 4.157 -8.264 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -3.138 5.809 -7.945 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -7.291 6.670 -8.017 1.00 0.00 H new ATOM 561 N THR A 39 -2.046 1.784 -10.499 1.00 0.00 N ATOM 562 CA THR A 39 -0.983 0.796 -10.638 1.00 0.00 C ATOM 563 C THR A 39 0.127 1.050 -9.624 1.00 0.00 C ATOM 564 O THR A 39 0.626 2.168 -9.503 1.00 0.00 O ATOM 565 CB THR A 39 -0.414 0.820 -12.058 1.00 0.00 C ATOM 566 OG1 THR A 39 -1.301 1.478 -12.945 1.00 0.00 O ATOM 567 CG2 THR A 39 -0.146 -0.561 -12.617 1.00 0.00 C ATOM 0 H THR A 39 -1.873 2.662 -10.988 1.00 0.00 H new ATOM 0 HA THR A 39 -1.408 -0.189 -10.446 1.00 0.00 H new ATOM 0 HB THR A 39 0.533 1.354 -11.980 1.00 0.00 H new ATOM 0 HG1 THR A 39 -0.917 1.484 -13.847 1.00 0.00 H new ATOM 0 HG21 THR A 39 0.256 -0.473 -13.626 1.00 0.00 H new ATOM 0 HG22 THR A 39 0.575 -1.077 -11.983 1.00 0.00 H new ATOM 0 HG23 THR A 39 -1.076 -1.129 -12.645 1.00 0.00 H new ATOM 575 N VAL A 40 0.501 0.007 -8.892 1.00 0.00 N ATOM 576 CA VAL A 40 1.543 0.116 -7.881 1.00 0.00 C ATOM 577 C VAL A 40 2.741 -0.757 -8.223 1.00 0.00 C ATOM 578 O VAL A 40 2.587 -1.895 -8.658 1.00 0.00 O ATOM 579 CB VAL A 40 1.004 -0.287 -6.484 1.00 0.00 C ATOM 580 CG1 VAL A 40 1.811 -1.428 -5.872 1.00 0.00 C ATOM 581 CG2 VAL A 40 0.998 0.904 -5.550 1.00 0.00 C ATOM 0 H VAL A 40 0.096 -0.925 -8.981 1.00 0.00 H new ATOM 0 HA VAL A 40 1.860 1.159 -7.860 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.019 -0.637 -6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.401 -1.680 -4.894 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.759 -2.301 -6.523 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.851 -1.120 -5.761 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.616 0.600 -4.575 1.00 0.00 H new ATOM 0 HG22 VAL A 40 2.013 1.285 -5.440 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.360 1.686 -5.962 1.00 0.00 H new ATOM 591 N VAL A 41 3.932 -0.227 -7.984 1.00 0.00 N ATOM 592 CA VAL A 41 5.157 -0.970 -8.224 1.00 0.00 C ATOM 593 C VAL A 41 5.722 -1.446 -6.892 1.00 0.00 C ATOM 594 O VAL A 41 6.419 -0.702 -6.204 1.00 0.00 O ATOM 595 CB VAL A 41 6.213 -0.121 -8.957 1.00 0.00 C ATOM 596 CG1 VAL A 41 7.415 -0.974 -9.339 1.00 0.00 C ATOM 597 CG2 VAL A 41 5.607 0.543 -10.185 1.00 0.00 C ATOM 0 H VAL A 41 4.074 0.716 -7.623 1.00 0.00 H new ATOM 0 HA VAL A 41 4.916 -1.820 -8.863 1.00 0.00 H new ATOM 0 HB VAL A 41 6.555 0.663 -8.281 1.00 0.00 H new ATOM 0 HG11 VAL A 41 8.150 -0.357 -9.856 1.00 0.00 H new ATOM 0 HG12 VAL A 41 7.863 -1.395 -8.439 1.00 0.00 H new ATOM 0 HG13 VAL A 41 7.094 -1.782 -9.996 1.00 0.00 H new ATOM 0 HG21 VAL A 41 6.368 1.138 -10.690 1.00 0.00 H new ATOM 0 HG22 VAL A 41 5.234 -0.222 -10.866 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.784 1.189 -9.880 1.00 0.00 H new ATOM 607 N LEU A 42 5.396 -2.686 -6.525 1.00 0.00 N ATOM 608 CA LEU A 42 5.845 -3.269 -5.260 1.00 0.00 C ATOM 609 C LEU A 42 7.315 -2.946 -4.970 1.00 0.00 C ATOM 610 O LEU A 42 7.736 -2.940 -3.813 1.00 0.00 O ATOM 611 CB LEU A 42 5.637 -4.787 -5.277 1.00 0.00 C ATOM 612 CG LEU A 42 4.186 -5.281 -5.146 1.00 0.00 C ATOM 613 CD1 LEU A 42 3.776 -5.402 -3.693 1.00 0.00 C ATOM 614 CD2 LEU A 42 3.212 -4.374 -5.867 1.00 0.00 C ATOM 0 H LEU A 42 4.819 -3.309 -7.090 1.00 0.00 H new ATOM 0 HA LEU A 42 5.246 -2.826 -4.464 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.048 -5.178 -6.208 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.220 -5.221 -4.465 1.00 0.00 H new ATOM 0 HG LEU A 42 4.152 -6.266 -5.612 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.746 -5.753 -3.634 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.431 -6.112 -3.188 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.856 -4.428 -3.210 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.200 -4.760 -5.749 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.269 -3.370 -5.446 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.465 -4.338 -6.927 1.00 0.00 H new ATOM 626 N SER A 43 8.084 -2.662 -6.018 1.00 0.00 N ATOM 627 CA SER A 43 9.493 -2.324 -5.863 1.00 0.00 C ATOM 628 C SER A 43 9.625 -0.898 -5.358 1.00 0.00 C ATOM 629 O SER A 43 10.341 -0.634 -4.392 1.00 0.00 O ATOM 630 CB SER A 43 10.238 -2.487 -7.190 1.00 0.00 C ATOM 631 OG SER A 43 11.274 -1.529 -7.324 1.00 0.00 O ATOM 0 H SER A 43 7.754 -2.660 -6.983 1.00 0.00 H new ATOM 0 HA SER A 43 9.938 -3.004 -5.137 1.00 0.00 H new ATOM 0 HB2 SER A 43 10.659 -3.491 -7.252 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.536 -2.384 -8.018 1.00 0.00 H new ATOM 0 HG SER A 43 11.998 -1.904 -7.867 1.00 0.00 H new ATOM 637 N THR A 44 8.904 0.015 -5.998 1.00 0.00 N ATOM 638 CA THR A 44 8.916 1.399 -5.594 1.00 0.00 C ATOM 639 C THR A 44 8.320 1.511 -4.200 1.00 0.00 C ATOM 640 O THR A 44 8.668 2.407 -3.431 1.00 0.00 O ATOM 641 CB THR A 44 8.120 2.237 -6.586 1.00 0.00 C ATOM 642 OG1 THR A 44 6.739 1.932 -6.509 1.00 0.00 O ATOM 643 CG2 THR A 44 8.558 2.042 -8.021 1.00 0.00 C ATOM 0 H THR A 44 8.306 -0.187 -6.799 1.00 0.00 H new ATOM 0 HA THR A 44 9.940 1.772 -5.578 1.00 0.00 H new ATOM 0 HB THR A 44 8.309 3.273 -6.305 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.624 1.016 -6.179 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.951 2.668 -8.675 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.607 2.322 -8.123 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.433 0.996 -8.301 1.00 0.00 H new ATOM 651 N ILE A 45 7.430 0.571 -3.873 1.00 0.00 N ATOM 652 CA ILE A 45 6.803 0.546 -2.562 1.00 0.00 C ATOM 653 C ILE A 45 7.863 0.488 -1.461 1.00 0.00 C ATOM 654 O ILE A 45 8.541 -0.526 -1.296 1.00 0.00 O ATOM 655 CB ILE A 45 5.869 -0.672 -2.412 1.00 0.00 C ATOM 656 CG1 ILE A 45 4.752 -0.625 -3.458 1.00 0.00 C ATOM 657 CG2 ILE A 45 5.291 -0.729 -1.006 1.00 0.00 C ATOM 658 CD1 ILE A 45 3.840 0.575 -3.329 1.00 0.00 C ATOM 0 H ILE A 45 7.132 -0.177 -4.499 1.00 0.00 H new ATOM 0 HA ILE A 45 6.218 1.460 -2.466 1.00 0.00 H new ATOM 0 HB ILE A 45 6.452 -1.578 -2.578 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.199 -0.624 -4.452 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.155 -1.533 -3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.634 -1.594 -0.917 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.102 -0.813 -0.282 1.00 0.00 H new ATOM 0 HG23 ILE A 45 4.722 0.180 -0.809 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.076 0.536 -4.105 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.363 0.566 -2.349 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.423 1.489 -3.440 1.00 0.00 H new ATOM 670 N ASP A 46 7.999 1.576 -0.711 1.00 0.00 N ATOM 671 CA ASP A 46 8.975 1.640 0.373 1.00 0.00 C ATOM 672 C ASP A 46 8.788 0.477 1.345 1.00 0.00 C ATOM 673 O ASP A 46 9.750 -0.007 1.941 1.00 0.00 O ATOM 674 CB ASP A 46 8.853 2.969 1.120 1.00 0.00 C ATOM 675 CG ASP A 46 9.904 3.124 2.201 1.00 0.00 C ATOM 676 OD1 ASP A 46 9.983 2.242 3.082 1.00 0.00 O ATOM 677 OD2 ASP A 46 10.648 4.126 2.167 1.00 0.00 O ATOM 0 H ASP A 46 7.447 2.425 -0.833 1.00 0.00 H new ATOM 0 HA ASP A 46 9.971 1.567 -0.064 1.00 0.00 H new ATOM 0 HB2 ASP A 46 8.942 3.791 0.410 1.00 0.00 H new ATOM 0 HB3 ASP A 46 7.862 3.041 1.568 1.00 0.00 H new ATOM 682 N LYS A 47 7.545 0.034 1.495 1.00 0.00 N ATOM 683 CA LYS A 47 7.229 -1.072 2.390 1.00 0.00 C ATOM 684 C LYS A 47 5.771 -1.493 2.238 1.00 0.00 C ATOM 685 O LYS A 47 4.957 -0.763 1.676 1.00 0.00 O ATOM 686 CB LYS A 47 7.518 -0.685 3.843 1.00 0.00 C ATOM 687 CG LYS A 47 6.586 0.382 4.392 1.00 0.00 C ATOM 688 CD LYS A 47 6.973 0.787 5.805 1.00 0.00 C ATOM 689 CE LYS A 47 5.748 1.055 6.664 1.00 0.00 C ATOM 690 NZ LYS A 47 6.013 0.800 8.106 1.00 0.00 N ATOM 0 H LYS A 47 6.739 0.425 1.007 1.00 0.00 H new ATOM 0 HA LYS A 47 7.862 -1.917 2.120 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.444 -1.575 4.468 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.546 -0.329 3.917 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.610 1.257 3.742 1.00 0.00 H new ATOM 0 HG3 LYS A 47 5.562 0.009 4.387 1.00 0.00 H new ATOM 0 HD2 LYS A 47 7.572 -0.002 6.260 1.00 0.00 H new ATOM 0 HD3 LYS A 47 7.597 1.680 5.770 1.00 0.00 H new ATOM 0 HE2 LYS A 47 5.431 2.089 6.531 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.925 0.424 6.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 5.125 0.544 8.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 6.694 0.020 8.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.406 1.658 8.544 1.00 0.00 H new ATOM 704 N LEU A 48 5.449 -2.676 2.749 1.00 0.00 N ATOM 705 CA LEU A 48 4.091 -3.200 2.674 1.00 0.00 C ATOM 706 C LEU A 48 3.437 -3.186 4.056 1.00 0.00 C ATOM 707 O LEU A 48 3.903 -3.856 4.975 1.00 0.00 O ATOM 708 CB LEU A 48 4.115 -4.628 2.125 1.00 0.00 C ATOM 709 CG LEU A 48 2.744 -5.287 1.964 1.00 0.00 C ATOM 710 CD1 LEU A 48 2.038 -4.750 0.729 1.00 0.00 C ATOM 711 CD2 LEU A 48 2.890 -6.799 1.883 1.00 0.00 C ATOM 0 H LEU A 48 6.112 -3.291 3.221 1.00 0.00 H new ATOM 0 HA LEU A 48 3.508 -2.567 2.005 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.612 -4.619 1.155 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.721 -5.245 2.788 1.00 0.00 H new ATOM 0 HG LEU A 48 2.138 -5.046 2.837 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.064 -5.229 0.629 1.00 0.00 H new ATOM 0 HD12 LEU A 48 1.904 -3.673 0.826 1.00 0.00 H new ATOM 0 HD13 LEU A 48 2.639 -4.963 -0.155 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.906 -7.254 1.769 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.512 -7.059 1.026 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.357 -7.169 2.796 1.00 0.00 H new ATOM 723 N GLN A 49 2.360 -2.419 4.201 1.00 0.00 N ATOM 724 CA GLN A 49 1.655 -2.326 5.475 1.00 0.00 C ATOM 725 C GLN A 49 0.266 -2.939 5.367 1.00 0.00 C ATOM 726 O GLN A 49 -0.357 -2.890 4.311 1.00 0.00 O ATOM 727 CB GLN A 49 1.539 -0.866 5.909 1.00 0.00 C ATOM 728 CG GLN A 49 1.563 -0.676 7.417 1.00 0.00 C ATOM 729 CD GLN A 49 1.305 0.760 7.827 1.00 0.00 C ATOM 730 OE1 GLN A 49 0.234 1.310 7.570 1.00 0.00 O ATOM 731 NE2 GLN A 49 2.290 1.378 8.469 1.00 0.00 N ATOM 0 H GLN A 49 1.957 -1.854 3.453 1.00 0.00 H new ATOM 0 HA GLN A 49 2.226 -2.879 6.221 1.00 0.00 H new ATOM 0 HB2 GLN A 49 2.357 -0.298 5.467 1.00 0.00 H new ATOM 0 HB3 GLN A 49 0.612 -0.451 5.513 1.00 0.00 H new ATOM 0 HG2 GLN A 49 0.812 -1.321 7.873 1.00 0.00 H new ATOM 0 HG3 GLN A 49 2.532 -0.992 7.804 1.00 0.00 H new ATOM 0 HE21 GLN A 49 3.162 0.885 8.662 1.00 0.00 H new ATOM 0 HE22 GLN A 49 2.175 2.346 8.769 1.00 0.00 H new ATOM 740 N ALA A 50 -0.212 -3.525 6.456 1.00 0.00 N ATOM 741 CA ALA A 50 -1.525 -4.146 6.465 1.00 0.00 C ATOM 742 C ALA A 50 -2.080 -4.241 7.884 1.00 0.00 C ATOM 743 O ALA A 50 -1.320 -4.316 8.849 1.00 0.00 O ATOM 744 CB ALA A 50 -1.430 -5.515 5.826 1.00 0.00 C ATOM 0 H ALA A 50 0.290 -3.582 7.342 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.216 -3.529 5.891 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -2.412 -5.987 5.829 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.080 -5.414 4.799 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.729 -6.132 6.389 1.00 0.00 H new ATOM 750 N THR A 51 -3.405 -4.233 8.012 1.00 0.00 N ATOM 751 CA THR A 51 -4.040 -4.314 9.323 1.00 0.00 C ATOM 752 C THR A 51 -3.877 -5.707 9.930 1.00 0.00 C ATOM 753 O THR A 51 -3.707 -6.692 9.211 1.00 0.00 O ATOM 754 CB THR A 51 -5.523 -3.963 9.220 1.00 0.00 C ATOM 755 OG1 THR A 51 -6.128 -4.653 8.142 1.00 0.00 O ATOM 756 CG2 THR A 51 -5.775 -2.484 9.022 1.00 0.00 C ATOM 0 H THR A 51 -4.055 -4.172 7.229 1.00 0.00 H new ATOM 0 HA THR A 51 -3.547 -3.594 9.977 1.00 0.00 H new ATOM 0 HB THR A 51 -5.959 -4.264 10.173 1.00 0.00 H new ATOM 0 HG1 THR A 51 -6.472 -5.515 8.457 1.00 0.00 H new ATOM 0 HG21 THR A 51 -6.848 -2.303 8.957 1.00 0.00 H new ATOM 0 HG22 THR A 51 -5.364 -1.929 9.865 1.00 0.00 H new ATOM 0 HG23 THR A 51 -5.295 -2.153 8.101 1.00 0.00 H new ATOM 764 N PRO A 52 -3.926 -5.804 11.271 1.00 0.00 N ATOM 765 CA PRO A 52 -3.782 -7.079 11.979 1.00 0.00 C ATOM 766 C PRO A 52 -5.036 -7.944 11.886 1.00 0.00 C ATOM 767 O PRO A 52 -6.115 -7.457 11.546 1.00 0.00 O ATOM 768 CB PRO A 52 -3.538 -6.648 13.424 1.00 0.00 C ATOM 769 CG PRO A 52 -4.238 -5.340 13.547 1.00 0.00 C ATOM 770 CD PRO A 52 -4.124 -4.675 12.202 1.00 0.00 C ATOM 0 HA PRO A 52 -2.985 -7.692 11.558 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -3.936 -7.379 14.128 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -2.473 -6.549 13.634 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -5.283 -5.482 13.824 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -3.783 -4.726 14.324 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -5.022 -4.107 11.958 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -3.287 -3.977 12.170 1.00 0.00 H new ATOM 778 N ALA A 53 -4.886 -9.229 12.191 1.00 0.00 N ATOM 779 CA ALA A 53 -6.004 -10.165 12.145 1.00 0.00 C ATOM 780 C ALA A 53 -7.139 -9.723 13.063 1.00 0.00 C ATOM 781 O ALA A 53 -8.298 -10.079 12.847 1.00 0.00 O ATOM 782 CB ALA A 53 -5.534 -11.563 12.520 1.00 0.00 C ATOM 0 H ALA A 53 -3.999 -9.647 12.473 1.00 0.00 H new ATOM 0 HA ALA A 53 -6.388 -10.180 11.125 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -6.377 -12.253 12.482 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -4.766 -11.889 11.818 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -5.121 -11.550 13.529 1.00 0.00 H new ATOM 788 N SER A 54 -6.803 -8.944 14.088 1.00 0.00 N ATOM 789 CA SER A 54 -7.799 -8.455 15.037 1.00 0.00 C ATOM 790 C SER A 54 -8.340 -7.089 14.617 1.00 0.00 C ATOM 791 O SER A 54 -8.920 -6.367 15.427 1.00 0.00 O ATOM 792 CB SER A 54 -7.195 -8.367 16.439 1.00 0.00 C ATOM 793 OG SER A 54 -8.184 -8.573 17.434 1.00 0.00 O ATOM 0 H SER A 54 -5.850 -8.638 14.282 1.00 0.00 H new ATOM 0 HA SER A 54 -8.628 -9.162 15.046 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.406 -9.112 16.546 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.732 -7.390 16.578 1.00 0.00 H new ATOM 0 HG SER A 54 -7.773 -8.513 18.321 1.00 0.00 H new ATOM 799 N SER A 55 -8.145 -6.740 13.348 1.00 0.00 N ATOM 800 CA SER A 55 -8.612 -5.461 12.824 1.00 0.00 C ATOM 801 C SER A 55 -10.096 -5.510 12.498 1.00 0.00 C ATOM 802 O SER A 55 -10.545 -6.348 11.716 1.00 0.00 O ATOM 803 CB SER A 55 -7.819 -5.084 11.573 1.00 0.00 C ATOM 804 OG SER A 55 -8.115 -3.761 11.162 1.00 0.00 O ATOM 0 H SER A 55 -7.666 -7.326 12.664 1.00 0.00 H new ATOM 0 HA SER A 55 -8.455 -4.705 13.593 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.752 -5.176 11.774 1.00 0.00 H new ATOM 0 HB3 SER A 55 -8.053 -5.780 10.767 1.00 0.00 H new ATOM 0 HG SER A 55 -8.388 -3.764 10.221 1.00 0.00 H new ATOM 810 N GLU A 56 -10.851 -4.590 13.089 1.00 0.00 N ATOM 811 CA GLU A 56 -12.284 -4.514 12.845 1.00 0.00 C ATOM 812 C GLU A 56 -12.558 -4.229 11.370 1.00 0.00 C ATOM 813 O GLU A 56 -13.680 -4.399 10.893 1.00 0.00 O ATOM 814 CB GLU A 56 -12.916 -3.427 13.716 1.00 0.00 C ATOM 815 CG GLU A 56 -14.403 -3.629 13.958 1.00 0.00 C ATOM 816 CD GLU A 56 -14.846 -3.124 15.317 1.00 0.00 C ATOM 817 OE1 GLU A 56 -15.115 -1.911 15.440 1.00 0.00 O ATOM 818 OE2 GLU A 56 -14.924 -3.942 16.257 1.00 0.00 O ATOM 0 H GLU A 56 -10.494 -3.889 13.738 1.00 0.00 H new ATOM 0 HA GLU A 56 -12.729 -5.474 13.105 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.401 -3.397 14.676 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.762 -2.458 13.242 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.967 -3.113 13.181 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -14.640 -4.689 13.873 1.00 0.00 H new ATOM 825 N LYS A 57 -11.522 -3.800 10.650 1.00 0.00 N ATOM 826 CA LYS A 57 -11.652 -3.501 9.227 1.00 0.00 C ATOM 827 C LYS A 57 -10.374 -3.856 8.471 1.00 0.00 C ATOM 828 O LYS A 57 -9.369 -3.150 8.554 1.00 0.00 O ATOM 829 CB LYS A 57 -12.013 -2.026 9.003 1.00 0.00 C ATOM 830 CG LYS A 57 -11.536 -1.095 10.105 1.00 0.00 C ATOM 831 CD LYS A 57 -10.037 -1.205 10.300 1.00 0.00 C ATOM 832 CE LYS A 57 -9.565 -0.368 11.479 1.00 0.00 C ATOM 833 NZ LYS A 57 -9.965 -0.967 12.782 1.00 0.00 N ATOM 0 H LYS A 57 -10.586 -3.652 11.029 1.00 0.00 H new ATOM 0 HA LYS A 57 -12.463 -4.115 8.836 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -11.585 -1.699 8.055 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.096 -1.938 8.911 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -11.799 -0.067 9.856 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -12.046 -1.338 11.037 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.766 -2.248 10.461 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -9.526 -0.879 9.394 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -8.480 -0.270 11.443 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.979 0.637 11.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -10.360 -0.227 13.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -10.682 -1.703 12.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.132 -1.390 13.240 1.00 0.00 H new ATOM 847 N MET A 58 -10.423 -4.960 7.733 1.00 0.00 N ATOM 848 CA MET A 58 -9.275 -5.422 6.958 1.00 0.00 C ATOM 849 C MET A 58 -8.790 -4.343 5.997 1.00 0.00 C ATOM 850 O MET A 58 -9.573 -3.788 5.226 1.00 0.00 O ATOM 851 CB MET A 58 -9.642 -6.684 6.179 1.00 0.00 C ATOM 852 CG MET A 58 -10.347 -7.733 7.022 1.00 0.00 C ATOM 853 SD MET A 58 -12.124 -7.791 6.725 1.00 0.00 S ATOM 854 CE MET A 58 -12.580 -9.210 7.716 1.00 0.00 C ATOM 0 H MET A 58 -11.248 -5.554 7.655 1.00 0.00 H new ATOM 0 HA MET A 58 -8.467 -5.648 7.654 1.00 0.00 H new ATOM 0 HB2 MET A 58 -10.284 -6.411 5.342 1.00 0.00 H new ATOM 0 HB3 MET A 58 -8.735 -7.118 5.757 1.00 0.00 H new ATOM 0 HG2 MET A 58 -9.916 -8.712 6.811 1.00 0.00 H new ATOM 0 HG3 MET A 58 -10.166 -7.526 8.077 1.00 0.00 H new ATOM 0 HE1 MET A 58 -13.139 -9.917 7.103 1.00 0.00 H new ATOM 0 HE2 MET A 58 -11.680 -9.692 8.097 1.00 0.00 H new ATOM 0 HE3 MET A 58 -13.199 -8.886 8.552 1.00 0.00 H new ATOM 864 N MET A 59 -7.495 -4.046 6.050 1.00 0.00 N ATOM 865 CA MET A 59 -6.913 -3.029 5.185 1.00 0.00 C ATOM 866 C MET A 59 -5.455 -3.333 4.858 1.00 0.00 C ATOM 867 O MET A 59 -4.677 -3.720 5.729 1.00 0.00 O ATOM 868 CB MET A 59 -7.006 -1.659 5.850 1.00 0.00 C ATOM 869 CG MET A 59 -8.433 -1.203 6.108 1.00 0.00 C ATOM 870 SD MET A 59 -8.570 0.588 6.268 1.00 0.00 S ATOM 871 CE MET A 59 -8.275 0.793 8.022 1.00 0.00 C ATOM 0 H MET A 59 -6.831 -4.495 6.682 1.00 0.00 H new ATOM 0 HA MET A 59 -7.479 -3.029 4.254 1.00 0.00 H new ATOM 0 HB2 MET A 59 -6.466 -1.686 6.796 1.00 0.00 H new ATOM 0 HB3 MET A 59 -6.507 -0.924 5.219 1.00 0.00 H new ATOM 0 HG2 MET A 59 -9.072 -1.541 5.292 1.00 0.00 H new ATOM 0 HG3 MET A 59 -8.802 -1.675 7.019 1.00 0.00 H new ATOM 0 HE1 MET A 59 -7.683 1.693 8.189 1.00 0.00 H new ATOM 0 HE2 MET A 59 -9.228 0.884 8.543 1.00 0.00 H new ATOM 0 HE3 MET A 59 -7.734 -0.073 8.404 1.00 0.00 H new ATOM 881 N LEU A 60 -5.093 -3.118 3.600 1.00 0.00 N ATOM 882 CA LEU A 60 -3.722 -3.331 3.143 1.00 0.00 C ATOM 883 C LEU A 60 -3.172 -2.034 2.553 1.00 0.00 C ATOM 884 O LEU A 60 -3.902 -1.285 1.906 1.00 0.00 O ATOM 885 CB LEU A 60 -3.657 -4.451 2.100 1.00 0.00 C ATOM 886 CG LEU A 60 -4.113 -5.840 2.573 1.00 0.00 C ATOM 887 CD1 LEU A 60 -3.645 -6.901 1.598 1.00 0.00 C ATOM 888 CD2 LEU A 60 -3.581 -6.162 3.961 1.00 0.00 C ATOM 0 H LEU A 60 -5.732 -2.795 2.873 1.00 0.00 H new ATOM 0 HA LEU A 60 -3.115 -3.630 3.997 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.269 -4.161 1.246 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.630 -4.530 1.744 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.202 -5.831 2.617 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.973 -7.882 1.942 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.068 -6.702 0.613 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -2.557 -6.884 1.536 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.924 -7.152 4.262 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.491 -6.145 3.946 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.946 -5.420 4.672 1.00 0.00 H new ATOM 900 N ARG A 61 -1.894 -1.756 2.798 1.00 0.00 N ATOM 901 CA ARG A 61 -1.285 -0.526 2.301 1.00 0.00 C ATOM 902 C ARG A 61 0.157 -0.736 1.849 1.00 0.00 C ATOM 903 O ARG A 61 0.871 -1.583 2.379 1.00 0.00 O ATOM 904 CB ARG A 61 -1.313 0.537 3.400 1.00 0.00 C ATOM 905 CG ARG A 61 -0.927 1.928 2.924 1.00 0.00 C ATOM 906 CD ARG A 61 -1.131 2.965 4.016 1.00 0.00 C ATOM 907 NE ARG A 61 -0.064 2.930 5.013 1.00 0.00 N ATOM 908 CZ ARG A 61 0.091 3.846 5.967 1.00 0.00 C ATOM 909 NH1 ARG A 61 -0.753 4.865 6.060 1.00 0.00 N ATOM 910 NH2 ARG A 61 1.093 3.742 6.830 1.00 0.00 N ATOM 0 H ARG A 61 -1.267 -2.358 3.331 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.863 -0.202 1.435 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -2.314 0.576 3.829 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -0.636 0.237 4.199 1.00 0.00 H new ATOM 0 HG2 ARG A 61 0.117 1.930 2.609 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -1.524 2.194 2.052 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -1.176 3.958 3.569 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.090 2.792 4.505 1.00 0.00 H new ATOM 0 HE ARG A 61 0.602 2.158 4.976 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -1.525 4.950 5.399 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -0.630 5.564 6.793 1.00 0.00 H new ATOM 0 HH21 ARG A 61 1.745 2.960 6.763 1.00 0.00 H new ATOM 0 HH22 ARG A 61 1.212 4.444 7.561 1.00 0.00 H new ATOM 924 N LEU A 62 0.581 0.070 0.880 1.00 0.00 N ATOM 925 CA LEU A 62 1.945 0.018 0.365 1.00 0.00 C ATOM 926 C LEU A 62 2.554 1.416 0.390 1.00 0.00 C ATOM 927 O LEU A 62 2.083 2.315 -0.303 1.00 0.00 O ATOM 928 CB LEU A 62 1.975 -0.536 -1.061 1.00 0.00 C ATOM 929 CG LEU A 62 1.396 -1.941 -1.227 1.00 0.00 C ATOM 930 CD1 LEU A 62 0.107 -1.880 -2.019 1.00 0.00 C ATOM 931 CD2 LEU A 62 2.399 -2.874 -1.902 1.00 0.00 C ATOM 0 H LEU A 62 -0.007 0.773 0.432 1.00 0.00 H new ATOM 0 HA LEU A 62 2.528 -0.649 1.000 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.424 0.145 -1.710 1.00 0.00 H new ATOM 0 HB3 LEU A 62 3.008 -0.543 -1.409 1.00 0.00 H new ATOM 0 HG LEU A 62 1.183 -2.344 -0.237 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.298 -2.885 -2.132 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.614 -1.255 -1.492 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.304 -1.455 -3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.960 -3.866 -2.007 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.653 -2.484 -2.888 1.00 0.00 H new ATOM 0 HD23 LEU A 62 3.301 -2.939 -1.294 1.00 0.00 H new ATOM 943 N ILE A 63 3.593 1.602 1.194 1.00 0.00 N ATOM 944 CA ILE A 63 4.241 2.904 1.299 1.00 0.00 C ATOM 945 C ILE A 63 5.125 3.174 0.089 1.00 0.00 C ATOM 946 O ILE A 63 5.567 2.246 -0.582 1.00 0.00 O ATOM 947 CB ILE A 63 5.094 3.019 2.578 1.00 0.00 C ATOM 948 CG1 ILE A 63 4.381 2.367 3.765 1.00 0.00 C ATOM 949 CG2 ILE A 63 5.404 4.478 2.876 1.00 0.00 C ATOM 950 CD1 ILE A 63 2.971 2.874 3.978 1.00 0.00 C ATOM 0 H ILE A 63 4.003 0.874 1.779 1.00 0.00 H new ATOM 0 HA ILE A 63 3.443 3.646 1.342 1.00 0.00 H new ATOM 0 HB ILE A 63 6.033 2.491 2.415 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.351 1.288 3.612 1.00 0.00 H new ATOM 0 HG13 ILE A 63 4.963 2.545 4.670 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.007 4.544 3.782 1.00 0.00 H new ATOM 0 HG22 ILE A 63 5.955 4.911 2.041 1.00 0.00 H new ATOM 0 HG23 ILE A 63 4.473 5.026 3.019 1.00 0.00 H new ATOM 0 HD11 ILE A 63 2.528 2.368 4.836 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.995 3.948 4.163 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.374 2.672 3.089 1.00 0.00 H new ATOM 962 N GLY A 64 5.375 4.450 -0.184 1.00 0.00 N ATOM 963 CA GLY A 64 6.205 4.817 -1.316 1.00 0.00 C ATOM 964 C GLY A 64 7.552 5.368 -0.893 1.00 0.00 C ATOM 965 O GLY A 64 7.642 6.145 0.057 1.00 0.00 O ATOM 0 H GLY A 64 5.018 5.236 0.358 1.00 0.00 H new ATOM 0 HA2 GLY A 64 6.356 3.943 -1.950 1.00 0.00 H new ATOM 0 HA3 GLY A 64 5.684 5.562 -1.918 1.00 0.00 H new ATOM 969 N LYS A 65 8.603 4.964 -1.600 1.00 0.00 N ATOM 970 CA LYS A 65 9.952 5.421 -1.291 1.00 0.00 C ATOM 971 C LYS A 65 10.110 6.904 -1.605 1.00 0.00 C ATOM 972 O LYS A 65 10.014 7.319 -2.760 1.00 0.00 O ATOM 973 CB LYS A 65 10.981 4.609 -2.081 1.00 0.00 C ATOM 974 CG LYS A 65 10.970 3.126 -1.748 1.00 0.00 C ATOM 975 CD LYS A 65 11.630 2.305 -2.844 1.00 0.00 C ATOM 976 CE LYS A 65 11.898 0.880 -2.388 1.00 0.00 C ATOM 977 NZ LYS A 65 13.079 0.799 -1.485 1.00 0.00 N ATOM 0 H LYS A 65 8.546 4.321 -2.390 1.00 0.00 H new ATOM 0 HA LYS A 65 10.123 5.274 -0.225 1.00 0.00 H new ATOM 0 HB2 LYS A 65 10.791 4.735 -3.147 1.00 0.00 H new ATOM 0 HB3 LYS A 65 11.976 5.010 -1.885 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.490 2.960 -0.804 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.942 2.791 -1.609 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.989 2.292 -3.726 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.568 2.776 -3.138 1.00 0.00 H new ATOM 0 HE2 LYS A 65 11.019 0.493 -1.872 1.00 0.00 H new ATOM 0 HE3 LYS A 65 12.062 0.245 -3.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 13.280 -0.197 -1.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 13.905 1.223 -1.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 12.879 1.315 -0.605 1.00 0.00 H new ATOM 991 N VAL A 66 10.353 7.700 -0.569 1.00 0.00 N ATOM 992 CA VAL A 66 10.526 9.138 -0.733 1.00 0.00 C ATOM 993 C VAL A 66 11.981 9.482 -1.046 1.00 0.00 C ATOM 994 O VAL A 66 12.882 8.674 -0.822 1.00 0.00 O ATOM 995 CB VAL A 66 10.084 9.904 0.530 1.00 0.00 C ATOM 996 CG1 VAL A 66 10.943 9.520 1.720 1.00 0.00 C ATOM 997 CG2 VAL A 66 10.128 11.406 0.294 1.00 0.00 C ATOM 0 H VAL A 66 10.435 7.373 0.394 1.00 0.00 H new ATOM 0 HA VAL A 66 9.896 9.442 -1.569 1.00 0.00 H new ATOM 0 HB VAL A 66 9.054 9.626 0.752 1.00 0.00 H new ATOM 0 HG11 VAL A 66 10.613 10.072 2.600 1.00 0.00 H new ATOM 0 HG12 VAL A 66 10.849 8.450 1.907 1.00 0.00 H new ATOM 0 HG13 VAL A 66 11.985 9.761 1.509 1.00 0.00 H new ATOM 0 HG21 VAL A 66 9.812 11.926 1.198 1.00 0.00 H new ATOM 0 HG22 VAL A 66 11.145 11.705 0.040 1.00 0.00 H new ATOM 0 HG23 VAL A 66 9.458 11.665 -0.526 1.00 0.00 H new ATOM 1007 N ASP A 67 12.199 10.684 -1.565 1.00 0.00 N ATOM 1008 CA ASP A 67 13.542 11.136 -1.910 1.00 0.00 C ATOM 1009 C ASP A 67 13.812 12.520 -1.326 1.00 0.00 C ATOM 1010 O ASP A 67 14.232 13.435 -2.034 1.00 0.00 O ATOM 1011 CB ASP A 67 13.716 11.165 -3.430 1.00 0.00 C ATOM 1012 CG ASP A 67 12.566 11.861 -4.132 1.00 0.00 C ATOM 1013 OD1 ASP A 67 11.931 12.734 -3.505 1.00 0.00 O ATOM 1014 OD2 ASP A 67 12.302 11.533 -5.307 1.00 0.00 O ATOM 0 H ASP A 67 11.463 11.364 -1.756 1.00 0.00 H new ATOM 0 HA ASP A 67 14.260 10.435 -1.484 1.00 0.00 H new ATOM 0 HB2 ASP A 67 14.649 11.673 -3.676 1.00 0.00 H new ATOM 0 HB3 ASP A 67 13.801 10.144 -3.803 1.00 0.00 H new ATOM 1019 N GLU A 68 13.567 12.664 -0.027 1.00 0.00 N ATOM 1020 CA GLU A 68 13.780 13.935 0.656 1.00 0.00 C ATOM 1021 C GLU A 68 15.257 14.325 0.660 1.00 0.00 C ATOM 1022 O GLU A 68 15.600 15.479 0.913 1.00 0.00 O ATOM 1023 CB GLU A 68 13.259 13.856 2.093 1.00 0.00 C ATOM 1024 CG GLU A 68 13.934 12.778 2.926 1.00 0.00 C ATOM 1025 CD GLU A 68 13.071 12.310 4.082 1.00 0.00 C ATOM 1026 OE1 GLU A 68 11.938 11.848 3.829 1.00 0.00 O ATOM 1027 OE2 GLU A 68 13.528 12.405 5.240 1.00 0.00 O ATOM 0 H GLU A 68 13.221 11.916 0.574 1.00 0.00 H new ATOM 0 HA GLU A 68 13.228 14.702 0.112 1.00 0.00 H new ATOM 0 HB2 GLU A 68 13.404 14.822 2.577 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.185 13.668 2.072 1.00 0.00 H new ATOM 0 HG2 GLU A 68 14.173 11.927 2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 68 14.878 13.161 3.314 1.00 0.00 H new ATOM 1034 N SER A 69 16.127 13.359 0.380 1.00 0.00 N ATOM 1035 CA SER A 69 17.564 13.611 0.355 1.00 0.00 C ATOM 1036 C SER A 69 18.082 13.648 -1.078 1.00 0.00 C ATOM 1037 O SER A 69 19.211 13.241 -1.353 1.00 0.00 O ATOM 1038 CB SER A 69 18.305 12.535 1.151 1.00 0.00 C ATOM 1039 OG SER A 69 18.176 12.751 2.545 1.00 0.00 O ATOM 0 H SER A 69 15.863 12.397 0.168 1.00 0.00 H new ATOM 0 HA SER A 69 17.747 14.582 0.814 1.00 0.00 H new ATOM 0 HB2 SER A 69 17.910 11.552 0.894 1.00 0.00 H new ATOM 0 HB3 SER A 69 19.360 12.537 0.876 1.00 0.00 H new ATOM 0 HG SER A 69 18.657 12.049 3.031 1.00 0.00 H new ATOM 1045 N LYS A 70 17.247 14.138 -1.988 1.00 0.00 N ATOM 1046 CA LYS A 70 17.618 14.227 -3.397 1.00 0.00 C ATOM 1047 C LYS A 70 17.210 15.578 -3.986 1.00 0.00 C ATOM 1048 O LYS A 70 17.955 16.174 -4.764 1.00 0.00 O ATOM 1049 CB LYS A 70 16.987 13.061 -4.177 1.00 0.00 C ATOM 1050 CG LYS A 70 16.055 13.478 -5.305 1.00 0.00 C ATOM 1051 CD LYS A 70 16.829 14.029 -6.491 1.00 0.00 C ATOM 1052 CE LYS A 70 17.004 12.981 -7.578 1.00 0.00 C ATOM 1053 NZ LYS A 70 15.844 12.949 -8.511 1.00 0.00 N ATOM 0 H LYS A 70 16.310 14.480 -1.776 1.00 0.00 H new ATOM 0 HA LYS A 70 18.702 14.152 -3.482 1.00 0.00 H new ATOM 0 HB2 LYS A 70 17.785 12.446 -4.593 1.00 0.00 H new ATOM 0 HB3 LYS A 70 16.432 12.434 -3.479 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.461 12.621 -5.623 1.00 0.00 H new ATOM 0 HG3 LYS A 70 15.357 14.233 -4.942 1.00 0.00 H new ATOM 0 HD2 LYS A 70 16.305 14.893 -6.899 1.00 0.00 H new ATOM 0 HD3 LYS A 70 17.807 14.377 -6.159 1.00 0.00 H new ATOM 0 HE2 LYS A 70 17.915 13.189 -8.139 1.00 0.00 H new ATOM 0 HE3 LYS A 70 17.128 12.000 -7.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 16.002 12.221 -9.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 14.978 12.726 -7.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 15.740 13.877 -8.968 1.00 0.00 H new ATOM 1067 N LYS A 71 16.022 16.052 -3.615 1.00 0.00 N ATOM 1068 CA LYS A 71 15.520 17.328 -4.110 1.00 0.00 C ATOM 1069 C LYS A 71 15.320 17.281 -5.621 1.00 0.00 C ATOM 1070 O LYS A 71 16.256 17.494 -6.390 1.00 0.00 O ATOM 1071 CB LYS A 71 16.481 18.461 -3.744 1.00 0.00 C ATOM 1072 CG LYS A 71 16.232 19.047 -2.364 1.00 0.00 C ATOM 1073 CD LYS A 71 17.525 19.515 -1.716 1.00 0.00 C ATOM 1074 CE LYS A 71 17.264 20.217 -0.393 1.00 0.00 C ATOM 1075 NZ LYS A 71 17.279 19.266 0.753 1.00 0.00 N ATOM 0 H LYS A 71 15.391 15.571 -2.974 1.00 0.00 H new ATOM 0 HA LYS A 71 14.556 17.518 -3.638 1.00 0.00 H new ATOM 0 HB2 LYS A 71 17.504 18.088 -3.792 1.00 0.00 H new ATOM 0 HB3 LYS A 71 16.395 19.254 -4.487 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.539 19.885 -2.443 1.00 0.00 H new ATOM 0 HG3 LYS A 71 15.756 18.299 -1.730 1.00 0.00 H new ATOM 0 HD2 LYS A 71 18.181 18.660 -1.552 1.00 0.00 H new ATOM 0 HD3 LYS A 71 18.047 20.193 -2.392 1.00 0.00 H new ATOM 0 HE2 LYS A 71 18.019 20.987 -0.236 1.00 0.00 H new ATOM 0 HE3 LYS A 71 16.298 20.721 -0.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 17.097 19.784 1.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 16.542 18.546 0.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 18.209 18.803 0.808 1.00 0.00 H new ATOM 1089 N ARG A 72 14.091 16.993 -6.037 1.00 0.00 N ATOM 1090 CA ARG A 72 13.761 16.911 -7.455 1.00 0.00 C ATOM 1091 C ARG A 72 13.165 18.226 -7.955 1.00 0.00 C ATOM 1092 O ARG A 72 12.291 18.807 -7.312 1.00 0.00 O ATOM 1093 CB ARG A 72 12.793 15.749 -7.703 1.00 0.00 C ATOM 1094 CG ARG A 72 11.357 16.045 -7.306 1.00 0.00 C ATOM 1095 CD ARG A 72 10.624 16.783 -8.412 1.00 0.00 C ATOM 1096 NE ARG A 72 9.565 15.970 -9.006 1.00 0.00 N ATOM 1097 CZ ARG A 72 8.431 15.661 -8.383 1.00 0.00 C ATOM 1098 NH1 ARG A 72 8.203 16.093 -7.149 1.00 0.00 N ATOM 1099 NH2 ARG A 72 7.520 14.917 -8.996 1.00 0.00 N ATOM 0 H ARG A 72 13.306 16.812 -5.411 1.00 0.00 H new ATOM 0 HA ARG A 72 14.679 16.728 -8.013 1.00 0.00 H new ATOM 0 HB2 ARG A 72 12.820 15.487 -8.761 1.00 0.00 H new ATOM 0 HB3 ARG A 72 13.140 14.876 -7.149 1.00 0.00 H new ATOM 0 HG2 ARG A 72 10.839 15.112 -7.082 1.00 0.00 H new ATOM 0 HG3 ARG A 72 11.344 16.644 -6.395 1.00 0.00 H new ATOM 0 HD2 ARG A 72 10.194 17.701 -8.012 1.00 0.00 H new ATOM 0 HD3 ARG A 72 11.334 17.074 -9.186 1.00 0.00 H new ATOM 0 HE ARG A 72 9.703 15.619 -9.954 1.00 0.00 H new ATOM 0 HH11 ARG A 72 8.900 16.666 -6.672 1.00 0.00 H new ATOM 0 HH12 ARG A 72 7.331 15.852 -6.677 1.00 0.00 H new ATOM 0 HH21 ARG A 72 7.689 14.582 -9.944 1.00 0.00 H new ATOM 0 HH22 ARG A 72 6.650 14.680 -8.519 1.00 0.00 H new ATOM 1113 N LYS A 73 13.648 18.690 -9.104 1.00 0.00 N ATOM 1114 CA LYS A 73 13.167 19.937 -9.690 1.00 0.00 C ATOM 1115 C LYS A 73 11.726 19.800 -10.167 1.00 0.00 C ATOM 1116 O LYS A 73 11.296 18.722 -10.575 1.00 0.00 O ATOM 1117 CB LYS A 73 14.060 20.352 -10.860 1.00 0.00 C ATOM 1118 CG LYS A 73 15.252 21.198 -10.446 1.00 0.00 C ATOM 1119 CD LYS A 73 16.470 20.340 -10.156 1.00 0.00 C ATOM 1120 CE LYS A 73 17.250 20.863 -8.962 1.00 0.00 C ATOM 1121 NZ LYS A 73 16.840 20.196 -7.694 1.00 0.00 N ATOM 0 H LYS A 73 14.372 18.221 -9.648 1.00 0.00 H new ATOM 0 HA LYS A 73 13.203 20.705 -8.918 1.00 0.00 H new ATOM 0 HB2 LYS A 73 14.419 19.457 -11.367 1.00 0.00 H new ATOM 0 HB3 LYS A 73 13.463 20.909 -11.582 1.00 0.00 H new ATOM 0 HG2 LYS A 73 15.487 21.909 -11.238 1.00 0.00 H new ATOM 0 HG3 LYS A 73 14.996 21.780 -9.560 1.00 0.00 H new ATOM 0 HD2 LYS A 73 16.156 19.314 -9.965 1.00 0.00 H new ATOM 0 HD3 LYS A 73 17.117 20.317 -11.033 1.00 0.00 H new ATOM 0 HE2 LYS A 73 18.316 20.705 -9.127 1.00 0.00 H new ATOM 0 HE3 LYS A 73 17.098 21.939 -8.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 17.396 20.581 -6.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 15.829 20.368 -7.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 17.009 19.173 -7.770 1.00 0.00 H new ATOM 1135 N ASP A 74 10.987 20.902 -10.119 1.00 0.00 N ATOM 1136 CA ASP A 74 9.596 20.907 -10.550 1.00 0.00 C ATOM 1137 C ASP A 74 9.481 21.346 -12.003 1.00 0.00 C ATOM 1138 O ASP A 74 8.644 20.843 -12.754 1.00 0.00 O ATOM 1139 CB ASP A 74 8.761 21.826 -9.655 1.00 0.00 C ATOM 1140 CG ASP A 74 7.463 21.181 -9.214 1.00 0.00 C ATOM 1141 OD1 ASP A 74 7.458 19.953 -8.984 1.00 0.00 O ATOM 1142 OD2 ASP A 74 6.451 21.902 -9.098 1.00 0.00 O ATOM 0 H ASP A 74 11.329 21.803 -9.786 1.00 0.00 H new ATOM 0 HA ASP A 74 9.212 19.890 -10.465 1.00 0.00 H new ATOM 0 HB2 ASP A 74 9.344 22.100 -8.776 1.00 0.00 H new ATOM 0 HB3 ASP A 74 8.541 22.749 -10.192 1.00 0.00 H new ATOM 1147 N ASN A 75 10.334 22.286 -12.389 1.00 0.00 N ATOM 1148 CA ASN A 75 10.353 22.811 -13.755 1.00 0.00 C ATOM 1149 C ASN A 75 11.160 24.103 -13.836 1.00 0.00 C ATOM 1150 O ASN A 75 11.726 24.428 -14.879 1.00 0.00 O ATOM 1151 CB ASN A 75 8.928 23.059 -14.262 1.00 0.00 C ATOM 1152 CG ASN A 75 8.467 21.992 -15.236 1.00 0.00 C ATOM 1153 OD1 ASN A 75 7.471 21.309 -15.001 1.00 0.00 O ATOM 1154 ND2 ASN A 75 9.195 21.844 -16.338 1.00 0.00 N ATOM 0 H ASN A 75 11.029 22.706 -11.772 1.00 0.00 H new ATOM 0 HA ASN A 75 10.829 22.062 -14.388 1.00 0.00 H new ATOM 0 HB2 ASN A 75 8.244 23.093 -13.414 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.882 24.034 -14.747 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.935 21.141 -17.030 1.00 0.00 H new ATOM 0 HD22 ASN A 75 10.014 22.433 -16.491 1.00 0.00 H new ATOM 1161 N GLU A 76 11.200 24.837 -12.733 1.00 0.00 N ATOM 1162 CA GLU A 76 11.928 26.100 -12.679 1.00 0.00 C ATOM 1163 C GLU A 76 13.078 26.037 -11.678 1.00 0.00 C ATOM 1164 O GLU A 76 13.439 27.046 -11.073 1.00 0.00 O ATOM 1165 CB GLU A 76 10.980 27.239 -12.302 1.00 0.00 C ATOM 1166 CG GLU A 76 11.362 28.577 -12.914 1.00 0.00 C ATOM 1167 CD GLU A 76 10.820 29.753 -12.127 1.00 0.00 C ATOM 1168 OE1 GLU A 76 9.652 30.133 -12.355 1.00 0.00 O ATOM 1169 OE2 GLU A 76 11.563 30.296 -11.282 1.00 0.00 O ATOM 0 H GLU A 76 10.737 24.580 -11.861 1.00 0.00 H new ATOM 0 HA GLU A 76 12.346 26.285 -13.669 1.00 0.00 H new ATOM 0 HB2 GLU A 76 9.970 26.979 -12.619 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.958 27.338 -11.217 1.00 0.00 H new ATOM 0 HG2 GLU A 76 12.448 28.651 -12.969 1.00 0.00 H new ATOM 0 HG3 GLU A 76 10.987 28.625 -13.936 1.00 0.00 H new ATOM 1176 N GLY A 77 13.651 24.851 -11.507 1.00 0.00 N ATOM 1177 CA GLY A 77 14.754 24.691 -10.576 1.00 0.00 C ATOM 1178 C GLY A 77 14.411 25.171 -9.179 1.00 0.00 C ATOM 1179 O GLY A 77 15.286 25.616 -8.436 1.00 0.00 O ATOM 0 H GLY A 77 13.373 23.999 -11.995 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.041 23.640 -10.535 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.619 25.243 -10.944 1.00 0.00 H new ATOM 1183 N ASN A 78 13.134 25.084 -8.820 1.00 0.00 N ATOM 1184 CA ASN A 78 12.679 25.517 -7.502 1.00 0.00 C ATOM 1185 C ASN A 78 12.995 24.482 -6.430 1.00 0.00 C ATOM 1186 O ASN A 78 12.709 24.693 -5.252 1.00 0.00 O ATOM 1187 CB ASN A 78 11.177 25.801 -7.526 1.00 0.00 C ATOM 1188 CG ASN A 78 10.775 26.700 -8.678 1.00 0.00 C ATOM 1189 OD1 ASN A 78 9.948 26.328 -9.510 1.00 0.00 O ATOM 1190 ND2 ASN A 78 11.362 27.890 -8.734 1.00 0.00 N ATOM 0 H ASN A 78 12.396 24.718 -9.422 1.00 0.00 H new ATOM 0 HA ASN A 78 13.216 26.432 -7.253 1.00 0.00 H new ATOM 0 HB2 ASN A 78 10.633 24.859 -7.598 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.884 26.268 -6.586 1.00 0.00 H new ATOM 0 HD21 ASN A 78 11.133 28.537 -9.489 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.042 28.157 -8.022 1.00 0.00 H new ATOM 1197 N GLU A 79 13.598 23.373 -6.838 1.00 0.00 N ATOM 1198 CA GLU A 79 13.965 22.317 -5.913 1.00 0.00 C ATOM 1199 C GLU A 79 12.761 21.827 -5.112 1.00 0.00 C ATOM 1200 O GLU A 79 12.257 22.531 -4.236 1.00 0.00 O ATOM 1201 CB GLU A 79 15.060 22.813 -4.973 1.00 0.00 C ATOM 1202 CG GLU A 79 15.885 21.696 -4.355 1.00 0.00 C ATOM 1203 CD GLU A 79 16.541 22.109 -3.052 1.00 0.00 C ATOM 1204 OE1 GLU A 79 15.825 22.210 -2.033 1.00 0.00 O ATOM 1205 OE2 GLU A 79 17.770 22.331 -3.050 1.00 0.00 O ATOM 0 H GLU A 79 13.843 23.184 -7.810 1.00 0.00 H new ATOM 0 HA GLU A 79 14.338 21.473 -6.493 1.00 0.00 H new ATOM 0 HB2 GLU A 79 15.723 23.482 -5.522 1.00 0.00 H new ATOM 0 HB3 GLU A 79 14.604 23.400 -4.176 1.00 0.00 H new ATOM 0 HG2 GLU A 79 15.245 20.832 -4.177 1.00 0.00 H new ATOM 0 HG3 GLU A 79 16.654 21.383 -5.062 1.00 0.00 H new ATOM 1212 N VAL A 80 12.307 20.615 -5.415 1.00 0.00 N ATOM 1213 CA VAL A 80 11.163 20.035 -4.720 1.00 0.00 C ATOM 1214 C VAL A 80 11.565 18.801 -3.922 1.00 0.00 C ATOM 1215 O VAL A 80 12.392 18.004 -4.363 1.00 0.00 O ATOM 1216 CB VAL A 80 10.046 19.648 -5.694 1.00 0.00 C ATOM 1217 CG1 VAL A 80 8.755 19.356 -4.942 1.00 0.00 C ATOM 1218 CG2 VAL A 80 9.836 20.737 -6.735 1.00 0.00 C ATOM 0 H VAL A 80 12.712 20.017 -6.135 1.00 0.00 H new ATOM 0 HA VAL A 80 10.795 20.803 -4.040 1.00 0.00 H new ATOM 0 HB VAL A 80 10.347 18.739 -6.215 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.974 19.083 -5.652 1.00 0.00 H new ATOM 0 HG12 VAL A 80 8.917 18.532 -4.247 1.00 0.00 H new ATOM 0 HG13 VAL A 80 8.448 20.243 -4.388 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.038 20.440 -7.416 1.00 0.00 H new ATOM 0 HG22 VAL A 80 9.562 21.667 -6.238 1.00 0.00 H new ATOM 0 HG23 VAL A 80 10.757 20.885 -7.298 1.00 0.00 H new ATOM 1228 N VAL A 81 10.963 18.647 -2.749 1.00 0.00 N ATOM 1229 CA VAL A 81 11.245 17.506 -1.888 1.00 0.00 C ATOM 1230 C VAL A 81 10.025 16.596 -1.792 1.00 0.00 C ATOM 1231 O VAL A 81 9.235 16.697 -0.853 1.00 0.00 O ATOM 1232 CB VAL A 81 11.664 17.957 -0.472 1.00 0.00 C ATOM 1233 CG1 VAL A 81 11.863 16.758 0.449 1.00 0.00 C ATOM 1234 CG2 VAL A 81 12.929 18.799 -0.537 1.00 0.00 C ATOM 0 H VAL A 81 10.275 19.299 -2.372 1.00 0.00 H new ATOM 0 HA VAL A 81 12.074 16.957 -2.335 1.00 0.00 H new ATOM 0 HB VAL A 81 10.861 18.567 -0.058 1.00 0.00 H new ATOM 0 HG11 VAL A 81 12.158 17.105 1.439 1.00 0.00 H new ATOM 0 HG12 VAL A 81 10.931 16.198 0.523 1.00 0.00 H new ATOM 0 HG13 VAL A 81 12.643 16.113 0.044 1.00 0.00 H new ATOM 0 HG21 VAL A 81 13.212 19.109 0.469 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.735 18.211 -0.975 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.748 19.681 -1.151 1.00 0.00 H new ATOM 1244 N PRO A 82 9.853 15.690 -2.771 1.00 0.00 N ATOM 1245 CA PRO A 82 8.722 14.760 -2.799 1.00 0.00 C ATOM 1246 C PRO A 82 8.451 14.130 -1.437 1.00 0.00 C ATOM 1247 O PRO A 82 9.377 13.824 -0.688 1.00 0.00 O ATOM 1248 CB PRO A 82 9.174 13.700 -3.800 1.00 0.00 C ATOM 1249 CG PRO A 82 10.069 14.431 -4.741 1.00 0.00 C ATOM 1250 CD PRO A 82 10.750 15.504 -3.930 1.00 0.00 C ATOM 0 HA PRO A 82 7.789 15.255 -3.068 1.00 0.00 H new ATOM 0 HB2 PRO A 82 9.701 12.885 -3.304 1.00 0.00 H new ATOM 0 HB3 PRO A 82 8.325 13.259 -4.322 1.00 0.00 H new ATOM 0 HG2 PRO A 82 10.801 13.756 -5.185 1.00 0.00 H new ATOM 0 HG3 PRO A 82 9.498 14.867 -5.561 1.00 0.00 H new ATOM 0 HD2 PRO A 82 11.748 15.197 -3.618 1.00 0.00 H new ATOM 0 HD3 PRO A 82 10.863 16.426 -4.501 1.00 0.00 H new ATOM 1258 N LYS A 83 7.174 13.944 -1.127 1.00 0.00 N ATOM 1259 CA LYS A 83 6.774 13.351 0.145 1.00 0.00 C ATOM 1260 C LYS A 83 6.686 11.835 0.037 1.00 0.00 C ATOM 1261 O LYS A 83 6.677 11.274 -1.060 1.00 0.00 O ATOM 1262 CB LYS A 83 5.430 13.922 0.600 1.00 0.00 C ATOM 1263 CG LYS A 83 5.558 15.173 1.454 1.00 0.00 C ATOM 1264 CD LYS A 83 4.312 16.038 1.363 1.00 0.00 C ATOM 1265 CE LYS A 83 4.647 17.514 1.519 1.00 0.00 C ATOM 1266 NZ LYS A 83 3.422 18.350 1.654 1.00 0.00 N ATOM 0 H LYS A 83 6.397 14.195 -1.738 1.00 0.00 H new ATOM 0 HA LYS A 83 7.534 13.599 0.886 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.826 14.152 -0.278 1.00 0.00 H new ATOM 0 HB3 LYS A 83 4.893 13.160 1.165 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.731 14.890 2.492 1.00 0.00 H new ATOM 0 HG3 LYS A 83 6.426 15.748 1.131 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.823 15.874 0.403 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.604 15.741 2.136 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.279 17.652 2.396 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.222 17.849 0.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 3.693 19.349 1.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.830 18.238 0.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.886 18.048 2.492 1.00 0.00 H new ATOM 1280 N PRO A 84 6.636 11.153 1.189 1.00 0.00 N ATOM 1281 CA PRO A 84 6.566 9.695 1.264 1.00 0.00 C ATOM 1282 C PRO A 84 5.151 9.177 1.023 1.00 0.00 C ATOM 1283 O PRO A 84 4.423 8.865 1.964 1.00 0.00 O ATOM 1284 CB PRO A 84 7.026 9.395 2.705 1.00 0.00 C ATOM 1285 CG PRO A 84 7.448 10.716 3.272 1.00 0.00 C ATOM 1286 CD PRO A 84 6.661 11.740 2.526 1.00 0.00 C ATOM 0 HA PRO A 84 7.176 9.208 0.503 1.00 0.00 H new ATOM 0 HB2 PRO A 84 6.219 8.956 3.291 1.00 0.00 H new ATOM 0 HB3 PRO A 84 7.851 8.682 2.714 1.00 0.00 H new ATOM 0 HG2 PRO A 84 7.244 10.767 4.342 1.00 0.00 H new ATOM 0 HG3 PRO A 84 8.519 10.874 3.144 1.00 0.00 H new ATOM 0 HD2 PRO A 84 5.660 11.871 2.937 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.141 12.718 2.538 1.00 0.00 H new ATOM 1294 N GLN A 85 4.768 9.098 -0.247 1.00 0.00 N ATOM 1295 CA GLN A 85 3.439 8.629 -0.622 1.00 0.00 C ATOM 1296 C GLN A 85 3.171 7.227 -0.082 1.00 0.00 C ATOM 1297 O GLN A 85 4.064 6.577 0.461 1.00 0.00 O ATOM 1298 CB GLN A 85 3.285 8.638 -2.144 1.00 0.00 C ATOM 1299 CG GLN A 85 4.218 7.673 -2.856 1.00 0.00 C ATOM 1300 CD GLN A 85 3.915 7.554 -4.337 1.00 0.00 C ATOM 1301 OE1 GLN A 85 3.839 6.451 -4.879 1.00 0.00 O ATOM 1302 NE2 GLN A 85 3.739 8.691 -4.999 1.00 0.00 N ATOM 0 H GLN A 85 5.361 9.354 -1.036 1.00 0.00 H new ATOM 0 HA GLN A 85 2.709 9.308 -0.181 1.00 0.00 H new ATOM 0 HB2 GLN A 85 2.255 8.388 -2.398 1.00 0.00 H new ATOM 0 HB3 GLN A 85 3.469 9.647 -2.513 1.00 0.00 H new ATOM 0 HG2 GLN A 85 5.248 8.006 -2.725 1.00 0.00 H new ATOM 0 HG3 GLN A 85 4.140 6.689 -2.393 1.00 0.00 H new ATOM 0 HE21 GLN A 85 3.811 9.583 -4.509 1.00 0.00 H new ATOM 0 HE22 GLN A 85 3.532 8.673 -5.998 1.00 0.00 H new ATOM 1311 N ARG A 86 1.933 6.773 -0.239 1.00 0.00 N ATOM 1312 CA ARG A 86 1.530 5.450 0.225 1.00 0.00 C ATOM 1313 C ARG A 86 0.179 5.066 -0.367 1.00 0.00 C ATOM 1314 O ARG A 86 -0.749 5.875 -0.389 1.00 0.00 O ATOM 1315 CB ARG A 86 1.460 5.419 1.754 1.00 0.00 C ATOM 1316 CG ARG A 86 0.800 6.648 2.360 1.00 0.00 C ATOM 1317 CD ARG A 86 -0.521 6.302 3.029 1.00 0.00 C ATOM 1318 NE ARG A 86 -1.284 7.497 3.384 1.00 0.00 N ATOM 1319 CZ ARG A 86 -1.914 8.265 2.499 1.00 0.00 C ATOM 1320 NH1 ARG A 86 -1.876 7.967 1.205 1.00 0.00 N ATOM 1321 NH2 ARG A 86 -2.584 9.334 2.907 1.00 0.00 N ATOM 0 H ARG A 86 1.187 7.305 -0.687 1.00 0.00 H new ATOM 0 HA ARG A 86 2.276 4.728 -0.107 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.910 4.531 2.066 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.470 5.325 2.153 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.471 7.099 3.091 1.00 0.00 H new ATOM 0 HG3 ARG A 86 0.630 7.392 1.581 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -1.114 5.679 2.360 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.330 5.714 3.927 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.337 7.758 4.369 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.362 7.146 0.886 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -2.361 8.559 0.531 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.616 9.568 3.899 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -3.067 9.923 2.228 1.00 0.00 H new ATOM 1335 N HIS A 87 0.071 3.832 -0.850 1.00 0.00 N ATOM 1336 CA HIS A 87 -1.172 3.355 -1.443 1.00 0.00 C ATOM 1337 C HIS A 87 -1.995 2.590 -0.414 1.00 0.00 C ATOM 1338 O HIS A 87 -1.611 1.504 0.018 1.00 0.00 O ATOM 1339 CB HIS A 87 -0.871 2.465 -2.650 1.00 0.00 C ATOM 1340 CG HIS A 87 0.320 2.914 -3.437 1.00 0.00 C ATOM 1341 ND1 HIS A 87 0.228 3.727 -4.549 1.00 0.00 N ATOM 1342 CD2 HIS A 87 1.639 2.671 -3.260 1.00 0.00 C ATOM 1343 CE1 HIS A 87 1.440 3.962 -5.020 1.00 0.00 C ATOM 1344 NE2 HIS A 87 2.314 3.333 -4.255 1.00 0.00 N ATOM 0 H HIS A 87 0.827 3.147 -0.842 1.00 0.00 H new ATOM 0 HA HIS A 87 -1.752 4.216 -1.776 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -0.706 1.444 -2.307 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -1.743 2.445 -3.304 1.00 0.00 H new ATOM 0 HD2 HIS A 87 2.079 2.068 -2.480 1.00 0.00 H new ATOM 0 HE1 HIS A 87 1.676 4.566 -5.884 1.00 0.00 H new ATOM 0 HE2 HIS A 87 3.326 3.338 -4.383 1.00 0.00 H new ATOM 1353 N MET A 88 -3.127 3.167 -0.023 1.00 0.00 N ATOM 1354 CA MET A 88 -4.000 2.543 0.964 1.00 0.00 C ATOM 1355 C MET A 88 -5.087 1.719 0.287 1.00 0.00 C ATOM 1356 O MET A 88 -5.672 2.139 -0.712 1.00 0.00 O ATOM 1357 CB MET A 88 -4.635 3.607 1.861 1.00 0.00 C ATOM 1358 CG MET A 88 -5.021 3.091 3.237 1.00 0.00 C ATOM 1359 SD MET A 88 -4.752 4.310 4.538 1.00 0.00 S ATOM 1360 CE MET A 88 -5.314 3.402 5.975 1.00 0.00 C ATOM 0 H MET A 88 -3.461 4.065 -0.374 1.00 0.00 H new ATOM 0 HA MET A 88 -3.393 1.876 1.577 1.00 0.00 H new ATOM 0 HB2 MET A 88 -3.938 4.437 1.976 1.00 0.00 H new ATOM 0 HB3 MET A 88 -5.523 4.003 1.368 1.00 0.00 H new ATOM 0 HG2 MET A 88 -6.071 2.799 3.230 1.00 0.00 H new ATOM 0 HG3 MET A 88 -4.443 2.194 3.460 1.00 0.00 H new ATOM 0 HE1 MET A 88 -6.154 3.926 6.431 1.00 0.00 H new ATOM 0 HE2 MET A 88 -5.630 2.403 5.674 1.00 0.00 H new ATOM 0 HE3 MET A 88 -4.501 3.323 6.697 1.00 0.00 H new ATOM 1370 N PHE A 89 -5.347 0.541 0.839 1.00 0.00 N ATOM 1371 CA PHE A 89 -6.358 -0.354 0.295 1.00 0.00 C ATOM 1372 C PHE A 89 -7.211 -0.952 1.407 1.00 0.00 C ATOM 1373 O PHE A 89 -6.711 -1.682 2.260 1.00 0.00 O ATOM 1374 CB PHE A 89 -5.692 -1.471 -0.508 1.00 0.00 C ATOM 1375 CG PHE A 89 -4.844 -0.973 -1.642 1.00 0.00 C ATOM 1376 CD1 PHE A 89 -5.407 -0.701 -2.879 1.00 0.00 C ATOM 1377 CD2 PHE A 89 -3.483 -0.778 -1.473 1.00 0.00 C ATOM 1378 CE1 PHE A 89 -4.628 -0.245 -3.925 1.00 0.00 C ATOM 1379 CE2 PHE A 89 -2.701 -0.322 -2.517 1.00 0.00 C ATOM 1380 CZ PHE A 89 -3.272 -0.056 -3.744 1.00 0.00 C ATOM 0 H PHE A 89 -4.869 0.183 1.666 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.007 0.224 -0.363 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -5.074 -2.069 0.161 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -6.463 -2.131 -0.905 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.467 -0.847 -3.027 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.028 -0.985 -0.515 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.079 -0.036 -4.884 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.641 -0.174 -2.372 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.661 0.299 -4.561 1.00 0.00 H new ATOM 1390 N SER A 90 -8.503 -0.644 1.392 1.00 0.00 N ATOM 1391 CA SER A 90 -9.419 -1.160 2.401 1.00 0.00 C ATOM 1392 C SER A 90 -10.037 -2.475 1.943 1.00 0.00 C ATOM 1393 O SER A 90 -10.780 -2.515 0.963 1.00 0.00 O ATOM 1394 CB SER A 90 -10.524 -0.143 2.691 1.00 0.00 C ATOM 1395 OG SER A 90 -10.034 1.184 2.600 1.00 0.00 O ATOM 0 H SER A 90 -8.938 -0.041 0.694 1.00 0.00 H new ATOM 0 HA SER A 90 -8.851 -1.337 3.314 1.00 0.00 H new ATOM 0 HB2 SER A 90 -11.343 -0.280 1.985 1.00 0.00 H new ATOM 0 HB3 SER A 90 -10.930 -0.317 3.688 1.00 0.00 H new ATOM 0 HG SER A 90 -10.760 1.815 2.788 1.00 0.00 H new ATOM 1401 N PHE A 91 -9.719 -3.548 2.653 1.00 0.00 N ATOM 1402 CA PHE A 91 -10.237 -4.865 2.314 1.00 0.00 C ATOM 1403 C PHE A 91 -11.523 -5.174 3.073 1.00 0.00 C ATOM 1404 O PHE A 91 -11.624 -4.929 4.274 1.00 0.00 O ATOM 1405 CB PHE A 91 -9.186 -5.930 2.611 1.00 0.00 C ATOM 1406 CG PHE A 91 -8.150 -6.048 1.535 1.00 0.00 C ATOM 1407 CD1 PHE A 91 -7.354 -4.966 1.199 1.00 0.00 C ATOM 1408 CD2 PHE A 91 -7.978 -7.240 0.856 1.00 0.00 C ATOM 1409 CE1 PHE A 91 -6.403 -5.072 0.203 1.00 0.00 C ATOM 1410 CE2 PHE A 91 -7.029 -7.355 -0.139 1.00 0.00 C ATOM 1411 CZ PHE A 91 -6.240 -6.268 -0.467 1.00 0.00 C ATOM 0 H PHE A 91 -9.105 -3.532 3.467 1.00 0.00 H new ATOM 0 HA PHE A 91 -10.469 -4.870 1.249 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -8.695 -5.695 3.555 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -9.679 -6.893 2.739 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.478 -4.029 1.721 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -8.594 -8.091 1.107 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -5.788 -4.221 -0.051 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.903 -8.292 -0.661 1.00 0.00 H new ATOM 0 HZ PHE A 91 -5.497 -6.354 -1.246 1.00 0.00 H new ATOM 1421 N ASN A 92 -12.501 -5.722 2.358 1.00 0.00 N ATOM 1422 CA ASN A 92 -13.782 -6.077 2.954 1.00 0.00 C ATOM 1423 C ASN A 92 -13.851 -7.579 3.216 1.00 0.00 C ATOM 1424 O ASN A 92 -14.923 -8.182 3.160 1.00 0.00 O ATOM 1425 CB ASN A 92 -14.929 -5.655 2.033 1.00 0.00 C ATOM 1426 CG ASN A 92 -15.446 -4.266 2.354 1.00 0.00 C ATOM 1427 OD1 ASN A 92 -16.593 -4.098 2.768 1.00 0.00 O ATOM 1428 ND2 ASN A 92 -14.598 -3.261 2.163 1.00 0.00 N ATOM 0 H ASN A 92 -12.429 -5.930 1.362 1.00 0.00 H new ATOM 0 HA ASN A 92 -13.878 -5.551 3.904 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -14.589 -5.683 0.998 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -15.745 -6.373 2.121 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -14.889 -2.304 2.361 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -13.656 -3.447 1.818 1.00 0.00 H new ATOM 1435 N ASN A 93 -12.696 -8.174 3.496 1.00 0.00 N ATOM 1436 CA ASN A 93 -12.612 -9.605 3.761 1.00 0.00 C ATOM 1437 C ASN A 93 -11.193 -10.001 4.137 1.00 0.00 C ATOM 1438 O ASN A 93 -10.257 -9.810 3.360 1.00 0.00 O ATOM 1439 CB ASN A 93 -13.075 -10.400 2.538 1.00 0.00 C ATOM 1440 CG ASN A 93 -14.490 -10.923 2.688 1.00 0.00 C ATOM 1441 OD1 ASN A 93 -15.108 -10.781 3.742 1.00 0.00 O ATOM 1442 ND2 ASN A 93 -15.009 -11.533 1.629 1.00 0.00 N ATOM 0 H ASN A 93 -11.802 -7.685 3.545 1.00 0.00 H new ATOM 0 HA ASN A 93 -13.268 -9.836 4.600 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -13.017 -9.766 1.653 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -12.397 -11.238 2.375 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -15.957 -11.907 1.669 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -14.459 -11.628 0.775 1.00 0.00 H new ATOM 1449 N ARG A 94 -11.042 -10.561 5.331 1.00 0.00 N ATOM 1450 CA ARG A 94 -9.737 -10.995 5.808 1.00 0.00 C ATOM 1451 C ARG A 94 -9.145 -12.045 4.875 1.00 0.00 C ATOM 1452 O ARG A 94 -7.946 -12.317 4.914 1.00 0.00 O ATOM 1453 CB ARG A 94 -9.845 -11.554 7.228 1.00 0.00 C ATOM 1454 CG ARG A 94 -9.182 -10.676 8.281 1.00 0.00 C ATOM 1455 CD ARG A 94 -8.159 -11.449 9.098 1.00 0.00 C ATOM 1456 NE ARG A 94 -8.581 -11.618 10.487 1.00 0.00 N ATOM 1457 CZ ARG A 94 -9.457 -12.537 10.889 1.00 0.00 C ATOM 1458 NH1 ARG A 94 -10.005 -13.370 10.013 1.00 0.00 N ATOM 1459 NH2 ARG A 94 -9.785 -12.621 12.170 1.00 0.00 N ATOM 0 H ARG A 94 -11.807 -10.725 5.985 1.00 0.00 H new ATOM 0 HA ARG A 94 -9.075 -10.130 5.821 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -10.898 -11.679 7.481 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -9.391 -12.545 7.255 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -8.695 -9.830 7.795 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -9.943 -10.267 8.945 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -7.999 -12.428 8.646 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -7.203 -10.926 9.071 1.00 0.00 H new ATOM 0 HE ARG A 94 -8.181 -10.996 11.189 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -9.756 -13.308 9.026 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -10.675 -14.072 10.327 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -9.367 -11.982 12.846 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -10.456 -13.324 12.480 1.00 0.00 H new ATOM 1473 N THR A 95 -9.991 -12.632 4.033 1.00 0.00 N ATOM 1474 CA THR A 95 -9.543 -13.646 3.094 1.00 0.00 C ATOM 1475 C THR A 95 -8.768 -13.005 1.950 1.00 0.00 C ATOM 1476 O THR A 95 -7.652 -13.418 1.631 1.00 0.00 O ATOM 1477 CB THR A 95 -10.742 -14.437 2.573 1.00 0.00 C ATOM 1478 OG1 THR A 95 -10.846 -15.683 3.238 1.00 0.00 O ATOM 1479 CG2 THR A 95 -10.700 -14.715 1.087 1.00 0.00 C ATOM 0 H THR A 95 -10.988 -12.421 3.985 1.00 0.00 H new ATOM 0 HA THR A 95 -8.872 -14.336 3.606 1.00 0.00 H new ATOM 0 HB THR A 95 -11.604 -13.800 2.774 1.00 0.00 H new ATOM 0 HG1 THR A 95 -11.620 -16.175 2.893 1.00 0.00 H new ATOM 0 HG21 THR A 95 -11.586 -15.280 0.797 1.00 0.00 H new ATOM 0 HG22 THR A 95 -10.677 -13.772 0.541 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.807 -15.294 0.850 1.00 0.00 H new ATOM 1487 N VAL A 96 -9.361 -11.985 1.345 1.00 0.00 N ATOM 1488 CA VAL A 96 -8.715 -11.278 0.245 1.00 0.00 C ATOM 1489 C VAL A 96 -7.483 -10.554 0.756 1.00 0.00 C ATOM 1490 O VAL A 96 -6.441 -10.532 0.098 1.00 0.00 O ATOM 1491 CB VAL A 96 -9.648 -10.254 -0.442 1.00 0.00 C ATOM 1492 CG1 VAL A 96 -9.546 -10.371 -1.954 1.00 0.00 C ATOM 1493 CG2 VAL A 96 -11.084 -10.429 0.019 1.00 0.00 C ATOM 0 H VAL A 96 -10.284 -11.629 1.595 1.00 0.00 H new ATOM 0 HA VAL A 96 -8.446 -12.029 -0.497 1.00 0.00 H new ATOM 0 HB VAL A 96 -9.326 -9.254 -0.153 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -10.209 -9.643 -2.421 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -8.519 -10.179 -2.265 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -9.836 -11.376 -2.262 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -11.718 -9.696 -0.480 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -11.426 -11.434 -0.229 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -11.140 -10.283 1.098 1.00 0.00 H new ATOM 1503 N MET A 97 -7.607 -9.970 1.942 1.00 0.00 N ATOM 1504 CA MET A 97 -6.497 -9.252 2.549 1.00 0.00 C ATOM 1505 C MET A 97 -5.397 -10.229 2.944 1.00 0.00 C ATOM 1506 O MET A 97 -4.211 -9.937 2.796 1.00 0.00 O ATOM 1507 CB MET A 97 -6.977 -8.440 3.758 1.00 0.00 C ATOM 1508 CG MET A 97 -6.949 -9.196 5.076 1.00 0.00 C ATOM 1509 SD MET A 97 -5.387 -9.006 5.951 1.00 0.00 S ATOM 1510 CE MET A 97 -5.932 -8.058 7.365 1.00 0.00 C ATOM 0 H MET A 97 -8.462 -9.980 2.499 1.00 0.00 H new ATOM 0 HA MET A 97 -6.088 -8.552 1.820 1.00 0.00 H new ATOM 0 HB2 MET A 97 -6.356 -7.549 3.851 1.00 0.00 H new ATOM 0 HB3 MET A 97 -7.995 -8.100 3.570 1.00 0.00 H new ATOM 0 HG2 MET A 97 -7.762 -8.843 5.710 1.00 0.00 H new ATOM 0 HG3 MET A 97 -7.129 -10.254 4.887 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.472 -7.070 7.340 1.00 0.00 H new ATOM 0 HE2 MET A 97 -7.017 -7.954 7.337 1.00 0.00 H new ATOM 0 HE3 MET A 97 -5.640 -8.571 8.281 1.00 0.00 H new ATOM 1520 N ASP A 98 -5.798 -11.402 3.429 1.00 0.00 N ATOM 1521 CA ASP A 98 -4.839 -12.425 3.819 1.00 0.00 C ATOM 1522 C ASP A 98 -4.087 -12.928 2.594 1.00 0.00 C ATOM 1523 O ASP A 98 -2.949 -13.388 2.693 1.00 0.00 O ATOM 1524 CB ASP A 98 -5.547 -13.587 4.523 1.00 0.00 C ATOM 1525 CG ASP A 98 -4.596 -14.708 4.896 1.00 0.00 C ATOM 1526 OD1 ASP A 98 -3.442 -14.408 5.270 1.00 0.00 O ATOM 1527 OD2 ASP A 98 -5.003 -15.885 4.813 1.00 0.00 O ATOM 0 H ASP A 98 -6.775 -11.664 3.560 1.00 0.00 H new ATOM 0 HA ASP A 98 -4.125 -11.986 4.516 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -6.038 -13.217 5.423 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -6.328 -13.980 3.872 1.00 0.00 H new ATOM 1532 N ASN A 99 -4.731 -12.827 1.437 1.00 0.00 N ATOM 1533 CA ASN A 99 -4.128 -13.258 0.183 1.00 0.00 C ATOM 1534 C ASN A 99 -3.199 -12.178 -0.359 1.00 0.00 C ATOM 1535 O ASN A 99 -1.986 -12.368 -0.422 1.00 0.00 O ATOM 1536 CB ASN A 99 -5.212 -13.581 -0.846 1.00 0.00 C ATOM 1537 CG ASN A 99 -6.131 -14.697 -0.387 1.00 0.00 C ATOM 1538 OD1 ASN A 99 -5.721 -15.586 0.358 1.00 0.00 O ATOM 1539 ND2 ASN A 99 -7.380 -14.655 -0.832 1.00 0.00 N ATOM 0 H ASN A 99 -5.674 -12.449 1.342 1.00 0.00 H new ATOM 0 HA ASN A 99 -3.545 -14.159 0.373 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.802 -12.686 -1.041 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -4.742 -13.865 -1.788 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -8.044 -15.379 -0.558 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -7.677 -13.898 -1.449 1.00 0.00 H new ATOM 1546 N ILE A 100 -3.775 -11.034 -0.734 1.00 0.00 N ATOM 1547 CA ILE A 100 -2.992 -9.916 -1.259 1.00 0.00 C ATOM 1548 C ILE A 100 -1.794 -9.632 -0.362 1.00 0.00 C ATOM 1549 O ILE A 100 -0.645 -9.669 -0.804 1.00 0.00 O ATOM 1550 CB ILE A 100 -3.842 -8.630 -1.374 1.00 0.00 C ATOM 1551 CG1 ILE A 100 -5.051 -8.863 -2.286 1.00 0.00 C ATOM 1552 CG2 ILE A 100 -2.995 -7.469 -1.885 1.00 0.00 C ATOM 1553 CD1 ILE A 100 -4.708 -8.900 -3.757 1.00 0.00 C ATOM 0 H ILE A 100 -4.779 -10.859 -0.684 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.652 -10.205 -2.253 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.209 -8.371 -0.381 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.527 -9.804 -2.010 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.782 -8.073 -2.113 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.612 -6.573 -1.959 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -2.172 -7.287 -1.194 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -2.595 -7.716 -2.868 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.615 -9.069 -4.338 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.261 -7.950 -4.050 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.001 -9.708 -3.946 1.00 0.00 H new ATOM 1565 N LYS A 101 -2.079 -9.353 0.905 1.00 0.00 N ATOM 1566 CA LYS A 101 -1.041 -9.065 1.887 1.00 0.00 C ATOM 1567 C LYS A 101 0.088 -10.087 1.804 1.00 0.00 C ATOM 1568 O LYS A 101 1.264 -9.745 1.932 1.00 0.00 O ATOM 1569 CB LYS A 101 -1.645 -9.085 3.289 1.00 0.00 C ATOM 1570 CG LYS A 101 -0.635 -8.838 4.395 1.00 0.00 C ATOM 1571 CD LYS A 101 -1.331 -8.552 5.712 1.00 0.00 C ATOM 1572 CE LYS A 101 -1.526 -9.816 6.531 1.00 0.00 C ATOM 1573 NZ LYS A 101 -0.266 -10.599 6.657 1.00 0.00 N ATOM 0 H LYS A 101 -3.028 -9.320 1.278 1.00 0.00 H new ATOM 0 HA LYS A 101 -0.629 -8.078 1.674 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -2.427 -8.328 3.348 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -2.123 -10.051 3.455 1.00 0.00 H new ATOM 0 HG2 LYS A 101 0.012 -9.709 4.503 1.00 0.00 H new ATOM 0 HG3 LYS A 101 0.005 -7.997 4.127 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.744 -7.834 6.285 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.299 -8.091 5.519 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.890 -9.552 7.524 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.293 -10.435 6.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -0.311 -11.194 7.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -0.147 -11.203 5.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 0.541 -9.948 6.732 1.00 0.00 H new ATOM 1587 N MET A 102 -0.286 -11.342 1.589 1.00 0.00 N ATOM 1588 CA MET A 102 0.683 -12.423 1.489 1.00 0.00 C ATOM 1589 C MET A 102 1.348 -12.417 0.122 1.00 0.00 C ATOM 1590 O MET A 102 2.565 -12.576 0.013 1.00 0.00 O ATOM 1591 CB MET A 102 0.003 -13.772 1.733 1.00 0.00 C ATOM 1592 CG MET A 102 -0.072 -14.157 3.202 1.00 0.00 C ATOM 1593 SD MET A 102 -0.283 -15.931 3.444 1.00 0.00 S ATOM 1594 CE MET A 102 -1.857 -16.200 2.631 1.00 0.00 C ATOM 0 H MET A 102 -1.257 -11.636 1.480 1.00 0.00 H new ATOM 0 HA MET A 102 1.447 -12.270 2.251 1.00 0.00 H new ATOM 0 HB2 MET A 102 -1.006 -13.741 1.322 1.00 0.00 H new ATOM 0 HB3 MET A 102 0.545 -14.546 1.190 1.00 0.00 H new ATOM 0 HG2 MET A 102 0.838 -13.831 3.706 1.00 0.00 H new ATOM 0 HG3 MET A 102 -0.903 -13.629 3.670 1.00 0.00 H new ATOM 0 HE1 MET A 102 -2.041 -17.270 2.539 1.00 0.00 H new ATOM 0 HE2 MET A 102 -2.653 -15.744 3.220 1.00 0.00 H new ATOM 0 HE3 MET A 102 -1.836 -15.749 1.639 1.00 0.00 H new ATOM 1604 N THR A 103 0.547 -12.231 -0.924 1.00 0.00 N ATOM 1605 CA THR A 103 1.064 -12.206 -2.273 1.00 0.00 C ATOM 1606 C THR A 103 2.138 -11.139 -2.428 1.00 0.00 C ATOM 1607 O THR A 103 3.250 -11.424 -2.870 1.00 0.00 O ATOM 1608 CB THR A 103 -0.070 -11.952 -3.256 1.00 0.00 C ATOM 1609 OG1 THR A 103 -1.319 -12.296 -2.688 1.00 0.00 O ATOM 1610 CG2 THR A 103 0.076 -12.729 -4.535 1.00 0.00 C ATOM 0 H THR A 103 -0.462 -12.096 -0.855 1.00 0.00 H new ATOM 0 HA THR A 103 1.516 -13.175 -2.485 1.00 0.00 H new ATOM 0 HB THR A 103 -0.023 -10.887 -3.482 1.00 0.00 H new ATOM 0 HG1 THR A 103 -2.041 -11.981 -3.271 1.00 0.00 H new ATOM 0 HG21 THR A 103 -0.763 -12.505 -5.194 1.00 0.00 H new ATOM 0 HG22 THR A 103 1.008 -12.450 -5.026 1.00 0.00 H new ATOM 0 HG23 THR A 103 0.088 -13.796 -4.313 1.00 0.00 H new ATOM 1618 N LEU A 104 1.801 -9.909 -2.053 1.00 0.00 N ATOM 1619 CA LEU A 104 2.747 -8.804 -2.145 1.00 0.00 C ATOM 1620 C LEU A 104 4.070 -9.196 -1.500 1.00 0.00 C ATOM 1621 O LEU A 104 5.129 -9.100 -2.118 1.00 0.00 O ATOM 1622 CB LEU A 104 2.186 -7.552 -1.462 1.00 0.00 C ATOM 1623 CG LEU A 104 0.752 -7.178 -1.846 1.00 0.00 C ATOM 1624 CD1 LEU A 104 0.044 -6.516 -0.674 1.00 0.00 C ATOM 1625 CD2 LEU A 104 0.742 -6.260 -3.059 1.00 0.00 C ATOM 0 H LEU A 104 0.885 -9.654 -1.685 1.00 0.00 H new ATOM 0 HA LEU A 104 2.913 -8.580 -3.199 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.228 -7.699 -0.383 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.837 -6.710 -1.695 1.00 0.00 H new ATOM 0 HG LEU A 104 0.217 -8.092 -2.104 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.974 -6.256 -0.964 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.017 -7.205 0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.581 -5.612 -0.388 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.287 -6.006 -3.315 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.294 -5.349 -2.830 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.211 -6.766 -3.902 1.00 0.00 H new ATOM 1637 N GLN A 105 3.991 -9.653 -0.253 1.00 0.00 N ATOM 1638 CA GLN A 105 5.173 -10.076 0.487 1.00 0.00 C ATOM 1639 C GLN A 105 5.926 -11.170 -0.264 1.00 0.00 C ATOM 1640 O GLN A 105 7.147 -11.113 -0.401 1.00 0.00 O ATOM 1641 CB GLN A 105 4.773 -10.582 1.876 1.00 0.00 C ATOM 1642 CG GLN A 105 5.140 -9.631 3.001 1.00 0.00 C ATOM 1643 CD GLN A 105 4.155 -9.689 4.152 1.00 0.00 C ATOM 1644 OE1 GLN A 105 4.506 -10.074 5.268 1.00 0.00 O ATOM 1645 NE2 GLN A 105 2.912 -9.306 3.885 1.00 0.00 N ATOM 0 H GLN A 105 3.117 -9.739 0.266 1.00 0.00 H new ATOM 0 HA GLN A 105 5.832 -9.214 0.593 1.00 0.00 H new ATOM 0 HB2 GLN A 105 3.697 -10.754 1.894 1.00 0.00 H new ATOM 0 HB3 GLN A 105 5.253 -11.544 2.055 1.00 0.00 H new ATOM 0 HG2 GLN A 105 6.137 -9.874 3.367 1.00 0.00 H new ATOM 0 HG3 GLN A 105 5.182 -8.613 2.613 1.00 0.00 H new ATOM 0 HE21 GLN A 105 2.665 -8.994 2.946 1.00 0.00 H new ATOM 0 HE22 GLN A 105 2.204 -9.324 4.619 1.00 0.00 H new ATOM 1654 N GLN A 106 5.189 -12.169 -0.757 1.00 0.00 N ATOM 1655 CA GLN A 106 5.798 -13.271 -1.498 1.00 0.00 C ATOM 1656 C GLN A 106 6.718 -12.732 -2.585 1.00 0.00 C ATOM 1657 O GLN A 106 7.763 -13.313 -2.882 1.00 0.00 O ATOM 1658 CB GLN A 106 4.717 -14.158 -2.118 1.00 0.00 C ATOM 1659 CG GLN A 106 4.271 -15.295 -1.213 1.00 0.00 C ATOM 1660 CD GLN A 106 4.033 -16.585 -1.972 1.00 0.00 C ATOM 1661 OE1 GLN A 106 4.854 -17.502 -1.934 1.00 0.00 O ATOM 1662 NE2 GLN A 106 2.904 -16.663 -2.668 1.00 0.00 N ATOM 0 H GLN A 106 4.176 -12.235 -0.656 1.00 0.00 H new ATOM 0 HA GLN A 106 6.387 -13.870 -0.804 1.00 0.00 H new ATOM 0 HB2 GLN A 106 3.853 -13.543 -2.367 1.00 0.00 H new ATOM 0 HB3 GLN A 106 5.092 -14.574 -3.053 1.00 0.00 H new ATOM 0 HG2 GLN A 106 5.028 -15.463 -0.447 1.00 0.00 H new ATOM 0 HG3 GLN A 106 3.355 -15.006 -0.698 1.00 0.00 H new ATOM 0 HE21 GLN A 106 2.252 -15.879 -2.671 1.00 0.00 H new ATOM 0 HE22 GLN A 106 2.689 -17.507 -3.199 1.00 0.00 H new ATOM 1671 N ILE A 107 6.321 -11.607 -3.164 1.00 0.00 N ATOM 1672 CA ILE A 107 7.097 -10.959 -4.208 1.00 0.00 C ATOM 1673 C ILE A 107 8.152 -10.047 -3.596 1.00 0.00 C ATOM 1674 O ILE A 107 9.333 -10.136 -3.921 1.00 0.00 O ATOM 1675 CB ILE A 107 6.193 -10.143 -5.145 1.00 0.00 C ATOM 1676 CG1 ILE A 107 4.942 -10.941 -5.522 1.00 0.00 C ATOM 1677 CG2 ILE A 107 6.969 -9.749 -6.383 1.00 0.00 C ATOM 1678 CD1 ILE A 107 3.805 -10.082 -6.028 1.00 0.00 C ATOM 0 H ILE A 107 5.457 -11.122 -2.924 1.00 0.00 H new ATOM 0 HA ILE A 107 7.587 -11.739 -4.790 1.00 0.00 H new ATOM 0 HB ILE A 107 5.869 -9.240 -4.627 1.00 0.00 H new ATOM 0 HG12 ILE A 107 5.204 -11.670 -6.288 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.603 -11.502 -4.651 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.326 -9.170 -7.046 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.831 -9.146 -6.096 1.00 0.00 H new ATOM 0 HG23 ILE A 107 7.310 -10.646 -6.900 1.00 0.00 H new ATOM 0 HD11 ILE A 107 2.953 -10.715 -6.276 1.00 0.00 H new ATOM 0 HD12 ILE A 107 3.515 -9.370 -5.255 1.00 0.00 H new ATOM 0 HD13 ILE A 107 4.126 -9.541 -6.918 1.00 0.00 H new ATOM 1690 N ILE A 108 7.710 -9.175 -2.699 1.00 0.00 N ATOM 1691 CA ILE A 108 8.607 -8.242 -2.014 1.00 0.00 C ATOM 1692 C ILE A 108 9.897 -8.923 -1.593 1.00 0.00 C ATOM 1693 O ILE A 108 10.990 -8.503 -1.968 1.00 0.00 O ATOM 1694 CB ILE A 108 7.950 -7.634 -0.759 1.00 0.00 C ATOM 1695 CG1 ILE A 108 6.573 -7.051 -1.110 1.00 0.00 C ATOM 1696 CG2 ILE A 108 8.867 -6.584 -0.139 1.00 0.00 C ATOM 1697 CD1 ILE A 108 6.363 -5.613 -0.675 1.00 0.00 C ATOM 0 H ILE A 108 6.731 -9.091 -2.425 1.00 0.00 H new ATOM 0 HA ILE A 108 8.824 -7.449 -2.730 1.00 0.00 H new ATOM 0 HB ILE A 108 7.798 -8.418 -0.018 1.00 0.00 H new ATOM 0 HG12 ILE A 108 6.431 -7.114 -2.189 1.00 0.00 H new ATOM 0 HG13 ILE A 108 5.803 -7.671 -0.651 1.00 0.00 H new ATOM 0 HG21 ILE A 108 8.391 -6.162 0.746 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.812 -7.047 0.143 1.00 0.00 H new ATOM 0 HG23 ILE A 108 9.054 -5.791 -0.863 1.00 0.00 H new ATOM 0 HD11 ILE A 108 5.364 -5.287 -0.965 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.468 -5.541 0.408 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.106 -4.976 -1.155 1.00 0.00 H new ATOM 1709 N SER A 109 9.753 -9.976 -0.813 1.00 0.00 N ATOM 1710 CA SER A 109 10.898 -10.739 -0.322 1.00 0.00 C ATOM 1711 C SER A 109 11.883 -11.044 -1.447 1.00 0.00 C ATOM 1712 O SER A 109 13.082 -11.192 -1.215 1.00 0.00 O ATOM 1713 CB SER A 109 10.432 -12.040 0.331 1.00 0.00 C ATOM 1714 OG SER A 109 11.272 -12.397 1.415 1.00 0.00 O ATOM 0 H SER A 109 8.849 -10.330 -0.500 1.00 0.00 H new ATOM 0 HA SER A 109 11.409 -10.129 0.423 1.00 0.00 H new ATOM 0 HB2 SER A 109 9.407 -11.927 0.684 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.428 -12.841 -0.409 1.00 0.00 H new ATOM 0 HG SER A 109 11.534 -13.338 1.330 1.00 0.00 H new ATOM 1720 N ARG A 110 11.366 -11.134 -2.665 1.00 0.00 N ATOM 1721 CA ARG A 110 12.194 -11.418 -3.827 1.00 0.00 C ATOM 1722 C ARG A 110 13.047 -10.212 -4.207 1.00 0.00 C ATOM 1723 O ARG A 110 14.101 -10.361 -4.819 1.00 0.00 O ATOM 1724 CB ARG A 110 11.329 -11.854 -5.013 1.00 0.00 C ATOM 1725 CG ARG A 110 11.551 -13.300 -5.422 1.00 0.00 C ATOM 1726 CD ARG A 110 11.865 -13.424 -6.905 1.00 0.00 C ATOM 1727 NE ARG A 110 13.298 -13.563 -7.152 1.00 0.00 N ATOM 1728 CZ ARG A 110 13.822 -13.839 -8.344 1.00 0.00 C ATOM 1729 NH1 ARG A 110 13.035 -14.005 -9.400 1.00 0.00 N ATOM 1730 NH2 ARG A 110 15.137 -13.948 -8.481 1.00 0.00 N ATOM 0 H ARG A 110 10.375 -11.014 -2.873 1.00 0.00 H new ATOM 0 HA ARG A 110 12.865 -12.236 -3.565 1.00 0.00 H new ATOM 0 HB2 ARG A 110 10.279 -11.713 -4.758 1.00 0.00 H new ATOM 0 HB3 ARG A 110 11.540 -11.207 -5.864 1.00 0.00 H new ATOM 0 HG2 ARG A 110 12.371 -13.721 -4.840 1.00 0.00 H new ATOM 0 HG3 ARG A 110 10.661 -13.885 -5.188 1.00 0.00 H new ATOM 0 HD2 ARG A 110 11.341 -14.287 -7.315 1.00 0.00 H new ATOM 0 HD3 ARG A 110 11.490 -12.545 -7.429 1.00 0.00 H new ATOM 0 HE ARG A 110 13.935 -13.441 -6.364 1.00 0.00 H new ATOM 0 HH11 ARG A 110 12.023 -13.921 -9.300 1.00 0.00 H new ATOM 0 HH12 ARG A 110 13.442 -14.216 -10.311 1.00 0.00 H new ATOM 0 HH21 ARG A 110 15.746 -13.820 -7.673 1.00 0.00 H new ATOM 0 HH22 ARG A 110 15.539 -14.160 -9.394 1.00 0.00 H new ATOM 1744 N TYR A 111 12.593 -9.018 -3.837 1.00 0.00 N ATOM 1745 CA TYR A 111 13.334 -7.799 -4.143 1.00 0.00 C ATOM 1746 C TYR A 111 14.534 -7.686 -3.218 1.00 0.00 C ATOM 1747 O TYR A 111 15.598 -7.212 -3.612 1.00 0.00 O ATOM 1748 CB TYR A 111 12.463 -6.542 -3.989 1.00 0.00 C ATOM 1749 CG TYR A 111 11.003 -6.699 -4.372 1.00 0.00 C ATOM 1750 CD1 TYR A 111 10.550 -7.777 -5.126 1.00 0.00 C ATOM 1751 CD2 TYR A 111 10.071 -5.747 -3.968 1.00 0.00 C ATOM 1752 CE1 TYR A 111 9.220 -7.900 -5.462 1.00 0.00 C ATOM 1753 CE2 TYR A 111 8.736 -5.865 -4.303 1.00 0.00 C ATOM 1754 CZ TYR A 111 8.316 -6.943 -5.049 1.00 0.00 C ATOM 1755 OH TYR A 111 6.988 -7.063 -5.380 1.00 0.00 O ATOM 0 H TYR A 111 11.722 -8.869 -3.328 1.00 0.00 H new ATOM 0 HA TYR A 111 13.656 -7.863 -5.182 1.00 0.00 H new ATOM 0 HB2 TYR A 111 12.513 -6.213 -2.951 1.00 0.00 H new ATOM 0 HB3 TYR A 111 12.895 -5.747 -4.597 1.00 0.00 H new ATOM 0 HD1 TYR A 111 11.252 -8.529 -5.453 1.00 0.00 H new ATOM 0 HD2 TYR A 111 10.398 -4.901 -3.382 1.00 0.00 H new ATOM 0 HE1 TYR A 111 8.885 -8.744 -6.047 1.00 0.00 H new ATOM 0 HE2 TYR A 111 8.027 -5.117 -3.982 1.00 0.00 H new ATOM 0 HH TYR A 111 6.462 -7.224 -4.569 1.00 0.00 H new ATOM 1765 N LYS A 112 14.352 -8.145 -1.987 1.00 0.00 N ATOM 1766 CA LYS A 112 15.416 -8.120 -0.999 1.00 0.00 C ATOM 1767 C LYS A 112 16.290 -9.324 -1.229 1.00 0.00 C ATOM 1768 O LYS A 112 17.519 -9.246 -1.234 1.00 0.00 O ATOM 1769 CB LYS A 112 14.884 -8.132 0.441 1.00 0.00 C ATOM 1770 CG LYS A 112 13.404 -8.415 0.540 1.00 0.00 C ATOM 1771 CD LYS A 112 12.612 -7.285 -0.073 1.00 0.00 C ATOM 1772 CE LYS A 112 12.698 -6.032 0.763 1.00 0.00 C ATOM 1773 NZ LYS A 112 11.476 -5.190 0.640 1.00 0.00 N ATOM 0 H LYS A 112 13.474 -8.540 -1.651 1.00 0.00 H new ATOM 0 HA LYS A 112 15.977 -7.193 -1.117 1.00 0.00 H new ATOM 0 HB2 LYS A 112 15.428 -8.884 1.013 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.092 -7.167 0.904 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.171 -9.350 0.030 1.00 0.00 H new ATOM 0 HG3 LYS A 112 13.120 -8.542 1.585 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.985 -7.080 -1.076 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.569 -7.584 -0.176 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.846 -6.304 1.808 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.569 -5.452 0.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.717 -4.198 0.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.096 -5.269 -0.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.761 -5.514 1.322 1.00 0.00 H new ATOM 1787 N ASP A 113 15.617 -10.438 -1.456 1.00 0.00 N ATOM 1788 CA ASP A 113 16.292 -11.692 -1.738 1.00 0.00 C ATOM 1789 C ASP A 113 17.108 -11.540 -3.010 1.00 0.00 C ATOM 1790 O ASP A 113 18.169 -12.143 -3.165 1.00 0.00 O ATOM 1791 CB ASP A 113 15.283 -12.832 -1.885 1.00 0.00 C ATOM 1792 CG ASP A 113 14.786 -13.340 -0.545 1.00 0.00 C ATOM 1793 OD1 ASP A 113 15.610 -13.469 0.384 1.00 0.00 O ATOM 1794 OD2 ASP A 113 13.572 -13.609 -0.426 1.00 0.00 O ATOM 0 H ASP A 113 14.599 -10.499 -1.450 1.00 0.00 H new ATOM 0 HA ASP A 113 16.953 -11.938 -0.907 1.00 0.00 H new ATOM 0 HB2 ASP A 113 14.435 -12.489 -2.478 1.00 0.00 H new ATOM 0 HB3 ASP A 113 15.744 -13.653 -2.434 1.00 0.00 H new ATOM 1799 N ALA A 114 16.607 -10.698 -3.910 1.00 0.00 N ATOM 1800 CA ALA A 114 17.287 -10.428 -5.161 1.00 0.00 C ATOM 1801 C ALA A 114 18.195 -9.211 -5.025 1.00 0.00 C ATOM 1802 O ALA A 114 19.134 -9.034 -5.801 1.00 0.00 O ATOM 1803 CB ALA A 114 16.288 -10.225 -6.290 1.00 0.00 C ATOM 0 H ALA A 114 15.729 -10.192 -3.790 1.00 0.00 H new ATOM 0 HA ALA A 114 17.903 -11.294 -5.405 1.00 0.00 H new ATOM 0 HB1 ALA A 114 16.823 -10.024 -7.218 1.00 0.00 H new ATOM 0 HB2 ALA A 114 15.684 -11.125 -6.407 1.00 0.00 H new ATOM 0 HB3 ALA A 114 15.640 -9.381 -6.055 1.00 0.00 H new ATOM 1809 N ASP A 115 17.909 -8.372 -4.030 1.00 0.00 N ATOM 1810 CA ASP A 115 18.704 -7.172 -3.792 1.00 0.00 C ATOM 1811 C ASP A 115 19.086 -7.056 -2.321 1.00 0.00 C ATOM 1812 O ASP A 115 18.249 -6.573 -1.529 1.00 0.00 O ATOM 1813 CB ASP A 115 17.935 -5.924 -4.231 1.00 0.00 C ATOM 1814 CG ASP A 115 17.246 -6.105 -5.570 1.00 0.00 C ATOM 1815 OD1 ASP A 115 17.899 -6.605 -6.510 1.00 0.00 O ATOM 1816 OD2 ASP A 115 16.055 -5.747 -5.678 1.00 0.00 O ATOM 0 H ASP A 115 17.135 -8.502 -3.379 1.00 0.00 H new ATOM 0 HA ASP A 115 19.617 -7.251 -4.382 1.00 0.00 H new ATOM 0 HB2 ASP A 115 17.191 -5.675 -3.474 1.00 0.00 H new ATOM 0 HB3 ASP A 115 18.623 -5.080 -4.291 1.00 0.00 H new TER 1821 ASP A 115 ATOM 1822 N ASP B 661 -21.656 13.274 9.139 1.00 0.00 N ATOM 1823 CA ASP B 661 -21.440 11.804 9.091 1.00 0.00 C ATOM 1824 C ASP B 661 -20.252 11.450 8.202 1.00 0.00 C ATOM 1825 O ASP B 661 -20.380 11.374 6.980 1.00 0.00 O ATOM 1826 CB ASP B 661 -22.713 11.143 8.561 1.00 0.00 C ATOM 1827 CG ASP B 661 -23.695 10.808 9.666 1.00 0.00 C ATOM 1828 OD1 ASP B 661 -23.245 10.372 10.747 1.00 0.00 O ATOM 1829 OD2 ASP B 661 -24.913 10.980 9.451 1.00 0.00 O ATOM 0 HA ASP B 661 -21.217 11.441 10.094 1.00 0.00 H new ATOM 0 HB2 ASP B 661 -23.192 11.808 7.843 1.00 0.00 H new ATOM 0 HB3 ASP B 661 -22.449 10.231 8.025 1.00 0.00 H new ATOM 1834 N LEU B 662 -19.097 11.235 8.823 1.00 0.00 N ATOM 1835 CA LEU B 662 -17.887 10.889 8.088 1.00 0.00 C ATOM 1836 C LEU B 662 -16.747 10.553 9.045 1.00 0.00 C ATOM 1837 O LEU B 662 -15.954 11.421 9.410 1.00 0.00 O ATOM 1838 CB LEU B 662 -17.476 12.041 7.170 1.00 0.00 C ATOM 1839 CG LEU B 662 -16.849 11.619 5.840 1.00 0.00 C ATOM 1840 CD1 LEU B 662 -17.929 11.329 4.810 1.00 0.00 C ATOM 1841 CD2 LEU B 662 -15.900 12.693 5.333 1.00 0.00 C ATOM 0 H LEU B 662 -18.974 11.294 9.834 1.00 0.00 H new ATOM 0 HA LEU B 662 -18.099 10.009 7.481 1.00 0.00 H new ATOM 0 HB2 LEU B 662 -18.355 12.651 6.962 1.00 0.00 H new ATOM 0 HB3 LEU B 662 -16.767 12.675 7.703 1.00 0.00 H new ATOM 0 HG LEU B 662 -16.277 10.706 6.003 1.00 0.00 H new ATOM 0 HD11 LEU B 662 -17.465 11.030 3.870 1.00 0.00 H new ATOM 0 HD12 LEU B 662 -18.569 10.524 5.171 1.00 0.00 H new ATOM 0 HD13 LEU B 662 -18.529 12.225 4.650 1.00 0.00 H new ATOM 0 HD21 LEU B 662 -15.463 12.375 4.386 1.00 0.00 H new ATOM 0 HD22 LEU B 662 -16.449 13.623 5.186 1.00 0.00 H new ATOM 0 HD23 LEU B 662 -15.106 12.852 6.063 1.00 0.00 H new ATOM 1853 N GLU B 663 -16.671 9.289 9.446 1.00 0.00 N ATOM 1854 CA GLU B 663 -15.628 8.838 10.360 1.00 0.00 C ATOM 1855 C GLU B 663 -15.723 7.335 10.597 1.00 0.00 C ATOM 1856 O GLU B 663 -16.485 6.877 11.448 1.00 0.00 O ATOM 1857 CB GLU B 663 -15.731 9.583 11.693 1.00 0.00 C ATOM 1858 CG GLU B 663 -14.433 9.597 12.485 1.00 0.00 C ATOM 1859 CD GLU B 663 -14.438 8.600 13.627 1.00 0.00 C ATOM 1860 OE1 GLU B 663 -15.354 8.670 14.473 1.00 0.00 O ATOM 1861 OE2 GLU B 663 -13.524 7.749 13.676 1.00 0.00 O ATOM 0 H GLU B 663 -17.319 8.558 9.153 1.00 0.00 H new ATOM 0 HA GLU B 663 -14.662 9.055 9.903 1.00 0.00 H new ATOM 0 HB2 GLU B 663 -16.042 10.610 11.502 1.00 0.00 H new ATOM 0 HB3 GLU B 663 -16.511 9.121 12.298 1.00 0.00 H new ATOM 0 HG2 GLU B 663 -13.601 9.375 11.817 1.00 0.00 H new ATOM 0 HG3 GLU B 663 -14.264 10.598 12.882 1.00 0.00 H new ATOM 1868 N VAL B 664 -14.945 6.570 9.837 1.00 0.00 N ATOM 1869 CA VAL B 664 -14.941 5.119 9.964 1.00 0.00 C ATOM 1870 C VAL B 664 -13.583 4.539 9.583 1.00 0.00 C ATOM 1871 O VAL B 664 -13.500 3.502 8.924 1.00 0.00 O ATOM 1872 CB VAL B 664 -16.030 4.474 9.083 1.00 0.00 C ATOM 1873 CG1 VAL B 664 -16.176 2.995 9.407 1.00 0.00 C ATOM 1874 CG2 VAL B 664 -17.356 5.199 9.256 1.00 0.00 C ATOM 0 H VAL B 664 -14.309 6.933 9.127 1.00 0.00 H new ATOM 0 HA VAL B 664 -15.150 4.892 11.009 1.00 0.00 H new ATOM 0 HB VAL B 664 -15.726 4.564 8.040 1.00 0.00 H new ATOM 0 HG11 VAL B 664 -16.949 2.559 8.775 1.00 0.00 H new ATOM 0 HG12 VAL B 664 -15.229 2.487 9.225 1.00 0.00 H new ATOM 0 HG13 VAL B 664 -16.455 2.878 10.454 1.00 0.00 H new ATOM 0 HG21 VAL B 664 -18.112 4.730 8.627 1.00 0.00 H new ATOM 0 HG22 VAL B 664 -17.667 5.144 10.299 1.00 0.00 H new ATOM 0 HG23 VAL B 664 -17.240 6.243 8.966 1.00 0.00 H new ATOM 1884 N LEU B 665 -12.519 5.216 10.002 1.00 0.00 N ATOM 1885 CA LEU B 665 -11.163 4.769 9.705 1.00 0.00 C ATOM 1886 C LEU B 665 -10.303 4.768 10.966 1.00 0.00 C ATOM 1887 O LEU B 665 -10.750 5.184 12.035 1.00 0.00 O ATOM 1888 CB LEU B 665 -10.532 5.668 8.635 1.00 0.00 C ATOM 1889 CG LEU B 665 -10.174 4.966 7.321 1.00 0.00 C ATOM 1890 CD1 LEU B 665 -8.914 4.133 7.487 1.00 0.00 C ATOM 1891 CD2 LEU B 665 -11.331 4.098 6.843 1.00 0.00 C ATOM 0 H LEU B 665 -12.570 6.076 10.548 1.00 0.00 H new ATOM 0 HA LEU B 665 -11.215 3.749 9.325 1.00 0.00 H new ATOM 0 HB2 LEU B 665 -11.221 6.484 8.416 1.00 0.00 H new ATOM 0 HB3 LEU B 665 -9.628 6.116 9.047 1.00 0.00 H new ATOM 0 HG LEU B 665 -9.984 5.729 6.566 1.00 0.00 H new ATOM 0 HD11 LEU B 665 -8.676 3.642 6.544 1.00 0.00 H new ATOM 0 HD12 LEU B 665 -8.086 4.779 7.779 1.00 0.00 H new ATOM 0 HD13 LEU B 665 -9.075 3.379 8.258 1.00 0.00 H new ATOM 0 HD21 LEU B 665 -11.057 3.608 5.909 1.00 0.00 H new ATOM 0 HD22 LEU B 665 -11.555 3.343 7.596 1.00 0.00 H new ATOM 0 HD23 LEU B 665 -12.211 4.721 6.681 1.00 0.00 H new ATOM 1903 N SER B 666 -9.068 4.296 10.832 1.00 0.00 N ATOM 1904 CA SER B 666 -8.144 4.239 11.959 1.00 0.00 C ATOM 1905 C SER B 666 -6.783 3.712 11.515 1.00 0.00 C ATOM 1906 O SER B 666 -6.574 2.503 11.424 1.00 0.00 O ATOM 1907 CB SER B 666 -8.712 3.350 13.067 1.00 0.00 C ATOM 1908 OG SER B 666 -8.226 3.745 14.338 1.00 0.00 O ATOM 0 H SER B 666 -8.684 3.947 9.954 1.00 0.00 H new ATOM 0 HA SER B 666 -8.016 5.250 12.346 1.00 0.00 H new ATOM 0 HB2 SER B 666 -9.801 3.403 13.058 1.00 0.00 H new ATOM 0 HB3 SER B 666 -8.442 2.311 12.878 1.00 0.00 H new ATOM 0 HG SER B 666 -8.605 3.162 15.029 1.00 0.00 H new ATOM 1914 N GLU B 667 -5.862 4.629 11.240 1.00 0.00 N ATOM 1915 CA GLU B 667 -4.519 4.258 10.804 1.00 0.00 C ATOM 1916 C GLU B 667 -3.551 4.186 11.976 1.00 0.00 C ATOM 1917 O GLU B 667 -2.334 4.235 11.801 1.00 0.00 O ATOM 1918 CB GLU B 667 -4.003 5.236 9.747 1.00 0.00 C ATOM 1919 CG GLU B 667 -5.016 5.542 8.656 1.00 0.00 C ATOM 1920 CD GLU B 667 -5.756 6.843 8.896 1.00 0.00 C ATOM 1921 OE1 GLU B 667 -6.339 7.003 9.989 1.00 0.00 O ATOM 1922 OE2 GLU B 667 -5.751 7.704 7.990 1.00 0.00 O ATOM 0 H GLU B 667 -6.020 5.634 11.311 1.00 0.00 H new ATOM 0 HA GLU B 667 -4.582 3.264 10.360 1.00 0.00 H new ATOM 0 HB2 GLU B 667 -3.715 6.167 10.235 1.00 0.00 H new ATOM 0 HB3 GLU B 667 -3.103 4.823 9.291 1.00 0.00 H new ATOM 0 HG2 GLU B 667 -4.505 5.591 7.694 1.00 0.00 H new ATOM 0 HG3 GLU B 667 -5.735 4.725 8.594 1.00 0.00 H new ATOM 1929 N GLU B 668 -4.107 4.068 13.166 1.00 0.00 N ATOM 1930 CA GLU B 668 -3.311 3.984 14.386 1.00 0.00 C ATOM 1931 C GLU B 668 -3.123 2.533 14.828 1.00 0.00 C ATOM 1932 O GLU B 668 -2.403 2.259 15.788 1.00 0.00 O ATOM 1933 CB GLU B 668 -3.975 4.786 15.506 1.00 0.00 C ATOM 1934 CG GLU B 668 -2.985 5.414 16.474 1.00 0.00 C ATOM 1935 CD GLU B 668 -3.626 6.453 17.372 1.00 0.00 C ATOM 1936 OE1 GLU B 668 -3.891 7.574 16.888 1.00 0.00 O ATOM 1937 OE2 GLU B 668 -3.864 6.147 18.559 1.00 0.00 O ATOM 0 H GLU B 668 -5.115 4.027 13.320 1.00 0.00 H new ATOM 0 HA GLU B 668 -2.328 4.405 14.173 1.00 0.00 H new ATOM 0 HB2 GLU B 668 -4.587 5.572 15.065 1.00 0.00 H new ATOM 0 HB3 GLU B 668 -4.648 4.132 16.061 1.00 0.00 H new ATOM 0 HG2 GLU B 668 -2.539 4.633 17.090 1.00 0.00 H new ATOM 0 HG3 GLU B 668 -2.175 5.877 15.910 1.00 0.00 H new ATOM 1944 N LEU B 669 -3.771 1.606 14.124 1.00 0.00 N ATOM 1945 CA LEU B 669 -3.665 0.188 14.453 1.00 0.00 C ATOM 1946 C LEU B 669 -3.100 -0.609 13.279 1.00 0.00 C ATOM 1947 O LEU B 669 -3.268 -1.827 13.208 1.00 0.00 O ATOM 1948 CB LEU B 669 -5.035 -0.373 14.850 1.00 0.00 C ATOM 1949 CG LEU B 669 -6.227 0.202 14.080 1.00 0.00 C ATOM 1950 CD1 LEU B 669 -6.338 -0.439 12.705 1.00 0.00 C ATOM 1951 CD2 LEU B 669 -7.513 0.002 14.869 1.00 0.00 C ATOM 0 H LEU B 669 -4.372 1.811 13.326 1.00 0.00 H new ATOM 0 HA LEU B 669 -2.981 0.092 15.296 1.00 0.00 H new ATOM 0 HB2 LEU B 669 -5.021 -1.454 14.710 1.00 0.00 H new ATOM 0 HB3 LEU B 669 -5.189 -0.191 15.914 1.00 0.00 H new ATOM 0 HG LEU B 669 -6.066 1.272 13.945 1.00 0.00 H new ATOM 0 HD11 LEU B 669 -7.191 -0.016 12.174 1.00 0.00 H new ATOM 0 HD12 LEU B 669 -5.427 -0.246 12.139 1.00 0.00 H new ATOM 0 HD13 LEU B 669 -6.476 -1.515 12.815 1.00 0.00 H new ATOM 0 HD21 LEU B 669 -8.352 0.416 14.309 1.00 0.00 H new ATOM 0 HD22 LEU B 669 -7.677 -1.063 15.034 1.00 0.00 H new ATOM 0 HD23 LEU B 669 -7.433 0.510 15.830 1.00 0.00 H new ATOM 1963 N PHE B 670 -2.430 0.082 12.360 1.00 0.00 N ATOM 1964 CA PHE B 670 -1.844 -0.569 11.195 1.00 0.00 C ATOM 1965 C PHE B 670 -0.503 -1.205 11.544 1.00 0.00 C ATOM 1966 O PHE B 670 0.417 -0.526 12.001 1.00 0.00 O ATOM 1967 CB PHE B 670 -1.664 0.439 10.059 1.00 0.00 C ATOM 1968 CG PHE B 670 -2.884 0.594 9.194 1.00 0.00 C ATOM 1969 CD1 PHE B 670 -4.135 0.765 9.765 1.00 0.00 C ATOM 1970 CD2 PHE B 670 -2.778 0.568 7.813 1.00 0.00 C ATOM 1971 CE1 PHE B 670 -5.259 0.909 8.974 1.00 0.00 C ATOM 1972 CE2 PHE B 670 -3.899 0.710 7.016 1.00 0.00 C ATOM 1973 CZ PHE B 670 -5.140 0.881 7.597 1.00 0.00 C ATOM 0 H PHE B 670 -2.280 1.090 12.401 1.00 0.00 H new ATOM 0 HA PHE B 670 -2.524 -1.356 10.869 1.00 0.00 H new ATOM 0 HB2 PHE B 670 -1.404 1.409 10.483 1.00 0.00 H new ATOM 0 HB3 PHE B 670 -0.825 0.127 9.437 1.00 0.00 H new ATOM 0 HD1 PHE B 670 -4.233 0.786 10.840 1.00 0.00 H new ATOM 0 HD2 PHE B 670 -1.809 0.435 7.354 1.00 0.00 H new ATOM 0 HE1 PHE B 670 -6.228 1.043 9.431 1.00 0.00 H new ATOM 0 HE2 PHE B 670 -3.804 0.687 5.940 1.00 0.00 H new ATOM 0 HZ PHE B 670 -6.017 0.993 6.976 1.00 0.00 H new ATOM 1983 N GLU B 671 -0.397 -2.511 11.324 1.00 0.00 N ATOM 1984 CA GLU B 671 0.832 -3.239 11.614 1.00 0.00 C ATOM 1985 C GLU B 671 1.632 -3.484 10.339 1.00 0.00 C ATOM 1986 O GLU B 671 1.065 -3.773 9.285 1.00 0.00 O ATOM 1987 CB GLU B 671 0.512 -4.572 12.294 1.00 0.00 C ATOM 1988 CG GLU B 671 1.559 -5.004 13.307 1.00 0.00 C ATOM 1989 CD GLU B 671 1.059 -6.100 14.229 1.00 0.00 C ATOM 1990 OE1 GLU B 671 -0.172 -6.203 14.415 1.00 0.00 O ATOM 1991 OE2 GLU B 671 1.898 -6.854 14.764 1.00 0.00 O ATOM 0 H GLU B 671 -1.149 -3.087 10.945 1.00 0.00 H new ATOM 0 HA GLU B 671 1.435 -2.631 12.289 1.00 0.00 H new ATOM 0 HB2 GLU B 671 -0.454 -4.493 12.793 1.00 0.00 H new ATOM 0 HB3 GLU B 671 0.415 -5.345 11.532 1.00 0.00 H new ATOM 0 HG2 GLU B 671 2.447 -5.354 12.780 1.00 0.00 H new ATOM 0 HG3 GLU B 671 1.861 -4.142 13.903 1.00 0.00 H new ATOM 1998 N ASP B 672 2.952 -3.366 10.442 1.00 0.00 N ATOM 1999 CA ASP B 672 3.828 -3.573 9.296 1.00 0.00 C ATOM 2000 C ASP B 672 4.103 -5.058 9.083 1.00 0.00 C ATOM 2001 O ASP B 672 4.755 -5.704 9.903 1.00 0.00 O ATOM 2002 CB ASP B 672 5.146 -2.822 9.490 1.00 0.00 C ATOM 2003 CG ASP B 672 4.935 -1.392 9.947 1.00 0.00 C ATOM 2004 OD1 ASP B 672 4.188 -0.656 9.269 1.00 0.00 O ATOM 2005 OD2 ASP B 672 5.516 -1.008 10.983 1.00 0.00 O ATOM 0 H ASP B 672 3.437 -3.128 11.307 1.00 0.00 H new ATOM 0 HA ASP B 672 3.324 -3.184 8.412 1.00 0.00 H new ATOM 0 HB2 ASP B 672 5.756 -3.349 10.224 1.00 0.00 H new ATOM 0 HB3 ASP B 672 5.703 -2.823 8.553 1.00 0.00 H new ATOM 2010 N VAL B 673 3.601 -5.595 7.974 1.00 0.00 N ATOM 2011 CA VAL B 673 3.793 -7.004 7.651 1.00 0.00 C ATOM 2012 C VAL B 673 5.278 -7.355 7.584 1.00 0.00 C ATOM 2013 O VAL B 673 6.115 -6.495 7.312 1.00 0.00 O ATOM 2014 CB VAL B 673 3.130 -7.367 6.307 1.00 0.00 C ATOM 2015 CG1 VAL B 673 1.630 -7.121 6.367 1.00 0.00 C ATOM 2016 CG2 VAL B 673 3.764 -6.578 5.169 1.00 0.00 C ATOM 0 H VAL B 673 3.058 -5.075 7.285 1.00 0.00 H new ATOM 0 HA VAL B 673 3.322 -7.579 8.448 1.00 0.00 H new ATOM 0 HB VAL B 673 3.292 -8.428 6.117 1.00 0.00 H new ATOM 0 HG11 VAL B 673 1.180 -7.383 5.410 1.00 0.00 H new ATOM 0 HG12 VAL B 673 1.192 -7.735 7.154 1.00 0.00 H new ATOM 0 HG13 VAL B 673 1.442 -6.069 6.581 1.00 0.00 H new ATOM 0 HG21 VAL B 673 3.284 -6.847 4.228 1.00 0.00 H new ATOM 0 HG22 VAL B 673 3.635 -5.511 5.350 1.00 0.00 H new ATOM 0 HG23 VAL B 673 4.827 -6.811 5.113 1.00 0.00 H new ATOM 2026 N PRO B 674 5.627 -8.629 7.831 1.00 0.00 N ATOM 2027 CA PRO B 674 7.018 -9.087 7.795 1.00 0.00 C ATOM 2028 C PRO B 674 7.566 -9.163 6.374 1.00 0.00 C ATOM 2029 O PRO B 674 6.959 -9.776 5.496 1.00 0.00 O ATOM 2030 CB PRO B 674 6.948 -10.481 8.416 1.00 0.00 C ATOM 2031 CG PRO B 674 5.562 -10.950 8.132 1.00 0.00 C ATOM 2032 CD PRO B 674 4.692 -9.722 8.164 1.00 0.00 C ATOM 0 HA PRO B 674 7.686 -8.405 8.321 1.00 0.00 H new ATOM 0 HB2 PRO B 674 7.690 -11.148 7.977 1.00 0.00 H new ATOM 0 HB3 PRO B 674 7.143 -10.448 9.488 1.00 0.00 H new ATOM 0 HG2 PRO B 674 5.508 -11.441 7.160 1.00 0.00 H new ATOM 0 HG3 PRO B 674 5.237 -11.678 8.875 1.00 0.00 H new ATOM 0 HD2 PRO B 674 3.878 -9.788 7.442 1.00 0.00 H new ATOM 0 HD3 PRO B 674 4.238 -9.577 9.144 1.00 0.00 H new ATOM 2040 N THR B 675 8.719 -8.539 6.155 1.00 0.00 N ATOM 2041 CA THR B 675 9.351 -8.537 4.841 1.00 0.00 C ATOM 2042 C THR B 675 10.860 -8.722 4.964 1.00 0.00 C ATOM 2043 O THR B 675 11.493 -8.156 5.856 1.00 0.00 O ATOM 2044 CB THR B 675 9.040 -7.233 4.103 1.00 0.00 C ATOM 2045 OG1 THR B 675 9.013 -6.141 5.005 1.00 0.00 O ATOM 2046 CG2 THR B 675 7.713 -7.260 3.373 1.00 0.00 C ATOM 0 H THR B 675 9.235 -8.028 6.871 1.00 0.00 H new ATOM 0 HA THR B 675 8.947 -9.372 4.269 1.00 0.00 H new ATOM 0 HB THR B 675 9.837 -7.119 3.369 1.00 0.00 H new ATOM 0 HG1 THR B 675 8.814 -5.316 4.514 1.00 0.00 H new ATOM 0 HG21 THR B 675 7.554 -6.305 2.871 1.00 0.00 H new ATOM 0 HG22 THR B 675 7.720 -8.061 2.634 1.00 0.00 H new ATOM 0 HG23 THR B 675 6.908 -7.433 4.087 1.00 0.00 H new ATOM 2054 N LYS B 676 11.429 -9.518 4.064 1.00 0.00 N ATOM 2055 CA LYS B 676 12.865 -9.779 4.071 1.00 0.00 C ATOM 2056 C LYS B 676 13.661 -8.479 4.011 1.00 0.00 C ATOM 2057 O LYS B 676 13.112 -7.418 3.712 1.00 0.00 O ATOM 2058 CB LYS B 676 13.245 -10.680 2.894 1.00 0.00 C ATOM 2059 CG LYS B 676 13.296 -12.156 3.250 1.00 0.00 C ATOM 2060 CD LYS B 676 14.530 -12.489 4.073 1.00 0.00 C ATOM 2061 CE LYS B 676 14.317 -13.734 4.918 1.00 0.00 C ATOM 2062 NZ LYS B 676 15.546 -14.572 4.994 1.00 0.00 N ATOM 0 H LYS B 676 10.918 -9.994 3.320 1.00 0.00 H new ATOM 0 HA LYS B 676 13.110 -10.286 5.004 1.00 0.00 H new ATOM 0 HB2 LYS B 676 12.526 -10.534 2.088 1.00 0.00 H new ATOM 0 HB3 LYS B 676 14.219 -10.373 2.512 1.00 0.00 H new ATOM 0 HG2 LYS B 676 12.401 -12.428 3.809 1.00 0.00 H new ATOM 0 HG3 LYS B 676 13.295 -12.752 2.337 1.00 0.00 H new ATOM 0 HD2 LYS B 676 15.381 -12.640 3.409 1.00 0.00 H new ATOM 0 HD3 LYS B 676 14.775 -11.647 4.720 1.00 0.00 H new ATOM 0 HE2 LYS B 676 14.014 -13.442 5.924 1.00 0.00 H new ATOM 0 HE3 LYS B 676 13.502 -14.323 4.497 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 15.358 -15.411 5.579 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 15.821 -14.872 4.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 16.318 -14.019 5.419 1.00 0.00 H new ATOM 2076 N SER B 677 14.955 -8.569 4.297 1.00 0.00 N ATOM 2077 CA SER B 677 15.826 -7.399 4.274 1.00 0.00 C ATOM 2078 C SER B 677 17.288 -7.804 4.401 1.00 0.00 C ATOM 2079 O SER B 677 18.163 -7.235 3.748 1.00 0.00 O ATOM 2080 CB SER B 677 15.450 -6.434 5.399 1.00 0.00 C ATOM 2081 OG SER B 677 16.063 -5.170 5.213 1.00 0.00 O ATOM 0 H SER B 677 15.424 -9.439 4.547 1.00 0.00 H new ATOM 0 HA SER B 677 15.691 -6.897 3.316 1.00 0.00 H new ATOM 0 HB2 SER B 677 14.367 -6.315 5.433 1.00 0.00 H new ATOM 0 HB3 SER B 677 15.755 -6.852 6.358 1.00 0.00 H new ATOM 0 HG SER B 677 15.806 -4.571 5.945 1.00 0.00 H new ATOM 2087 N GLN B 678 17.541 -8.790 5.246 1.00 0.00 N ATOM 2088 CA GLN B 678 18.895 -9.285 5.470 1.00 0.00 C ATOM 2089 C GLN B 678 19.780 -8.199 6.075 1.00 0.00 C ATOM 2090 O GLN B 678 19.868 -7.091 5.548 1.00 0.00 O ATOM 2091 CB GLN B 678 19.505 -9.783 4.158 1.00 0.00 C ATOM 2092 CG GLN B 678 20.830 -10.505 4.337 1.00 0.00 C ATOM 2093 CD GLN B 678 21.452 -10.920 3.018 1.00 0.00 C ATOM 2094 OE1 GLN B 678 21.806 -12.083 2.825 1.00 0.00 O ATOM 2095 NE2 GLN B 678 21.586 -9.968 2.102 1.00 0.00 N ATOM 0 H GLN B 678 16.824 -9.268 5.792 1.00 0.00 H new ATOM 0 HA GLN B 678 18.837 -10.116 6.173 1.00 0.00 H new ATOM 0 HB2 GLN B 678 18.798 -10.454 3.671 1.00 0.00 H new ATOM 0 HB3 GLN B 678 19.651 -8.934 3.490 1.00 0.00 H new ATOM 0 HG2 GLN B 678 21.523 -9.857 4.873 1.00 0.00 H new ATOM 0 HG3 GLN B 678 20.677 -11.389 4.956 1.00 0.00 H new ATOM 0 HE21 GLN B 678 21.278 -9.017 2.306 1.00 0.00 H new ATOM 0 HE22 GLN B 678 21.997 -10.188 1.194 1.00 0.00 H new ATOM 2104 N ILE B 679 20.434 -8.526 7.185 1.00 0.00 N ATOM 2105 CA ILE B 679 21.312 -7.579 7.862 1.00 0.00 C ATOM 2106 C ILE B 679 22.756 -8.071 7.854 1.00 0.00 C ATOM 2107 O ILE B 679 23.447 -8.024 8.873 1.00 0.00 O ATOM 2108 CB ILE B 679 20.866 -7.340 9.318 1.00 0.00 C ATOM 2109 CG1 ILE B 679 19.372 -7.014 9.375 1.00 0.00 C ATOM 2110 CG2 ILE B 679 21.682 -6.220 9.947 1.00 0.00 C ATOM 2111 CD1 ILE B 679 18.649 -7.685 10.522 1.00 0.00 C ATOM 0 H ILE B 679 20.372 -9.440 7.634 1.00 0.00 H new ATOM 0 HA ILE B 679 21.249 -6.638 7.315 1.00 0.00 H new ATOM 0 HB ILE B 679 21.040 -8.254 9.886 1.00 0.00 H new ATOM 0 HG12 ILE B 679 19.247 -5.934 9.460 1.00 0.00 H new ATOM 0 HG13 ILE B 679 18.907 -7.316 8.437 1.00 0.00 H new ATOM 0 HG21 ILE B 679 21.354 -6.064 10.975 1.00 0.00 H new ATOM 0 HG22 ILE B 679 22.738 -6.491 9.940 1.00 0.00 H new ATOM 0 HG23 ILE B 679 21.539 -5.302 9.377 1.00 0.00 H new ATOM 0 HD11 ILE B 679 17.595 -7.408 10.499 1.00 0.00 H new ATOM 0 HD12 ILE B 679 18.742 -8.767 10.428 1.00 0.00 H new ATOM 0 HD13 ILE B 679 19.088 -7.364 11.467 1.00 0.00 H new ATOM 2123 N SER B 680 23.208 -8.545 6.698 1.00 0.00 N ATOM 2124 CA SER B 680 24.570 -9.047 6.555 1.00 0.00 C ATOM 2125 C SER B 680 25.421 -8.085 5.732 1.00 0.00 C ATOM 2126 O SER B 680 24.856 -7.395 4.859 1.00 0.00 O ATOM 2127 CB SER B 680 24.561 -10.428 5.899 1.00 0.00 C ATOM 2128 OG SER B 680 25.851 -11.014 5.925 1.00 0.00 O ATOM 0 H SER B 680 22.650 -8.592 5.845 1.00 0.00 H new ATOM 0 HA SER B 680 25.007 -9.129 7.550 1.00 0.00 H new ATOM 0 HB2 SER B 680 23.854 -11.075 6.417 1.00 0.00 H new ATOM 0 HB3 SER B 680 24.218 -10.342 4.868 1.00 0.00 H new ATOM 0 HG SER B 680 25.818 -11.897 5.501 1.00 0.00 H new TER 2134 SER B 680