USER MOD reduce.3.24.130724 H: found=0, std=0, add=1096, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1096 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 40 THR OG1 : rot 79:sc= 0.133 USER MOD Set 1.2: A 79 THR OG1 : rot -169:sc= 0.0255 USER MOD Set 1.3: A 127 LYS NZ :NH3+ -146:sc= 1.22 (180deg=1.02) USER MOD Set 2.1: A 90 LYS NZ :NH3+ -170:sc= 1.76 (180deg=0.556) USER MOD Set 2.2: A 91 ASN : amide:sc= 2.05 K(o=3.8,f=-7.9!) USER MOD Set 2.3: A 108 GLN : amide:sc= -0.0612 K(o=3.8,f=-7.9) USER MOD Set 3.1: A 89 HIS : no HE2:sc= 0.178 K(o=-0.35,f=-7.1!) USER MOD Set 3.2: A 107 ASN : amide:sc= -0.973 K(o=-0.35,f=-4.7!) USER MOD Set 3.3: A 114 ASN : amide:sc= 0.447 K(o=-0.35,f=-1.2) USER MOD Set 4.1: A 32 SER OG : rot 96:sc= 2.15 USER MOD Set 4.2: A 37 HIS : no HE2:sc= -0.474 K(o=1.7,f=-9.1!) USER MOD Set 5.1: A 13 ASN : amide:sc= 0 X(o=1.2,f=1.1) USER MOD Set 5.2: A 15 TYR OH : rot 27:sc= 1.23 USER MOD Single : A 1 MET CE :methyl 144:sc= -0.928 (180deg=-2.54!) USER MOD Single : A 1 MET N :NH3+ 154:sc= -1.1! (180deg=-2.24!) USER MOD Single : A 11 GLN : amide:sc= 0.476 X(o=0.48,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0469 USER MOD Single : A 21 ASN :FLIP amide:sc= -0.0309 F(o=-1.3!,f=-0.031) USER MOD Single : A 22 LYS NZ :NH3+ -158:sc= -1.67! (180deg=-3.21!) USER MOD Single : A 23 THR OG1 : rot 160:sc= -1.99! USER MOD Single : A 27 SER OG : rot 84:sc= 1.23 USER MOD Single : A 30 ASN : amide:sc= 0.0432 K(o=0.043,f=-7.3!) USER MOD Single : A 34 MET CE :methyl 174:sc= -0.905 (180deg=-0.914) USER MOD Single : A 39 MET CE :methyl -132:sc= -1.06 (180deg=-7.42!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -71:sc= -1.72! USER MOD Single : A 47 GLN : amide:sc= -0.42 K(o=-0.42,f=-1.3) USER MOD Single : A 48 ASN : amide:sc= 1.21 K(o=1.2,f=-0.16) USER MOD Single : A 52 GLN :FLIP amide:sc= 0.0959 F(o=-1.1,f=0.096) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0.521 USER MOD Single : A 68 ASN : amide:sc= 0.501 K(o=0.5,f=-0.19) USER MOD Single : A 70 LYS NZ :NH3+ -161:sc= -1.11 (180deg=-2.79!) USER MOD Single : A 72 GLN : amide:sc= 0.14 X(o=0.14,f=-0.074) USER MOD Single : A 78 GLN : amide:sc= 1.07 K(o=1.1,f=-0.051) USER MOD Single : A 82 ASN : amide:sc= -0.77 X(o=-0.77,f=-1) USER MOD Single : A 95 ASN : amide:sc= -0.0225 X(o=-0.023,f=0) USER MOD Single : A 96 SER OG : rot -124:sc= 0.252 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 ASN : amide:sc= -1.11 K(o=-1.1,f=-6.6!) USER MOD Single : A 106 TYR OH : rot -146:sc= 1.83 USER MOD Single : A 110 LYS NZ :NH3+ 156:sc= 0.589 (180deg=-0.325) USER MOD Single : A 119 ASN : amide:sc= 0.306 X(o=0.31,f=-0.0026) USER MOD Single : A 123 SER OG : rot 80:sc= -0.379 USER MOD Single : A 131 THR OG1 : rot -78:sc= 0.0384 USER MOD Single : A 132 THR OG1 : rot 180:sc=-0.00939 USER MOD Single : A 134 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 137 ASN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN :FLIP amide:sc= -0.0114 F(o=-1.4!,f=-0.011) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.565 63.560 -15.440 1.00 0.00 N ATOM 2 CA MET A 1 19.174 64.076 -15.476 1.00 0.00 C ATOM 3 C MET A 1 18.312 63.264 -14.526 1.00 0.00 C ATOM 4 O MET A 1 17.941 63.735 -13.454 1.00 0.00 O ATOM 5 CB MET A 1 18.577 64.004 -16.890 1.00 0.00 C ATOM 6 CG MET A 1 19.376 64.741 -17.956 1.00 0.00 C ATOM 7 SD MET A 1 20.920 63.908 -18.369 1.00 0.00 S ATOM 8 CE MET A 1 21.493 64.913 -19.735 1.00 0.00 C ATOM 0 H1 MET A 1 21.038 63.773 -16.342 1.00 0.00 H new ATOM 0 H2 MET A 1 21.084 64.014 -14.661 1.00 0.00 H new ATOM 0 H3 MET A 1 20.550 62.531 -15.292 1.00 0.00 H new ATOM 0 HA MET A 1 19.195 65.122 -15.172 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.490 62.957 -17.180 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.567 64.413 -16.865 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.769 64.839 -18.856 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.595 65.750 -17.607 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.579 64.993 -19.697 1.00 0.00 H new ATOM 0 HE2 MET A 1 21.196 64.451 -20.676 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.053 65.908 -19.664 1.00 0.00 H new ATOM 20 N VAL A 2 17.998 62.039 -14.925 1.00 0.00 N ATOM 21 CA VAL A 2 17.320 61.111 -14.041 1.00 0.00 C ATOM 22 C VAL A 2 18.364 60.403 -13.198 1.00 0.00 C ATOM 23 O VAL A 2 19.229 59.711 -13.726 1.00 0.00 O ATOM 24 CB VAL A 2 16.493 60.073 -14.828 1.00 0.00 C ATOM 25 CG1 VAL A 2 15.799 59.101 -13.885 1.00 0.00 C ATOM 26 CG2 VAL A 2 15.480 60.770 -15.726 1.00 0.00 C ATOM 0 H VAL A 2 18.203 61.669 -15.853 1.00 0.00 H new ATOM 0 HA VAL A 2 16.628 61.669 -13.411 1.00 0.00 H new ATOM 0 HB VAL A 2 17.175 59.500 -15.457 1.00 0.00 H new ATOM 0 HG11 VAL A 2 15.223 58.380 -14.465 1.00 0.00 H new ATOM 0 HG12 VAL A 2 16.546 58.575 -13.291 1.00 0.00 H new ATOM 0 HG13 VAL A 2 15.130 59.651 -13.223 1.00 0.00 H new ATOM 0 HG21 VAL A 2 14.905 60.023 -16.274 1.00 0.00 H new ATOM 0 HG22 VAL A 2 14.806 61.371 -15.116 1.00 0.00 H new ATOM 0 HG23 VAL A 2 16.003 61.415 -16.432 1.00 0.00 H new ATOM 36 N CYS A 3 18.283 60.588 -11.897 1.00 0.00 N ATOM 37 CA CYS A 3 19.314 60.107 -10.996 1.00 0.00 C ATOM 38 C CYS A 3 18.680 59.635 -9.691 1.00 0.00 C ATOM 39 O CYS A 3 17.473 59.805 -9.503 1.00 0.00 O ATOM 40 CB CYS A 3 20.327 61.231 -10.738 1.00 0.00 C ATOM 41 SG CYS A 3 21.137 61.865 -12.242 1.00 0.00 S ATOM 0 H CYS A 3 17.511 61.070 -11.436 1.00 0.00 H new ATOM 0 HA CYS A 3 19.836 59.263 -11.447 1.00 0.00 H new ATOM 0 HB2 CYS A 3 19.819 62.055 -10.237 1.00 0.00 H new ATOM 0 HB3 CYS A 3 21.092 60.865 -10.053 1.00 0.00 H new ATOM 46 N PRO A 4 19.464 59.007 -8.786 1.00 0.00 N ATOM 47 CA PRO A 4 18.968 58.588 -7.470 1.00 0.00 C ATOM 48 C PRO A 4 18.320 59.738 -6.697 1.00 0.00 C ATOM 49 O PRO A 4 18.558 60.912 -6.988 1.00 0.00 O ATOM 50 CB PRO A 4 20.223 58.094 -6.749 1.00 0.00 C ATOM 51 CG PRO A 4 21.156 57.695 -7.839 1.00 0.00 C ATOM 52 CD PRO A 4 20.878 58.629 -8.984 1.00 0.00 C ATOM 0 HA PRO A 4 18.189 57.831 -7.555 1.00 0.00 H new ATOM 0 HB2 PRO A 4 20.655 58.877 -6.125 1.00 0.00 H new ATOM 0 HB3 PRO A 4 19.997 57.253 -6.094 1.00 0.00 H new ATOM 0 HG2 PRO A 4 22.193 57.774 -7.514 1.00 0.00 H new ATOM 0 HG3 PRO A 4 20.993 56.658 -8.133 1.00 0.00 H new ATOM 0 HD2 PRO A 4 21.533 59.500 -8.960 1.00 0.00 H new ATOM 0 HD3 PRO A 4 21.032 58.141 -9.946 1.00 0.00 H new ATOM 60 N ILE A 5 17.515 59.383 -5.706 1.00 0.00 N ATOM 61 CA ILE A 5 16.723 60.350 -4.954 1.00 0.00 C ATOM 62 C ILE A 5 17.605 61.406 -4.278 1.00 0.00 C ATOM 63 O ILE A 5 18.651 61.085 -3.714 1.00 0.00 O ATOM 64 CB ILE A 5 15.836 59.650 -3.884 1.00 0.00 C ATOM 65 CG1 ILE A 5 14.771 58.757 -4.542 1.00 0.00 C ATOM 66 CG2 ILE A 5 15.164 60.672 -2.976 1.00 0.00 C ATOM 67 CD1 ILE A 5 15.299 57.440 -5.074 1.00 0.00 C ATOM 0 H ILE A 5 17.391 58.418 -5.400 1.00 0.00 H new ATOM 0 HA ILE A 5 16.077 60.849 -5.676 1.00 0.00 H new ATOM 0 HB ILE A 5 16.491 59.022 -3.280 1.00 0.00 H new ATOM 0 HG12 ILE A 5 13.986 58.552 -3.814 1.00 0.00 H new ATOM 0 HG13 ILE A 5 14.309 59.307 -5.362 1.00 0.00 H new ATOM 0 HG21 ILE A 5 14.550 60.155 -2.238 1.00 0.00 H new ATOM 0 HG22 ILE A 5 15.926 61.262 -2.466 1.00 0.00 H new ATOM 0 HG23 ILE A 5 14.534 61.331 -3.574 1.00 0.00 H new ATOM 0 HD11 ILE A 5 14.482 56.874 -5.521 1.00 0.00 H new ATOM 0 HD12 ILE A 5 16.062 57.632 -5.828 1.00 0.00 H new ATOM 0 HD13 ILE A 5 15.734 56.865 -4.256 1.00 0.00 H new ATOM 79 N ASP A 6 17.170 62.666 -4.401 1.00 0.00 N ATOM 80 CA ASP A 6 17.769 63.823 -3.715 1.00 0.00 C ATOM 81 C ASP A 6 19.015 64.347 -4.435 1.00 0.00 C ATOM 82 O ASP A 6 19.422 65.492 -4.228 1.00 0.00 O ATOM 83 CB ASP A 6 18.078 63.521 -2.240 1.00 0.00 C ATOM 84 CG ASP A 6 18.394 64.779 -1.452 1.00 0.00 C ATOM 85 OD1 ASP A 6 17.451 65.548 -1.145 1.00 0.00 O ATOM 86 OD2 ASP A 6 19.580 65.024 -1.163 1.00 0.00 O ATOM 0 H ASP A 6 16.377 62.917 -4.991 1.00 0.00 H new ATOM 0 HA ASP A 6 17.019 64.613 -3.744 1.00 0.00 H new ATOM 0 HB2 ASP A 6 17.225 63.016 -1.788 1.00 0.00 H new ATOM 0 HB3 ASP A 6 18.923 62.835 -2.180 1.00 0.00 H new ATOM 91 N TRP A 7 19.609 63.532 -5.300 1.00 0.00 N ATOM 92 CA TRP A 7 20.738 63.985 -6.109 1.00 0.00 C ATOM 93 C TRP A 7 20.317 65.184 -6.962 1.00 0.00 C ATOM 94 O TRP A 7 19.388 65.090 -7.765 1.00 0.00 O ATOM 95 CB TRP A 7 21.262 62.858 -7.007 1.00 0.00 C ATOM 96 CG TRP A 7 21.985 61.761 -6.272 1.00 0.00 C ATOM 97 CD1 TRP A 7 21.467 60.920 -5.329 1.00 0.00 C ATOM 98 CD2 TRP A 7 23.358 61.377 -6.438 1.00 0.00 C ATOM 99 NE1 TRP A 7 22.431 60.036 -4.902 1.00 0.00 N ATOM 100 CE2 TRP A 7 23.600 60.296 -5.567 1.00 0.00 C ATOM 101 CE3 TRP A 7 24.404 61.842 -7.239 1.00 0.00 C ATOM 102 CZ2 TRP A 7 24.849 59.674 -5.479 1.00 0.00 C ATOM 103 CZ3 TRP A 7 25.638 61.227 -7.149 1.00 0.00 C ATOM 104 CH2 TRP A 7 25.850 60.153 -6.277 1.00 0.00 C ATOM 0 H TRP A 7 19.332 62.563 -5.459 1.00 0.00 H new ATOM 0 HA TRP A 7 21.543 64.283 -5.437 1.00 0.00 H new ATOM 0 HB2 TRP A 7 20.423 62.423 -7.550 1.00 0.00 H new ATOM 0 HB3 TRP A 7 21.935 63.286 -7.750 1.00 0.00 H new ATOM 0 HD1 TRP A 7 20.449 60.945 -4.970 1.00 0.00 H new ATOM 0 HE1 TRP A 7 22.297 59.305 -4.203 1.00 0.00 H new ATOM 0 HE3 TRP A 7 24.251 62.668 -7.917 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 25.017 58.846 -4.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 26.453 61.581 -7.762 1.00 0.00 H new ATOM 0 HH2 TRP A 7 26.826 59.693 -6.234 1.00 0.00 H new ATOM 115 N ARG A 8 21.003 66.308 -6.782 1.00 0.00 N ATOM 116 CA ARG A 8 20.639 67.551 -7.455 1.00 0.00 C ATOM 117 C ARG A 8 20.989 67.504 -8.929 1.00 0.00 C ATOM 118 O ARG A 8 22.152 67.629 -9.304 1.00 0.00 O ATOM 119 CB ARG A 8 21.334 68.748 -6.795 1.00 0.00 C ATOM 120 CG ARG A 8 20.435 69.529 -5.854 1.00 0.00 C ATOM 121 CD ARG A 8 19.675 68.600 -4.935 1.00 0.00 C ATOM 122 NE ARG A 8 18.802 69.314 -4.003 1.00 0.00 N ATOM 123 CZ ARG A 8 18.239 68.739 -2.938 1.00 0.00 C ATOM 124 NH1 ARG A 8 18.466 67.463 -2.682 1.00 0.00 N ATOM 125 NH2 ARG A 8 17.454 69.441 -2.129 1.00 0.00 N ATOM 0 H ARG A 8 21.818 66.384 -6.173 1.00 0.00 H new ATOM 0 HA ARG A 8 19.559 67.669 -7.361 1.00 0.00 H new ATOM 0 HB2 ARG A 8 22.204 68.393 -6.242 1.00 0.00 H new ATOM 0 HB3 ARG A 8 21.702 69.418 -7.572 1.00 0.00 H new ATOM 0 HG2 ARG A 8 21.035 70.221 -5.263 1.00 0.00 H new ATOM 0 HG3 ARG A 8 19.733 70.130 -6.432 1.00 0.00 H new ATOM 0 HD2 ARG A 8 19.076 67.914 -5.534 1.00 0.00 H new ATOM 0 HD3 ARG A 8 20.384 67.995 -4.370 1.00 0.00 H new ATOM 0 HE ARG A 8 18.614 70.302 -4.176 1.00 0.00 H new ATOM 0 HH11 ARG A 8 19.071 66.919 -3.298 1.00 0.00 H new ATOM 0 HH12 ARG A 8 18.037 67.022 -1.869 1.00 0.00 H new ATOM 0 HH21 ARG A 8 17.277 70.427 -2.319 1.00 0.00 H new ATOM 0 HH22 ARG A 8 17.028 68.994 -1.317 1.00 0.00 H new ATOM 139 N ALA A 9 19.979 67.306 -9.753 1.00 0.00 N ATOM 140 CA ALA A 9 20.166 67.282 -11.190 1.00 0.00 C ATOM 141 C ALA A 9 20.368 68.692 -11.723 1.00 0.00 C ATOM 142 O ALA A 9 19.514 69.561 -11.554 1.00 0.00 O ATOM 143 CB ALA A 9 18.973 66.623 -11.866 1.00 0.00 C ATOM 0 H ALA A 9 19.016 67.159 -9.450 1.00 0.00 H new ATOM 0 HA ALA A 9 21.059 66.698 -11.415 1.00 0.00 H new ATOM 0 HB1 ALA A 9 19.127 66.612 -12.945 1.00 0.00 H new ATOM 0 HB2 ALA A 9 18.869 65.600 -11.504 1.00 0.00 H new ATOM 0 HB3 ALA A 9 18.068 67.184 -11.634 1.00 0.00 H new ATOM 149 N PHE A 10 21.505 68.913 -12.358 1.00 0.00 N ATOM 150 CA PHE A 10 21.802 70.196 -12.959 1.00 0.00 C ATOM 151 C PHE A 10 22.220 69.994 -14.409 1.00 0.00 C ATOM 152 O PHE A 10 23.329 69.525 -14.691 1.00 0.00 O ATOM 153 CB PHE A 10 22.893 70.932 -12.173 1.00 0.00 C ATOM 154 CG PHE A 10 23.060 72.366 -12.590 1.00 0.00 C ATOM 155 CD1 PHE A 10 22.220 73.347 -12.085 1.00 0.00 C ATOM 156 CD2 PHE A 10 24.047 72.734 -13.491 1.00 0.00 C ATOM 157 CE1 PHE A 10 22.363 74.665 -12.469 1.00 0.00 C ATOM 158 CE2 PHE A 10 24.192 74.052 -13.879 1.00 0.00 C ATOM 159 CZ PHE A 10 23.350 75.018 -13.367 1.00 0.00 C ATOM 0 H PHE A 10 22.240 68.215 -12.470 1.00 0.00 H new ATOM 0 HA PHE A 10 20.905 70.815 -12.931 1.00 0.00 H new ATOM 0 HB2 PHE A 10 22.653 70.895 -11.110 1.00 0.00 H new ATOM 0 HB3 PHE A 10 23.841 70.410 -12.304 1.00 0.00 H new ATOM 0 HD1 PHE A 10 21.445 73.077 -11.383 1.00 0.00 H new ATOM 0 HD2 PHE A 10 24.710 71.982 -13.894 1.00 0.00 H new ATOM 0 HE1 PHE A 10 21.703 75.420 -12.067 1.00 0.00 H new ATOM 0 HE2 PHE A 10 24.964 74.326 -14.583 1.00 0.00 H new ATOM 0 HZ PHE A 10 23.463 76.049 -13.669 1.00 0.00 H new ATOM 169 N GLN A 11 21.298 70.324 -15.314 1.00 0.00 N ATOM 170 CA GLN A 11 21.488 70.159 -16.755 1.00 0.00 C ATOM 171 C GLN A 11 21.703 68.694 -17.130 1.00 0.00 C ATOM 172 O GLN A 11 20.767 68.000 -17.524 1.00 0.00 O ATOM 173 CB GLN A 11 22.653 71.010 -17.273 1.00 0.00 C ATOM 174 CG GLN A 11 22.433 72.506 -17.122 1.00 0.00 C ATOM 175 CD GLN A 11 23.524 73.319 -17.789 1.00 0.00 C ATOM 176 OE1 GLN A 11 23.419 73.674 -18.959 1.00 0.00 O ATOM 177 NE2 GLN A 11 24.584 73.611 -17.053 1.00 0.00 N ATOM 0 H GLN A 11 20.390 70.717 -15.065 1.00 0.00 H new ATOM 0 HA GLN A 11 20.571 70.505 -17.233 1.00 0.00 H new ATOM 0 HB2 GLN A 11 23.561 70.730 -16.739 1.00 0.00 H new ATOM 0 HB3 GLN A 11 22.819 70.781 -18.326 1.00 0.00 H new ATOM 0 HG2 GLN A 11 21.468 72.774 -17.553 1.00 0.00 H new ATOM 0 HG3 GLN A 11 22.390 72.759 -16.063 1.00 0.00 H new ATOM 0 HE21 GLN A 11 24.634 73.298 -16.084 1.00 0.00 H new ATOM 0 HE22 GLN A 11 25.351 74.150 -17.455 1.00 0.00 H new ATOM 186 N SER A 12 22.931 68.223 -16.992 1.00 0.00 N ATOM 187 CA SER A 12 23.275 66.874 -17.394 1.00 0.00 C ATOM 188 C SER A 12 23.575 65.988 -16.187 1.00 0.00 C ATOM 189 O SER A 12 23.199 64.816 -16.162 1.00 0.00 O ATOM 190 CB SER A 12 24.484 66.908 -18.329 1.00 0.00 C ATOM 191 OG SER A 12 24.259 67.796 -19.409 1.00 0.00 O ATOM 0 H SER A 12 23.707 68.759 -16.603 1.00 0.00 H new ATOM 0 HA SER A 12 22.418 66.448 -17.915 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.370 67.219 -17.775 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.683 65.907 -18.711 1.00 0.00 H new ATOM 0 HG SER A 12 25.045 67.805 -19.995 1.00 0.00 H new ATOM 197 N ASN A 13 24.216 66.557 -15.176 1.00 0.00 N ATOM 198 CA ASN A 13 24.729 65.761 -14.068 1.00 0.00 C ATOM 199 C ASN A 13 23.815 65.871 -12.857 1.00 0.00 C ATOM 200 O ASN A 13 22.868 66.652 -12.857 1.00 0.00 O ATOM 201 CB ASN A 13 26.142 66.214 -13.678 1.00 0.00 C ATOM 202 CG ASN A 13 27.112 66.212 -14.846 1.00 0.00 C ATOM 203 OD1 ASN A 13 27.682 65.179 -15.193 1.00 0.00 O ATOM 204 ND2 ASN A 13 27.342 67.379 -15.430 1.00 0.00 N ATOM 0 H ASN A 13 24.393 67.559 -15.099 1.00 0.00 H new ATOM 0 HA ASN A 13 24.765 64.723 -14.398 1.00 0.00 H new ATOM 0 HB2 ASN A 13 26.092 67.218 -13.257 1.00 0.00 H new ATOM 0 HB3 ASN A 13 26.524 65.559 -12.895 1.00 0.00 H new ATOM 0 HD21 ASN A 13 28.012 67.443 -16.196 1.00 0.00 H new ATOM 0 HD22 ASN A 13 26.849 68.214 -15.113 1.00 0.00 H new ATOM 211 N CYS A 14 24.102 65.082 -11.832 1.00 0.00 N ATOM 212 CA CYS A 14 23.355 65.140 -10.581 1.00 0.00 C ATOM 213 C CYS A 14 24.324 65.105 -9.405 1.00 0.00 C ATOM 214 O CYS A 14 25.223 64.270 -9.365 1.00 0.00 O ATOM 215 CB CYS A 14 22.364 63.978 -10.491 1.00 0.00 C ATOM 216 SG CYS A 14 21.227 63.854 -11.906 1.00 0.00 S ATOM 0 H CYS A 14 24.851 64.390 -11.841 1.00 0.00 H new ATOM 0 HA CYS A 14 22.789 66.071 -10.550 1.00 0.00 H new ATOM 0 HB2 CYS A 14 22.922 63.046 -10.405 1.00 0.00 H new ATOM 0 HB3 CYS A 14 21.779 64.085 -9.578 1.00 0.00 H new ATOM 221 N TYR A 15 24.150 66.019 -8.460 1.00 0.00 N ATOM 222 CA TYR A 15 25.110 66.196 -7.378 1.00 0.00 C ATOM 223 C TYR A 15 24.485 65.927 -6.019 1.00 0.00 C ATOM 224 O TYR A 15 23.460 66.511 -5.670 1.00 0.00 O ATOM 225 CB TYR A 15 25.677 67.617 -7.423 1.00 0.00 C ATOM 226 CG TYR A 15 26.319 67.941 -8.748 1.00 0.00 C ATOM 227 CD1 TYR A 15 25.556 68.390 -9.819 1.00 0.00 C ATOM 228 CD2 TYR A 15 27.679 67.762 -8.937 1.00 0.00 C ATOM 229 CE1 TYR A 15 26.140 68.645 -11.048 1.00 0.00 C ATOM 230 CE2 TYR A 15 28.270 68.025 -10.156 1.00 0.00 C ATOM 231 CZ TYR A 15 27.499 68.461 -11.207 1.00 0.00 C ATOM 232 OH TYR A 15 28.088 68.689 -12.428 1.00 0.00 O ATOM 0 H TYR A 15 23.351 66.651 -8.421 1.00 0.00 H new ATOM 0 HA TYR A 15 25.913 65.473 -7.518 1.00 0.00 H new ATOM 0 HB2 TYR A 15 24.877 68.330 -7.227 1.00 0.00 H new ATOM 0 HB3 TYR A 15 26.413 67.736 -6.628 1.00 0.00 H new ATOM 0 HD1 TYR A 15 24.494 68.542 -9.691 1.00 0.00 H new ATOM 0 HD2 TYR A 15 28.287 67.411 -8.117 1.00 0.00 H new ATOM 0 HE1 TYR A 15 25.537 68.985 -11.877 1.00 0.00 H new ATOM 0 HE2 TYR A 15 29.334 67.889 -10.284 1.00 0.00 H new ATOM 0 HH TYR A 15 27.562 69.349 -12.927 1.00 0.00 H new ATOM 242 N PHE A 16 25.105 65.043 -5.260 1.00 0.00 N ATOM 243 CA PHE A 16 24.646 64.731 -3.916 1.00 0.00 C ATOM 244 C PHE A 16 25.659 65.231 -2.891 1.00 0.00 C ATOM 245 O PHE A 16 26.827 64.829 -2.918 1.00 0.00 O ATOM 246 CB PHE A 16 24.437 63.225 -3.761 1.00 0.00 C ATOM 247 CG PHE A 16 23.816 62.829 -2.451 1.00 0.00 C ATOM 248 CD1 PHE A 16 22.485 63.113 -2.186 1.00 0.00 C ATOM 249 CD2 PHE A 16 24.560 62.168 -1.488 1.00 0.00 C ATOM 250 CE1 PHE A 16 21.911 62.747 -0.985 1.00 0.00 C ATOM 251 CE2 PHE A 16 23.990 61.800 -0.284 1.00 0.00 C ATOM 252 CZ PHE A 16 22.664 62.090 -0.032 1.00 0.00 C ATOM 0 H PHE A 16 25.933 64.524 -5.552 1.00 0.00 H new ATOM 0 HA PHE A 16 23.693 65.232 -3.745 1.00 0.00 H new ATOM 0 HB2 PHE A 16 23.804 62.870 -4.574 1.00 0.00 H new ATOM 0 HB3 PHE A 16 25.399 62.722 -3.863 1.00 0.00 H new ATOM 0 HD1 PHE A 16 21.891 63.626 -2.927 1.00 0.00 H new ATOM 0 HD2 PHE A 16 25.597 61.937 -1.680 1.00 0.00 H new ATOM 0 HE1 PHE A 16 20.873 62.974 -0.791 1.00 0.00 H new ATOM 0 HE2 PHE A 16 24.581 61.286 0.459 1.00 0.00 H new ATOM 0 HZ PHE A 16 22.217 61.804 0.908 1.00 0.00 H new ATOM 262 N PRO A 17 25.235 66.138 -2.000 1.00 0.00 N ATOM 263 CA PRO A 17 26.080 66.670 -0.940 1.00 0.00 C ATOM 264 C PRO A 17 26.075 65.783 0.300 1.00 0.00 C ATOM 265 O PRO A 17 25.023 65.333 0.750 1.00 0.00 O ATOM 266 CB PRO A 17 25.444 68.032 -0.618 1.00 0.00 C ATOM 267 CG PRO A 17 24.186 68.121 -1.433 1.00 0.00 C ATOM 268 CD PRO A 17 23.902 66.741 -1.957 1.00 0.00 C ATOM 0 HA PRO A 17 27.123 66.734 -1.249 1.00 0.00 H new ATOM 0 HB2 PRO A 17 25.223 68.115 0.446 1.00 0.00 H new ATOM 0 HB3 PRO A 17 26.125 68.846 -0.866 1.00 0.00 H new ATOM 0 HG2 PRO A 17 23.357 68.480 -0.824 1.00 0.00 H new ATOM 0 HG3 PRO A 17 24.308 68.828 -2.254 1.00 0.00 H new ATOM 0 HD2 PRO A 17 23.228 66.189 -1.302 1.00 0.00 H new ATOM 0 HD3 PRO A 17 23.437 66.769 -2.943 1.00 0.00 H new ATOM 276 N LEU A 18 27.253 65.527 0.847 1.00 0.00 N ATOM 277 CA LEU A 18 27.364 64.746 2.064 1.00 0.00 C ATOM 278 C LEU A 18 28.096 65.541 3.132 1.00 0.00 C ATOM 279 O LEU A 18 29.090 66.212 2.850 1.00 0.00 O ATOM 280 CB LEU A 18 28.112 63.426 1.820 1.00 0.00 C ATOM 281 CG LEU A 18 27.503 62.489 0.772 1.00 0.00 C ATOM 282 CD1 LEU A 18 28.001 62.836 -0.624 1.00 0.00 C ATOM 283 CD2 LEU A 18 27.821 61.041 1.109 1.00 0.00 C ATOM 0 H LEU A 18 28.143 65.849 0.467 1.00 0.00 H new ATOM 0 HA LEU A 18 26.352 64.516 2.399 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.133 63.661 1.518 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.175 62.888 2.766 1.00 0.00 H new ATOM 0 HG LEU A 18 26.421 62.620 0.785 1.00 0.00 H new ATOM 0 HD11 LEU A 18 27.554 62.156 -1.349 1.00 0.00 H new ATOM 0 HD12 LEU A 18 27.720 63.861 -0.866 1.00 0.00 H new ATOM 0 HD13 LEU A 18 29.086 62.740 -0.658 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.382 60.387 0.356 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.902 60.900 1.126 1.00 0.00 H new ATOM 0 HD23 LEU A 18 27.408 60.796 2.087 1.00 0.00 H new ATOM 295 N THR A 19 27.607 65.455 4.359 1.00 0.00 N ATOM 296 CA THR A 19 28.275 66.068 5.491 1.00 0.00 C ATOM 297 C THR A 19 29.282 65.095 6.088 1.00 0.00 C ATOM 298 O THR A 19 30.033 65.434 7.003 1.00 0.00 O ATOM 299 CB THR A 19 27.256 66.500 6.561 1.00 0.00 C ATOM 300 OG1 THR A 19 26.275 65.467 6.737 1.00 0.00 O ATOM 301 CG2 THR A 19 26.569 67.799 6.165 1.00 0.00 C ATOM 0 H THR A 19 26.745 64.963 4.595 1.00 0.00 H new ATOM 0 HA THR A 19 28.800 66.957 5.142 1.00 0.00 H new ATOM 0 HB THR A 19 27.788 66.665 7.498 1.00 0.00 H new ATOM 0 HG1 THR A 19 25.628 65.743 7.420 1.00 0.00 H new ATOM 0 HG21 THR A 19 25.854 68.083 6.937 1.00 0.00 H new ATOM 0 HG22 THR A 19 27.315 68.586 6.054 1.00 0.00 H new ATOM 0 HG23 THR A 19 26.045 67.660 5.219 1.00 0.00 H new ATOM 309 N ASP A 20 29.280 63.881 5.540 1.00 0.00 N ATOM 310 CA ASP A 20 30.199 62.822 5.945 1.00 0.00 C ATOM 311 C ASP A 20 31.648 63.270 5.825 1.00 0.00 C ATOM 312 O ASP A 20 32.021 63.941 4.865 1.00 0.00 O ATOM 313 CB ASP A 20 29.961 61.576 5.085 1.00 0.00 C ATOM 314 CG ASP A 20 31.124 60.603 5.103 1.00 0.00 C ATOM 315 OD1 ASP A 20 31.285 59.877 6.104 1.00 0.00 O ATOM 316 OD2 ASP A 20 31.889 60.557 4.109 1.00 0.00 O ATOM 0 H ASP A 20 28.637 63.604 4.798 1.00 0.00 H new ATOM 0 HA ASP A 20 30.008 62.586 6.992 1.00 0.00 H new ATOM 0 HB2 ASP A 20 29.064 61.066 5.437 1.00 0.00 H new ATOM 0 HB3 ASP A 20 29.770 61.884 4.057 1.00 0.00 H new ATOM 321 N ASN A 21 32.449 62.898 6.810 1.00 0.00 N ATOM 322 CA ASN A 21 33.861 63.254 6.823 1.00 0.00 C ATOM 323 C ASN A 21 34.686 62.150 6.185 1.00 0.00 C ATOM 324 O ASN A 21 34.875 61.077 6.765 1.00 0.00 O ATOM 325 CB ASN A 21 34.350 63.524 8.250 1.00 0.00 C ATOM 326 CG ASN A 21 33.726 64.764 8.867 1.00 0.00 C ATOM 327 OD1 ASN A 21 33.408 65.749 8.040 1.00 0.00 O flip ATOM 328 ND2 ASN A 21 33.534 64.837 10.077 1.00 0.00 N flip ATOM 0 H ASN A 21 32.146 62.348 7.614 1.00 0.00 H new ATOM 0 HA ASN A 21 33.985 64.170 6.245 1.00 0.00 H new ATOM 0 HB2 ASN A 21 34.123 62.660 8.875 1.00 0.00 H new ATOM 0 HB3 ASN A 21 35.434 63.636 8.242 1.00 0.00 H new ATOM 0 HD21 ASN A 21 33.792 64.058 10.682 1.00 0.00 H new ATOM 0 HD22 ASN A 21 33.116 65.677 10.477 1.00 0.00 H new ATOM 335 N LYS A 22 35.142 62.401 4.975 1.00 0.00 N ATOM 336 CA LYS A 22 35.913 61.433 4.231 1.00 0.00 C ATOM 337 C LYS A 22 37.054 62.129 3.511 1.00 0.00 C ATOM 338 O LYS A 22 36.970 63.319 3.218 1.00 0.00 O ATOM 339 CB LYS A 22 34.995 60.740 3.236 1.00 0.00 C ATOM 340 CG LYS A 22 35.480 59.380 2.790 1.00 0.00 C ATOM 341 CD LYS A 22 35.630 58.404 3.957 1.00 0.00 C ATOM 342 CE LYS A 22 34.289 57.976 4.548 1.00 0.00 C ATOM 343 NZ LYS A 22 33.661 59.042 5.372 1.00 0.00 N ATOM 0 H LYS A 22 34.988 63.281 4.483 1.00 0.00 H new ATOM 0 HA LYS A 22 36.338 60.691 4.907 1.00 0.00 H new ATOM 0 HB2 LYS A 22 34.007 60.632 3.684 1.00 0.00 H new ATOM 0 HB3 LYS A 22 34.880 61.378 2.360 1.00 0.00 H new ATOM 0 HG2 LYS A 22 34.780 58.968 2.063 1.00 0.00 H new ATOM 0 HG3 LYS A 22 36.439 59.487 2.284 1.00 0.00 H new ATOM 0 HD2 LYS A 22 36.171 57.520 3.618 1.00 0.00 H new ATOM 0 HD3 LYS A 22 36.234 58.868 4.737 1.00 0.00 H new ATOM 0 HE2 LYS A 22 33.612 57.700 3.740 1.00 0.00 H new ATOM 0 HE3 LYS A 22 34.434 57.086 5.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 32.982 58.615 6.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 34.397 59.545 5.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 33.165 59.713 4.752 1.00 0.00 H new ATOM 357 N THR A 23 38.118 61.394 3.241 1.00 0.00 N ATOM 358 CA THR A 23 39.250 61.953 2.523 1.00 0.00 C ATOM 359 C THR A 23 38.948 61.972 1.034 1.00 0.00 C ATOM 360 O THR A 23 37.979 61.355 0.593 1.00 0.00 O ATOM 361 CB THR A 23 40.541 61.149 2.767 1.00 0.00 C ATOM 362 OG1 THR A 23 40.407 59.833 2.220 1.00 0.00 O ATOM 363 CG2 THR A 23 40.850 61.052 4.249 1.00 0.00 C ATOM 0 H THR A 23 38.222 60.415 3.506 1.00 0.00 H new ATOM 0 HA THR A 23 39.409 62.966 2.894 1.00 0.00 H new ATOM 0 HB THR A 23 41.362 61.670 2.275 1.00 0.00 H new ATOM 0 HG1 THR A 23 41.296 59.443 2.085 1.00 0.00 H new ATOM 0 HG21 THR A 23 41.766 60.479 4.393 1.00 0.00 H new ATOM 0 HG22 THR A 23 40.979 62.053 4.660 1.00 0.00 H new ATOM 0 HG23 THR A 23 40.027 60.554 4.760 1.00 0.00 H new ATOM 371 N TRP A 24 39.773 62.659 0.262 1.00 0.00 N ATOM 372 CA TRP A 24 39.564 62.763 -1.176 1.00 0.00 C ATOM 373 C TRP A 24 39.584 61.377 -1.819 1.00 0.00 C ATOM 374 O TRP A 24 38.777 61.073 -2.696 1.00 0.00 O ATOM 375 CB TRP A 24 40.647 63.646 -1.794 1.00 0.00 C ATOM 376 CG TRP A 24 40.303 64.153 -3.158 1.00 0.00 C ATOM 377 CD1 TRP A 24 39.523 65.230 -3.448 1.00 0.00 C ATOM 378 CD2 TRP A 24 40.730 63.611 -4.411 1.00 0.00 C ATOM 379 NE1 TRP A 24 39.437 65.396 -4.806 1.00 0.00 N ATOM 380 CE2 TRP A 24 40.168 64.415 -5.421 1.00 0.00 C ATOM 381 CE3 TRP A 24 41.530 62.528 -4.780 1.00 0.00 C ATOM 382 CZ2 TRP A 24 40.382 64.168 -6.774 1.00 0.00 C ATOM 383 CZ3 TRP A 24 41.742 62.284 -6.123 1.00 0.00 C ATOM 384 CH2 TRP A 24 41.170 63.101 -7.105 1.00 0.00 C ATOM 0 H TRP A 24 40.596 63.155 0.606 1.00 0.00 H new ATOM 0 HA TRP A 24 38.589 63.214 -1.358 1.00 0.00 H new ATOM 0 HB2 TRP A 24 40.830 64.495 -1.136 1.00 0.00 H new ATOM 0 HB3 TRP A 24 41.577 63.080 -1.850 1.00 0.00 H new ATOM 0 HD1 TRP A 24 39.042 65.861 -2.715 1.00 0.00 H new ATOM 0 HE1 TRP A 24 38.913 66.131 -5.281 1.00 0.00 H new ATOM 0 HE3 TRP A 24 41.975 61.892 -4.029 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 39.942 64.796 -7.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 42.359 61.449 -6.420 1.00 0.00 H new ATOM 0 HH2 TRP A 24 41.355 62.884 -8.147 1.00 0.00 H new ATOM 395 N ALA A 25 40.493 60.531 -1.345 1.00 0.00 N ATOM 396 CA ALA A 25 40.647 59.188 -1.884 1.00 0.00 C ATOM 397 C ALA A 25 39.471 58.295 -1.496 1.00 0.00 C ATOM 398 O ALA A 25 38.882 57.630 -2.348 1.00 0.00 O ATOM 399 CB ALA A 25 41.955 58.577 -1.407 1.00 0.00 C ATOM 0 H ALA A 25 41.136 60.755 -0.585 1.00 0.00 H new ATOM 0 HA ALA A 25 40.665 59.262 -2.971 1.00 0.00 H new ATOM 0 HB1 ALA A 25 42.058 57.572 -1.817 1.00 0.00 H new ATOM 0 HB2 ALA A 25 42.789 59.194 -1.743 1.00 0.00 H new ATOM 0 HB3 ALA A 25 41.957 58.526 -0.318 1.00 0.00 H new ATOM 405 N GLU A 26 39.120 58.297 -0.215 1.00 0.00 N ATOM 406 CA GLU A 26 38.048 57.439 0.277 1.00 0.00 C ATOM 407 C GLU A 26 36.695 57.907 -0.248 1.00 0.00 C ATOM 408 O GLU A 26 35.771 57.110 -0.399 1.00 0.00 O ATOM 409 CB GLU A 26 38.034 57.397 1.804 1.00 0.00 C ATOM 410 CG GLU A 26 39.357 56.984 2.420 1.00 0.00 C ATOM 411 CD GLU A 26 39.948 55.759 1.758 1.00 0.00 C ATOM 412 OE1 GLU A 26 39.532 54.629 2.094 1.00 0.00 O ATOM 413 OE2 GLU A 26 40.823 55.923 0.887 1.00 0.00 O ATOM 0 H GLU A 26 39.559 58.879 0.498 1.00 0.00 H new ATOM 0 HA GLU A 26 38.236 56.431 -0.092 1.00 0.00 H new ATOM 0 HB2 GLU A 26 37.760 58.382 2.182 1.00 0.00 H new ATOM 0 HB3 GLU A 26 37.260 56.703 2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 26 40.063 57.811 2.343 1.00 0.00 H new ATOM 0 HG3 GLU A 26 39.213 56.785 3.482 1.00 0.00 H new ATOM 420 N SER A 27 36.576 59.203 -0.506 1.00 0.00 N ATOM 421 CA SER A 27 35.385 59.741 -1.149 1.00 0.00 C ATOM 422 C SER A 27 35.149 59.079 -2.504 1.00 0.00 C ATOM 423 O SER A 27 34.032 58.671 -2.805 1.00 0.00 O ATOM 424 CB SER A 27 35.498 61.255 -1.310 1.00 0.00 C ATOM 425 OG SER A 27 35.501 61.896 -0.046 1.00 0.00 O ATOM 0 H SER A 27 37.287 59.899 -0.281 1.00 0.00 H new ATOM 0 HA SER A 27 34.530 59.522 -0.509 1.00 0.00 H new ATOM 0 HB2 SER A 27 36.413 61.501 -1.850 1.00 0.00 H new ATOM 0 HB3 SER A 27 34.666 61.625 -1.909 1.00 0.00 H new ATOM 0 HG SER A 27 36.410 61.894 0.320 1.00 0.00 H new ATOM 431 N GLU A 28 36.206 58.951 -3.301 1.00 0.00 N ATOM 432 CA GLU A 28 36.112 58.288 -4.601 1.00 0.00 C ATOM 433 C GLU A 28 36.013 56.774 -4.449 1.00 0.00 C ATOM 434 O GLU A 28 35.645 56.074 -5.385 1.00 0.00 O ATOM 435 CB GLU A 28 37.285 58.669 -5.509 1.00 0.00 C ATOM 436 CG GLU A 28 37.154 60.061 -6.117 1.00 0.00 C ATOM 437 CD GLU A 28 36.001 60.181 -7.109 1.00 0.00 C ATOM 438 OE1 GLU A 28 34.968 59.494 -6.934 1.00 0.00 O ATOM 439 OE2 GLU A 28 36.117 60.979 -8.066 1.00 0.00 O ATOM 0 H GLU A 28 37.138 59.297 -3.071 1.00 0.00 H new ATOM 0 HA GLU A 28 35.195 58.637 -5.075 1.00 0.00 H new ATOM 0 HB2 GLU A 28 38.210 58.617 -4.935 1.00 0.00 H new ATOM 0 HB3 GLU A 28 37.366 57.936 -6.312 1.00 0.00 H new ATOM 0 HG2 GLU A 28 37.013 60.787 -5.317 1.00 0.00 H new ATOM 0 HG3 GLU A 28 38.086 60.319 -6.621 1.00 0.00 H new ATOM 446 N ARG A 29 36.403 56.262 -3.288 1.00 0.00 N ATOM 447 CA ARG A 29 36.208 54.848 -2.983 1.00 0.00 C ATOM 448 C ARG A 29 34.737 54.551 -2.686 1.00 0.00 C ATOM 449 O ARG A 29 34.232 53.480 -3.016 1.00 0.00 O ATOM 450 CB ARG A 29 37.077 54.412 -1.802 1.00 0.00 C ATOM 451 CG ARG A 29 38.538 54.198 -2.159 1.00 0.00 C ATOM 452 CD ARG A 29 39.330 53.701 -0.961 1.00 0.00 C ATOM 453 NE ARG A 29 40.664 53.229 -1.335 1.00 0.00 N ATOM 454 CZ ARG A 29 41.626 52.944 -0.453 1.00 0.00 C ATOM 455 NH1 ARG A 29 41.443 53.181 0.839 1.00 0.00 N ATOM 456 NH2 ARG A 29 42.788 52.454 -0.872 1.00 0.00 N ATOM 0 H ARG A 29 36.853 56.799 -2.547 1.00 0.00 H new ATOM 0 HA ARG A 29 36.510 54.279 -3.863 1.00 0.00 H new ATOM 0 HB2 ARG A 29 37.011 55.166 -1.017 1.00 0.00 H new ATOM 0 HB3 ARG A 29 36.675 53.487 -1.389 1.00 0.00 H new ATOM 0 HG2 ARG A 29 38.614 53.477 -2.973 1.00 0.00 H new ATOM 0 HG3 ARG A 29 38.968 55.133 -2.520 1.00 0.00 H new ATOM 0 HD2 ARG A 29 39.423 54.505 -0.231 1.00 0.00 H new ATOM 0 HD3 ARG A 29 38.783 52.892 -0.477 1.00 0.00 H new ATOM 0 HE ARG A 29 40.871 53.111 -2.327 1.00 0.00 H new ATOM 0 HH11 ARG A 29 40.564 53.583 1.164 1.00 0.00 H new ATOM 0 HH12 ARG A 29 42.181 52.961 1.507 1.00 0.00 H new ATOM 0 HH21 ARG A 29 42.946 52.295 -1.867 1.00 0.00 H new ATOM 0 HH22 ARG A 29 43.522 52.236 -0.198 1.00 0.00 H new ATOM 470 N ASN A 30 34.059 55.499 -2.050 1.00 0.00 N ATOM 471 CA ASN A 30 32.636 55.350 -1.749 1.00 0.00 C ATOM 472 C ASN A 30 31.799 55.793 -2.947 1.00 0.00 C ATOM 473 O ASN A 30 30.778 55.190 -3.277 1.00 0.00 O ATOM 474 CB ASN A 30 32.265 56.166 -0.507 1.00 0.00 C ATOM 475 CG ASN A 30 30.812 55.994 -0.089 1.00 0.00 C ATOM 476 OD1 ASN A 30 30.201 56.919 0.447 1.00 0.00 O ATOM 477 ND2 ASN A 30 30.251 54.814 -0.314 1.00 0.00 N ATOM 0 H ASN A 30 34.468 56.378 -1.732 1.00 0.00 H new ATOM 0 HA ASN A 30 32.428 54.300 -1.545 1.00 0.00 H new ATOM 0 HB2 ASN A 30 32.911 55.872 0.320 1.00 0.00 H new ATOM 0 HB3 ASN A 30 32.458 57.221 -0.702 1.00 0.00 H new ATOM 0 HD21 ASN A 30 29.282 54.649 -0.041 1.00 0.00 H new ATOM 0 HD22 ASN A 30 30.788 54.071 -0.761 1.00 0.00 H new ATOM 484 N CYS A 31 32.248 56.855 -3.591 1.00 0.00 N ATOM 485 CA CYS A 31 31.644 57.334 -4.821 1.00 0.00 C ATOM 486 C CYS A 31 32.282 56.615 -5.997 1.00 0.00 C ATOM 487 O CYS A 31 33.104 55.731 -5.791 1.00 0.00 O ATOM 488 CB CYS A 31 31.774 58.854 -4.935 1.00 0.00 C ATOM 489 SG CYS A 31 30.768 59.740 -3.705 1.00 0.00 S ATOM 0 H CYS A 31 33.043 57.411 -3.275 1.00 0.00 H new ATOM 0 HA CYS A 31 30.577 57.114 -4.819 1.00 0.00 H new ATOM 0 HB2 CYS A 31 32.820 59.135 -4.813 1.00 0.00 H new ATOM 0 HB3 CYS A 31 31.475 59.166 -5.936 1.00 0.00 H new ATOM 494 N SER A 32 31.836 56.918 -7.211 1.00 0.00 N ATOM 495 CA SER A 32 32.326 56.249 -8.419 1.00 0.00 C ATOM 496 C SER A 32 31.779 54.824 -8.532 1.00 0.00 C ATOM 497 O SER A 32 31.346 54.408 -9.605 1.00 0.00 O ATOM 498 CB SER A 32 33.861 56.272 -8.489 1.00 0.00 C ATOM 499 OG SER A 32 34.338 57.597 -8.689 1.00 0.00 O ATOM 0 H SER A 32 31.128 57.630 -7.389 1.00 0.00 H new ATOM 0 HA SER A 32 31.952 56.808 -9.277 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.278 55.866 -7.567 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.202 55.631 -9.302 1.00 0.00 H new ATOM 0 HG SER A 32 34.575 57.993 -7.825 1.00 0.00 H new ATOM 505 N GLY A 33 31.768 54.093 -7.420 1.00 0.00 N ATOM 506 CA GLY A 33 31.152 52.778 -7.395 1.00 0.00 C ATOM 507 C GLY A 33 29.660 52.846 -7.669 1.00 0.00 C ATOM 508 O GLY A 33 29.054 51.873 -8.111 1.00 0.00 O ATOM 0 H GLY A 33 32.176 54.390 -6.534 1.00 0.00 H new ATOM 0 HA2 GLY A 33 31.629 52.140 -8.139 1.00 0.00 H new ATOM 0 HA3 GLY A 33 31.322 52.316 -6.422 1.00 0.00 H new ATOM 512 N MET A 34 29.074 54.014 -7.418 1.00 0.00 N ATOM 513 CA MET A 34 27.654 54.245 -7.681 1.00 0.00 C ATOM 514 C MET A 34 27.439 54.714 -9.117 1.00 0.00 C ATOM 515 O MET A 34 26.356 55.176 -9.465 1.00 0.00 O ATOM 516 CB MET A 34 27.093 55.309 -6.728 1.00 0.00 C ATOM 517 CG MET A 34 27.127 54.925 -5.258 1.00 0.00 C ATOM 518 SD MET A 34 26.432 56.203 -4.190 1.00 0.00 S ATOM 519 CE MET A 34 27.633 57.516 -4.398 1.00 0.00 C ATOM 0 H MET A 34 29.563 54.821 -7.030 1.00 0.00 H new ATOM 0 HA MET A 34 27.133 53.300 -7.524 1.00 0.00 H new ATOM 0 HB2 MET A 34 27.658 56.231 -6.862 1.00 0.00 H new ATOM 0 HB3 MET A 34 26.062 55.523 -7.010 1.00 0.00 H new ATOM 0 HG2 MET A 34 26.573 53.997 -5.116 1.00 0.00 H new ATOM 0 HG3 MET A 34 28.157 54.730 -4.961 1.00 0.00 H new ATOM 0 HE1 MET A 34 27.285 58.412 -3.884 1.00 0.00 H new ATOM 0 HE2 MET A 34 28.589 57.204 -3.978 1.00 0.00 H new ATOM 0 HE3 MET A 34 27.756 57.732 -5.459 1.00 0.00 H new ATOM 529 N GLY A 35 28.470 54.594 -9.947 1.00 0.00 N ATOM 530 CA GLY A 35 28.409 55.161 -11.283 1.00 0.00 C ATOM 531 C GLY A 35 28.508 56.668 -11.219 1.00 0.00 C ATOM 532 O GLY A 35 27.843 57.387 -11.960 1.00 0.00 O ATOM 0 H GLY A 35 29.343 54.117 -9.721 1.00 0.00 H new ATOM 0 HA2 GLY A 35 29.220 54.762 -11.892 1.00 0.00 H new ATOM 0 HA3 GLY A 35 27.476 54.871 -11.766 1.00 0.00 H new ATOM 536 N ALA A 36 29.360 57.134 -10.319 1.00 0.00 N ATOM 537 CA ALA A 36 29.451 58.545 -9.988 1.00 0.00 C ATOM 538 C ALA A 36 30.906 58.990 -9.945 1.00 0.00 C ATOM 539 O ALA A 36 31.799 58.234 -10.312 1.00 0.00 O ATOM 540 CB ALA A 36 28.772 58.807 -8.650 1.00 0.00 C ATOM 0 H ALA A 36 30.008 56.543 -9.798 1.00 0.00 H new ATOM 0 HA ALA A 36 28.942 59.122 -10.760 1.00 0.00 H new ATOM 0 HB1 ALA A 36 28.844 59.867 -8.407 1.00 0.00 H new ATOM 0 HB2 ALA A 36 27.723 58.519 -8.712 1.00 0.00 H new ATOM 0 HB3 ALA A 36 29.263 58.223 -7.872 1.00 0.00 H new ATOM 546 N HIS A 37 31.131 60.226 -9.540 1.00 0.00 N ATOM 547 CA HIS A 37 32.479 60.753 -9.371 1.00 0.00 C ATOM 548 C HIS A 37 32.420 61.957 -8.439 1.00 0.00 C ATOM 549 O HIS A 37 31.329 62.428 -8.133 1.00 0.00 O ATOM 550 CB HIS A 37 33.039 61.155 -10.735 1.00 0.00 C ATOM 551 CG HIS A 37 34.471 60.784 -10.942 1.00 0.00 C ATOM 552 ND1 HIS A 37 35.024 59.606 -10.483 1.00 0.00 N ATOM 553 CD2 HIS A 37 35.464 61.436 -11.582 1.00 0.00 C ATOM 554 CE1 HIS A 37 36.293 59.552 -10.835 1.00 0.00 C ATOM 555 NE2 HIS A 37 36.584 60.651 -11.505 1.00 0.00 N ATOM 0 H HIS A 37 30.391 60.893 -9.319 1.00 0.00 H new ATOM 0 HA HIS A 37 33.133 59.996 -8.937 1.00 0.00 H new ATOM 0 HB2 HIS A 37 32.438 60.687 -11.514 1.00 0.00 H new ATOM 0 HB3 HIS A 37 32.934 62.233 -10.855 1.00 0.00 H new ATOM 0 HD1 HIS A 37 34.528 58.889 -9.954 1.00 0.00 H new ATOM 0 HD2 HIS A 37 35.390 62.399 -12.066 1.00 0.00 H new ATOM 0 HE1 HIS A 37 36.977 58.746 -10.613 1.00 0.00 H new ATOM 564 N LEU A 38 33.558 62.440 -7.961 1.00 0.00 N ATOM 565 CA LEU A 38 33.569 63.667 -7.165 1.00 0.00 C ATOM 566 C LEU A 38 33.126 64.862 -8.005 1.00 0.00 C ATOM 567 O LEU A 38 33.380 64.913 -9.210 1.00 0.00 O ATOM 568 CB LEU A 38 34.950 63.932 -6.563 1.00 0.00 C ATOM 569 CG LEU A 38 35.334 63.022 -5.398 1.00 0.00 C ATOM 570 CD1 LEU A 38 36.702 63.395 -4.859 1.00 0.00 C ATOM 571 CD2 LEU A 38 34.292 63.100 -4.294 1.00 0.00 C ATOM 0 H LEU A 38 34.473 62.013 -8.105 1.00 0.00 H new ATOM 0 HA LEU A 38 32.862 63.530 -6.346 1.00 0.00 H new ATOM 0 HB2 LEU A 38 35.698 63.826 -7.349 1.00 0.00 H new ATOM 0 HB3 LEU A 38 34.989 64.967 -6.223 1.00 0.00 H new ATOM 0 HG LEU A 38 35.374 61.996 -5.764 1.00 0.00 H new ATOM 0 HD11 LEU A 38 36.958 62.736 -4.030 1.00 0.00 H new ATOM 0 HD12 LEU A 38 37.445 63.290 -5.649 1.00 0.00 H new ATOM 0 HD13 LEU A 38 36.687 64.428 -4.510 1.00 0.00 H new ATOM 0 HD21 LEU A 38 34.583 62.445 -3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.221 64.126 -3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 38 33.324 62.785 -4.684 1.00 0.00 H new ATOM 583 N MET A 39 32.452 65.814 -7.361 1.00 0.00 N ATOM 584 CA MET A 39 31.911 66.980 -8.055 1.00 0.00 C ATOM 585 C MET A 39 32.998 67.781 -8.754 1.00 0.00 C ATOM 586 O MET A 39 33.988 68.189 -8.145 1.00 0.00 O ATOM 587 CB MET A 39 31.166 67.908 -7.094 1.00 0.00 C ATOM 588 CG MET A 39 30.666 69.175 -7.776 1.00 0.00 C ATOM 589 SD MET A 39 29.908 70.356 -6.648 1.00 0.00 S ATOM 590 CE MET A 39 29.487 71.668 -7.795 1.00 0.00 C ATOM 0 H MET A 39 32.268 65.800 -6.358 1.00 0.00 H new ATOM 0 HA MET A 39 31.218 66.591 -8.801 1.00 0.00 H new ATOM 0 HB2 MET A 39 30.320 67.374 -6.661 1.00 0.00 H new ATOM 0 HB3 MET A 39 31.827 68.179 -6.271 1.00 0.00 H new ATOM 0 HG2 MET A 39 31.501 69.657 -8.284 1.00 0.00 H new ATOM 0 HG3 MET A 39 29.941 68.902 -8.543 1.00 0.00 H new ATOM 0 HE1 MET A 39 29.818 72.625 -7.391 1.00 0.00 H new ATOM 0 HE2 MET A 39 29.979 71.488 -8.751 1.00 0.00 H new ATOM 0 HE3 MET A 39 28.407 71.690 -7.942 1.00 0.00 H new ATOM 600 N THR A 40 32.799 68.005 -10.036 1.00 0.00 N ATOM 601 CA THR A 40 33.666 68.868 -10.799 1.00 0.00 C ATOM 602 C THR A 40 32.869 70.040 -11.348 1.00 0.00 C ATOM 603 O THR A 40 32.049 69.872 -12.249 1.00 0.00 O ATOM 604 CB THR A 40 34.347 68.091 -11.936 1.00 0.00 C ATOM 605 OG1 THR A 40 33.368 67.386 -12.714 1.00 0.00 O ATOM 606 CG2 THR A 40 35.351 67.106 -11.364 1.00 0.00 C ATOM 0 H THR A 40 32.035 67.595 -10.573 1.00 0.00 H new ATOM 0 HA THR A 40 34.448 69.250 -10.143 1.00 0.00 H new ATOM 0 HB THR A 40 34.867 68.801 -12.580 1.00 0.00 H new ATOM 0 HG1 THR A 40 32.930 68.009 -13.331 1.00 0.00 H new ATOM 0 HG21 THR A 40 35.829 66.560 -12.177 1.00 0.00 H new ATOM 0 HG22 THR A 40 36.108 67.647 -10.796 1.00 0.00 H new ATOM 0 HG23 THR A 40 34.838 66.403 -10.707 1.00 0.00 H new ATOM 614 N ILE A 41 33.087 71.214 -10.763 1.00 0.00 N ATOM 615 CA ILE A 41 32.345 72.411 -11.137 1.00 0.00 C ATOM 616 C ILE A 41 32.532 72.721 -12.616 1.00 0.00 C ATOM 617 O ILE A 41 33.587 73.201 -13.040 1.00 0.00 O ATOM 618 CB ILE A 41 32.764 73.630 -10.284 1.00 0.00 C ATOM 619 CG1 ILE A 41 32.575 73.320 -8.794 1.00 0.00 C ATOM 620 CG2 ILE A 41 31.960 74.861 -10.683 1.00 0.00 C ATOM 621 CD1 ILE A 41 32.905 74.477 -7.875 1.00 0.00 C ATOM 0 H ILE A 41 33.775 71.361 -10.025 1.00 0.00 H new ATOM 0 HA ILE A 41 31.290 72.212 -10.947 1.00 0.00 H new ATOM 0 HB ILE A 41 33.818 73.839 -10.464 1.00 0.00 H new ATOM 0 HG12 ILE A 41 31.541 73.019 -8.625 1.00 0.00 H new ATOM 0 HG13 ILE A 41 33.202 72.469 -8.529 1.00 0.00 H new ATOM 0 HG21 ILE A 41 32.268 75.710 -10.073 1.00 0.00 H new ATOM 0 HG22 ILE A 41 32.138 75.087 -11.734 1.00 0.00 H new ATOM 0 HG23 ILE A 41 30.898 74.668 -10.528 1.00 0.00 H new ATOM 0 HD11 ILE A 41 32.745 74.176 -6.840 1.00 0.00 H new ATOM 0 HD12 ILE A 41 33.947 74.765 -8.013 1.00 0.00 H new ATOM 0 HD13 ILE A 41 32.260 75.324 -8.110 1.00 0.00 H new ATOM 633 N SER A 42 31.506 72.421 -13.394 1.00 0.00 N ATOM 634 CA SER A 42 31.561 72.586 -14.831 1.00 0.00 C ATOM 635 C SER A 42 31.097 73.983 -15.234 1.00 0.00 C ATOM 636 O SER A 42 31.568 74.548 -16.224 1.00 0.00 O ATOM 637 CB SER A 42 30.699 71.515 -15.502 1.00 0.00 C ATOM 638 OG SER A 42 31.061 70.219 -15.047 1.00 0.00 O ATOM 0 H SER A 42 30.618 72.059 -13.047 1.00 0.00 H new ATOM 0 HA SER A 42 32.593 72.471 -15.162 1.00 0.00 H new ATOM 0 HB2 SER A 42 29.647 71.701 -15.286 1.00 0.00 H new ATOM 0 HB3 SER A 42 30.817 71.572 -16.584 1.00 0.00 H new ATOM 0 HG SER A 42 30.497 69.549 -15.487 1.00 0.00 H new ATOM 644 N THR A 43 30.177 74.549 -14.461 1.00 0.00 N ATOM 645 CA THR A 43 29.670 75.879 -14.756 1.00 0.00 C ATOM 646 C THR A 43 29.541 76.725 -13.491 1.00 0.00 C ATOM 647 O THR A 43 29.348 76.209 -12.386 1.00 0.00 O ATOM 648 CB THR A 43 28.307 75.833 -15.485 1.00 0.00 C ATOM 649 OG1 THR A 43 27.393 74.988 -14.783 1.00 0.00 O ATOM 650 CG2 THR A 43 28.460 75.340 -16.917 1.00 0.00 C ATOM 0 H THR A 43 29.772 74.111 -13.634 1.00 0.00 H new ATOM 0 HA THR A 43 30.401 76.342 -15.419 1.00 0.00 H new ATOM 0 HB THR A 43 27.914 76.849 -15.510 1.00 0.00 H new ATOM 0 HG1 THR A 43 27.667 74.053 -14.885 1.00 0.00 H new ATOM 0 HG21 THR A 43 27.484 75.320 -17.401 1.00 0.00 H new ATOM 0 HG22 THR A 43 29.122 76.011 -17.464 1.00 0.00 H new ATOM 0 HG23 THR A 43 28.884 74.336 -16.913 1.00 0.00 H new ATOM 658 N GLU A 44 29.651 78.033 -13.671 1.00 0.00 N ATOM 659 CA GLU A 44 29.523 78.982 -12.578 1.00 0.00 C ATOM 660 C GLU A 44 28.137 78.889 -11.942 1.00 0.00 C ATOM 661 O GLU A 44 28.005 78.879 -10.720 1.00 0.00 O ATOM 662 CB GLU A 44 29.793 80.387 -13.113 1.00 0.00 C ATOM 663 CG GLU A 44 28.882 80.774 -14.265 1.00 0.00 C ATOM 664 CD GLU A 44 29.452 81.885 -15.115 1.00 0.00 C ATOM 665 OE1 GLU A 44 29.303 83.055 -14.740 1.00 0.00 O ATOM 666 OE2 GLU A 44 30.057 81.567 -16.164 1.00 0.00 O ATOM 0 H GLU A 44 29.831 78.464 -14.578 1.00 0.00 H new ATOM 0 HA GLU A 44 30.251 78.749 -11.801 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.670 81.107 -12.304 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.830 80.451 -13.441 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.703 79.899 -14.891 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.915 81.085 -13.869 1.00 0.00 H new ATOM 673 N ALA A 45 27.109 78.794 -12.782 1.00 0.00 N ATOM 674 CA ALA A 45 25.737 78.660 -12.308 1.00 0.00 C ATOM 675 C ALA A 45 25.581 77.393 -11.478 1.00 0.00 C ATOM 676 O ALA A 45 24.867 77.381 -10.480 1.00 0.00 O ATOM 677 CB ALA A 45 24.768 78.649 -13.481 1.00 0.00 C ATOM 0 H ALA A 45 27.203 78.808 -13.798 1.00 0.00 H new ATOM 0 HA ALA A 45 25.505 79.517 -11.676 1.00 0.00 H new ATOM 0 HB1 ALA A 45 23.748 78.548 -13.110 1.00 0.00 H new ATOM 0 HB2 ALA A 45 24.861 79.581 -14.038 1.00 0.00 H new ATOM 0 HB3 ALA A 45 25.000 77.810 -14.137 1.00 0.00 H new ATOM 683 N GLU A 46 26.272 76.342 -11.896 1.00 0.00 N ATOM 684 CA GLU A 46 26.272 75.072 -11.182 1.00 0.00 C ATOM 685 C GLU A 46 26.687 75.279 -9.731 1.00 0.00 C ATOM 686 O GLU A 46 25.992 74.852 -8.809 1.00 0.00 O ATOM 687 CB GLU A 46 27.227 74.114 -11.881 1.00 0.00 C ATOM 688 CG GLU A 46 27.263 72.713 -11.310 1.00 0.00 C ATOM 689 CD GLU A 46 28.094 71.795 -12.175 1.00 0.00 C ATOM 690 OE1 GLU A 46 29.326 71.761 -11.992 1.00 0.00 O ATOM 691 OE2 GLU A 46 27.521 71.128 -13.060 1.00 0.00 O ATOM 0 H GLU A 46 26.848 76.345 -12.738 1.00 0.00 H new ATOM 0 HA GLU A 46 25.267 74.649 -11.186 1.00 0.00 H new ATOM 0 HB2 GLU A 46 26.951 74.054 -12.934 1.00 0.00 H new ATOM 0 HB3 GLU A 46 28.232 74.533 -11.839 1.00 0.00 H new ATOM 0 HG2 GLU A 46 27.675 72.739 -10.301 1.00 0.00 H new ATOM 0 HG3 GLU A 46 26.248 72.323 -11.230 1.00 0.00 H new ATOM 698 N GLN A 47 27.816 75.957 -9.536 1.00 0.00 N ATOM 699 CA GLN A 47 28.275 76.285 -8.192 1.00 0.00 C ATOM 700 C GLN A 47 27.242 77.143 -7.463 1.00 0.00 C ATOM 701 O GLN A 47 26.886 76.862 -6.321 1.00 0.00 O ATOM 702 CB GLN A 47 29.609 77.026 -8.239 1.00 0.00 C ATOM 703 CG GLN A 47 30.184 77.309 -6.860 1.00 0.00 C ATOM 704 CD GLN A 47 31.341 78.282 -6.895 1.00 0.00 C ATOM 705 OE1 GLN A 47 31.393 79.168 -7.740 1.00 0.00 O ATOM 706 NE2 GLN A 47 32.279 78.122 -5.976 1.00 0.00 N ATOM 0 H GLN A 47 28.424 76.287 -10.286 1.00 0.00 H new ATOM 0 HA GLN A 47 28.408 75.349 -7.650 1.00 0.00 H new ATOM 0 HB2 GLN A 47 30.325 76.436 -8.811 1.00 0.00 H new ATOM 0 HB3 GLN A 47 29.476 77.968 -8.771 1.00 0.00 H new ATOM 0 HG2 GLN A 47 29.398 77.709 -6.219 1.00 0.00 H new ATOM 0 HG3 GLN A 47 30.516 76.373 -6.411 1.00 0.00 H new ATOM 0 HE21 GLN A 47 32.198 77.372 -5.290 1.00 0.00 H new ATOM 0 HE22 GLN A 47 33.083 78.749 -5.953 1.00 0.00 H new ATOM 715 N ASN A 48 26.750 78.176 -8.141 1.00 0.00 N ATOM 716 CA ASN A 48 25.788 79.108 -7.552 1.00 0.00 C ATOM 717 C ASN A 48 24.533 78.393 -7.056 1.00 0.00 C ATOM 718 O ASN A 48 23.952 78.774 -6.040 1.00 0.00 O ATOM 719 CB ASN A 48 25.398 80.193 -8.563 1.00 0.00 C ATOM 720 CG ASN A 48 26.408 81.325 -8.648 1.00 0.00 C ATOM 721 OD1 ASN A 48 26.316 82.308 -7.918 1.00 0.00 O ATOM 722 ND2 ASN A 48 27.375 81.199 -9.546 1.00 0.00 N ATOM 0 H ASN A 48 27.003 78.391 -9.105 1.00 0.00 H new ATOM 0 HA ASN A 48 26.275 79.571 -6.694 1.00 0.00 H new ATOM 0 HB2 ASN A 48 25.287 79.739 -9.548 1.00 0.00 H new ATOM 0 HB3 ASN A 48 24.426 80.602 -8.289 1.00 0.00 H new ATOM 0 HD21 ASN A 48 28.075 81.934 -9.648 1.00 0.00 H new ATOM 0 HD22 ASN A 48 27.419 80.367 -10.135 1.00 0.00 H new ATOM 729 N PHE A 49 24.117 77.355 -7.767 1.00 0.00 N ATOM 730 CA PHE A 49 22.917 76.623 -7.393 1.00 0.00 C ATOM 731 C PHE A 49 23.195 75.558 -6.336 1.00 0.00 C ATOM 732 O PHE A 49 22.322 75.243 -5.538 1.00 0.00 O ATOM 733 CB PHE A 49 22.256 75.993 -8.623 1.00 0.00 C ATOM 734 CG PHE A 49 21.395 76.954 -9.396 1.00 0.00 C ATOM 735 CD1 PHE A 49 20.062 77.125 -9.062 1.00 0.00 C ATOM 736 CD2 PHE A 49 21.915 77.688 -10.450 1.00 0.00 C ATOM 737 CE1 PHE A 49 19.263 78.007 -9.764 1.00 0.00 C ATOM 738 CE2 PHE A 49 21.123 78.573 -11.156 1.00 0.00 C ATOM 739 CZ PHE A 49 19.795 78.732 -10.812 1.00 0.00 C ATOM 0 H PHE A 49 24.589 77.003 -8.600 1.00 0.00 H new ATOM 0 HA PHE A 49 22.230 77.346 -6.954 1.00 0.00 H new ATOM 0 HB2 PHE A 49 23.031 75.600 -9.282 1.00 0.00 H new ATOM 0 HB3 PHE A 49 21.648 75.146 -8.306 1.00 0.00 H new ATOM 0 HD1 PHE A 49 19.641 76.562 -8.242 1.00 0.00 H new ATOM 0 HD2 PHE A 49 22.953 77.567 -10.723 1.00 0.00 H new ATOM 0 HE1 PHE A 49 18.225 78.129 -9.494 1.00 0.00 H new ATOM 0 HE2 PHE A 49 21.541 79.139 -11.975 1.00 0.00 H new ATOM 0 HZ PHE A 49 19.173 79.423 -11.362 1.00 0.00 H new ATOM 749 N ILE A 50 24.398 75.004 -6.308 1.00 0.00 N ATOM 750 CA ILE A 50 24.699 73.954 -5.340 1.00 0.00 C ATOM 751 C ILE A 50 24.975 74.546 -3.954 1.00 0.00 C ATOM 752 O ILE A 50 24.654 73.936 -2.932 1.00 0.00 O ATOM 753 CB ILE A 50 25.887 73.061 -5.787 1.00 0.00 C ATOM 754 CG1 ILE A 50 25.976 71.807 -4.913 1.00 0.00 C ATOM 755 CG2 ILE A 50 27.200 73.825 -5.738 1.00 0.00 C ATOM 756 CD1 ILE A 50 24.765 70.904 -5.016 1.00 0.00 C ATOM 0 H ILE A 50 25.168 75.255 -6.928 1.00 0.00 H new ATOM 0 HA ILE A 50 23.814 73.319 -5.284 1.00 0.00 H new ATOM 0 HB ILE A 50 25.706 72.761 -6.819 1.00 0.00 H new ATOM 0 HG12 ILE A 50 26.864 71.242 -5.194 1.00 0.00 H new ATOM 0 HG13 ILE A 50 26.106 72.108 -3.874 1.00 0.00 H new ATOM 0 HG21 ILE A 50 28.013 73.172 -6.057 1.00 0.00 H new ATOM 0 HG22 ILE A 50 27.145 74.687 -6.403 1.00 0.00 H new ATOM 0 HG23 ILE A 50 27.386 74.164 -4.719 1.00 0.00 H new ATOM 0 HD11 ILE A 50 24.901 70.037 -4.369 1.00 0.00 H new ATOM 0 HD12 ILE A 50 23.875 71.452 -4.706 1.00 0.00 H new ATOM 0 HD13 ILE A 50 24.646 70.572 -6.047 1.00 0.00 H new ATOM 768 N ILE A 51 25.526 75.759 -3.921 1.00 0.00 N ATOM 769 CA ILE A 51 25.910 76.391 -2.660 1.00 0.00 C ATOM 770 C ILE A 51 24.693 76.852 -1.856 1.00 0.00 C ATOM 771 O ILE A 51 24.832 77.352 -0.737 1.00 0.00 O ATOM 772 CB ILE A 51 26.855 77.590 -2.882 1.00 0.00 C ATOM 773 CG1 ILE A 51 26.191 78.651 -3.766 1.00 0.00 C ATOM 774 CG2 ILE A 51 28.170 77.119 -3.490 1.00 0.00 C ATOM 775 CD1 ILE A 51 27.048 79.880 -3.995 1.00 0.00 C ATOM 0 H ILE A 51 25.716 76.322 -4.750 1.00 0.00 H new ATOM 0 HA ILE A 51 26.438 75.626 -2.091 1.00 0.00 H new ATOM 0 HB ILE A 51 27.067 78.048 -1.916 1.00 0.00 H new ATOM 0 HG12 ILE A 51 25.946 78.206 -4.730 1.00 0.00 H new ATOM 0 HG13 ILE A 51 25.250 78.956 -3.307 1.00 0.00 H new ATOM 0 HG21 ILE A 51 28.828 77.975 -3.642 1.00 0.00 H new ATOM 0 HG22 ILE A 51 28.649 76.408 -2.816 1.00 0.00 H new ATOM 0 HG23 ILE A 51 27.976 76.636 -4.448 1.00 0.00 H new ATOM 0 HD11 ILE A 51 26.511 80.585 -4.629 1.00 0.00 H new ATOM 0 HD12 ILE A 51 27.272 80.351 -3.038 1.00 0.00 H new ATOM 0 HD13 ILE A 51 27.978 79.589 -4.483 1.00 0.00 H new ATOM 787 N GLN A 52 23.503 76.706 -2.431 1.00 0.00 N ATOM 788 CA GLN A 52 22.276 77.019 -1.713 1.00 0.00 C ATOM 789 C GLN A 52 21.800 75.795 -0.936 1.00 0.00 C ATOM 790 O GLN A 52 21.026 75.911 0.011 1.00 0.00 O ATOM 791 CB GLN A 52 21.186 77.496 -2.679 1.00 0.00 C ATOM 792 CG GLN A 52 20.552 76.380 -3.496 1.00 0.00 C ATOM 793 CD GLN A 52 19.542 76.882 -4.513 1.00 0.00 C ATOM 794 OE1 GLN A 52 19.774 78.069 -5.052 1.00 0.00 O flip ATOM 795 NE2 GLN A 52 18.572 76.198 -4.824 1.00 0.00 N flip ATOM 0 H GLN A 52 23.364 76.375 -3.386 1.00 0.00 H new ATOM 0 HA GLN A 52 22.482 77.826 -1.010 1.00 0.00 H new ATOM 0 HB2 GLN A 52 20.407 78.003 -2.110 1.00 0.00 H new ATOM 0 HB3 GLN A 52 21.614 78.232 -3.359 1.00 0.00 H new ATOM 0 HG2 GLN A 52 21.336 75.828 -4.014 1.00 0.00 H new ATOM 0 HG3 GLN A 52 20.061 75.679 -2.821 1.00 0.00 H new ATOM 0 HE21 GLN A 52 18.428 75.288 -4.386 1.00 0.00 H new ATOM 0 HE22 GLN A 52 17.910 76.539 -5.521 1.00 0.00 H new ATOM 804 N PHE A 53 22.272 74.622 -1.350 1.00 0.00 N ATOM 805 CA PHE A 53 21.912 73.373 -0.693 1.00 0.00 C ATOM 806 C PHE A 53 22.957 73.005 0.349 1.00 0.00 C ATOM 807 O PHE A 53 22.655 72.355 1.348 1.00 0.00 O ATOM 808 CB PHE A 53 21.811 72.233 -1.709 1.00 0.00 C ATOM 809 CG PHE A 53 20.811 72.452 -2.809 1.00 0.00 C ATOM 810 CD1 PHE A 53 19.452 72.430 -2.546 1.00 0.00 C ATOM 811 CD2 PHE A 53 21.235 72.654 -4.112 1.00 0.00 C ATOM 812 CE1 PHE A 53 18.534 72.608 -3.563 1.00 0.00 C ATOM 813 CE2 PHE A 53 20.323 72.836 -5.133 1.00 0.00 C ATOM 814 CZ PHE A 53 18.970 72.810 -4.858 1.00 0.00 C ATOM 0 H PHE A 53 22.907 74.513 -2.141 1.00 0.00 H new ATOM 0 HA PHE A 53 20.944 73.517 -0.214 1.00 0.00 H new ATOM 0 HB2 PHE A 53 22.793 72.076 -2.156 1.00 0.00 H new ATOM 0 HB3 PHE A 53 21.552 71.316 -1.180 1.00 0.00 H new ATOM 0 HD1 PHE A 53 19.106 72.272 -1.535 1.00 0.00 H new ATOM 0 HD2 PHE A 53 22.292 72.669 -4.332 1.00 0.00 H new ATOM 0 HE1 PHE A 53 17.476 72.589 -3.346 1.00 0.00 H new ATOM 0 HE2 PHE A 53 20.667 72.998 -6.144 1.00 0.00 H new ATOM 0 HZ PHE A 53 18.254 72.947 -5.654 1.00 0.00 H new ATOM 824 N LEU A 54 24.190 73.413 0.089 1.00 0.00 N ATOM 825 CA LEU A 54 25.315 73.070 0.948 1.00 0.00 C ATOM 826 C LEU A 54 25.251 73.811 2.276 1.00 0.00 C ATOM 827 O LEU A 54 24.836 74.973 2.336 1.00 0.00 O ATOM 828 CB LEU A 54 26.628 73.403 0.243 1.00 0.00 C ATOM 829 CG LEU A 54 26.830 72.721 -1.108 1.00 0.00 C ATOM 830 CD1 LEU A 54 28.121 73.193 -1.747 1.00 0.00 C ATOM 831 CD2 LEU A 54 26.838 71.210 -0.947 1.00 0.00 C ATOM 0 H LEU A 54 24.439 73.987 -0.717 1.00 0.00 H new ATOM 0 HA LEU A 54 25.263 72.000 1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 54 26.681 74.482 0.099 1.00 0.00 H new ATOM 0 HB3 LEU A 54 27.454 73.128 0.898 1.00 0.00 H new ATOM 0 HG LEU A 54 26.000 72.992 -1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 54 28.252 72.699 -2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 54 28.080 74.272 -1.896 1.00 0.00 H new ATOM 0 HD13 LEU A 54 28.960 72.948 -1.096 1.00 0.00 H new ATOM 0 HD21 LEU A 54 26.983 70.741 -1.920 1.00 0.00 H new ATOM 0 HD22 LEU A 54 27.649 70.919 -0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 54 25.887 70.884 -0.525 1.00 0.00 H new ATOM 843 N ASP A 55 25.677 73.136 3.335 1.00 0.00 N ATOM 844 CA ASP A 55 25.734 73.747 4.651 1.00 0.00 C ATOM 845 C ASP A 55 26.930 74.676 4.723 1.00 0.00 C ATOM 846 O ASP A 55 28.046 74.297 4.364 1.00 0.00 O ATOM 847 CB ASP A 55 25.834 72.689 5.747 1.00 0.00 C ATOM 848 CG ASP A 55 25.796 73.297 7.134 1.00 0.00 C ATOM 849 OD1 ASP A 55 26.849 73.760 7.614 1.00 0.00 O ATOM 850 OD2 ASP A 55 24.715 73.317 7.755 1.00 0.00 O ATOM 0 H ASP A 55 25.988 72.165 3.306 1.00 0.00 H new ATOM 0 HA ASP A 55 24.815 74.312 4.810 1.00 0.00 H new ATOM 0 HB2 ASP A 55 25.014 71.979 5.641 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.760 72.127 5.624 1.00 0.00 H new ATOM 855 N ARG A 56 26.704 75.881 5.208 1.00 0.00 N ATOM 856 CA ARG A 56 27.712 76.928 5.153 1.00 0.00 C ATOM 857 C ARG A 56 28.696 76.849 6.320 1.00 0.00 C ATOM 858 O ARG A 56 29.272 77.858 6.720 1.00 0.00 O ATOM 859 CB ARG A 56 27.031 78.297 5.119 1.00 0.00 C ATOM 860 CG ARG A 56 26.142 78.491 3.899 1.00 0.00 C ATOM 861 CD ARG A 56 25.607 79.911 3.808 1.00 0.00 C ATOM 862 NE ARG A 56 24.780 80.104 2.614 1.00 0.00 N ATOM 863 CZ ARG A 56 24.637 81.272 1.977 1.00 0.00 C ATOM 864 NH1 ARG A 56 25.273 82.360 2.405 1.00 0.00 N ATOM 865 NH2 ARG A 56 23.863 81.346 0.898 1.00 0.00 N ATOM 0 H ARG A 56 25.828 76.163 5.647 1.00 0.00 H new ATOM 0 HA ARG A 56 28.291 76.783 4.241 1.00 0.00 H new ATOM 0 HB2 ARG A 56 26.432 78.421 6.021 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.793 79.076 5.133 1.00 0.00 H new ATOM 0 HG2 ARG A 56 26.707 78.258 2.997 1.00 0.00 H new ATOM 0 HG3 ARG A 56 25.308 77.791 3.943 1.00 0.00 H new ATOM 0 HD2 ARG A 56 25.019 80.136 4.698 1.00 0.00 H new ATOM 0 HD3 ARG A 56 26.440 80.613 3.791 1.00 0.00 H new ATOM 0 HE ARG A 56 24.281 79.295 2.244 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.876 82.308 3.226 1.00 0.00 H new ATOM 0 HH12 ARG A 56 25.157 83.245 1.912 1.00 0.00 H new ATOM 0 HH21 ARG A 56 23.381 80.514 0.558 1.00 0.00 H new ATOM 0 HH22 ARG A 56 23.752 82.235 0.410 1.00 0.00 H new ATOM 879 N ARG A 57 28.896 75.653 6.855 1.00 0.00 N ATOM 880 CA ARG A 57 29.891 75.454 7.900 1.00 0.00 C ATOM 881 C ARG A 57 30.852 74.320 7.529 1.00 0.00 C ATOM 882 O ARG A 57 31.908 74.164 8.144 1.00 0.00 O ATOM 883 CB ARG A 57 29.199 75.174 9.244 1.00 0.00 C ATOM 884 CG ARG A 57 29.296 73.731 9.716 1.00 0.00 C ATOM 885 CD ARG A 57 28.266 73.425 10.789 1.00 0.00 C ATOM 886 NE ARG A 57 26.911 73.431 10.243 1.00 0.00 N ATOM 887 CZ ARG A 57 25.806 73.251 10.962 1.00 0.00 C ATOM 888 NH1 ARG A 57 25.881 73.097 12.281 1.00 0.00 N ATOM 889 NH2 ARG A 57 24.627 73.228 10.357 1.00 0.00 N ATOM 0 H ARG A 57 28.387 74.811 6.586 1.00 0.00 H new ATOM 0 HA ARG A 57 30.479 76.367 7.999 1.00 0.00 H new ATOM 0 HB2 ARG A 57 29.635 75.822 10.005 1.00 0.00 H new ATOM 0 HB3 ARG A 57 28.147 75.445 9.160 1.00 0.00 H new ATOM 0 HG2 ARG A 57 29.151 73.060 8.869 1.00 0.00 H new ATOM 0 HG3 ARG A 57 30.296 73.541 10.106 1.00 0.00 H new ATOM 0 HD2 ARG A 57 28.477 72.452 11.232 1.00 0.00 H new ATOM 0 HD3 ARG A 57 28.341 74.162 11.589 1.00 0.00 H new ATOM 0 HE ARG A 57 26.805 73.584 9.240 1.00 0.00 H new ATOM 0 HH11 ARG A 57 26.789 73.117 12.746 1.00 0.00 H new ATOM 0 HH12 ARG A 57 25.031 72.959 12.828 1.00 0.00 H new ATOM 0 HH21 ARG A 57 24.570 73.348 9.346 1.00 0.00 H new ATOM 0 HH22 ARG A 57 23.776 73.090 10.903 1.00 0.00 H new ATOM 903 N LEU A 58 30.490 73.532 6.518 1.00 0.00 N ATOM 904 CA LEU A 58 31.313 72.394 6.114 1.00 0.00 C ATOM 905 C LEU A 58 32.212 72.730 4.927 1.00 0.00 C ATOM 906 O LEU A 58 31.941 73.658 4.163 1.00 0.00 O ATOM 907 CB LEU A 58 30.451 71.174 5.759 1.00 0.00 C ATOM 908 CG LEU A 58 29.844 70.402 6.939 1.00 0.00 C ATOM 909 CD1 LEU A 58 30.869 70.211 8.048 1.00 0.00 C ATOM 910 CD2 LEU A 58 28.599 71.092 7.462 1.00 0.00 C ATOM 0 H LEU A 58 29.640 73.659 5.968 1.00 0.00 H new ATOM 0 HA LEU A 58 31.941 72.155 6.972 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.638 71.506 5.113 1.00 0.00 H new ATOM 0 HB3 LEU A 58 31.060 70.483 5.176 1.00 0.00 H new ATOM 0 HG LEU A 58 29.551 69.416 6.578 1.00 0.00 H new ATOM 0 HD11 LEU A 58 30.415 69.662 8.873 1.00 0.00 H new ATOM 0 HD12 LEU A 58 31.721 69.650 7.664 1.00 0.00 H new ATOM 0 HD13 LEU A 58 31.206 71.185 8.403 1.00 0.00 H new ATOM 0 HD21 LEU A 58 28.191 70.523 8.297 1.00 0.00 H new ATOM 0 HD22 LEU A 58 28.854 72.097 7.798 1.00 0.00 H new ATOM 0 HD23 LEU A 58 27.856 71.153 6.667 1.00 0.00 H new ATOM 922 N SER A 59 33.286 71.961 4.790 1.00 0.00 N ATOM 923 CA SER A 59 34.187 72.073 3.653 1.00 0.00 C ATOM 924 C SER A 59 34.027 70.852 2.747 1.00 0.00 C ATOM 925 O SER A 59 34.315 69.729 3.158 1.00 0.00 O ATOM 926 CB SER A 59 35.631 72.183 4.149 1.00 0.00 C ATOM 927 OG SER A 59 35.940 71.128 5.044 1.00 0.00 O ATOM 0 H SER A 59 33.555 71.244 5.464 1.00 0.00 H new ATOM 0 HA SER A 59 33.943 72.968 3.082 1.00 0.00 H new ATOM 0 HB2 SER A 59 36.314 72.157 3.300 1.00 0.00 H new ATOM 0 HB3 SER A 59 35.777 73.142 4.646 1.00 0.00 H new ATOM 0 HG SER A 59 36.868 71.217 5.347 1.00 0.00 H new ATOM 933 N TYR A 60 33.560 71.075 1.528 1.00 0.00 N ATOM 934 CA TYR A 60 33.242 69.982 0.613 1.00 0.00 C ATOM 935 C TYR A 60 34.359 69.745 -0.402 1.00 0.00 C ATOM 936 O TYR A 60 34.740 70.655 -1.125 1.00 0.00 O ATOM 937 CB TYR A 60 31.943 70.301 -0.127 1.00 0.00 C ATOM 938 CG TYR A 60 30.736 70.436 0.777 1.00 0.00 C ATOM 939 CD1 TYR A 60 30.393 71.657 1.348 1.00 0.00 C ATOM 940 CD2 TYR A 60 29.941 69.338 1.055 1.00 0.00 C ATOM 941 CE1 TYR A 60 29.286 71.773 2.169 1.00 0.00 C ATOM 942 CE2 TYR A 60 28.832 69.444 1.873 1.00 0.00 C ATOM 943 CZ TYR A 60 28.510 70.664 2.428 1.00 0.00 C ATOM 944 OH TYR A 60 27.403 70.776 3.241 1.00 0.00 O ATOM 0 H TYR A 60 33.391 72.005 1.146 1.00 0.00 H new ATOM 0 HA TYR A 60 33.130 69.073 1.204 1.00 0.00 H new ATOM 0 HB2 TYR A 60 32.073 71.229 -0.684 1.00 0.00 H new ATOM 0 HB3 TYR A 60 31.751 69.515 -0.858 1.00 0.00 H new ATOM 0 HD1 TYR A 60 31.000 72.527 1.147 1.00 0.00 H new ATOM 0 HD2 TYR A 60 30.192 68.380 0.625 1.00 0.00 H new ATOM 0 HE1 TYR A 60 29.031 72.728 2.605 1.00 0.00 H new ATOM 0 HE2 TYR A 60 28.222 68.576 2.076 1.00 0.00 H new ATOM 0 HH TYR A 60 26.966 69.903 3.320 1.00 0.00 H new ATOM 954 N PHE A 61 34.877 68.521 -0.458 1.00 0.00 N ATOM 955 CA PHE A 61 35.916 68.173 -1.431 1.00 0.00 C ATOM 956 C PHE A 61 35.427 68.338 -2.866 1.00 0.00 C ATOM 957 O PHE A 61 34.291 67.988 -3.194 1.00 0.00 O ATOM 958 CB PHE A 61 36.403 66.737 -1.232 1.00 0.00 C ATOM 959 CG PHE A 61 37.580 66.620 -0.311 1.00 0.00 C ATOM 960 CD1 PHE A 61 38.835 67.052 -0.713 1.00 0.00 C ATOM 961 CD2 PHE A 61 37.437 66.076 0.949 1.00 0.00 C ATOM 962 CE1 PHE A 61 39.922 66.943 0.130 1.00 0.00 C ATOM 963 CE2 PHE A 61 38.520 65.964 1.795 1.00 0.00 C ATOM 964 CZ PHE A 61 39.766 66.398 1.386 1.00 0.00 C ATOM 0 H PHE A 61 34.598 67.755 0.155 1.00 0.00 H new ATOM 0 HA PHE A 61 36.743 68.863 -1.260 1.00 0.00 H new ATOM 0 HB2 PHE A 61 35.583 66.137 -0.837 1.00 0.00 H new ATOM 0 HB3 PHE A 61 36.669 66.316 -2.201 1.00 0.00 H new ATOM 0 HD1 PHE A 61 38.963 67.479 -1.697 1.00 0.00 H new ATOM 0 HD2 PHE A 61 36.466 65.734 1.276 1.00 0.00 H new ATOM 0 HE1 PHE A 61 40.894 67.284 -0.194 1.00 0.00 H new ATOM 0 HE2 PHE A 61 38.394 65.536 2.779 1.00 0.00 H new ATOM 0 HZ PHE A 61 40.615 66.311 2.048 1.00 0.00 H new ATOM 974 N LEU A 62 36.299 68.873 -3.711 1.00 0.00 N ATOM 975 CA LEU A 62 36.002 69.037 -5.125 1.00 0.00 C ATOM 976 C LEU A 62 36.922 68.153 -5.961 1.00 0.00 C ATOM 977 O LEU A 62 37.827 67.512 -5.430 1.00 0.00 O ATOM 978 CB LEU A 62 36.157 70.503 -5.535 1.00 0.00 C ATOM 979 CG LEU A 62 35.215 71.476 -4.826 1.00 0.00 C ATOM 980 CD1 LEU A 62 35.504 72.904 -5.256 1.00 0.00 C ATOM 981 CD2 LEU A 62 33.763 71.119 -5.110 1.00 0.00 C ATOM 0 H LEU A 62 37.225 69.203 -3.437 1.00 0.00 H new ATOM 0 HA LEU A 62 34.970 68.735 -5.303 1.00 0.00 H new ATOM 0 HB2 LEU A 62 37.185 70.811 -5.343 1.00 0.00 H new ATOM 0 HB3 LEU A 62 35.995 70.583 -6.610 1.00 0.00 H new ATOM 0 HG LEU A 62 35.385 71.397 -3.752 1.00 0.00 H new ATOM 0 HD11 LEU A 62 34.824 73.583 -4.742 1.00 0.00 H new ATOM 0 HD12 LEU A 62 36.533 73.159 -5.002 1.00 0.00 H new ATOM 0 HD13 LEU A 62 35.362 72.995 -6.333 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.108 71.823 -4.597 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.579 71.169 -6.183 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.560 70.109 -4.754 1.00 0.00 H new ATOM 993 N GLY A 63 36.698 68.134 -7.268 1.00 0.00 N ATOM 994 CA GLY A 63 37.441 67.241 -8.139 1.00 0.00 C ATOM 995 C GLY A 63 38.824 67.745 -8.524 1.00 0.00 C ATOM 996 O GLY A 63 39.551 67.053 -9.233 1.00 0.00 O ATOM 0 H GLY A 63 36.013 68.722 -7.743 1.00 0.00 H new ATOM 0 HA2 GLY A 63 37.544 66.275 -7.646 1.00 0.00 H new ATOM 0 HA3 GLY A 63 36.862 67.075 -9.048 1.00 0.00 H new ATOM 1000 N LEU A 64 39.193 68.942 -8.081 1.00 0.00 N ATOM 1001 CA LEU A 64 40.521 69.483 -8.380 1.00 0.00 C ATOM 1002 C LEU A 64 41.566 68.885 -7.455 1.00 0.00 C ATOM 1003 O LEU A 64 41.413 68.920 -6.232 1.00 0.00 O ATOM 1004 CB LEU A 64 40.551 71.005 -8.246 1.00 0.00 C ATOM 1005 CG LEU A 64 40.112 71.791 -9.478 1.00 0.00 C ATOM 1006 CD1 LEU A 64 40.175 73.281 -9.200 1.00 0.00 C ATOM 1007 CD2 LEU A 64 40.986 71.443 -10.672 1.00 0.00 C ATOM 0 H LEU A 64 38.601 69.553 -7.519 1.00 0.00 H new ATOM 0 HA LEU A 64 40.749 69.216 -9.412 1.00 0.00 H new ATOM 0 HB2 LEU A 64 39.912 71.290 -7.410 1.00 0.00 H new ATOM 0 HB3 LEU A 64 41.566 71.308 -7.988 1.00 0.00 H new ATOM 0 HG LEU A 64 39.082 71.520 -9.712 1.00 0.00 H new ATOM 0 HD11 LEU A 64 39.859 73.830 -10.087 1.00 0.00 H new ATOM 0 HD12 LEU A 64 39.514 73.524 -8.368 1.00 0.00 H new ATOM 0 HD13 LEU A 64 41.197 73.561 -8.945 1.00 0.00 H new ATOM 0 HD21 LEU A 64 40.658 72.013 -11.541 1.00 0.00 H new ATOM 0 HD22 LEU A 64 42.024 71.689 -10.447 1.00 0.00 H new ATOM 0 HD23 LEU A 64 40.904 70.377 -10.885 1.00 0.00 H new ATOM 1019 N ARG A 65 42.629 68.348 -8.034 1.00 0.00 N ATOM 1020 CA ARG A 65 43.690 67.747 -7.240 1.00 0.00 C ATOM 1021 C ARG A 65 45.069 68.117 -7.763 1.00 0.00 C ATOM 1022 O ARG A 65 45.347 67.982 -8.956 1.00 0.00 O ATOM 1023 CB ARG A 65 43.569 66.222 -7.247 1.00 0.00 C ATOM 1024 CG ARG A 65 44.622 65.535 -6.391 1.00 0.00 C ATOM 1025 CD ARG A 65 44.814 64.082 -6.788 1.00 0.00 C ATOM 1026 NE ARG A 65 45.668 63.363 -5.841 1.00 0.00 N ATOM 1027 CZ ARG A 65 46.487 62.368 -6.178 1.00 0.00 C ATOM 1028 NH1 ARG A 65 46.627 62.020 -7.455 1.00 0.00 N ATOM 1029 NH2 ARG A 65 47.189 61.741 -5.241 1.00 0.00 N ATOM 0 H ARG A 65 42.780 68.316 -9.042 1.00 0.00 H new ATOM 0 HA ARG A 65 43.578 68.133 -6.227 1.00 0.00 H new ATOM 0 HB2 ARG A 65 42.579 65.941 -6.889 1.00 0.00 H new ATOM 0 HB3 ARG A 65 43.652 65.862 -8.272 1.00 0.00 H new ATOM 0 HG2 ARG A 65 45.569 66.066 -6.486 1.00 0.00 H new ATOM 0 HG3 ARG A 65 44.330 65.589 -5.342 1.00 0.00 H new ATOM 0 HD2 ARG A 65 43.843 63.591 -6.846 1.00 0.00 H new ATOM 0 HD3 ARG A 65 45.255 64.033 -7.783 1.00 0.00 H new ATOM 0 HE ARG A 65 45.634 63.642 -4.860 1.00 0.00 H new ATOM 0 HH11 ARG A 65 46.106 62.516 -8.179 1.00 0.00 H new ATOM 0 HH12 ARG A 65 47.255 61.258 -7.710 1.00 0.00 H new ATOM 0 HH21 ARG A 65 47.101 62.021 -4.264 1.00 0.00 H new ATOM 0 HH22 ARG A 65 47.816 60.979 -5.498 1.00 0.00 H new ATOM 1043 N ASP A 66 45.923 68.595 -6.870 1.00 0.00 N ATOM 1044 CA ASP A 66 47.352 68.603 -7.129 1.00 0.00 C ATOM 1045 C ASP A 66 47.941 67.344 -6.519 1.00 0.00 C ATOM 1046 O ASP A 66 47.460 66.860 -5.496 1.00 0.00 O ATOM 1047 CB ASP A 66 48.051 69.835 -6.558 1.00 0.00 C ATOM 1048 CG ASP A 66 49.552 69.764 -6.774 1.00 0.00 C ATOM 1049 OD1 ASP A 66 50.022 70.159 -7.863 1.00 0.00 O ATOM 1050 OD2 ASP A 66 50.262 69.266 -5.879 1.00 0.00 O ATOM 0 H ASP A 66 45.652 68.980 -5.965 1.00 0.00 H new ATOM 0 HA ASP A 66 47.508 68.635 -8.207 1.00 0.00 H new ATOM 0 HB2 ASP A 66 47.655 70.733 -7.032 1.00 0.00 H new ATOM 0 HB3 ASP A 66 47.838 69.916 -5.492 1.00 0.00 H new ATOM 1055 N GLU A 67 48.973 66.813 -7.142 1.00 0.00 N ATOM 1056 CA GLU A 67 49.461 65.493 -6.791 1.00 0.00 C ATOM 1057 C GLU A 67 50.976 65.390 -6.914 1.00 0.00 C ATOM 1058 O GLU A 67 51.503 64.302 -7.144 1.00 0.00 O ATOM 1059 CB GLU A 67 48.798 64.471 -7.710 1.00 0.00 C ATOM 1060 CG GLU A 67 48.485 65.034 -9.086 1.00 0.00 C ATOM 1061 CD GLU A 67 48.191 63.966 -10.106 1.00 0.00 C ATOM 1062 OE1 GLU A 67 47.081 63.394 -10.080 1.00 0.00 O ATOM 1063 OE2 GLU A 67 49.076 63.707 -10.946 1.00 0.00 O ATOM 0 H GLU A 67 49.489 67.273 -7.892 1.00 0.00 H new ATOM 0 HA GLU A 67 49.209 65.298 -5.749 1.00 0.00 H new ATOM 0 HB2 GLU A 67 49.453 63.606 -7.816 1.00 0.00 H new ATOM 0 HB3 GLU A 67 47.876 64.118 -7.248 1.00 0.00 H new ATOM 0 HG2 GLU A 67 47.628 65.704 -9.012 1.00 0.00 H new ATOM 0 HG3 GLU A 67 49.329 65.633 -9.428 1.00 0.00 H new ATOM 1070 N ASN A 68 51.673 66.512 -6.766 1.00 0.00 N ATOM 1071 CA ASN A 68 53.139 66.510 -6.857 1.00 0.00 C ATOM 1072 C ASN A 68 53.709 67.911 -6.642 1.00 0.00 C ATOM 1073 O ASN A 68 54.882 68.145 -6.924 1.00 0.00 O ATOM 1074 CB ASN A 68 53.572 66.002 -8.243 1.00 0.00 C ATOM 1075 CG ASN A 68 54.918 65.285 -8.256 1.00 0.00 C ATOM 1076 OD1 ASN A 68 55.109 64.351 -9.032 1.00 0.00 O ATOM 1077 ND2 ASN A 68 55.861 65.725 -7.440 1.00 0.00 N ATOM 0 H ASN A 68 51.258 67.426 -6.585 1.00 0.00 H new ATOM 0 HA ASN A 68 53.523 65.853 -6.077 1.00 0.00 H new ATOM 0 HB2 ASN A 68 52.808 65.323 -8.623 1.00 0.00 H new ATOM 0 HB3 ASN A 68 53.617 66.848 -8.929 1.00 0.00 H new ATOM 0 HD21 ASN A 68 56.782 65.287 -7.442 1.00 0.00 H new ATOM 0 HD22 ASN A 68 55.667 66.503 -6.809 1.00 0.00 H new ATOM 1084 N ALA A 69 52.891 68.834 -6.129 1.00 0.00 N ATOM 1085 CA ALA A 69 53.241 70.254 -6.129 1.00 0.00 C ATOM 1086 C ALA A 69 53.495 70.696 -7.565 1.00 0.00 C ATOM 1087 O ALA A 69 54.297 71.587 -7.836 1.00 0.00 O ATOM 1088 CB ALA A 69 54.451 70.527 -5.239 1.00 0.00 C ATOM 0 H ALA A 69 51.985 68.623 -5.710 1.00 0.00 H new ATOM 0 HA ALA A 69 52.414 70.831 -5.716 1.00 0.00 H new ATOM 0 HB1 ALA A 69 54.686 71.591 -5.260 1.00 0.00 H new ATOM 0 HB2 ALA A 69 54.226 70.226 -4.216 1.00 0.00 H new ATOM 0 HB3 ALA A 69 55.307 69.959 -5.604 1.00 0.00 H new ATOM 1094 N LYS A 70 52.763 70.065 -8.480 1.00 0.00 N ATOM 1095 CA LYS A 70 52.962 70.257 -9.907 1.00 0.00 C ATOM 1096 C LYS A 70 52.187 71.471 -10.401 1.00 0.00 C ATOM 1097 O LYS A 70 52.463 72.001 -11.476 1.00 0.00 O ATOM 1098 CB LYS A 70 52.548 68.995 -10.691 1.00 0.00 C ATOM 1099 CG LYS A 70 51.231 68.367 -10.233 1.00 0.00 C ATOM 1100 CD LYS A 70 50.686 67.362 -11.250 1.00 0.00 C ATOM 1101 CE LYS A 70 51.629 66.182 -11.477 1.00 0.00 C ATOM 1102 NZ LYS A 70 51.379 65.054 -10.533 1.00 0.00 N ATOM 0 H LYS A 70 52.017 69.408 -8.250 1.00 0.00 H new ATOM 0 HA LYS A 70 54.023 70.435 -10.080 1.00 0.00 H new ATOM 0 HB2 LYS A 70 52.466 69.250 -11.748 1.00 0.00 H new ATOM 0 HB3 LYS A 70 53.340 68.252 -10.603 1.00 0.00 H new ATOM 0 HG2 LYS A 70 51.382 67.867 -9.276 1.00 0.00 H new ATOM 0 HG3 LYS A 70 50.493 69.153 -10.070 1.00 0.00 H new ATOM 0 HD2 LYS A 70 49.721 66.990 -10.905 1.00 0.00 H new ATOM 0 HD3 LYS A 70 50.511 67.870 -12.199 1.00 0.00 H new ATOM 0 HE2 LYS A 70 51.517 65.825 -12.501 1.00 0.00 H new ATOM 0 HE3 LYS A 70 52.660 66.520 -11.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 52.215 64.435 -10.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 51.193 65.432 -9.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 50.555 64.507 -10.856 1.00 0.00 H new ATOM 1116 N GLY A 71 51.194 71.886 -9.621 1.00 0.00 N ATOM 1117 CA GLY A 71 50.423 73.069 -9.958 1.00 0.00 C ATOM 1118 C GLY A 71 49.513 72.845 -11.146 1.00 0.00 C ATOM 1119 O GLY A 71 48.869 73.775 -11.632 1.00 0.00 O ATOM 0 H GLY A 71 50.909 71.422 -8.758 1.00 0.00 H new ATOM 0 HA2 GLY A 71 49.825 73.367 -9.097 1.00 0.00 H new ATOM 0 HA3 GLY A 71 51.103 73.893 -10.175 1.00 0.00 H new ATOM 1123 N GLN A 72 49.462 71.609 -11.617 1.00 0.00 N ATOM 1124 CA GLN A 72 48.634 71.264 -12.758 1.00 0.00 C ATOM 1125 C GLN A 72 47.229 70.935 -12.282 1.00 0.00 C ATOM 1126 O GLN A 72 46.891 69.771 -12.060 1.00 0.00 O ATOM 1127 CB GLN A 72 49.226 70.080 -13.531 1.00 0.00 C ATOM 1128 CG GLN A 72 50.664 70.288 -13.991 1.00 0.00 C ATOM 1129 CD GLN A 72 50.842 71.532 -14.841 1.00 0.00 C ATOM 1130 OE1 GLN A 72 50.675 71.496 -16.057 1.00 0.00 O ATOM 1131 NE2 GLN A 72 51.215 72.634 -14.209 1.00 0.00 N ATOM 0 H GLN A 72 49.986 70.827 -11.224 1.00 0.00 H new ATOM 0 HA GLN A 72 48.598 72.118 -13.435 1.00 0.00 H new ATOM 0 HB2 GLN A 72 49.183 69.192 -12.901 1.00 0.00 H new ATOM 0 HB3 GLN A 72 48.603 69.882 -14.403 1.00 0.00 H new ATOM 0 HG2 GLN A 72 51.313 70.356 -13.118 1.00 0.00 H new ATOM 0 HG3 GLN A 72 50.987 69.417 -14.561 1.00 0.00 H new ATOM 0 HE21 GLN A 72 51.343 72.623 -13.197 1.00 0.00 H new ATOM 0 HE22 GLN A 72 51.374 73.494 -14.734 1.00 0.00 H new ATOM 1140 N TRP A 73 46.434 71.974 -12.085 1.00 0.00 N ATOM 1141 CA TRP A 73 45.083 71.820 -11.579 1.00 0.00 C ATOM 1142 C TRP A 73 44.180 71.156 -12.605 1.00 0.00 C ATOM 1143 O TRP A 73 43.790 71.764 -13.600 1.00 0.00 O ATOM 1144 CB TRP A 73 44.507 73.174 -11.165 1.00 0.00 C ATOM 1145 CG TRP A 73 45.170 73.745 -9.952 1.00 0.00 C ATOM 1146 CD1 TRP A 73 46.088 74.754 -9.912 1.00 0.00 C ATOM 1147 CD2 TRP A 73 44.969 73.328 -8.599 1.00 0.00 C ATOM 1148 NE1 TRP A 73 46.467 74.992 -8.613 1.00 0.00 N ATOM 1149 CE2 TRP A 73 45.793 74.129 -7.789 1.00 0.00 C ATOM 1150 CE3 TRP A 73 44.168 72.355 -7.995 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 45.840 73.984 -6.405 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 44.216 72.213 -6.624 1.00 0.00 C ATOM 1153 CH2 TRP A 73 45.046 73.025 -5.842 1.00 0.00 C ATOM 0 H TRP A 73 46.705 72.940 -12.270 1.00 0.00 H new ATOM 0 HA TRP A 73 45.129 71.174 -10.702 1.00 0.00 H new ATOM 0 HB2 TRP A 73 44.611 73.875 -11.993 1.00 0.00 H new ATOM 0 HB3 TRP A 73 43.440 73.065 -10.972 1.00 0.00 H new ATOM 0 HD1 TRP A 73 46.461 75.287 -10.774 1.00 0.00 H new ATOM 0 HE1 TRP A 73 47.140 75.696 -8.311 1.00 0.00 H new ATOM 0 HE3 TRP A 73 43.523 71.726 -8.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 46.481 74.607 -5.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 43.603 71.463 -6.146 1.00 0.00 H new ATOM 0 HH2 TRP A 73 45.059 72.891 -4.770 1.00 0.00 H new ATOM 1164 N ARG A 74 43.868 69.897 -12.357 1.00 0.00 N ATOM 1165 CA ARG A 74 42.966 69.151 -13.210 1.00 0.00 C ATOM 1166 C ARG A 74 41.847 68.552 -12.374 1.00 0.00 C ATOM 1167 O ARG A 74 42.055 68.202 -11.204 1.00 0.00 O ATOM 1168 CB ARG A 74 43.718 68.040 -13.953 1.00 0.00 C ATOM 1169 CG ARG A 74 44.373 67.015 -13.036 1.00 0.00 C ATOM 1170 CD ARG A 74 45.015 65.890 -13.832 1.00 0.00 C ATOM 1171 NE ARG A 74 45.602 64.861 -12.970 1.00 0.00 N ATOM 1172 CZ ARG A 74 45.767 63.588 -13.335 1.00 0.00 C ATOM 1173 NH1 ARG A 74 45.367 63.182 -14.537 1.00 0.00 N ATOM 1174 NH2 ARG A 74 46.326 62.722 -12.499 1.00 0.00 N ATOM 0 H ARG A 74 44.231 69.367 -11.564 1.00 0.00 H new ATOM 0 HA ARG A 74 42.541 69.831 -13.948 1.00 0.00 H new ATOM 0 HB2 ARG A 74 43.023 67.526 -14.617 1.00 0.00 H new ATOM 0 HB3 ARG A 74 44.485 68.492 -14.582 1.00 0.00 H new ATOM 0 HG2 ARG A 74 45.128 67.505 -12.421 1.00 0.00 H new ATOM 0 HG3 ARG A 74 43.627 66.603 -12.357 1.00 0.00 H new ATOM 0 HD2 ARG A 74 44.267 65.434 -14.480 1.00 0.00 H new ATOM 0 HD3 ARG A 74 45.789 66.302 -14.480 1.00 0.00 H new ATOM 0 HE ARG A 74 45.903 65.134 -12.034 1.00 0.00 H new ATOM 0 HH11 ARG A 74 44.934 63.844 -15.181 1.00 0.00 H new ATOM 0 HH12 ARG A 74 45.494 62.209 -14.815 1.00 0.00 H new ATOM 0 HH21 ARG A 74 46.631 63.029 -11.575 1.00 0.00 H new ATOM 0 HH22 ARG A 74 46.451 61.750 -12.780 1.00 0.00 H new ATOM 1188 N TRP A 75 40.659 68.467 -12.952 1.00 0.00 N ATOM 1189 CA TRP A 75 39.551 67.815 -12.282 1.00 0.00 C ATOM 1190 C TRP A 75 39.618 66.311 -12.541 1.00 0.00 C ATOM 1191 O TRP A 75 39.928 65.877 -13.652 1.00 0.00 O ATOM 1192 CB TRP A 75 38.209 68.369 -12.765 1.00 0.00 C ATOM 1193 CG TRP A 75 38.040 69.854 -12.587 1.00 0.00 C ATOM 1194 CD1 TRP A 75 38.418 70.826 -13.466 1.00 0.00 C ATOM 1195 CD2 TRP A 75 37.432 70.537 -11.479 1.00 0.00 C ATOM 1196 NE1 TRP A 75 38.084 72.063 -12.981 1.00 0.00 N ATOM 1197 CE2 TRP A 75 37.480 71.916 -11.763 1.00 0.00 C ATOM 1198 CE3 TRP A 75 36.852 70.123 -10.277 1.00 0.00 C ATOM 1199 CZ2 TRP A 75 36.972 72.877 -10.893 1.00 0.00 C ATOM 1200 CZ3 TRP A 75 36.349 71.077 -9.413 1.00 0.00 C ATOM 1201 CH2 TRP A 75 36.411 72.440 -9.725 1.00 0.00 C ATOM 0 H TRP A 75 40.441 68.839 -13.876 1.00 0.00 H new ATOM 0 HA TRP A 75 39.629 68.010 -11.212 1.00 0.00 H new ATOM 0 HB2 TRP A 75 38.091 68.128 -13.821 1.00 0.00 H new ATOM 0 HB3 TRP A 75 37.408 67.859 -12.230 1.00 0.00 H new ATOM 0 HD1 TRP A 75 38.911 70.646 -14.410 1.00 0.00 H new ATOM 0 HE1 TRP A 75 38.258 72.951 -13.452 1.00 0.00 H new ATOM 0 HE3 TRP A 75 36.798 69.074 -10.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 37.019 73.929 -11.132 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 35.900 70.766 -8.481 1.00 0.00 H new ATOM 0 HH2 TRP A 75 36.008 73.161 -9.029 1.00 0.00 H new ATOM 1212 N VAL A 76 39.331 65.525 -11.512 1.00 0.00 N ATOM 1213 CA VAL A 76 39.392 64.067 -11.604 1.00 0.00 C ATOM 1214 C VAL A 76 38.322 63.513 -12.557 1.00 0.00 C ATOM 1215 O VAL A 76 38.360 62.345 -12.948 1.00 0.00 O ATOM 1216 CB VAL A 76 39.242 63.424 -10.202 1.00 0.00 C ATOM 1217 CG1 VAL A 76 37.849 63.660 -9.634 1.00 0.00 C ATOM 1218 CG2 VAL A 76 39.572 61.937 -10.236 1.00 0.00 C ATOM 0 H VAL A 76 39.051 65.874 -10.595 1.00 0.00 H new ATOM 0 HA VAL A 76 40.370 63.808 -12.011 1.00 0.00 H new ATOM 0 HB VAL A 76 39.960 63.909 -9.541 1.00 0.00 H new ATOM 0 HG11 VAL A 76 37.774 63.197 -8.650 1.00 0.00 H new ATOM 0 HG12 VAL A 76 37.669 64.731 -9.546 1.00 0.00 H new ATOM 0 HG13 VAL A 76 37.106 63.220 -10.299 1.00 0.00 H new ATOM 0 HG21 VAL A 76 39.457 61.516 -9.237 1.00 0.00 H new ATOM 0 HG22 VAL A 76 38.895 61.430 -10.924 1.00 0.00 H new ATOM 0 HG23 VAL A 76 40.600 61.800 -10.571 1.00 0.00 H new ATOM 1228 N ASP A 77 37.382 64.366 -12.944 1.00 0.00 N ATOM 1229 CA ASP A 77 36.290 63.971 -13.833 1.00 0.00 C ATOM 1230 C ASP A 77 36.600 64.405 -15.267 1.00 0.00 C ATOM 1231 O ASP A 77 35.703 64.710 -16.050 1.00 0.00 O ATOM 1232 CB ASP A 77 34.987 64.606 -13.340 1.00 0.00 C ATOM 1233 CG ASP A 77 33.742 64.035 -13.990 1.00 0.00 C ATOM 1234 OD1 ASP A 77 33.533 62.811 -13.895 1.00 0.00 O ATOM 1235 OD2 ASP A 77 32.962 64.823 -14.571 1.00 0.00 O ATOM 0 H ASP A 77 37.352 65.344 -12.655 1.00 0.00 H new ATOM 0 HA ASP A 77 36.180 62.887 -13.825 1.00 0.00 H new ATOM 0 HB2 ASP A 77 34.915 64.473 -12.261 1.00 0.00 H new ATOM 0 HB3 ASP A 77 35.023 65.679 -13.527 1.00 0.00 H new ATOM 1240 N GLN A 78 37.900 64.463 -15.582 1.00 0.00 N ATOM 1241 CA GLN A 78 38.393 64.799 -16.927 1.00 0.00 C ATOM 1242 C GLN A 78 38.195 66.288 -17.238 1.00 0.00 C ATOM 1243 O GLN A 78 38.757 66.815 -18.201 1.00 0.00 O ATOM 1244 CB GLN A 78 37.713 63.915 -17.992 1.00 0.00 C ATOM 1245 CG GLN A 78 38.284 64.070 -19.397 1.00 0.00 C ATOM 1246 CD GLN A 78 37.318 64.739 -20.356 1.00 0.00 C ATOM 1247 OE1 GLN A 78 36.528 64.077 -21.024 1.00 0.00 O ATOM 1248 NE2 GLN A 78 37.376 66.058 -20.434 1.00 0.00 N ATOM 0 H GLN A 78 38.644 64.278 -14.909 1.00 0.00 H new ATOM 0 HA GLN A 78 39.464 64.599 -16.952 1.00 0.00 H new ATOM 0 HB2 GLN A 78 37.801 62.871 -17.690 1.00 0.00 H new ATOM 0 HB3 GLN A 78 36.649 64.151 -18.017 1.00 0.00 H new ATOM 0 HG2 GLN A 78 39.203 64.655 -19.348 1.00 0.00 H new ATOM 0 HG3 GLN A 78 38.552 63.087 -19.785 1.00 0.00 H new ATOM 0 HE21 GLN A 78 38.046 66.574 -19.863 1.00 0.00 H new ATOM 0 HE22 GLN A 78 36.751 66.560 -21.065 1.00 0.00 H new ATOM 1257 N THR A 79 37.414 66.961 -16.405 1.00 0.00 N ATOM 1258 CA THR A 79 37.112 68.370 -16.591 1.00 0.00 C ATOM 1259 C THR A 79 38.392 69.215 -16.584 1.00 0.00 C ATOM 1260 O THR A 79 39.256 69.048 -15.714 1.00 0.00 O ATOM 1261 CB THR A 79 36.162 68.858 -15.479 1.00 0.00 C ATOM 1262 OG1 THR A 79 35.167 67.854 -15.220 1.00 0.00 O ATOM 1263 CG2 THR A 79 35.478 70.161 -15.870 1.00 0.00 C ATOM 0 H THR A 79 36.974 66.546 -15.584 1.00 0.00 H new ATOM 0 HA THR A 79 36.628 68.486 -17.561 1.00 0.00 H new ATOM 0 HB THR A 79 36.753 69.037 -14.581 1.00 0.00 H new ATOM 0 HG1 THR A 79 34.467 68.228 -14.645 1.00 0.00 H new ATOM 0 HG21 THR A 79 34.815 70.479 -15.066 1.00 0.00 H new ATOM 0 HG22 THR A 79 36.231 70.929 -16.045 1.00 0.00 H new ATOM 0 HG23 THR A 79 34.898 70.008 -16.780 1.00 0.00 H new ATOM 1271 N PRO A 80 38.546 70.104 -17.580 1.00 0.00 N ATOM 1272 CA PRO A 80 39.687 71.017 -17.661 1.00 0.00 C ATOM 1273 C PRO A 80 39.588 72.148 -16.644 1.00 0.00 C ATOM 1274 O PRO A 80 38.505 72.456 -16.142 1.00 0.00 O ATOM 1275 CB PRO A 80 39.617 71.577 -19.092 1.00 0.00 C ATOM 1276 CG PRO A 80 38.560 70.784 -19.790 1.00 0.00 C ATOM 1277 CD PRO A 80 37.640 70.277 -18.718 1.00 0.00 C ATOM 0 HA PRO A 80 40.626 70.508 -17.442 1.00 0.00 H new ATOM 0 HB2 PRO A 80 39.368 72.638 -19.085 1.00 0.00 H new ATOM 0 HB3 PRO A 80 40.578 71.478 -19.598 1.00 0.00 H new ATOM 0 HG2 PRO A 80 38.019 71.402 -20.507 1.00 0.00 H new ATOM 0 HG3 PRO A 80 38.999 69.958 -20.349 1.00 0.00 H new ATOM 0 HD2 PRO A 80 36.843 70.987 -18.498 1.00 0.00 H new ATOM 0 HD3 PRO A 80 37.162 69.340 -19.003 1.00 0.00 H new ATOM 1285 N PHE A 81 40.722 72.762 -16.346 1.00 0.00 N ATOM 1286 CA PHE A 81 40.774 73.850 -15.383 1.00 0.00 C ATOM 1287 C PHE A 81 40.119 75.107 -15.957 1.00 0.00 C ATOM 1288 O PHE A 81 40.299 75.427 -17.132 1.00 0.00 O ATOM 1289 CB PHE A 81 42.230 74.133 -15.004 1.00 0.00 C ATOM 1290 CG PHE A 81 42.396 75.157 -13.919 1.00 0.00 C ATOM 1291 CD1 PHE A 81 41.902 74.923 -12.646 1.00 0.00 C ATOM 1292 CD2 PHE A 81 43.050 76.351 -14.172 1.00 0.00 C ATOM 1293 CE1 PHE A 81 42.057 75.862 -11.646 1.00 0.00 C ATOM 1294 CE2 PHE A 81 43.210 77.292 -13.176 1.00 0.00 C ATOM 1295 CZ PHE A 81 42.714 77.047 -11.911 1.00 0.00 C ATOM 0 H PHE A 81 41.623 72.524 -16.760 1.00 0.00 H new ATOM 0 HA PHE A 81 40.223 73.558 -14.489 1.00 0.00 H new ATOM 0 HB2 PHE A 81 42.698 73.202 -14.684 1.00 0.00 H new ATOM 0 HB3 PHE A 81 42.766 74.470 -15.891 1.00 0.00 H new ATOM 0 HD1 PHE A 81 41.390 73.996 -12.434 1.00 0.00 H new ATOM 0 HD2 PHE A 81 43.439 76.548 -15.160 1.00 0.00 H new ATOM 0 HE1 PHE A 81 41.665 75.670 -10.658 1.00 0.00 H new ATOM 0 HE2 PHE A 81 43.723 78.219 -13.386 1.00 0.00 H new ATOM 0 HZ PHE A 81 42.840 77.782 -11.129 1.00 0.00 H new ATOM 1305 N ASN A 82 39.356 75.810 -15.128 1.00 0.00 N ATOM 1306 CA ASN A 82 38.670 77.025 -15.561 1.00 0.00 C ATOM 1307 C ASN A 82 39.538 78.258 -15.330 1.00 0.00 C ATOM 1308 O ASN A 82 39.828 78.614 -14.190 1.00 0.00 O ATOM 1309 CB ASN A 82 37.339 77.194 -14.820 1.00 0.00 C ATOM 1310 CG ASN A 82 36.215 76.361 -15.410 1.00 0.00 C ATOM 1311 OD1 ASN A 82 35.510 76.810 -16.314 1.00 0.00 O ATOM 1312 ND2 ASN A 82 36.023 75.159 -14.888 1.00 0.00 N ATOM 0 H ASN A 82 39.196 75.561 -14.152 1.00 0.00 H new ATOM 0 HA ASN A 82 38.475 76.925 -16.629 1.00 0.00 H new ATOM 0 HB2 ASN A 82 37.476 76.919 -13.774 1.00 0.00 H new ATOM 0 HB3 ASN A 82 37.051 78.245 -14.838 1.00 0.00 H new ATOM 0 HD21 ASN A 82 35.268 74.567 -15.234 1.00 0.00 H new ATOM 0 HD22 ASN A 82 36.630 74.825 -14.140 1.00 0.00 H new ATOM 1319 N PRO A 83 39.953 78.934 -16.417 1.00 0.00 N ATOM 1320 CA PRO A 83 40.797 80.134 -16.342 1.00 0.00 C ATOM 1321 C PRO A 83 40.029 81.374 -15.881 1.00 0.00 C ATOM 1322 O PRO A 83 40.627 82.407 -15.576 1.00 0.00 O ATOM 1323 CB PRO A 83 41.293 80.327 -17.786 1.00 0.00 C ATOM 1324 CG PRO A 83 40.856 79.108 -18.536 1.00 0.00 C ATOM 1325 CD PRO A 83 39.659 78.576 -17.807 1.00 0.00 C ATOM 0 HA PRO A 83 41.597 80.008 -15.612 1.00 0.00 H new ATOM 0 HB2 PRO A 83 40.870 81.230 -18.227 1.00 0.00 H new ATOM 0 HB3 PRO A 83 42.377 80.436 -17.815 1.00 0.00 H new ATOM 0 HG2 PRO A 83 40.606 79.355 -19.568 1.00 0.00 H new ATOM 0 HG3 PRO A 83 41.653 78.365 -18.570 1.00 0.00 H new ATOM 0 HD2 PRO A 83 38.734 79.033 -18.157 1.00 0.00 H new ATOM 0 HD3 PRO A 83 39.551 77.499 -17.935 1.00 0.00 H new ATOM 1333 N ARG A 84 38.704 81.280 -15.859 1.00 0.00 N ATOM 1334 CA ARG A 84 37.866 82.389 -15.413 1.00 0.00 C ATOM 1335 C ARG A 84 36.955 81.953 -14.275 1.00 0.00 C ATOM 1336 O ARG A 84 36.816 82.653 -13.275 1.00 0.00 O ATOM 1337 CB ARG A 84 37.038 82.951 -16.573 1.00 0.00 C ATOM 1338 CG ARG A 84 37.536 84.299 -17.072 1.00 0.00 C ATOM 1339 CD ARG A 84 38.987 84.225 -17.518 1.00 0.00 C ATOM 1340 NE ARG A 84 39.576 85.547 -17.715 1.00 0.00 N ATOM 1341 CZ ARG A 84 40.743 85.923 -17.187 1.00 0.00 C ATOM 1342 NH1 ARG A 84 41.425 85.082 -16.411 1.00 0.00 N ATOM 1343 NH2 ARG A 84 41.222 87.139 -17.427 1.00 0.00 N ATOM 0 H ARG A 84 38.187 80.448 -16.144 1.00 0.00 H new ATOM 0 HA ARG A 84 38.523 83.178 -15.047 1.00 0.00 H new ATOM 0 HB2 ARG A 84 37.051 82.239 -17.398 1.00 0.00 H new ATOM 0 HB3 ARG A 84 36.000 83.050 -16.255 1.00 0.00 H new ATOM 0 HG2 ARG A 84 36.915 84.633 -17.903 1.00 0.00 H new ATOM 0 HG3 ARG A 84 37.435 85.041 -16.280 1.00 0.00 H new ATOM 0 HD2 ARG A 84 39.566 83.679 -16.773 1.00 0.00 H new ATOM 0 HD3 ARG A 84 39.050 83.660 -18.448 1.00 0.00 H new ATOM 0 HE ARG A 84 39.067 86.220 -18.288 1.00 0.00 H new ATOM 0 HH11 ARG A 84 41.056 84.151 -16.220 1.00 0.00 H new ATOM 0 HH12 ARG A 84 42.317 85.369 -16.008 1.00 0.00 H new ATOM 0 HH21 ARG A 84 40.698 87.787 -18.015 1.00 0.00 H new ATOM 0 HH22 ARG A 84 42.114 87.425 -17.023 1.00 0.00 H new ATOM 1357 N ARG A 85 36.356 80.780 -14.420 1.00 0.00 N ATOM 1358 CA ARG A 85 35.483 80.233 -13.390 1.00 0.00 C ATOM 1359 C ARG A 85 36.313 79.515 -12.338 1.00 0.00 C ATOM 1360 O ARG A 85 36.064 78.355 -12.018 1.00 0.00 O ATOM 1361 CB ARG A 85 34.474 79.264 -14.007 1.00 0.00 C ATOM 1362 CG ARG A 85 33.508 79.919 -14.971 1.00 0.00 C ATOM 1363 CD ARG A 85 32.616 78.890 -15.639 1.00 0.00 C ATOM 1364 NE ARG A 85 31.627 79.516 -16.508 1.00 0.00 N ATOM 1365 CZ ARG A 85 31.224 79.020 -17.671 1.00 0.00 C ATOM 1366 NH1 ARG A 85 31.730 77.877 -18.130 1.00 0.00 N ATOM 1367 NH2 ARG A 85 30.313 79.681 -18.371 1.00 0.00 N ATOM 0 H ARG A 85 36.459 80.187 -15.243 1.00 0.00 H new ATOM 0 HA ARG A 85 34.939 81.052 -12.921 1.00 0.00 H new ATOM 0 HB2 ARG A 85 35.015 78.475 -14.529 1.00 0.00 H new ATOM 0 HB3 ARG A 85 33.907 78.787 -13.208 1.00 0.00 H new ATOM 0 HG2 ARG A 85 32.894 80.645 -14.438 1.00 0.00 H new ATOM 0 HG3 ARG A 85 34.065 80.469 -15.730 1.00 0.00 H new ATOM 0 HD2 ARG A 85 33.228 78.201 -16.221 1.00 0.00 H new ATOM 0 HD3 ARG A 85 32.108 78.299 -14.877 1.00 0.00 H new ATOM 0 HE ARG A 85 31.216 80.397 -16.200 1.00 0.00 H new ATOM 0 HH11 ARG A 85 32.433 77.376 -17.587 1.00 0.00 H new ATOM 0 HH12 ARG A 85 31.415 77.503 -19.025 1.00 0.00 H new ATOM 0 HH21 ARG A 85 29.932 80.557 -18.014 1.00 0.00 H new ATOM 0 HH22 ARG A 85 29.993 79.313 -19.267 1.00 0.00 H new ATOM 1381 N VAL A 86 37.308 80.209 -11.818 1.00 0.00 N ATOM 1382 CA VAL A 86 38.213 79.617 -10.857 1.00 0.00 C ATOM 1383 C VAL A 86 37.806 79.995 -9.432 1.00 0.00 C ATOM 1384 O VAL A 86 37.964 79.202 -8.510 1.00 0.00 O ATOM 1385 CB VAL A 86 39.674 80.023 -11.145 1.00 0.00 C ATOM 1386 CG1 VAL A 86 39.925 81.496 -10.849 1.00 0.00 C ATOM 1387 CG2 VAL A 86 40.626 79.136 -10.372 1.00 0.00 C ATOM 0 H VAL A 86 37.508 81.183 -12.046 1.00 0.00 H new ATOM 0 HA VAL A 86 38.148 78.533 -10.952 1.00 0.00 H new ATOM 0 HB VAL A 86 39.857 79.882 -12.210 1.00 0.00 H new ATOM 0 HG11 VAL A 86 40.965 81.738 -11.066 1.00 0.00 H new ATOM 0 HG12 VAL A 86 39.273 82.108 -11.471 1.00 0.00 H new ATOM 0 HG13 VAL A 86 39.717 81.697 -9.798 1.00 0.00 H new ATOM 0 HG21 VAL A 86 41.653 79.433 -10.584 1.00 0.00 H new ATOM 0 HG22 VAL A 86 40.432 79.237 -9.304 1.00 0.00 H new ATOM 0 HG23 VAL A 86 40.479 78.098 -10.670 1.00 0.00 H new ATOM 1397 N PHE A 87 37.268 81.209 -9.278 1.00 0.00 N ATOM 1398 CA PHE A 87 36.679 81.679 -8.017 1.00 0.00 C ATOM 1399 C PHE A 87 37.726 81.884 -6.916 1.00 0.00 C ATOM 1400 O PHE A 87 37.955 83.012 -6.479 1.00 0.00 O ATOM 1401 CB PHE A 87 35.582 80.716 -7.541 1.00 0.00 C ATOM 1402 CG PHE A 87 34.548 80.417 -8.595 1.00 0.00 C ATOM 1403 CD1 PHE A 87 33.701 81.412 -9.058 1.00 0.00 C ATOM 1404 CD2 PHE A 87 34.430 79.142 -9.124 1.00 0.00 C ATOM 1405 CE1 PHE A 87 32.756 81.138 -10.031 1.00 0.00 C ATOM 1406 CE2 PHE A 87 33.488 78.862 -10.095 1.00 0.00 C ATOM 1407 CZ PHE A 87 32.650 79.862 -10.550 1.00 0.00 C ATOM 0 H PHE A 87 37.228 81.899 -10.029 1.00 0.00 H new ATOM 0 HA PHE A 87 36.236 82.654 -8.220 1.00 0.00 H new ATOM 0 HB2 PHE A 87 36.043 79.782 -7.220 1.00 0.00 H new ATOM 0 HB3 PHE A 87 35.087 81.143 -6.669 1.00 0.00 H new ATOM 0 HD1 PHE A 87 33.779 82.411 -8.655 1.00 0.00 H new ATOM 0 HD2 PHE A 87 35.083 78.357 -8.773 1.00 0.00 H new ATOM 0 HE1 PHE A 87 32.102 81.921 -10.384 1.00 0.00 H new ATOM 0 HE2 PHE A 87 33.407 77.863 -10.498 1.00 0.00 H new ATOM 0 HZ PHE A 87 31.913 79.647 -11.310 1.00 0.00 H new ATOM 1417 N TRP A 88 38.354 80.791 -6.489 1.00 0.00 N ATOM 1418 CA TRP A 88 39.323 80.794 -5.389 1.00 0.00 C ATOM 1419 C TRP A 88 38.776 81.419 -4.102 1.00 0.00 C ATOM 1420 O TRP A 88 37.569 81.652 -3.954 1.00 0.00 O ATOM 1421 CB TRP A 88 40.614 81.498 -5.807 1.00 0.00 C ATOM 1422 CG TRP A 88 41.566 80.601 -6.530 1.00 0.00 C ATOM 1423 CD1 TRP A 88 41.984 80.729 -7.816 1.00 0.00 C ATOM 1424 CD2 TRP A 88 42.212 79.432 -6.009 1.00 0.00 C ATOM 1425 NE1 TRP A 88 42.863 79.718 -8.130 1.00 0.00 N ATOM 1426 CE2 TRP A 88 43.017 78.908 -7.036 1.00 0.00 C ATOM 1427 CE3 TRP A 88 42.190 78.780 -4.771 1.00 0.00 C ATOM 1428 CZ2 TRP A 88 43.792 77.764 -6.866 1.00 0.00 C ATOM 1429 CZ3 TRP A 88 42.959 77.644 -4.603 1.00 0.00 C ATOM 1430 CH2 TRP A 88 43.751 77.146 -5.646 1.00 0.00 C ATOM 0 H TRP A 88 38.205 79.869 -6.899 1.00 0.00 H new ATOM 0 HA TRP A 88 39.533 79.748 -5.167 1.00 0.00 H new ATOM 0 HB2 TRP A 88 40.367 82.346 -6.446 1.00 0.00 H new ATOM 0 HB3 TRP A 88 41.105 81.899 -4.920 1.00 0.00 H new ATOM 0 HD1 TRP A 88 41.672 81.510 -8.493 1.00 0.00 H new ATOM 0 HE1 TRP A 88 43.325 79.592 -9.031 1.00 0.00 H new ATOM 0 HE3 TRP A 88 41.583 79.158 -3.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 44.404 77.378 -7.668 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 42.949 77.132 -3.652 1.00 0.00 H new ATOM 0 HH2 TRP A 88 44.341 76.256 -5.484 1.00 0.00 H new ATOM 1441 N HIS A 89 39.678 81.649 -3.159 1.00 0.00 N ATOM 1442 CA HIS A 89 39.340 82.244 -1.882 1.00 0.00 C ATOM 1443 C HIS A 89 39.682 83.729 -1.895 1.00 0.00 C ATOM 1444 O HIS A 89 39.196 84.485 -1.047 1.00 0.00 O ATOM 1445 CB HIS A 89 40.099 81.532 -0.753 1.00 0.00 C ATOM 1446 CG HIS A 89 39.460 81.672 0.593 1.00 0.00 C ATOM 1447 ND1 HIS A 89 38.607 82.702 0.917 1.00 0.00 N ATOM 1448 CD2 HIS A 89 39.518 80.878 1.688 1.00 0.00 C ATOM 1449 CE1 HIS A 89 38.164 82.537 2.145 1.00 0.00 C ATOM 1450 NE2 HIS A 89 38.702 81.439 2.641 1.00 0.00 N ATOM 0 H HIS A 89 40.668 81.426 -3.262 1.00 0.00 H new ATOM 0 HA HIS A 89 38.270 82.132 -1.708 1.00 0.00 H new ATOM 0 HB2 HIS A 89 40.181 80.473 -0.996 1.00 0.00 H new ATOM 0 HB3 HIS A 89 41.113 81.928 -0.705 1.00 0.00 H new ATOM 0 HD1 HIS A 89 38.357 83.475 0.300 1.00 0.00 H new ATOM 0 HD2 HIS A 89 40.097 79.973 1.793 1.00 0.00 H new ATOM 0 HE1 HIS A 89 37.476 83.190 2.660 1.00 0.00 H new ATOM 1459 N LYS A 90 40.536 84.117 -2.854 1.00 0.00 N ATOM 1460 CA LYS A 90 40.940 85.515 -3.076 1.00 0.00 C ATOM 1461 C LYS A 90 42.085 85.910 -2.137 1.00 0.00 C ATOM 1462 O LYS A 90 42.634 87.015 -2.218 1.00 0.00 O ATOM 1463 CB LYS A 90 39.746 86.471 -2.918 1.00 0.00 C ATOM 1464 CG LYS A 90 40.084 87.931 -3.149 1.00 0.00 C ATOM 1465 CD LYS A 90 39.380 88.821 -2.143 1.00 0.00 C ATOM 1466 CE LYS A 90 40.353 89.792 -1.496 1.00 0.00 C ATOM 1467 NZ LYS A 90 41.464 89.081 -0.803 1.00 0.00 N ATOM 0 H LYS A 90 40.971 83.463 -3.505 1.00 0.00 H new ATOM 0 HA LYS A 90 41.300 85.598 -4.102 1.00 0.00 H new ATOM 0 HB2 LYS A 90 38.964 86.176 -3.617 1.00 0.00 H new ATOM 0 HB3 LYS A 90 39.336 86.359 -1.914 1.00 0.00 H new ATOM 0 HG2 LYS A 90 41.162 88.074 -3.074 1.00 0.00 H new ATOM 0 HG3 LYS A 90 39.794 88.219 -4.159 1.00 0.00 H new ATOM 0 HD2 LYS A 90 38.583 89.376 -2.639 1.00 0.00 H new ATOM 0 HD3 LYS A 90 38.910 88.206 -1.375 1.00 0.00 H new ATOM 0 HE2 LYS A 90 40.764 90.456 -2.257 1.00 0.00 H new ATOM 0 HE3 LYS A 90 39.820 90.419 -0.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 42.010 89.760 -0.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 41.071 88.346 -0.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 42.088 88.640 -1.509 1.00 0.00 H new ATOM 1481 N ASN A 91 42.430 85.001 -1.244 1.00 0.00 N ATOM 1482 CA ASN A 91 43.552 85.184 -0.328 1.00 0.00 C ATOM 1483 C ASN A 91 43.866 83.873 0.379 1.00 0.00 C ATOM 1484 O ASN A 91 43.570 83.683 1.558 1.00 0.00 O ATOM 1485 CB ASN A 91 43.302 86.320 0.685 1.00 0.00 C ATOM 1486 CG ASN A 91 41.931 86.286 1.340 1.00 0.00 C ATOM 1487 OD1 ASN A 91 40.971 86.876 0.831 1.00 0.00 O ATOM 1488 ND2 ASN A 91 41.829 85.619 2.475 1.00 0.00 N ATOM 0 H ASN A 91 41.943 84.112 -1.129 1.00 0.00 H new ATOM 0 HA ASN A 91 44.418 85.483 -0.918 1.00 0.00 H new ATOM 0 HB2 ASN A 91 44.064 86.271 1.463 1.00 0.00 H new ATOM 0 HB3 ASN A 91 43.425 87.277 0.177 1.00 0.00 H new ATOM 0 HD21 ASN A 91 40.935 85.578 2.964 1.00 0.00 H new ATOM 0 HD22 ASN A 91 42.645 85.145 2.863 1.00 0.00 H new ATOM 1495 N GLU A 92 44.440 82.958 -0.379 1.00 0.00 N ATOM 1496 CA GLU A 92 44.763 81.629 0.106 1.00 0.00 C ATOM 1497 C GLU A 92 46.248 81.332 -0.086 1.00 0.00 C ATOM 1498 O GLU A 92 46.870 81.816 -1.033 1.00 0.00 O ATOM 1499 CB GLU A 92 43.916 80.576 -0.628 1.00 0.00 C ATOM 1500 CG GLU A 92 44.070 80.588 -2.148 1.00 0.00 C ATOM 1501 CD GLU A 92 43.445 81.808 -2.805 1.00 0.00 C ATOM 1502 OE1 GLU A 92 42.233 81.769 -3.094 1.00 0.00 O ATOM 1503 OE2 GLU A 92 44.153 82.814 -3.007 1.00 0.00 O ATOM 0 H GLU A 92 44.697 83.116 -1.353 1.00 0.00 H new ATOM 0 HA GLU A 92 44.536 81.587 1.171 1.00 0.00 H new ATOM 0 HB2 GLU A 92 44.185 79.588 -0.256 1.00 0.00 H new ATOM 0 HB3 GLU A 92 42.866 80.735 -0.380 1.00 0.00 H new ATOM 0 HG2 GLU A 92 45.130 80.551 -2.399 1.00 0.00 H new ATOM 0 HG3 GLU A 92 43.613 79.688 -2.560 1.00 0.00 H new ATOM 1510 N PRO A 93 46.847 80.568 0.837 1.00 0.00 N ATOM 1511 CA PRO A 93 48.227 80.133 0.730 1.00 0.00 C ATOM 1512 C PRO A 93 48.341 78.728 0.145 1.00 0.00 C ATOM 1513 O PRO A 93 47.364 78.167 -0.348 1.00 0.00 O ATOM 1514 CB PRO A 93 48.666 80.142 2.191 1.00 0.00 C ATOM 1515 CG PRO A 93 47.434 79.775 2.966 1.00 0.00 C ATOM 1516 CD PRO A 93 46.240 80.086 2.087 1.00 0.00 C ATOM 0 HA PRO A 93 48.827 80.759 0.070 1.00 0.00 H new ATOM 0 HB2 PRO A 93 49.471 79.428 2.366 1.00 0.00 H new ATOM 0 HB3 PRO A 93 49.040 81.122 2.485 1.00 0.00 H new ATOM 0 HG2 PRO A 93 47.449 78.719 3.234 1.00 0.00 H new ATOM 0 HG3 PRO A 93 47.383 80.339 3.897 1.00 0.00 H new ATOM 0 HD2 PRO A 93 45.625 79.202 1.919 1.00 0.00 H new ATOM 0 HD3 PRO A 93 45.596 80.842 2.538 1.00 0.00 H new ATOM 1524 N ASP A 94 49.542 78.173 0.194 1.00 0.00 N ATOM 1525 CA ASP A 94 49.757 76.781 -0.171 1.00 0.00 C ATOM 1526 C ASP A 94 50.407 76.063 0.997 1.00 0.00 C ATOM 1527 O ASP A 94 51.598 76.234 1.261 1.00 0.00 O ATOM 1528 CB ASP A 94 50.629 76.658 -1.427 1.00 0.00 C ATOM 1529 CG ASP A 94 50.854 75.212 -1.841 1.00 0.00 C ATOM 1530 OD1 ASP A 94 49.925 74.604 -2.418 1.00 0.00 O ATOM 1531 OD2 ASP A 94 51.956 74.682 -1.595 1.00 0.00 O ATOM 0 H ASP A 94 50.386 78.667 0.484 1.00 0.00 H new ATOM 0 HA ASP A 94 48.794 76.324 -0.400 1.00 0.00 H new ATOM 0 HB2 ASP A 94 50.157 77.198 -2.248 1.00 0.00 H new ATOM 0 HB3 ASP A 94 51.592 77.134 -1.245 1.00 0.00 H new ATOM 1536 N ASN A 95 49.608 75.318 1.738 1.00 0.00 N ATOM 1537 CA ASN A 95 50.100 74.601 2.902 1.00 0.00 C ATOM 1538 C ASN A 95 50.265 73.127 2.575 1.00 0.00 C ATOM 1539 O ASN A 95 51.139 72.444 3.112 1.00 0.00 O ATOM 1540 CB ASN A 95 49.140 74.787 4.082 1.00 0.00 C ATOM 1541 CG ASN A 95 49.572 74.026 5.324 1.00 0.00 C ATOM 1542 OD1 ASN A 95 50.345 74.528 6.138 1.00 0.00 O ATOM 1543 ND2 ASN A 95 49.057 72.816 5.489 1.00 0.00 N ATOM 0 H ASN A 95 48.612 75.193 1.555 1.00 0.00 H new ATOM 0 HA ASN A 95 51.073 75.005 3.182 1.00 0.00 H new ATOM 0 HB2 ASN A 95 49.067 75.848 4.320 1.00 0.00 H new ATOM 0 HB3 ASN A 95 48.144 74.457 3.788 1.00 0.00 H new ATOM 0 HD21 ASN A 95 49.299 72.267 6.314 1.00 0.00 H new ATOM 0 HD22 ASN A 95 48.419 72.434 4.791 1.00 0.00 H new ATOM 1550 N SER A 96 49.426 72.639 1.677 1.00 0.00 N ATOM 1551 CA SER A 96 49.464 71.241 1.298 1.00 0.00 C ATOM 1552 C SER A 96 50.362 71.032 0.079 1.00 0.00 C ATOM 1553 O SER A 96 49.899 70.623 -0.989 1.00 0.00 O ATOM 1554 CB SER A 96 48.050 70.733 1.017 1.00 0.00 C ATOM 1555 OG SER A 96 48.025 69.318 0.945 1.00 0.00 O ATOM 0 H SER A 96 48.713 73.190 1.199 1.00 0.00 H new ATOM 0 HA SER A 96 49.883 70.670 2.127 1.00 0.00 H new ATOM 0 HB2 SER A 96 47.375 71.073 1.802 1.00 0.00 H new ATOM 0 HB3 SER A 96 47.687 71.155 0.080 1.00 0.00 H new ATOM 0 HG SER A 96 47.649 69.041 0.083 1.00 0.00 H new ATOM 1561 N GLN A 97 51.647 71.323 0.247 1.00 0.00 N ATOM 1562 CA GLN A 97 52.623 71.126 -0.816 1.00 0.00 C ATOM 1563 C GLN A 97 52.849 69.633 -1.076 1.00 0.00 C ATOM 1564 O GLN A 97 53.629 68.970 -0.390 1.00 0.00 O ATOM 1565 CB GLN A 97 53.946 71.827 -0.475 1.00 0.00 C ATOM 1566 CG GLN A 97 54.486 71.497 0.909 1.00 0.00 C ATOM 1567 CD GLN A 97 55.887 72.030 1.133 1.00 0.00 C ATOM 1568 OE1 GLN A 97 56.079 73.149 1.598 1.00 0.00 O ATOM 1569 NE2 GLN A 97 56.882 71.220 0.804 1.00 0.00 N ATOM 0 H GLN A 97 52.037 71.697 1.112 1.00 0.00 H new ATOM 0 HA GLN A 97 52.228 71.572 -1.728 1.00 0.00 H new ATOM 0 HB2 GLN A 97 54.693 71.552 -1.220 1.00 0.00 H new ATOM 0 HB3 GLN A 97 53.803 72.905 -0.550 1.00 0.00 H new ATOM 0 HG2 GLN A 97 53.819 71.913 1.664 1.00 0.00 H new ATOM 0 HG3 GLN A 97 54.487 70.416 1.046 1.00 0.00 H new ATOM 0 HE21 GLN A 97 56.682 70.296 0.420 1.00 0.00 H new ATOM 0 HE22 GLN A 97 57.848 71.520 0.935 1.00 0.00 H new ATOM 1578 N GLY A 98 52.135 69.109 -2.057 1.00 0.00 N ATOM 1579 CA GLY A 98 52.220 67.700 -2.383 1.00 0.00 C ATOM 1580 C GLY A 98 50.906 67.188 -2.927 1.00 0.00 C ATOM 1581 O GLY A 98 50.787 66.905 -4.114 1.00 0.00 O ATOM 0 H GLY A 98 51.490 69.641 -2.641 1.00 0.00 H new ATOM 0 HA2 GLY A 98 53.009 67.540 -3.118 1.00 0.00 H new ATOM 0 HA3 GLY A 98 52.494 67.133 -1.493 1.00 0.00 H new ATOM 1585 N GLU A 99 49.921 67.075 -2.050 1.00 0.00 N ATOM 1586 CA GLU A 99 48.562 66.759 -2.460 1.00 0.00 C ATOM 1587 C GLU A 99 47.641 67.913 -2.120 1.00 0.00 C ATOM 1588 O GLU A 99 46.981 67.905 -1.078 1.00 0.00 O ATOM 1589 CB GLU A 99 48.039 65.497 -1.779 1.00 0.00 C ATOM 1590 CG GLU A 99 48.617 64.206 -2.316 1.00 0.00 C ATOM 1591 CD GLU A 99 47.789 63.012 -1.893 1.00 0.00 C ATOM 1592 OE1 GLU A 99 47.871 62.615 -0.713 1.00 0.00 O ATOM 1593 OE2 GLU A 99 47.033 62.483 -2.740 1.00 0.00 O ATOM 0 H GLU A 99 50.039 67.198 -1.044 1.00 0.00 H new ATOM 0 HA GLU A 99 48.580 66.587 -3.536 1.00 0.00 H new ATOM 0 HB2 GLU A 99 48.254 65.560 -0.712 1.00 0.00 H new ATOM 0 HB3 GLU A 99 46.955 65.466 -1.884 1.00 0.00 H new ATOM 0 HG2 GLU A 99 48.663 64.251 -3.404 1.00 0.00 H new ATOM 0 HG3 GLU A 99 49.640 64.087 -1.958 1.00 0.00 H new ATOM 1600 N ASN A 100 47.617 68.920 -2.969 1.00 0.00 N ATOM 1601 CA ASN A 100 46.762 70.064 -2.729 1.00 0.00 C ATOM 1602 C ASN A 100 45.410 69.849 -3.393 1.00 0.00 C ATOM 1603 O ASN A 100 45.263 70.000 -4.604 1.00 0.00 O ATOM 1604 CB ASN A 100 47.416 71.360 -3.227 1.00 0.00 C ATOM 1605 CG ASN A 100 46.672 72.606 -2.766 1.00 0.00 C ATOM 1606 OD1 ASN A 100 45.454 72.593 -2.585 1.00 0.00 O ATOM 1607 ND2 ASN A 100 47.399 73.692 -2.561 1.00 0.00 N ATOM 0 H ASN A 100 48.173 68.970 -3.822 1.00 0.00 H new ATOM 0 HA ASN A 100 46.614 70.165 -1.654 1.00 0.00 H new ATOM 0 HB2 ASN A 100 48.445 71.403 -2.871 1.00 0.00 H new ATOM 0 HB3 ASN A 100 47.456 71.347 -4.316 1.00 0.00 H new ATOM 0 HD21 ASN A 100 46.952 74.552 -2.243 1.00 0.00 H new ATOM 0 HD22 ASN A 100 48.406 73.669 -2.720 1.00 0.00 H new ATOM 1614 N CYS A 101 44.442 69.444 -2.595 1.00 0.00 N ATOM 1615 CA CYS A 101 43.074 69.318 -3.056 1.00 0.00 C ATOM 1616 C CYS A 101 42.264 70.494 -2.538 1.00 0.00 C ATOM 1617 O CYS A 101 42.408 70.893 -1.382 1.00 0.00 O ATOM 1618 CB CYS A 101 42.464 67.993 -2.586 1.00 0.00 C ATOM 1619 SG CYS A 101 42.962 66.543 -3.564 1.00 0.00 S ATOM 0 H CYS A 101 44.580 69.195 -1.616 1.00 0.00 H new ATOM 0 HA CYS A 101 43.060 69.322 -4.146 1.00 0.00 H new ATOM 0 HB2 CYS A 101 42.745 67.827 -1.546 1.00 0.00 H new ATOM 0 HB3 CYS A 101 41.378 68.078 -2.613 1.00 0.00 H new ATOM 1624 N VAL A 102 41.435 71.071 -3.392 1.00 0.00 N ATOM 1625 CA VAL A 102 40.634 72.214 -2.992 1.00 0.00 C ATOM 1626 C VAL A 102 39.265 71.773 -2.499 1.00 0.00 C ATOM 1627 O VAL A 102 38.648 70.861 -3.058 1.00 0.00 O ATOM 1628 CB VAL A 102 40.461 73.245 -4.129 1.00 0.00 C ATOM 1629 CG1 VAL A 102 41.802 73.842 -4.521 1.00 0.00 C ATOM 1630 CG2 VAL A 102 39.780 72.619 -5.337 1.00 0.00 C ATOM 0 H VAL A 102 41.300 70.770 -4.357 1.00 0.00 H new ATOM 0 HA VAL A 102 41.178 72.698 -2.181 1.00 0.00 H new ATOM 0 HB VAL A 102 39.822 74.047 -3.760 1.00 0.00 H new ATOM 0 HG11 VAL A 102 41.658 74.566 -5.323 1.00 0.00 H new ATOM 0 HG12 VAL A 102 42.245 74.340 -3.658 1.00 0.00 H new ATOM 0 HG13 VAL A 102 42.467 73.049 -4.863 1.00 0.00 H new ATOM 0 HG21 VAL A 102 39.671 73.368 -6.122 1.00 0.00 H new ATOM 0 HG22 VAL A 102 40.384 71.791 -5.707 1.00 0.00 H new ATOM 0 HG23 VAL A 102 38.796 72.250 -5.049 1.00 0.00 H new ATOM 1640 N VAL A 103 38.811 72.402 -1.432 1.00 0.00 N ATOM 1641 CA VAL A 103 37.487 72.137 -0.906 1.00 0.00 C ATOM 1642 C VAL A 103 36.613 73.378 -0.999 1.00 0.00 C ATOM 1643 O VAL A 103 37.103 74.503 -0.899 1.00 0.00 O ATOM 1644 CB VAL A 103 37.523 71.649 0.561 1.00 0.00 C ATOM 1645 CG1 VAL A 103 38.169 70.279 0.657 1.00 0.00 C ATOM 1646 CG2 VAL A 103 38.256 72.644 1.448 1.00 0.00 C ATOM 0 H VAL A 103 39.341 73.101 -0.912 1.00 0.00 H new ATOM 0 HA VAL A 103 37.064 71.340 -1.518 1.00 0.00 H new ATOM 0 HB VAL A 103 36.494 71.571 0.913 1.00 0.00 H new ATOM 0 HG11 VAL A 103 38.184 69.956 1.698 1.00 0.00 H new ATOM 0 HG12 VAL A 103 37.598 69.565 0.063 1.00 0.00 H new ATOM 0 HG13 VAL A 103 39.190 70.331 0.279 1.00 0.00 H new ATOM 0 HG21 VAL A 103 38.267 72.277 2.474 1.00 0.00 H new ATOM 0 HG22 VAL A 103 39.280 72.762 1.094 1.00 0.00 H new ATOM 0 HG23 VAL A 103 37.747 73.607 1.412 1.00 0.00 H new ATOM 1656 N LEU A 104 35.327 73.156 -1.203 1.00 0.00 N ATOM 1657 CA LEU A 104 34.350 74.224 -1.230 1.00 0.00 C ATOM 1658 C LEU A 104 33.952 74.546 0.202 1.00 0.00 C ATOM 1659 O LEU A 104 33.195 73.800 0.826 1.00 0.00 O ATOM 1660 CB LEU A 104 33.122 73.791 -2.042 1.00 0.00 C ATOM 1661 CG LEU A 104 32.132 74.904 -2.398 1.00 0.00 C ATOM 1662 CD1 LEU A 104 32.819 76.014 -3.175 1.00 0.00 C ATOM 1663 CD2 LEU A 104 30.978 74.339 -3.207 1.00 0.00 C ATOM 0 H LEU A 104 34.932 72.228 -1.355 1.00 0.00 H new ATOM 0 HA LEU A 104 34.774 75.110 -1.703 1.00 0.00 H new ATOM 0 HB2 LEU A 104 33.466 73.327 -2.967 1.00 0.00 H new ATOM 0 HB3 LEU A 104 32.590 73.024 -1.480 1.00 0.00 H new ATOM 0 HG LEU A 104 31.745 75.325 -1.470 1.00 0.00 H new ATOM 0 HD11 LEU A 104 32.094 76.792 -3.416 1.00 0.00 H new ATOM 0 HD12 LEU A 104 33.620 76.439 -2.571 1.00 0.00 H new ATOM 0 HD13 LEU A 104 33.236 75.609 -4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 104 30.281 75.139 -3.454 1.00 0.00 H new ATOM 0 HD22 LEU A 104 31.361 73.895 -4.126 1.00 0.00 H new ATOM 0 HD23 LEU A 104 30.463 73.577 -2.623 1.00 0.00 H new ATOM 1675 N VAL A 105 34.500 75.623 0.731 1.00 0.00 N ATOM 1676 CA VAL A 105 34.278 75.984 2.120 1.00 0.00 C ATOM 1677 C VAL A 105 33.731 77.404 2.237 1.00 0.00 C ATOM 1678 O VAL A 105 34.127 78.302 1.489 1.00 0.00 O ATOM 1679 CB VAL A 105 35.580 75.834 2.949 1.00 0.00 C ATOM 1680 CG1 VAL A 105 36.710 76.666 2.359 1.00 0.00 C ATOM 1681 CG2 VAL A 105 35.346 76.199 4.409 1.00 0.00 C ATOM 0 H VAL A 105 35.104 76.266 0.219 1.00 0.00 H new ATOM 0 HA VAL A 105 33.534 75.298 2.525 1.00 0.00 H new ATOM 0 HB VAL A 105 35.878 74.786 2.906 1.00 0.00 H new ATOM 0 HG11 VAL A 105 37.609 76.539 2.963 1.00 0.00 H new ATOM 0 HG12 VAL A 105 36.909 76.338 1.339 1.00 0.00 H new ATOM 0 HG13 VAL A 105 36.423 77.717 2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 105 36.276 76.085 4.966 1.00 0.00 H new ATOM 0 HG22 VAL A 105 35.008 77.233 4.476 1.00 0.00 H new ATOM 0 HG23 VAL A 105 34.587 75.541 4.831 1.00 0.00 H new ATOM 1691 N TYR A 106 32.804 77.586 3.165 1.00 0.00 N ATOM 1692 CA TYR A 106 32.209 78.885 3.418 1.00 0.00 C ATOM 1693 C TYR A 106 33.073 79.656 4.405 1.00 0.00 C ATOM 1694 O TYR A 106 33.017 79.424 5.612 1.00 0.00 O ATOM 1695 CB TYR A 106 30.800 78.697 3.978 1.00 0.00 C ATOM 1696 CG TYR A 106 29.932 79.937 3.970 1.00 0.00 C ATOM 1697 CD1 TYR A 106 29.241 80.302 2.827 1.00 0.00 C ATOM 1698 CD2 TYR A 106 29.767 80.714 5.113 1.00 0.00 C ATOM 1699 CE1 TYR A 106 28.417 81.405 2.812 1.00 0.00 C ATOM 1700 CE2 TYR A 106 28.931 81.815 5.110 1.00 0.00 C ATOM 1701 CZ TYR A 106 28.260 82.157 3.954 1.00 0.00 C ATOM 1702 OH TYR A 106 27.399 83.230 3.943 1.00 0.00 O ATOM 0 H TYR A 106 32.446 76.839 3.761 1.00 0.00 H new ATOM 0 HA TYR A 106 32.147 79.451 2.488 1.00 0.00 H new ATOM 0 HB2 TYR A 106 30.299 77.918 3.403 1.00 0.00 H new ATOM 0 HB3 TYR A 106 30.879 78.335 5.003 1.00 0.00 H new ATOM 0 HD1 TYR A 106 29.350 79.710 1.930 1.00 0.00 H new ATOM 0 HD2 TYR A 106 30.300 80.453 6.015 1.00 0.00 H new ATOM 0 HE1 TYR A 106 27.895 81.679 1.907 1.00 0.00 H new ATOM 0 HE2 TYR A 106 28.804 82.404 6.007 1.00 0.00 H new ATOM 0 HH TYR A 106 27.750 83.937 4.524 1.00 0.00 H new ATOM 1712 N ASN A 107 33.893 80.552 3.889 1.00 0.00 N ATOM 1713 CA ASN A 107 34.817 81.297 4.724 1.00 0.00 C ATOM 1714 C ASN A 107 34.927 82.730 4.224 1.00 0.00 C ATOM 1715 O ASN A 107 35.013 82.963 3.018 1.00 0.00 O ATOM 1716 CB ASN A 107 36.185 80.607 4.731 1.00 0.00 C ATOM 1717 CG ASN A 107 37.165 81.251 5.692 1.00 0.00 C ATOM 1718 OD1 ASN A 107 37.929 82.135 5.314 1.00 0.00 O ATOM 1719 ND2 ASN A 107 37.152 80.808 6.939 1.00 0.00 N ATOM 0 H ASN A 107 33.938 80.782 2.896 1.00 0.00 H new ATOM 0 HA ASN A 107 34.443 81.322 5.748 1.00 0.00 H new ATOM 0 HB2 ASN A 107 36.056 79.558 5.000 1.00 0.00 H new ATOM 0 HB3 ASN A 107 36.603 80.629 3.725 1.00 0.00 H new ATOM 0 HD21 ASN A 107 37.793 81.203 7.627 1.00 0.00 H new ATOM 0 HD22 ASN A 107 36.501 80.072 7.212 1.00 0.00 H new ATOM 1726 N GLN A 108 34.917 83.680 5.160 1.00 0.00 N ATOM 1727 CA GLN A 108 34.833 85.110 4.839 1.00 0.00 C ATOM 1728 C GLN A 108 33.475 85.412 4.215 1.00 0.00 C ATOM 1729 O GLN A 108 33.340 86.330 3.409 1.00 0.00 O ATOM 1730 CB GLN A 108 35.959 85.554 3.895 1.00 0.00 C ATOM 1731 CG GLN A 108 37.357 85.286 4.429 1.00 0.00 C ATOM 1732 CD GLN A 108 38.446 85.801 3.505 1.00 0.00 C ATOM 1733 OE1 GLN A 108 39.544 86.124 3.943 1.00 0.00 O ATOM 1734 NE2 GLN A 108 38.143 85.900 2.219 1.00 0.00 N ATOM 0 H GLN A 108 34.967 83.483 6.160 1.00 0.00 H new ATOM 0 HA GLN A 108 34.948 85.671 5.767 1.00 0.00 H new ATOM 0 HB2 GLN A 108 35.842 85.041 2.940 1.00 0.00 H new ATOM 0 HB3 GLN A 108 35.855 86.621 3.699 1.00 0.00 H new ATOM 0 HG2 GLN A 108 37.464 85.755 5.407 1.00 0.00 H new ATOM 0 HG3 GLN A 108 37.487 84.214 4.574 1.00 0.00 H new ATOM 0 HE21 GLN A 108 37.219 85.622 1.890 1.00 0.00 H new ATOM 0 HE22 GLN A 108 38.834 86.255 1.558 1.00 0.00 H new ATOM 1743 N ASP A 109 32.488 84.596 4.599 1.00 0.00 N ATOM 1744 CA ASP A 109 31.094 84.724 4.149 1.00 0.00 C ATOM 1745 C ASP A 109 30.932 84.310 2.685 1.00 0.00 C ATOM 1746 O ASP A 109 29.826 84.262 2.154 1.00 0.00 O ATOM 1747 CB ASP A 109 30.559 86.144 4.374 1.00 0.00 C ATOM 1748 CG ASP A 109 29.053 86.224 4.201 1.00 0.00 C ATOM 1749 OD1 ASP A 109 28.340 85.458 4.889 1.00 0.00 O ATOM 1750 OD2 ASP A 109 28.584 87.050 3.392 1.00 0.00 O ATOM 0 H ASP A 109 32.635 83.816 5.240 1.00 0.00 H new ATOM 0 HA ASP A 109 30.500 84.040 4.756 1.00 0.00 H new ATOM 0 HB2 ASP A 109 30.826 86.476 5.377 1.00 0.00 H new ATOM 0 HB3 ASP A 109 31.040 86.827 3.674 1.00 0.00 H new ATOM 1755 N LYS A 110 32.032 83.970 2.035 1.00 0.00 N ATOM 1756 CA LYS A 110 31.966 83.530 0.656 1.00 0.00 C ATOM 1757 C LYS A 110 32.357 82.069 0.533 1.00 0.00 C ATOM 1758 O LYS A 110 33.241 81.582 1.241 1.00 0.00 O ATOM 1759 CB LYS A 110 32.867 84.375 -0.250 1.00 0.00 C ATOM 1760 CG LYS A 110 34.348 84.256 0.073 1.00 0.00 C ATOM 1761 CD LYS A 110 35.214 84.994 -0.941 1.00 0.00 C ATOM 1762 CE LYS A 110 35.684 84.084 -2.075 1.00 0.00 C ATOM 1763 NZ LYS A 110 34.560 83.521 -2.877 1.00 0.00 N ATOM 0 H LYS A 110 32.970 83.990 2.436 1.00 0.00 H new ATOM 0 HA LYS A 110 30.933 83.655 0.332 1.00 0.00 H new ATOM 0 HB2 LYS A 110 32.706 84.078 -1.286 1.00 0.00 H new ATOM 0 HB3 LYS A 110 32.570 85.421 -0.169 1.00 0.00 H new ATOM 0 HG2 LYS A 110 34.535 84.656 1.069 1.00 0.00 H new ATOM 0 HG3 LYS A 110 34.631 83.204 0.094 1.00 0.00 H new ATOM 0 HD2 LYS A 110 34.650 85.828 -1.358 1.00 0.00 H new ATOM 0 HD3 LYS A 110 36.082 85.417 -0.435 1.00 0.00 H new ATOM 0 HE2 LYS A 110 36.346 84.646 -2.733 1.00 0.00 H new ATOM 0 HE3 LYS A 110 36.270 83.265 -1.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 34.903 83.268 -3.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 34.189 82.672 -2.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 33.803 84.230 -2.960 1.00 0.00 H new ATOM 1777 N TRP A 111 31.685 81.373 -0.362 1.00 0.00 N ATOM 1778 CA TRP A 111 32.108 80.043 -0.748 1.00 0.00 C ATOM 1779 C TRP A 111 33.399 80.160 -1.532 1.00 0.00 C ATOM 1780 O TRP A 111 33.506 80.987 -2.446 1.00 0.00 O ATOM 1781 CB TRP A 111 31.039 79.343 -1.585 1.00 0.00 C ATOM 1782 CG TRP A 111 29.854 78.894 -0.787 1.00 0.00 C ATOM 1783 CD1 TRP A 111 28.649 79.526 -0.673 1.00 0.00 C ATOM 1784 CD2 TRP A 111 29.766 77.711 0.013 1.00 0.00 C ATOM 1785 NE1 TRP A 111 27.813 78.800 0.141 1.00 0.00 N ATOM 1786 CE2 TRP A 111 28.478 77.683 0.576 1.00 0.00 C ATOM 1787 CE3 TRP A 111 30.652 76.669 0.303 1.00 0.00 C ATOM 1788 CZ2 TRP A 111 28.055 76.654 1.414 1.00 0.00 C ATOM 1789 CZ3 TRP A 111 30.231 75.651 1.135 1.00 0.00 C ATOM 1790 CH2 TRP A 111 28.943 75.649 1.681 1.00 0.00 C ATOM 0 H TRP A 111 30.845 81.706 -0.835 1.00 0.00 H new ATOM 0 HA TRP A 111 32.265 79.441 0.147 1.00 0.00 H new ATOM 0 HB2 TRP A 111 30.703 80.020 -2.370 1.00 0.00 H new ATOM 0 HB3 TRP A 111 31.483 78.479 -2.078 1.00 0.00 H new ATOM 0 HD1 TRP A 111 28.391 80.459 -1.152 1.00 0.00 H new ATOM 0 HE1 TRP A 111 26.854 79.051 0.382 1.00 0.00 H new ATOM 0 HE3 TRP A 111 31.647 76.661 -0.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 27.062 76.650 1.838 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 30.908 74.842 1.368 1.00 0.00 H new ATOM 0 HH2 TRP A 111 28.644 74.837 2.327 1.00 0.00 H new ATOM 1801 N ALA A 112 34.388 79.379 -1.156 1.00 0.00 N ATOM 1802 CA ALA A 112 35.693 79.476 -1.772 1.00 0.00 C ATOM 1803 C ALA A 112 36.394 78.135 -1.773 1.00 0.00 C ATOM 1804 O ALA A 112 35.972 77.205 -1.087 1.00 0.00 O ATOM 1805 CB ALA A 112 36.531 80.501 -1.033 1.00 0.00 C ATOM 0 H ALA A 112 34.313 78.670 -0.427 1.00 0.00 H new ATOM 0 HA ALA A 112 35.564 79.791 -2.808 1.00 0.00 H new ATOM 0 HB1 ALA A 112 37.514 80.572 -1.499 1.00 0.00 H new ATOM 0 HB2 ALA A 112 36.038 81.472 -1.075 1.00 0.00 H new ATOM 0 HB3 ALA A 112 36.644 80.196 0.007 1.00 0.00 H new ATOM 1811 N TRP A 113 37.461 78.045 -2.548 1.00 0.00 N ATOM 1812 CA TRP A 113 38.270 76.843 -2.595 1.00 0.00 C ATOM 1813 C TRP A 113 39.459 77.001 -1.658 1.00 0.00 C ATOM 1814 O TRP A 113 40.257 77.924 -1.811 1.00 0.00 O ATOM 1815 CB TRP A 113 38.765 76.574 -4.022 1.00 0.00 C ATOM 1816 CG TRP A 113 37.669 76.431 -5.041 1.00 0.00 C ATOM 1817 CD1 TRP A 113 36.325 76.349 -4.808 1.00 0.00 C ATOM 1818 CD2 TRP A 113 37.833 76.343 -6.461 1.00 0.00 C ATOM 1819 NE1 TRP A 113 35.646 76.226 -5.997 1.00 0.00 N ATOM 1820 CE2 TRP A 113 36.550 76.218 -7.026 1.00 0.00 C ATOM 1821 CE3 TRP A 113 38.941 76.363 -7.312 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 36.345 76.111 -8.399 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 38.738 76.257 -8.674 1.00 0.00 C ATOM 1824 CH2 TRP A 113 37.449 76.133 -9.206 1.00 0.00 C ATOM 0 H TRP A 113 37.787 78.796 -3.156 1.00 0.00 H new ATOM 0 HA TRP A 113 37.660 75.996 -2.280 1.00 0.00 H new ATOM 0 HB2 TRP A 113 39.423 77.388 -4.325 1.00 0.00 H new ATOM 0 HB3 TRP A 113 39.365 75.664 -4.020 1.00 0.00 H new ATOM 0 HD1 TRP A 113 35.863 76.377 -3.832 1.00 0.00 H new ATOM 0 HE1 TRP A 113 34.634 76.153 -6.097 1.00 0.00 H new ATOM 0 HE3 TRP A 113 39.939 76.460 -6.911 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 35.351 76.014 -8.811 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 39.588 76.270 -9.340 1.00 0.00 H new ATOM 0 HH2 TRP A 113 37.324 76.053 -10.276 1.00 0.00 H new ATOM 1835 N ASN A 114 39.555 76.131 -0.667 1.00 0.00 N ATOM 1836 CA ASN A 114 40.673 76.174 0.266 1.00 0.00 C ATOM 1837 C ASN A 114 41.646 75.057 -0.050 1.00 0.00 C ATOM 1838 O ASN A 114 41.230 73.980 -0.480 1.00 0.00 O ATOM 1839 CB ASN A 114 40.200 76.015 1.713 1.00 0.00 C ATOM 1840 CG ASN A 114 41.071 76.782 2.689 1.00 0.00 C ATOM 1841 OD1 ASN A 114 40.774 77.931 3.026 1.00 0.00 O ATOM 1842 ND2 ASN A 114 42.158 76.169 3.133 1.00 0.00 N ATOM 0 H ASN A 114 38.878 75.390 -0.486 1.00 0.00 H new ATOM 0 HA ASN A 114 41.157 77.145 0.159 1.00 0.00 H new ATOM 0 HB2 ASN A 114 39.170 76.363 1.797 1.00 0.00 H new ATOM 0 HB3 ASN A 114 40.202 74.958 1.980 1.00 0.00 H new ATOM 0 HD21 ASN A 114 42.786 76.648 3.779 1.00 0.00 H new ATOM 0 HD22 ASN A 114 42.367 75.218 2.829 1.00 0.00 H new ATOM 1849 N ASP A 115 42.930 75.307 0.158 1.00 0.00 N ATOM 1850 CA ASP A 115 43.928 74.268 -0.012 1.00 0.00 C ATOM 1851 C ASP A 115 43.866 73.328 1.182 1.00 0.00 C ATOM 1852 O ASP A 115 43.698 73.764 2.325 1.00 0.00 O ATOM 1853 CB ASP A 115 45.341 74.860 -0.168 1.00 0.00 C ATOM 1854 CG ASP A 115 46.025 75.175 1.153 1.00 0.00 C ATOM 1855 OD1 ASP A 115 45.605 76.138 1.829 1.00 0.00 O ATOM 1856 OD2 ASP A 115 46.993 74.459 1.509 1.00 0.00 O ATOM 0 H ASP A 115 43.301 76.214 0.442 1.00 0.00 H new ATOM 0 HA ASP A 115 43.712 73.717 -0.927 1.00 0.00 H new ATOM 0 HB2 ASP A 115 45.959 74.158 -0.728 1.00 0.00 H new ATOM 0 HB3 ASP A 115 45.279 75.773 -0.761 1.00 0.00 H new ATOM 1861 N VAL A 116 43.929 72.039 0.917 1.00 0.00 N ATOM 1862 CA VAL A 116 43.899 71.052 1.978 1.00 0.00 C ATOM 1863 C VAL A 116 44.501 69.746 1.475 1.00 0.00 C ATOM 1864 O VAL A 116 44.371 69.416 0.292 1.00 0.00 O ATOM 1865 CB VAL A 116 42.445 70.826 2.488 1.00 0.00 C ATOM 1866 CG1 VAL A 116 41.634 69.960 1.539 1.00 0.00 C ATOM 1867 CG2 VAL A 116 42.431 70.257 3.893 1.00 0.00 C ATOM 0 H VAL A 116 44.001 71.650 -0.023 1.00 0.00 H new ATOM 0 HA VAL A 116 44.490 71.419 2.817 1.00 0.00 H new ATOM 0 HB VAL A 116 41.967 71.805 2.519 1.00 0.00 H new ATOM 0 HG11 VAL A 116 40.627 69.830 1.936 1.00 0.00 H new ATOM 0 HG12 VAL A 116 41.580 70.442 0.563 1.00 0.00 H new ATOM 0 HG13 VAL A 116 42.112 68.986 1.436 1.00 0.00 H new ATOM 0 HG21 VAL A 116 41.400 70.112 4.217 1.00 0.00 H new ATOM 0 HG22 VAL A 116 42.952 69.300 3.903 1.00 0.00 H new ATOM 0 HG23 VAL A 116 42.930 70.949 4.571 1.00 0.00 H new ATOM 1877 N PRO A 117 45.227 69.016 2.336 1.00 0.00 N ATOM 1878 CA PRO A 117 45.720 67.687 1.999 1.00 0.00 C ATOM 1879 C PRO A 117 44.588 66.808 1.500 1.00 0.00 C ATOM 1880 O PRO A 117 43.537 66.729 2.131 1.00 0.00 O ATOM 1881 CB PRO A 117 46.289 67.149 3.323 1.00 0.00 C ATOM 1882 CG PRO A 117 45.835 68.107 4.376 1.00 0.00 C ATOM 1883 CD PRO A 117 45.646 69.424 3.682 1.00 0.00 C ATOM 0 HA PRO A 117 46.465 67.705 1.203 1.00 0.00 H new ATOM 0 HB2 PRO A 117 45.924 66.142 3.526 1.00 0.00 H new ATOM 0 HB3 PRO A 117 47.377 67.093 3.288 1.00 0.00 H new ATOM 0 HG2 PRO A 117 44.905 67.771 4.835 1.00 0.00 H new ATOM 0 HG3 PRO A 117 46.573 68.189 5.174 1.00 0.00 H new ATOM 0 HD2 PRO A 117 44.891 70.037 4.174 1.00 0.00 H new ATOM 0 HD3 PRO A 117 46.566 70.008 3.661 1.00 0.00 H new ATOM 1891 N CYS A 118 44.788 66.178 0.352 1.00 0.00 N ATOM 1892 CA CYS A 118 43.775 65.301 -0.216 1.00 0.00 C ATOM 1893 C CYS A 118 43.420 64.193 0.773 1.00 0.00 C ATOM 1894 O CYS A 118 42.296 63.688 0.790 1.00 0.00 O ATOM 1895 CB CYS A 118 44.261 64.730 -1.546 1.00 0.00 C ATOM 1896 SG CYS A 118 44.728 66.010 -2.749 1.00 0.00 S ATOM 0 H CYS A 118 45.640 66.257 -0.203 1.00 0.00 H new ATOM 0 HA CYS A 118 42.870 65.876 -0.409 1.00 0.00 H new ATOM 0 HB2 CYS A 118 45.118 64.082 -1.364 1.00 0.00 H new ATOM 0 HB3 CYS A 118 43.476 64.107 -1.975 1.00 0.00 H new ATOM 1901 N ASN A 119 44.375 63.837 1.619 1.00 0.00 N ATOM 1902 CA ASN A 119 44.106 62.941 2.728 1.00 0.00 C ATOM 1903 C ASN A 119 43.712 63.745 3.965 1.00 0.00 C ATOM 1904 O ASN A 119 44.488 63.888 4.907 1.00 0.00 O ATOM 1905 CB ASN A 119 45.308 62.037 3.022 1.00 0.00 C ATOM 1906 CG ASN A 119 45.443 60.906 2.017 1.00 0.00 C ATOM 1907 OD1 ASN A 119 44.842 59.847 2.182 1.00 0.00 O ATOM 1908 ND2 ASN A 119 46.236 61.110 0.974 1.00 0.00 N ATOM 0 H ASN A 119 45.342 64.156 1.557 1.00 0.00 H new ATOM 0 HA ASN A 119 43.274 62.293 2.450 1.00 0.00 H new ATOM 0 HB2 ASN A 119 46.219 62.635 3.016 1.00 0.00 H new ATOM 0 HB3 ASN A 119 45.208 61.619 4.024 1.00 0.00 H new ATOM 0 HD21 ASN A 119 46.362 60.375 0.278 1.00 0.00 H new ATOM 0 HD22 ASN A 119 46.720 62.002 0.868 1.00 0.00 H new ATOM 1915 N PHE A 120 42.519 64.322 3.904 1.00 0.00 N ATOM 1916 CA PHE A 120 41.929 65.050 5.022 1.00 0.00 C ATOM 1917 C PHE A 120 40.455 64.687 5.111 1.00 0.00 C ATOM 1918 O PHE A 120 39.772 64.641 4.091 1.00 0.00 O ATOM 1919 CB PHE A 120 42.088 66.572 4.835 1.00 0.00 C ATOM 1920 CG PHE A 120 41.423 67.398 5.904 1.00 0.00 C ATOM 1921 CD1 PHE A 120 41.955 67.464 7.182 1.00 0.00 C ATOM 1922 CD2 PHE A 120 40.268 68.113 5.625 1.00 0.00 C ATOM 1923 CE1 PHE A 120 41.346 68.228 8.161 1.00 0.00 C ATOM 1924 CE2 PHE A 120 39.655 68.879 6.599 1.00 0.00 C ATOM 1925 CZ PHE A 120 40.195 68.936 7.869 1.00 0.00 C ATOM 0 H PHE A 120 41.929 64.298 3.072 1.00 0.00 H new ATOM 0 HA PHE A 120 42.442 64.773 5.943 1.00 0.00 H new ATOM 0 HB2 PHE A 120 43.150 66.815 4.812 1.00 0.00 H new ATOM 0 HB3 PHE A 120 41.676 66.853 3.866 1.00 0.00 H new ATOM 0 HD1 PHE A 120 42.854 66.913 7.416 1.00 0.00 H new ATOM 0 HD2 PHE A 120 39.842 68.071 4.634 1.00 0.00 H new ATOM 0 HE1 PHE A 120 41.770 68.271 9.154 1.00 0.00 H new ATOM 0 HE2 PHE A 120 38.756 69.431 6.367 1.00 0.00 H new ATOM 0 HZ PHE A 120 39.719 69.533 8.633 1.00 0.00 H new ATOM 1935 N GLU A 121 39.974 64.390 6.305 1.00 0.00 N ATOM 1936 CA GLU A 121 38.566 64.080 6.490 1.00 0.00 C ATOM 1937 C GLU A 121 37.722 65.348 6.413 1.00 0.00 C ATOM 1938 O GLU A 121 37.765 66.194 7.305 1.00 0.00 O ATOM 1939 CB GLU A 121 38.328 63.378 7.833 1.00 0.00 C ATOM 1940 CG GLU A 121 38.906 61.970 7.919 1.00 0.00 C ATOM 1941 CD GLU A 121 40.422 61.939 7.874 1.00 0.00 C ATOM 1942 OE1 GLU A 121 41.053 62.903 8.361 1.00 0.00 O ATOM 1943 OE2 GLU A 121 40.976 60.949 7.358 1.00 0.00 O ATOM 0 H GLU A 121 40.533 64.357 7.157 1.00 0.00 H new ATOM 0 HA GLU A 121 38.267 63.405 5.688 1.00 0.00 H new ATOM 0 HB2 GLU A 121 38.761 63.985 8.628 1.00 0.00 H new ATOM 0 HB3 GLU A 121 37.255 63.329 8.018 1.00 0.00 H new ATOM 0 HG2 GLU A 121 38.567 61.502 8.843 1.00 0.00 H new ATOM 0 HG3 GLU A 121 38.513 61.373 7.096 1.00 0.00 H new ATOM 1950 N ALA A 122 36.955 65.471 5.341 1.00 0.00 N ATOM 1951 CA ALA A 122 36.080 66.616 5.153 1.00 0.00 C ATOM 1952 C ALA A 122 34.780 66.176 4.499 1.00 0.00 C ATOM 1953 O ALA A 122 34.599 64.995 4.211 1.00 0.00 O ATOM 1954 CB ALA A 122 36.768 67.681 4.312 1.00 0.00 C ATOM 0 H ALA A 122 36.921 64.788 4.585 1.00 0.00 H new ATOM 0 HA ALA A 122 35.852 67.047 6.128 1.00 0.00 H new ATOM 0 HB1 ALA A 122 36.098 68.531 4.182 1.00 0.00 H new ATOM 0 HB2 ALA A 122 37.678 68.010 4.814 1.00 0.00 H new ATOM 0 HB3 ALA A 122 37.022 67.266 3.336 1.00 0.00 H new ATOM 1960 N SER A 123 33.878 67.123 4.273 1.00 0.00 N ATOM 1961 CA SER A 123 32.601 66.826 3.649 1.00 0.00 C ATOM 1962 C SER A 123 32.778 66.574 2.153 1.00 0.00 C ATOM 1963 O SER A 123 33.837 66.856 1.586 1.00 0.00 O ATOM 1964 CB SER A 123 31.620 67.966 3.904 1.00 0.00 C ATOM 1965 OG SER A 123 31.427 68.151 5.296 1.00 0.00 O ATOM 0 H SER A 123 34.011 68.105 4.514 1.00 0.00 H new ATOM 0 HA SER A 123 32.194 65.917 4.091 1.00 0.00 H new ATOM 0 HB2 SER A 123 31.998 68.886 3.458 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.666 67.747 3.424 1.00 0.00 H new ATOM 0 HG SER A 123 32.177 68.663 5.665 1.00 0.00 H new ATOM 1971 N ARG A 124 31.741 66.065 1.510 1.00 0.00 N ATOM 1972 CA ARG A 124 31.885 65.533 0.167 1.00 0.00 C ATOM 1973 C ARG A 124 30.731 65.959 -0.735 1.00 0.00 C ATOM 1974 O ARG A 124 29.607 66.137 -0.274 1.00 0.00 O ATOM 1975 CB ARG A 124 31.911 64.012 0.257 1.00 0.00 C ATOM 1976 CG ARG A 124 32.495 63.320 -0.956 1.00 0.00 C ATOM 1977 CD ARG A 124 32.044 61.870 -1.031 1.00 0.00 C ATOM 1978 NE ARG A 124 31.971 61.232 0.284 1.00 0.00 N ATOM 1979 CZ ARG A 124 31.354 60.071 0.505 1.00 0.00 C ATOM 1980 NH1 ARG A 124 30.830 59.394 -0.511 1.00 0.00 N ATOM 1981 NH2 ARG A 124 31.257 59.581 1.735 1.00 0.00 N ATOM 0 H ARG A 124 30.797 66.009 1.893 1.00 0.00 H new ATOM 0 HA ARG A 124 32.808 65.921 -0.265 1.00 0.00 H new ATOM 0 HB2 ARG A 124 32.486 63.723 1.136 1.00 0.00 H new ATOM 0 HB3 ARG A 124 30.893 63.652 0.410 1.00 0.00 H new ATOM 0 HG2 ARG A 124 32.189 63.846 -1.860 1.00 0.00 H new ATOM 0 HG3 ARG A 124 33.583 63.364 -0.914 1.00 0.00 H new ATOM 0 HD2 ARG A 124 31.065 61.823 -1.508 1.00 0.00 H new ATOM 0 HD3 ARG A 124 32.734 61.311 -1.663 1.00 0.00 H new ATOM 0 HE ARG A 124 32.416 61.700 1.073 1.00 0.00 H new ATOM 0 HH11 ARG A 124 30.900 59.763 -1.460 1.00 0.00 H new ATOM 0 HH12 ARG A 124 30.358 58.506 -0.342 1.00 0.00 H new ATOM 0 HH21 ARG A 124 31.656 60.094 2.521 1.00 0.00 H new ATOM 0 HH22 ARG A 124 30.783 58.692 1.894 1.00 0.00 H new ATOM 1995 N ILE A 125 31.023 66.131 -2.019 1.00 0.00 N ATOM 1996 CA ILE A 125 29.987 66.286 -3.032 1.00 0.00 C ATOM 1997 C ILE A 125 30.302 65.366 -4.201 1.00 0.00 C ATOM 1998 O ILE A 125 31.381 65.453 -4.787 1.00 0.00 O ATOM 1999 CB ILE A 125 29.874 67.730 -3.570 1.00 0.00 C ATOM 2000 CG1 ILE A 125 29.734 68.737 -2.430 1.00 0.00 C ATOM 2001 CG2 ILE A 125 28.681 67.840 -4.512 1.00 0.00 C ATOM 2002 CD1 ILE A 125 29.729 70.177 -2.898 1.00 0.00 C ATOM 0 H ILE A 125 31.975 66.167 -2.384 1.00 0.00 H new ATOM 0 HA ILE A 125 29.038 66.035 -2.558 1.00 0.00 H new ATOM 0 HB ILE A 125 30.789 67.962 -4.114 1.00 0.00 H new ATOM 0 HG12 ILE A 125 28.810 68.535 -1.888 1.00 0.00 H new ATOM 0 HG13 ILE A 125 30.554 68.594 -1.726 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.607 68.861 -4.888 1.00 0.00 H new ATOM 0 HG22 ILE A 125 28.814 67.154 -5.349 1.00 0.00 H new ATOM 0 HG23 ILE A 125 27.768 67.584 -3.974 1.00 0.00 H new ATOM 0 HD11 ILE A 125 29.627 70.839 -2.038 1.00 0.00 H new ATOM 0 HD12 ILE A 125 30.664 70.395 -3.414 1.00 0.00 H new ATOM 0 HD13 ILE A 125 28.893 70.335 -3.579 1.00 0.00 H new ATOM 2014 N CYS A 126 29.385 64.476 -4.532 1.00 0.00 N ATOM 2015 CA CYS A 126 29.603 63.559 -5.637 1.00 0.00 C ATOM 2016 C CYS A 126 28.571 63.762 -6.734 1.00 0.00 C ATOM 2017 O CYS A 126 27.404 64.053 -6.467 1.00 0.00 O ATOM 2018 CB CYS A 126 29.604 62.109 -5.151 1.00 0.00 C ATOM 2019 SG CYS A 126 31.070 61.679 -4.169 1.00 0.00 S ATOM 0 H CYS A 126 28.489 64.368 -4.057 1.00 0.00 H new ATOM 0 HA CYS A 126 30.584 63.776 -6.059 1.00 0.00 H new ATOM 0 HB2 CYS A 126 28.710 61.934 -4.552 1.00 0.00 H new ATOM 0 HB3 CYS A 126 29.545 61.445 -6.013 1.00 0.00 H new ATOM 2024 N LYS A 127 29.024 63.612 -7.965 1.00 0.00 N ATOM 2025 CA LYS A 127 28.197 63.818 -9.135 1.00 0.00 C ATOM 2026 C LYS A 127 27.974 62.505 -9.867 1.00 0.00 C ATOM 2027 O LYS A 127 28.863 61.663 -9.927 1.00 0.00 O ATOM 2028 CB LYS A 127 28.873 64.811 -10.081 1.00 0.00 C ATOM 2029 CG LYS A 127 30.259 64.374 -10.534 1.00 0.00 C ATOM 2030 CD LYS A 127 30.860 65.332 -11.550 1.00 0.00 C ATOM 2031 CE LYS A 127 30.080 65.333 -12.855 1.00 0.00 C ATOM 2032 NZ LYS A 127 30.782 66.106 -13.913 1.00 0.00 N ATOM 0 H LYS A 127 29.984 63.342 -8.180 1.00 0.00 H new ATOM 0 HA LYS A 127 27.235 64.214 -8.811 1.00 0.00 H new ATOM 0 HB2 LYS A 127 28.241 64.953 -10.958 1.00 0.00 H new ATOM 0 HB3 LYS A 127 28.950 65.778 -9.584 1.00 0.00 H new ATOM 0 HG2 LYS A 127 30.917 64.305 -9.668 1.00 0.00 H new ATOM 0 HG3 LYS A 127 30.199 63.376 -10.969 1.00 0.00 H new ATOM 0 HD2 LYS A 127 30.875 66.340 -11.135 1.00 0.00 H new ATOM 0 HD3 LYS A 127 31.895 65.052 -11.745 1.00 0.00 H new ATOM 0 HE2 LYS A 127 29.932 64.307 -13.191 1.00 0.00 H new ATOM 0 HE3 LYS A 127 29.091 65.760 -12.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 30.082 66.574 -14.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 31.391 66.824 -13.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 31.364 65.462 -14.485 1.00 0.00 H new ATOM 2046 N ILE A 128 26.786 62.330 -10.401 1.00 0.00 N ATOM 2047 CA ILE A 128 26.505 61.211 -11.280 1.00 0.00 C ATOM 2048 C ILE A 128 26.105 61.747 -12.652 1.00 0.00 C ATOM 2049 O ILE A 128 25.381 62.743 -12.744 1.00 0.00 O ATOM 2050 CB ILE A 128 25.391 60.292 -10.710 1.00 0.00 C ATOM 2051 CG1 ILE A 128 25.154 59.089 -11.626 1.00 0.00 C ATOM 2052 CG2 ILE A 128 24.098 61.066 -10.506 1.00 0.00 C ATOM 2053 CD1 ILE A 128 24.063 58.157 -11.144 1.00 0.00 C ATOM 0 H ILE A 128 25.993 62.951 -10.242 1.00 0.00 H new ATOM 0 HA ILE A 128 27.406 60.603 -11.365 1.00 0.00 H new ATOM 0 HB ILE A 128 25.726 59.925 -9.740 1.00 0.00 H new ATOM 0 HG12 ILE A 128 24.897 59.448 -12.622 1.00 0.00 H new ATOM 0 HG13 ILE A 128 26.083 58.527 -11.719 1.00 0.00 H new ATOM 0 HG21 ILE A 128 23.334 60.399 -10.106 1.00 0.00 H new ATOM 0 HG22 ILE A 128 24.270 61.883 -9.805 1.00 0.00 H new ATOM 0 HG23 ILE A 128 23.762 61.471 -11.460 1.00 0.00 H new ATOM 0 HD11 ILE A 128 23.955 57.330 -11.846 1.00 0.00 H new ATOM 0 HD12 ILE A 128 24.326 57.767 -10.161 1.00 0.00 H new ATOM 0 HD13 ILE A 128 23.122 58.702 -11.078 1.00 0.00 H new ATOM 2065 N PRO A 129 26.630 61.149 -13.732 1.00 0.00 N ATOM 2066 CA PRO A 129 26.248 61.515 -15.096 1.00 0.00 C ATOM 2067 C PRO A 129 24.757 61.311 -15.345 1.00 0.00 C ATOM 2068 O PRO A 129 24.065 60.684 -14.541 1.00 0.00 O ATOM 2069 CB PRO A 129 27.078 60.572 -15.979 1.00 0.00 C ATOM 2070 CG PRO A 129 27.519 59.473 -15.073 1.00 0.00 C ATOM 2071 CD PRO A 129 27.650 60.089 -13.712 1.00 0.00 C ATOM 0 HA PRO A 129 26.434 62.569 -15.301 1.00 0.00 H new ATOM 0 HB2 PRO A 129 26.485 60.185 -16.807 1.00 0.00 H new ATOM 0 HB3 PRO A 129 27.933 61.090 -16.414 1.00 0.00 H new ATOM 0 HG2 PRO A 129 26.794 58.659 -15.065 1.00 0.00 H new ATOM 0 HG3 PRO A 129 28.468 59.051 -15.404 1.00 0.00 H new ATOM 0 HD2 PRO A 129 27.463 59.363 -12.920 1.00 0.00 H new ATOM 0 HD3 PRO A 129 28.649 60.492 -13.545 1.00 0.00 H new ATOM 2079 N GLY A 130 24.270 61.864 -16.455 1.00 0.00 N ATOM 2080 CA GLY A 130 22.873 61.713 -16.836 1.00 0.00 C ATOM 2081 C GLY A 130 22.350 60.297 -16.675 1.00 0.00 C ATOM 2082 O GLY A 130 21.207 60.115 -16.266 1.00 0.00 O ATOM 0 H GLY A 130 24.826 62.421 -17.105 1.00 0.00 H new ATOM 0 HA2 GLY A 130 22.265 62.387 -16.232 1.00 0.00 H new ATOM 0 HA3 GLY A 130 22.753 62.020 -17.875 1.00 0.00 H new ATOM 2086 N THR A 131 23.196 59.321 -17.029 1.00 0.00 N ATOM 2087 CA THR A 131 22.961 57.875 -16.831 1.00 0.00 C ATOM 2088 C THR A 131 21.703 57.321 -17.515 1.00 0.00 C ATOM 2089 O THR A 131 21.548 56.102 -17.621 1.00 0.00 O ATOM 2090 CB THR A 131 22.979 57.456 -15.337 1.00 0.00 C ATOM 2091 OG1 THR A 131 22.258 58.384 -14.520 1.00 0.00 O ATOM 2092 CG2 THR A 131 24.407 57.334 -14.833 1.00 0.00 C ATOM 0 H THR A 131 24.092 59.516 -17.475 1.00 0.00 H new ATOM 0 HA THR A 131 23.813 57.419 -17.335 1.00 0.00 H new ATOM 0 HB THR A 131 22.487 56.486 -15.267 1.00 0.00 H new ATOM 0 HG1 THR A 131 22.809 59.180 -14.365 1.00 0.00 H new ATOM 0 HG21 THR A 131 24.399 57.039 -13.784 1.00 0.00 H new ATOM 0 HG22 THR A 131 24.936 56.581 -15.417 1.00 0.00 H new ATOM 0 HG23 THR A 131 24.913 58.294 -14.936 1.00 0.00 H new ATOM 2100 N THR A 132 20.830 58.194 -17.996 1.00 0.00 N ATOM 2101 CA THR A 132 19.634 57.770 -18.704 1.00 0.00 C ATOM 2102 C THR A 132 19.999 56.944 -19.925 1.00 0.00 C ATOM 2103 O THR A 132 19.538 55.823 -20.078 1.00 0.00 O ATOM 2104 CB THR A 132 18.786 58.979 -19.135 1.00 0.00 C ATOM 2105 OG1 THR A 132 19.610 59.945 -19.809 1.00 0.00 O ATOM 2106 CG2 THR A 132 18.119 59.628 -17.935 1.00 0.00 C ATOM 0 H THR A 132 20.930 59.205 -17.907 1.00 0.00 H new ATOM 0 HA THR A 132 19.047 57.158 -18.020 1.00 0.00 H new ATOM 0 HB THR A 132 18.011 58.625 -19.815 1.00 0.00 H new ATOM 0 HG1 THR A 132 19.061 60.710 -20.081 1.00 0.00 H new ATOM 0 HG21 THR A 132 17.525 60.480 -18.266 1.00 0.00 H new ATOM 0 HG22 THR A 132 17.471 58.903 -17.443 1.00 0.00 H new ATOM 0 HG23 THR A 132 18.882 59.967 -17.234 1.00 0.00 H new ATOM 2114 N LEU A 133 20.890 57.495 -20.750 1.00 0.00 N ATOM 2115 CA LEU A 133 21.318 56.859 -21.997 1.00 0.00 C ATOM 2116 C LEU A 133 21.832 55.440 -21.761 1.00 0.00 C ATOM 2117 O LEU A 133 21.828 54.606 -22.664 1.00 0.00 O ATOM 2118 CB LEU A 133 22.419 57.696 -22.648 1.00 0.00 C ATOM 2119 CG LEU A 133 22.071 59.169 -22.874 1.00 0.00 C ATOM 2120 CD1 LEU A 133 23.279 59.923 -23.404 1.00 0.00 C ATOM 2121 CD2 LEU A 133 20.896 59.301 -23.834 1.00 0.00 C ATOM 0 H LEU A 133 21.336 58.395 -20.573 1.00 0.00 H new ATOM 0 HA LEU A 133 20.451 56.799 -22.655 1.00 0.00 H new ATOM 0 HB2 LEU A 133 23.311 57.642 -22.024 1.00 0.00 H new ATOM 0 HB3 LEU A 133 22.674 57.248 -23.608 1.00 0.00 H new ATOM 0 HG LEU A 133 21.782 59.606 -21.918 1.00 0.00 H new ATOM 0 HD11 LEU A 133 23.015 60.969 -23.560 1.00 0.00 H new ATOM 0 HD12 LEU A 133 24.094 59.857 -22.683 1.00 0.00 H new ATOM 0 HD13 LEU A 133 23.596 59.484 -24.350 1.00 0.00 H new ATOM 0 HD21 LEU A 133 20.664 60.356 -23.982 1.00 0.00 H new ATOM 0 HD22 LEU A 133 21.156 58.849 -24.791 1.00 0.00 H new ATOM 0 HD23 LEU A 133 20.026 58.793 -23.417 1.00 0.00 H new ATOM 2133 N ASN A 134 22.285 55.179 -20.545 1.00 0.00 N ATOM 2134 CA ASN A 134 22.780 53.865 -20.179 1.00 0.00 C ATOM 2135 C ASN A 134 21.631 52.982 -19.705 1.00 0.00 C ATOM 2136 O ASN A 134 21.440 51.869 -20.191 1.00 0.00 O ATOM 2137 CB ASN A 134 23.832 53.984 -19.073 1.00 0.00 C ATOM 2138 CG ASN A 134 25.005 54.861 -19.467 1.00 0.00 C ATOM 2139 OD1 ASN A 134 24.990 56.073 -19.247 1.00 0.00 O ATOM 2140 ND2 ASN A 134 26.032 54.257 -20.044 1.00 0.00 N ATOM 0 H ASN A 134 22.319 55.866 -19.792 1.00 0.00 H new ATOM 0 HA ASN A 134 23.238 53.411 -21.057 1.00 0.00 H new ATOM 0 HB2 ASN A 134 23.365 54.392 -18.176 1.00 0.00 H new ATOM 0 HB3 ASN A 134 24.198 52.989 -18.818 1.00 0.00 H new ATOM 0 HD21 ASN A 134 26.850 54.798 -20.324 1.00 0.00 H new ATOM 0 HD22 ASN A 134 26.005 53.251 -20.209 1.00 0.00 H new ATOM 2147 N ALA A 135 20.862 53.495 -18.754 1.00 0.00 N ATOM 2148 CA ALA A 135 19.786 52.732 -18.135 1.00 0.00 C ATOM 2149 C ALA A 135 18.449 52.917 -18.854 1.00 0.00 C ATOM 2150 O ALA A 135 17.400 52.675 -18.261 1.00 0.00 O ATOM 2151 CB ALA A 135 19.655 53.124 -16.671 1.00 0.00 C ATOM 0 H ALA A 135 20.965 54.443 -18.392 1.00 0.00 H new ATOM 0 HA ALA A 135 20.046 51.676 -18.214 1.00 0.00 H new ATOM 0 HB1 ALA A 135 18.849 52.551 -16.212 1.00 0.00 H new ATOM 0 HB2 ALA A 135 20.591 52.914 -16.153 1.00 0.00 H new ATOM 0 HB3 ALA A 135 19.431 54.188 -16.598 1.00 0.00 H new ATOM 2157 N GLU A 136 18.495 53.314 -20.126 1.00 0.00 N ATOM 2158 CA GLU A 136 17.281 53.571 -20.915 1.00 0.00 C ATOM 2159 C GLU A 136 16.280 52.425 -20.799 1.00 0.00 C ATOM 2160 O GLU A 136 15.206 52.576 -20.216 1.00 0.00 O ATOM 2161 CB GLU A 136 17.633 53.778 -22.392 1.00 0.00 C ATOM 2162 CG GLU A 136 18.220 55.142 -22.718 1.00 0.00 C ATOM 2163 CD GLU A 136 17.218 56.269 -22.535 1.00 0.00 C ATOM 2164 OE1 GLU A 136 16.171 56.241 -23.213 1.00 0.00 O ATOM 2165 OE2 GLU A 136 17.478 57.176 -21.713 1.00 0.00 O ATOM 0 H GLU A 136 19.364 53.466 -20.638 1.00 0.00 H new ATOM 0 HA GLU A 136 16.824 54.475 -20.513 1.00 0.00 H new ATOM 0 HB2 GLU A 136 18.345 53.009 -22.693 1.00 0.00 H new ATOM 0 HB3 GLU A 136 16.734 53.632 -22.990 1.00 0.00 H new ATOM 0 HG2 GLU A 136 19.085 55.323 -22.080 1.00 0.00 H new ATOM 0 HG3 GLU A 136 18.578 55.143 -23.748 1.00 0.00 H new ATOM 2172 N ASN A 137 16.654 51.266 -21.322 1.00 0.00 N ATOM 2173 CA ASN A 137 15.763 50.111 -21.323 1.00 0.00 C ATOM 2174 C ASN A 137 15.669 49.497 -19.935 1.00 0.00 C ATOM 2175 O ASN A 137 14.654 48.905 -19.577 1.00 0.00 O ATOM 2176 CB ASN A 137 16.237 49.062 -22.334 1.00 0.00 C ATOM 2177 CG ASN A 137 16.135 49.552 -23.766 1.00 0.00 C ATOM 2178 OD1 ASN A 137 15.267 50.355 -24.098 1.00 0.00 O ATOM 2179 ND2 ASN A 137 17.022 49.074 -24.626 1.00 0.00 N ATOM 0 H ASN A 137 17.565 51.099 -21.750 1.00 0.00 H new ATOM 0 HA ASN A 137 14.771 50.454 -21.616 1.00 0.00 H new ATOM 0 HB2 ASN A 137 17.271 48.794 -22.117 1.00 0.00 H new ATOM 0 HB3 ASN A 137 15.642 48.156 -22.220 1.00 0.00 H new ATOM 0 HD21 ASN A 137 16.999 49.372 -25.601 1.00 0.00 H new ATOM 0 HD22 ASN A 137 17.728 48.408 -24.313 1.00 0.00 H new ATOM 2186 N LEU A 138 16.724 49.665 -19.149 1.00 0.00 N ATOM 2187 CA LEU A 138 16.763 49.124 -17.798 1.00 0.00 C ATOM 2188 C LEU A 138 15.653 49.757 -16.963 1.00 0.00 C ATOM 2189 O LEU A 138 14.910 49.063 -16.273 1.00 0.00 O ATOM 2190 CB LEU A 138 18.144 49.384 -17.170 1.00 0.00 C ATOM 2191 CG LEU A 138 18.519 48.520 -15.952 1.00 0.00 C ATOM 2192 CD1 LEU A 138 17.756 48.947 -14.707 1.00 0.00 C ATOM 2193 CD2 LEU A 138 18.271 47.047 -16.247 1.00 0.00 C ATOM 0 H LEU A 138 17.565 50.172 -19.425 1.00 0.00 H new ATOM 0 HA LEU A 138 16.601 48.046 -17.828 1.00 0.00 H new ATOM 0 HB2 LEU A 138 18.902 49.236 -17.939 1.00 0.00 H new ATOM 0 HB3 LEU A 138 18.192 50.432 -16.873 1.00 0.00 H new ATOM 0 HG LEU A 138 19.581 48.667 -15.757 1.00 0.00 H new ATOM 0 HD11 LEU A 138 18.046 48.315 -13.868 1.00 0.00 H new ATOM 0 HD12 LEU A 138 17.989 49.987 -14.476 1.00 0.00 H new ATOM 0 HD13 LEU A 138 16.685 48.846 -14.884 1.00 0.00 H new ATOM 0 HD21 LEU A 138 18.541 46.451 -15.375 1.00 0.00 H new ATOM 0 HD22 LEU A 138 17.217 46.895 -16.478 1.00 0.00 H new ATOM 0 HD23 LEU A 138 18.877 46.740 -17.099 1.00 0.00 H new ATOM 2205 N TYR A 139 15.533 51.074 -17.062 1.00 0.00 N ATOM 2206 CA TYR A 139 14.518 51.809 -16.322 1.00 0.00 C ATOM 2207 C TYR A 139 13.173 51.715 -17.038 1.00 0.00 C ATOM 2208 O TYR A 139 12.122 51.845 -16.423 1.00 0.00 O ATOM 2209 CB TYR A 139 14.942 53.273 -16.171 1.00 0.00 C ATOM 2210 CG TYR A 139 14.206 54.020 -15.080 1.00 0.00 C ATOM 2211 CD1 TYR A 139 14.569 53.865 -13.748 1.00 0.00 C ATOM 2212 CD2 TYR A 139 13.158 54.881 -15.379 1.00 0.00 C ATOM 2213 CE1 TYR A 139 13.907 54.547 -12.745 1.00 0.00 C ATOM 2214 CE2 TYR A 139 12.493 55.568 -14.381 1.00 0.00 C ATOM 2215 CZ TYR A 139 12.872 55.398 -13.065 1.00 0.00 C ATOM 2216 OH TYR A 139 12.216 56.083 -12.067 1.00 0.00 O ATOM 0 H TYR A 139 16.129 51.657 -17.650 1.00 0.00 H new ATOM 0 HA TYR A 139 14.413 51.370 -15.330 1.00 0.00 H new ATOM 0 HB2 TYR A 139 16.012 53.311 -15.964 1.00 0.00 H new ATOM 0 HB3 TYR A 139 14.782 53.786 -17.119 1.00 0.00 H new ATOM 0 HD1 TYR A 139 15.381 53.201 -13.492 1.00 0.00 H new ATOM 0 HD2 TYR A 139 12.858 55.016 -16.408 1.00 0.00 H new ATOM 0 HE1 TYR A 139 14.200 54.413 -11.714 1.00 0.00 H new ATOM 0 HE2 TYR A 139 11.681 56.235 -14.630 1.00 0.00 H new ATOM 0 HH TYR A 139 11.513 56.641 -12.461 1.00 0.00 H new ATOM 2226 N PHE A 140 13.222 51.477 -18.346 1.00 0.00 N ATOM 2227 CA PHE A 140 12.013 51.333 -19.157 1.00 0.00 C ATOM 2228 C PHE A 140 11.246 50.067 -18.773 1.00 0.00 C ATOM 2229 O PHE A 140 10.037 49.972 -18.982 1.00 0.00 O ATOM 2230 CB PHE A 140 12.387 51.297 -20.644 1.00 0.00 C ATOM 2231 CG PHE A 140 11.210 51.217 -21.574 1.00 0.00 C ATOM 2232 CD1 PHE A 140 10.446 52.341 -21.842 1.00 0.00 C ATOM 2233 CD2 PHE A 140 10.870 50.019 -22.182 1.00 0.00 C ATOM 2234 CE1 PHE A 140 9.365 52.272 -22.699 1.00 0.00 C ATOM 2235 CE2 PHE A 140 9.790 49.944 -23.041 1.00 0.00 C ATOM 2236 CZ PHE A 140 9.037 51.072 -23.299 1.00 0.00 C ATOM 0 H PHE A 140 14.091 51.379 -18.871 1.00 0.00 H new ATOM 0 HA PHE A 140 11.366 52.190 -18.970 1.00 0.00 H new ATOM 0 HB2 PHE A 140 12.965 52.190 -20.883 1.00 0.00 H new ATOM 0 HB3 PHE A 140 13.036 50.440 -20.823 1.00 0.00 H new ATOM 0 HD1 PHE A 140 10.698 53.282 -21.376 1.00 0.00 H new ATOM 0 HD2 PHE A 140 11.456 49.134 -21.982 1.00 0.00 H new ATOM 0 HE1 PHE A 140 8.777 53.155 -22.900 1.00 0.00 H new ATOM 0 HE2 PHE A 140 9.536 49.005 -23.510 1.00 0.00 H new ATOM 0 HZ PHE A 140 8.192 51.016 -23.969 1.00 0.00 H new ATOM 2246 N GLN A 141 11.962 49.096 -18.223 1.00 0.00 N ATOM 2247 CA GLN A 141 11.352 47.847 -17.775 1.00 0.00 C ATOM 2248 C GLN A 141 10.796 47.974 -16.358 1.00 0.00 C ATOM 2249 O GLN A 141 10.190 47.036 -15.841 1.00 0.00 O ATOM 2250 CB GLN A 141 12.374 46.711 -17.824 1.00 0.00 C ATOM 2251 CG GLN A 141 12.870 46.394 -19.225 1.00 0.00 C ATOM 2252 CD GLN A 141 13.959 45.338 -19.235 1.00 0.00 C ATOM 2253 OE1 GLN A 141 14.740 45.279 -18.167 1.00 0.00 O flip ATOM 2254 NE2 GLN A 141 14.099 44.583 -20.194 1.00 0.00 N flip ATOM 0 H GLN A 141 12.970 49.148 -18.075 1.00 0.00 H new ATOM 0 HA GLN A 141 10.525 47.623 -18.449 1.00 0.00 H new ATOM 0 HB2 GLN A 141 13.226 46.974 -17.197 1.00 0.00 H new ATOM 0 HB3 GLN A 141 11.928 45.814 -17.395 1.00 0.00 H new ATOM 0 HG2 GLN A 141 12.033 46.053 -19.834 1.00 0.00 H new ATOM 0 HG3 GLN A 141 13.249 47.306 -19.687 1.00 0.00 H new ATOM 0 HE21 GLN A 141 13.477 44.660 -20.999 1.00 0.00 H new ATOM 0 HE22 GLN A 141 14.837 43.879 -20.186 1.00 0.00 H new ATOM 2263 N SER A 142 11.037 49.117 -15.728 1.00 0.00 N ATOM 2264 CA SER A 142 10.605 49.345 -14.359 1.00 0.00 C ATOM 2265 C SER A 142 9.267 50.087 -14.327 1.00 0.00 C ATOM 2266 O SER A 142 8.216 49.415 -14.372 1.00 0.00 O ATOM 2267 CB SER A 142 11.680 50.133 -13.599 1.00 0.00 C ATOM 2268 OG SER A 142 11.268 50.426 -12.277 1.00 0.00 O ATOM 0 H SER A 142 11.532 49.903 -16.148 1.00 0.00 H new ATOM 0 HA SER A 142 10.463 48.381 -13.871 1.00 0.00 H new ATOM 0 HB2 SER A 142 12.606 49.558 -13.574 1.00 0.00 H new ATOM 0 HB3 SER A 142 11.896 51.061 -14.129 1.00 0.00 H new ATOM 0 HG SER A 142 11.974 50.927 -11.818 1.00 0.00 H new TER 2274 SER A 142